0 B12R0.5 C#CCCCCCCCCCOC 34a_100000034437_200000210301 [0,0,0,0,0,0|2,0,1]=3 1 B12R0.5 C#CCCCCCCCCCOC 7a_100000034437_200000210301 [0,0,0,0,0,0|2,0,1]=3 2 B12R0.5 C#CCCCCCCCCCO[13CH3] 34a_100000034437_200025704644 [0,0,0,0,0,0|2,0,1]=3 3 B12R0.5 C#CCCCCCCCCCO[13CH3] 7a_100000034437_200025704644 [0,0,0,0,0,0|2,0,1]=3 4 B12R0.5 C#CCCCCCCCCOCC 34a_100000065265_100000210202 [0,0,0,0,0,0|2,0,1]=3 5 B12R0.5 C#CCCCCCCCCOCC 7a_100000065265_100000210202 [0,0,0,0,0,0|2,0,1]=3 6 B12R0.5 C#CCCCCCCCCOCF 34a_100000065265_100015361967 [0,0,0,0,0,0|2,0,2]=4 7 B12R0.5 C#CCCCCCCCCOCF 7a_100000065265_100015361967 [0,0,0,0,0,0|2,0,2]=4 8 B12R0.5 C#CCCCCCCCNCCF 34a_100000724931_100153394163 [0,0,0,0,0,0|2,0,2]=4 9 B12R0.5 C#CCCCCCCCNCCO 2230a_100016997473_100153394163 [0,0,0,0,0,0|1,0,2]=3 10 B12R0.5 C#CCCCCCCCNCCO 34a_100016990907_100153394163 [0,0,0,0,0,0|1,0,2]=3 11 B12R0.5 C#CCCCCCCCOCCBr 34a_100000211926_100153394163 [0,0,0,0,0,0|2,0,2]=4 12 B12R0.5 C#CCCCCCCCOCCC 34a_100000054614_100000210303 [0,0,0,0,0,0|2,0,1]=3 13 B12R0.5 C#CCCCCCCCOCCC 34a_100000210258_100153394163 [0,0,0,0,0,0|2,0,1]=3 14 B12R0.5 C#CCCCCCCCOCCC 7a_100000054614_100000210303 [0,0,0,0,0,0|2,0,1]=3 15 B12R0.5 C#CCCCCCCCOCCF 34a_100000054614_100011217306 [0,0,0,0,0,0|2,0,2]=4 16 B12R0.5 C#CCCCCCCCOCCF 7a_100000054614_100011217306 [0,0,0,0,0,0|2,0,2]=4 17 B12R0.5 C#CCCCCCCCOCCN 34a_100000210304_100153394163 [0,0,0,0,0,0|2,0,2]=4 18 B12R0.5 C#CCCCCCCCOCCO 34a_100000054614_100000211926 [0,0,0,0,0,0|1,0,2]=3 19 B12R0.5 C#CCCCCCCCOCCO 7a_100000054614_100000211926 [0,0,0,0,0,0|1,0,2]=3 20 B12R0.5 C#CCCCCCCCOCSC 34a_100000054614_100011218213 [0,0,0,0,0,0|3,0,1]=4 21 B12R0.5 C#CCCCCCCCSCCC 62a_100000210303_100153394163 [0,0,0,0,0,0|2,0,1]=3 22 B12R0.5 C#CCCCCCCCSCCC 62a_100153394163_100000210303 [0,0,0,0,0,0|2,0,1]=3 23 B12R0.5 C#CCCCCCCCSCCF 62a_100011217306_100153394163 [0,0,0,0,0,0|2,0,2]=4 24 B12R0.5 C#CCCCCCCCSCCF 62a_100153394163_100011217306 [0,0,0,0,0,0|2,0,2]=4 25 B12R0.5 C#CCCCCCCCSCCO 62a_100000211926_100153394163 [0,0,0,0,0,0|1,0,2]=3 26 B12R0.5 C#CCCCCCCCSCCO 62a_100153394163_100000211926 [0,0,0,0,0,0|1,0,2]=3 27 B12R0.5 C#CCCCCCCCSCOC 62a_100000766300_100153394163 [0,0,0,0,0,0|3,0,1]=4 28 B12R0.5 C#CCCCCCCCSCOC 62a_100153394163_100000766300 [0,0,0,0,0,0|3,0,1]=4 29 B12R0.5 C#CCCCCCCCSCSC 62a_100011218213_100153394163 [0,0,0,0,0,0|3,0,1]=4 30 B12R0.5 C#CCCCCCCCSCSC 62a_100153394163_100011218213 [0,0,0,0,0,0|3,0,1]=4 31 B12R0.5 C#CCCCCCCNCCCC 2230a_100000102301_100012276617 [0,0,0,0,0,0|2,0,1]=3 32 B12R0.5 C#CCCCCCCNCCCC 7a_106832991798_100012276617 [0,0,0,0,0,0|2,0,1]=3 33 B12R0.5 C#CCCCCCCNCCCF 2230a_100015189416_100012276617 [0,0,0,0,0,0|2,0,2]=4 34 B12R0.5 C#CCCCCCCNCCCF 34a_100015189416_100012276617 [0,0,0,0,0,0|2,0,2]=4 35 B12R0.5 C#CCCCCCCNCCOC 2230a_100000209980_100012276617 [0,0,0,0,0,0|3,0,1]=4 36 B12R0.5 C#CCCCCCCNCCSC 2230a_100020590264_100012276617 [0,0,0,0,0,0|3,0,1]=4 37 B12R0.5 C#CCCCCCCOCCCBr 34a_100011217188_100012276617 [0,0,0,0,0,0|2,0,2]=4 38 B12R0.5 C#CCCCCCCOCCCC 34a_100000210227_100012276617 [0,0,0,0,0,0|2,0,1]=3 39 B12R0.5 C#CCCCCCCOCCCC 34a_100011217361_100000210210 [0,0,0,0,0,0|2,0,1]=3 40 B12R0.5 C#CCCCCCCOCCCC 7a_100000210227_100012276617 [0,0,0,0,0,0|2,0,1]=3 41 B12R0.5 C#CCCCCCCOCCCC 7a_100011217361_100000210211 [0,0,0,0,0,0|2,0,1]=3 42 B12R0.5 C#CCCCCCCOCCCCl 34a_100000230001_100012276617 [0,0,0,0,0,0|2,0,2]=4 43 B12R0.5 C#CCCCCCCOCCCF 34a_100000759539_100012276617 [0,0,0,0,0,0|2,0,2]=4 44 B12R0.5 C#CCCCCCCOCCCF 34a_100011217361_100011934791 [0,0,0,0,0,0|2,0,2]=4 45 B12R0.5 C#CCCCCCCOCCCF 7a_100011217361_100011934791 [0,0,0,0,0,0|2,0,2]=4 46 B12R0.5 C#CCCCCCCOCCCN 34a_100000182051_100012276617 [0,0,0,0,0,0|2,0,2]=4 47 B12R0.5 C#CCCCCCCOCCCO 34a_100011217361_100000230001 [0,0,0,0,0,0|1,0,2]=3 48 B12R0.5 C#CCCCCCCOCCCO 7a_100011217361_100011215043 [0,0,0,0,0,0|1,0,2]=3 49 B12R0.5 C#CCCCCCCOCCOC 34a_100000210237_100012276617 [0,0,0,0,0,0|3,0,1]=4 50 B12R0.5 C#CCCCCCCOCCOC 34a_100011217361_100011201679 [0,0,0,0,0,0|3,0,1]=4 51 B12R0.5 C#CCCCCCCOCCOC 7a_100011217361_100000233755 [0,0,0,0,0,0|3,0,1]=4 52 B12R0.5 C#CCCCCCCOCCSC 34a_100000230434_100012276617 [0,0,0,0,0,0|3,0,1]=4 53 B12R0.5 C#CCCCCCCOCCSC 34a_100011217361_100000212216 [0,0,0,0,0,0|3,0,1]=4 54 B12R0.5 C#CCCCCCCOCCSC 7a_100000230434_100012276617 [0,0,0,0,0,0|3,0,1]=4 55 B12R0.5 C#CCCCCCCOCCSC 7a_100011217361_100000212216 [0,0,0,0,0,0|3,0,1]=4 56 B12R0.5 C#CCCCCCCSCCCC 62a_100000210211_100012276617 [0,0,0,0,0,0|2,0,1]=3 57 B12R0.5 C#CCCCCCCSCCCC 62a_100012276617_100000210210 [0,0,0,0,0,0|2,0,1]=3 58 B12R0.5 C#CCCCCCCSCCCF 62a_100011934791_100012276617 [0,0,0,0,0,0|2,0,2]=4 59 B12R0.5 C#CCCCCCCSCCCF 62a_100012276617_100011934791 [0,0,0,0,0,0|2,0,2]=4 60 B12R0.5 C#CCCCCCCSCCCO 62a_100011215043_100012276617 [0,0,0,0,0,0|1,0,2]=3 61 B12R0.5 C#CCCCCCCSCCCO 62a_100012276617_100011215043 [0,0,0,0,0,0|1,0,2]=3 62 B12R0.5 C#CCCCCCCSCCOC 62a_100000233755_100012276617 [0,0,0,0,0,0|3,0,1]=4 63 B12R0.5 C#CCCCCCCSCCOC 62a_100012276617_100000233755 [0,0,0,0,0,0|3,0,1]=4 64 B12R0.5 C#CCCCCCCSCCSC 62a_100000212216_100012276617 [0,0,0,0,0,0|3,0,1]=4 65 B12R0.5 C#CCCCCCCSCCSC 62a_100012276617_100000751147 [0,0,0,0,0,0|3,0,1]=4 66 B12R0.5 C#CCCCCCCSCOCC 62a_100000739092_100012276617 [0,0,0,0,0,0|3,0,1]=4 67 B12R0.5 C#CCCCCCCSCOCC 62a_100012276617_100000739092 [0,0,0,0,0,0|3,0,1]=4 68 B12R0.5 C#CCCCCCNCCCCC 2230a_100000209983_100012094781 [0,0,0,0,0,0|2,0,1]=3 69 B12R0.5 C#CCCCCCNCCCCO 2230a_100000750430_100012094781 [0,0,0,0,0,0|1,0,2]=3 70 B12R0.5 C#CCCCCCNCCCCO 34a_100000750430_100012094781 [0,0,0,0,0,0|1,0,2]=3 71 B12R0.5 C#CCCCCCNCCCOC 34a_100150723488_100012094781 [0,0,0,0,0,0|3,0,1]=4 72 B12R0.5 C#CCCCCCNCCCSC 2230a_100000749238_100012094781 [0,0,0,0,0,0|3,0,1]=4 73 B12R0.5 C#CCCCCCNCCOCC 2230a_102516460346_100012094781 [0,0,0,0,0,0|3,0,1]=4 74 B12R0.5 C#CCCCCCNCCOCC 34a_102516460346_100012094781 [0,0,0,0,0,0|3,0,1]=4 75 B12R0.5 C#CCCCCCNCCSCC 2230a_100000106463_100012094781 [0,0,0,0,0,0|3,0,1]=4 76 B12R0.5 C#CCCCCCOCCCCBr 34a_100011216708_100012094781 [0,0,0,0,0,0|2,0,2]=4 77 B12R0.5 C#CCCCCCOCCCCC 34a_100000210253_100012094781 [0,0,0,0,0,0|2,0,1]=3 78 B12R0.5 C#CCCCCCOCCCCC 34a_100000766912_100000718602 [0,0,0,0,0,0|2,0,1]=3 79 B12R0.5 C#CCCCCCOCCCCC 7a_100000210253_100012094781 [0,0,0,0,0,0|2,0,1]=3 80 B12R0.5 C#CCCCCCOCCCCC 7a_100000766912_100000210326 [0,0,0,0,0,0|2,0,1]=3 81 B12R0.5 C#CCCCCCOCCCCCl 34a_100000210776_100012094781 [0,0,0,0,0,0|2,0,2]=4 82 B12R0.5 C#CCCCCCOCCCCCl 7a_100000210776_100012094781 [0,0,0,0,0,0|2,0,2]=4 83 B12R0.5 C#CCCCCCOCCCCF 34a_100000766912_100000729493 [0,0,0,0,0,0|2,0,2]=4 84 B12R0.5 C#CCCCCCOCCCCF 34a_100011995726_100012094781 [0,0,0,0,0,0|2,0,2]=4 85 B12R0.5 C#CCCCCCOCCCCF 7a_100000766912_100000729493 [0,0,0,0,0,0|2,0,2]=4 86 B12R0.5 C#CCCCCCOCCCCF 7a_100011995726_100012094781 [0,0,0,0,0,0|2,0,2]=4 87 B12R0.5 C#CCCCCCOCCCCI 34a_200012148704_100012094781 [0,0,0,0,0,0|2,0,2]=4 88 B12R0.5 C#CCCCCCOCCCCN 34a_100000750430_100012094781 [0,0,0,0,0,0|2,0,2]=4 89 B12R0.5 C#CCCCCCOCCCCO 34a_100000766912_100011216708 [0,0,0,0,0,0|1,0,2]=3 90 B12R0.5 C#CCCCCCOCCCCO 7a_100000766912_100000210776 [0,0,0,0,0,0|1,0,2]=3 91 B12R0.5 C#CCCCCCOCCCNC 34a_100000213112_100012094781 [0,0,0,0,0,0|3,0,1]=4 92 B12R0.5 C#CCCCCCOCCCOC 34a_100000740835_100012094781 [0,0,0,0,0,0|3,0,1]=4 93 B12R0.5 C#CCCCCCOCCCOC 34a_100000766912_100000740836 [0,0,0,0,0,0|3,0,1]=4 94 B12R0.5 C#CCCCCCOCCCOC 7a_100000766912_100000740836 [0,0,0,0,0,0|3,0,1]=4 95 B12R0.5 C#CCCCCCOCCCSC 34a_100000690336_100012094781 [0,0,0,0,0,0|3,0,1]=4 96 B12R0.5 C#CCCCCCOCCCSC 7a_100000690336_100012094781 [0,0,0,0,0,0|3,0,1]=4 97 B12R0.5 C#CCCCCCOCCOCC 34a_100000210136_100012094781 [0,0,0,0,0,0|3,0,1]=4 98 B12R0.5 C#CCCCCCOCCOCC 34a_100000766912_100000210147 [0,0,0,0,0,0|3,0,1]=4 99 B12R0.5 C#CCCCCCOCCOCC 7a_100000210136_100012094781 [0,0,0,0,0,0|3,0,1]=4 100 B12R0.5 C#CCCCCCOCCOCC 7a_100000766912_100011215890 [0,0,0,0,0,0|3,0,1]=4 101 B12R0.5 C#CCCCCCOCCSCC 34a_100000212035_100012094781 [0,0,0,0,0,0|3,0,1]=4 102 B12R0.5 C#CCCCCCOCCSCC 34a_100000766912_100000757381 [0,0,0,0,0,0|3,0,1]=4 103 B12R0.5 C#CCCCCCOCCSCC 7a_100000212035_100012094781 [0,0,0,0,0,0|3,0,1]=4 104 B12R0.5 C#CCCCCCOCCSCC 7a_100000766912_100000757381 [0,0,0,0,0,0|3,0,1]=4 105 B12R0.5 C#CCCCCCSCCCCC 62a_100000210326_100012094781 [0,0,0,0,0,0|2,0,1]=3 106 B12R0.5 C#CCCCCCSCCCCC 62a_100012094781_100000210326 [0,0,0,0,0,0|2,0,1]=3 107 B12R0.5 C#CCCCCCSCCCCF 62a_100000729493_100012094781 [0,0,0,0,0,0|2,0,2]=4 108 B12R0.5 C#CCCCCCSCCCCF 62a_100012094781_100000729493 [0,0,0,0,0,0|2,0,2]=4 109 B12R0.5 C#CCCCCCSCCCCO 62a_100000210776_100012094781 [0,0,0,0,0,0|1,0,2]=3 110 B12R0.5 C#CCCCCCSCCCCO 62a_100012094781_100000210776 [0,0,0,0,0,0|1,0,2]=3 111 B12R0.5 C#CCCCCCSCCCOC 62a_100000709357_100012094781 [0,0,0,0,0,0|3,0,1]=4 112 B12R0.5 C#CCCCCCSCCCOC 62a_100012094781_100000709357 [0,0,0,0,0,0|3,0,1]=4 113 B12R0.5 C#CCCCCCSCCOCC 62a_100000210147_100012094781 [0,0,0,0,0,0|3,0,1]=4 114 B12R0.5 C#CCCCCCSCCOCC 62a_100012094781_100011215890 [0,0,0,0,0,0|3,0,1]=4 115 B12R0.5 C#CCCCCCSCCSCC 62a_100000757381_100012094781 [0,0,0,0,0,0|3,0,1]=4 116 B12R0.5 C#CCCCCCSCCSCC 62a_100012094781_100000757381 [0,0,0,0,0,0|3,0,1]=4 117 B12R0.5 C#CCCCCNCCCCCC 2230a_100000210581_100010269958 [0,0,0,0,0,0|2,0,1]=3 118 B12R0.5 C#CCCCCNCCCCCC 2230a_100000706060_100000210314 [0,0,0,0,0,0|2,0,1]=3 119 B12R0.5 C#CCCCCNCCCCCC 34a_100000706060_100000210314 [0,0,0,0,0,0|2,0,1]=3 120 B12R0.5 C#CCCCCNCCCCCF 2230a_100000706060_100000729378 [0,0,0,0,0,0|2,0,2]=4 121 B12R0.5 C#CCCCCNCCCCCF 34a_100000706060_100000729378 [0,0,0,0,0,0|2,0,2]=4 122 B12R0.5 C#CCCCCNCCCCCO 2230a_100000706060_100000746330 [0,0,0,0,0,0|1,0,2]=3 123 B12R0.5 C#CCCCCNCCCCCO 2230a_100000762737_100010269958 [0,0,0,0,0,0|1,0,2]=3 124 B12R0.5 C#CCCCCNCCCCCO 34a_100000706060_100000746330 [0,0,0,0,0,0|1,0,2]=3 125 B12R0.5 C#CCCCCNCCCCCO 34a_100000762737_100010269958 [0,0,0,0,0,0|1,0,2]=3 126 B12R0.5 C#CCCCCNCCCCOC 2230a_100000706060_100000730899 [0,0,0,0,0,0|3,0,1]=4 127 B12R0.5 C#CCCCCNCCCCOC 34a_100000706060_100000755781 [0,0,0,0,0,0|3,0,1]=4 128 B12R0.5 C#CCCCCNCCCOCC 2230a_100000210961_100010269958 [0,0,0,0,0,0|3,0,1]=4 129 B12R0.5 C#CCCCCNCCCOCC 2230a_100000706060_100012232248 [0,0,0,0,0,0|3,0,1]=4 130 B12R0.5 C#CCCCCNCCCOCC 34a_100000210961_100010269958 [0,0,0,0,0,0|3,0,1]=4 131 B12R0.5 C#CCCCCNCCCOCC 34a_100000706060_100012232248 [0,0,0,0,0,0|3,0,1]=4 132 B12R0.5 C#CCCCCNCCOCCC 2230a_100000706060_100011215938 [0,0,0,0,0,0|3,0,1]=4 133 B12R0.5 C#CCCCCNCCOCCC 2230a_100161115042_100010269958 [0,0,0,0,0,0|3,0,1]=4 134 B12R0.5 C#CCCCCNCCOCCC 34a_100000706060_100011215938 [0,0,0,0,0,0|3,0,1]=4 135 B12R0.5 C#CCCCCNCCOCCC 34a_100161115042_100010269958 [0,0,0,0,0,0|3,0,1]=4 136 B12R0.5 C#CCCCCNCCOCCO 2230a_100000211614_100010269958 [0,0,0,0,0,0|2,0,2]=4 137 B12R0.5 C#CCCCCNCCOCCO 2230a_100000706060_100011215305 [0,0,0,0,0,0|2,0,2]=4 138 B12R0.5 C#CCCCCNCCOCCO 34a_100000211614_100010269958 [0,0,0,0,0,0|2,0,2]=4 139 B12R0.5 C#CCCCCNCCOCCO 34a_100000706060_100000692535 [0,0,0,0,0,0|2,0,2]=4 140 B12R0.5 C#CCCCCNCCSCCC 2230a_100020603323_100010269958 [0,0,0,0,0,0|3,0,1]=4 141 B12R0.5 C#CCCCCNCCSCCO 2230a_100011219999_100010269958 [0,0,0,0,0,0|2,0,2]=4 142 B12R0.5 C#CCCCCNCOCCCC 2230a_100000706060_100011995733 [0,0,0,0,0,0|3,0,1]=4 143 B12R0.5 C#CCCCCNCOCCCC 34a_100000706060_100011995733 [0,0,0,0,0,0|3,0,1]=4 144 B12R0.5 C#CCCCCOCCCCCBr 34a_100000746331_100010269958 [0,0,0,0,0,0|2,0,2]=4 145 B12R0.5 C#CCCCCOCCCCCBr 7a_100000746331_100010269958 [0,0,0,0,0,0|2,0,2]=4 146 B12R0.5 C#CCCCCOCCCCCC 34a_100000210259_100010269958 [0,0,0,0,0,0|2,0,1]=3 147 B12R0.5 C#CCCCCOCCCCCC 34a_100000766709_100000210314 [0,0,0,0,0,0|2,0,1]=3 148 B12R0.5 C#CCCCCOCCCCCC 7a_100000210259_100010269958 [0,0,0,0,0,0|2,0,1]=3 149 B12R0.5 C#CCCCCOCCCCCC 7a_100000766709_100000210314 [0,0,0,0,0,0|2,0,1]=3 150 B12R0.5 C#CCCCCOCCCCCCl 34a_100000746330_100010269958 [0,0,0,0,0,0|2,0,2]=4 151 B12R0.5 C#CCCCCOCCCCCCl 7a_100000746330_100010269958 [0,0,0,0,0,0|2,0,2]=4 152 B12R0.5 C#CCCCCOCCCCCF 34a_100000766709_100000729378 [0,0,0,0,0,0|2,0,2]=4 153 B12R0.5 C#CCCCCOCCCCCF 7a_100000766709_100000729378 [0,0,0,0,0,0|2,0,2]=4 154 B12R0.5 C#CCCCCOCCCCCI 34a_200012148887_100010269958 [0,0,0,0,0,0|2,0,2]=4 155 B12R0.5 C#CCCCCOCCCCCI 7a_200012148887_100010269958 [0,0,0,0,0,0|2,0,2]=4 156 B12R0.5 C#CCCCCOCCCCCN 34a_100000762737_100010269958 [0,0,0,0,0,0|2,0,2]=4 157 B12R0.5 C#CCCCCOCCCCCO 34a_100000766709_100000746330 [0,0,0,0,0,0|1,0,2]=3 158 B12R0.5 C#CCCCCOCCCCCO 7a_100000766709_100000746330 [0,0,0,0,0,0|1,0,2]=3 159 B12R0.5 C#CCCCCOCCCCOC 34a_100000740925_100010269958 [0,0,0,0,0,0|3,0,1]=4 160 B12R0.5 C#CCCCCOCCCCOC 34a_100000766709_100000755781 [0,0,0,0,0,0|3,0,1]=4 161 B12R0.5 C#CCCCCOCCCCOC 7a_100000766709_100000730899 [0,0,0,0,0,0|3,0,1]=4 162 B12R0.5 C#CCCCCOCCCCSC 34a_100011217163_100010269958 [0,0,0,0,0,0|3,0,1]=4 163 B12R0.5 C#CCCCCOCCCCSC 7a_100011217163_100010269958 [0,0,0,0,0,0|3,0,1]=4 164 B12R0.5 C#CCCCCOCCCOCC 34a_100000757476_100010269958 [0,0,0,0,0,0|3,0,1]=4 165 B12R0.5 C#CCCCCOCCCOCC 34a_100000766709_100012232248 [0,0,0,0,0,0|3,0,1]=4 166 B12R0.5 C#CCCCCOCCCOCC 7a_100000757476_100010269958 [0,0,0,0,0,0|3,0,1]=4 167 B12R0.5 C#CCCCCOCCCOCC 7a_100000766709_100012232248 [0,0,0,0,0,0|3,0,1]=4 168 B12R0.5 C#CCCCCOCCCSCC 34a_100011216438_100010269958 [0,0,0,0,0,0|3,0,1]=4 169 B12R0.5 C#CCCCCOCCCSCC 7a_100011216438_100010269958 [0,0,0,0,0,0|3,0,1]=4 170 B12R0.5 C#CCCCCOCCOCCC 34a_100000752267_100010269958 [0,0,0,0,0,0|3,0,1]=4 171 B12R0.5 C#CCCCCOCCOCCC 34a_100000766709_100011215938 [0,0,0,0,0,0|3,0,1]=4 172 B12R0.5 C#CCCCCOCCOCCC 7a_100000752267_100010269958 [0,0,0,0,0,0|3,0,1]=4 173 B12R0.5 C#CCCCCOCCOCCC 7a_100000766709_100011215938 [0,0,0,0,0,0|3,0,1]=4 174 B12R0.5 C#CCCCCOCCOCCO 34a_100000766709_100000692535 [0,0,0,0,0,0|2,0,2]=4 175 B12R0.5 C#CCCCCOCCOCCO 7a_100000766709_100011215305 [0,0,0,0,0,0|2,0,2]=4 176 B12R0.5 C#CCCCCOCCSCCC 34a_200000230433_100010269958 [0,0,0,0,0,0|3,0,1]=4 177 B12R0.5 C#CCCCCOCCSCCC 7a_200000230433_100010269958 [0,0,0,0,0,0|3,0,1]=4 178 B12R0.5 C#CCCCCOCOCCCC 34a_100000766709_100011995733 [0,0,0,0,0,0|3,0,1]=4 179 B12R0.5 C#CCCCCSCCCCCC 62a_100000210314_100010269958 [0,0,0,0,0,0|2,0,1]=3 180 B12R0.5 C#CCCCCSCCCCCC 62a_100010269958_100000210757 [0,0,0,0,0,0|2,0,1]=3 181 B12R0.5 C#CCCCCSCCCCCF 62a_100000729378_100010269958 [0,0,0,0,0,0|2,0,2]=4 182 B12R0.5 C#CCCCCSCCCCCF 62a_100010269958_100000729378 [0,0,0,0,0,0|2,0,2]=4 183 B12R0.5 C#CCCCCSCCCCCO 62a_100000746330_100010269958 [0,0,0,0,0,0|1,0,2]=3 184 B12R0.5 C#CCCCCSCCCCCO 62a_100010269958_100000746330 [0,0,0,0,0,0|1,0,2]=3 185 B12R0.5 C#CCCCCSCCCCOC 62a_100000730899_100010269958 [0,0,0,0,0,0|3,0,1]=4 186 B12R0.5 C#CCCCCSCCCCOC 62a_100010269958_100000730899 [0,0,0,0,0,0|3,0,1]=4 187 B12R0.5 C#CCCCCSCCCOCC 62a_100010269958_100012232248 [0,0,0,0,0,0|3,0,1]=4 188 B12R0.5 C#CCCCCSCCCOCC 62a_100012232248_100010269958 [0,0,0,0,0,0|3,0,1]=4 189 B12R0.5 C#CCCCCSCCOCCC 62a_100010269958_100011215938 [0,0,0,0,0,0|3,0,1]=4 190 B12R0.5 C#CCCCCSCCOCCC 62a_100011215938_100010269958 [0,0,0,0,0,0|3,0,1]=4 191 B12R0.5 C#CCCCCSCCOCCO 62a_100010269958_100011215305 [0,0,0,0,0,0|2,0,2]=4 192 B12R0.5 C#CCCCCSCCOCCO 62a_100011215305_100010269958 [0,0,0,0,0,0|2,0,2]=4 193 B12R0.5 C#CCCCCSCOCCCC 62a_100010269958_100011995733 [0,0,0,0,0,0|3,0,1]=4 194 B12R0.5 C#CCCCCSCOCCCC 62a_100011995733_100010269958 [0,0,0,0,0,0|3,0,1]=4 195 B12R0.5 C#CCCCNCCCCCCC 2230a_100000229938_100000731252 [0,0,0,0,0,0|2,0,1]=3 196 B12R0.5 C#CCCCNCCCCCCC 34a_100000718082_100000210614 [0,0,0,0,0,0|2,0,1]=3 197 B12R0.5 C#CCCCNCCCCCCF 34a_100000718082_100015922095 [0,0,0,0,0,0|2,0,2]=4 198 B12R0.5 C#CCCCNCCCCCCO 2230a_100000686447_100000731252 [0,0,0,0,0,0|1,0,2]=3 199 B12R0.5 C#CCCCNCCCCCCO 34a_100000686447_100000695029 [0,0,0,0,0,0|1,0,2]=3 200 B12R0.5 C#CCCCNCCCCCCO 34a_100000718082_100000766143 [0,0,0,0,0,0|1,0,2]=3 201 B12R0.5 C#CCCCNCCCCCOC 2230a_100000747528_100000731252 [0,0,0,0,0,0|3,0,1]=4 202 B12R0.5 C#CCCCNCCCCCOC 34a_100000747528_100000695029 [0,0,0,0,0,0|3,0,1]=4 203 B12R0.5 C#CCCCNCCCOCCC 2230a_100011217757_100000731252 [0,0,0,0,0,0|3,0,1]=4 204 B12R0.5 C#CCCCNCCCOCCC 34a_100011217757_100000695029 [0,0,0,0,0,0|3,0,1]=4 205 B12R0.5 C#CCCCNCCOCCCC 34a_100000718082_100000743108 [0,0,0,0,0,0|3,0,1]=4 206 B12R0.5 C#CCCCNCCSCCCC 2230a_100025743550_100000731252 [0,0,0,0,0,0|3,0,1]=4 207 B12R0.5 C#CCCCOCCCCCCBr 34a_100011215345_100000695029 [0,0,0,0,0,0|2,0,2]=4 208 B12R0.5 C#CCCCOCCCCCCBr 7a_100011215345_100011215417 [0,0,0,0,0,0|2,0,2]=4 209 B12R0.5 C#CCCCOCCCCCCC 34a_100000210272_100000695029 [0,0,0,0,0,0|2,0,1]=3 210 B12R0.5 C#CCCCOCCCCCCC 34a_100000215630_100000210614 [0,0,0,0,0,0|2,0,1]=3 211 B12R0.5 C#CCCCOCCCCCCC 7a_100000210272_100011215417 [0,0,0,0,0,0|2,0,1]=3 212 B12R0.5 C#CCCCOCCCCCCC 7a_100000215630_100000210614 [0,0,0,0,0,0|2,0,1]=3 213 B12R0.5 C#CCCCOCCCCCCCl 34a_100000766143_100000695029 [0,0,0,0,0,0|2,0,2]=4 214 B12R0.5 C#CCCCOCCCCCCCl 7a_100000766143_100011215417 [0,0,0,0,0,0|2,0,2]=4 215 B12R0.5 C#CCCCOCCCCCCF 34a_100000215630_100015922095 [0,0,0,0,0,0|2,0,2]=4 216 B12R0.5 C#CCCCOCCCCCCF 34a_100000732779_100000695029 [0,0,0,0,0,0|2,0,2]=4 217 B12R0.5 C#CCCCOCCCCCCF 7a_100000215630_100015922095 [0,0,0,0,0,0|2,0,2]=4 218 B12R0.5 C#CCCCOCCCCCCF 7a_100000732779_100011215417 [0,0,0,0,0,0|2,0,2]=4 219 B12R0.5 C#CCCCOCCCCCCN 34a_100000686447_100000695029 [0,0,0,0,0,0|2,0,2]=4 220 B12R0.5 C#CCCCOCCCCCCO 34a_100000215630_100000766143 [0,0,0,0,0,0|1,0,2]=3 221 B12R0.5 C#CCCCOCCCCCCO 7a_100000215630_100000766143 [0,0,0,0,0,0|1,0,2]=3 222 B12R0.5 C#CCCCOCCCCCNC 34a_100000722520_100000695029 [0,0,0,0,0,0|3,0,1]=4 223 B12R0.5 C#CCCCOCCOCCCC 34a_100000210238_100000695029 [0,0,0,0,0,0|3,0,1]=4 224 B12R0.5 C#CCCCOCCOCCCC 34a_100000215630_100000743108 [0,0,0,0,0,0|3,0,1]=4 225 B12R0.5 C#CCCCOCCOCCCC 7a_100000210238_100011215417 [0,0,0,0,0,0|3,0,1]=4 226 B12R0.5 C#CCCCOCCOCCCC 7a_100000215630_100000743108 [0,0,0,0,0,0|3,0,1]=4 227 B12R0.5 C#CCCCOCCSCCCC 34a_200000230436_100000695029 [0,0,0,0,0,0|3,0,1]=4 228 B12R0.5 C#CCCCOCCSCCCC 7a_200000230436_100011215417 [0,0,0,0,0,0|3,0,1]=4 229 B12R0.5 C#CCCCSCCCCCCC 62a_100000210614_100011215417 [0,0,0,0,0,0|2,0,1]=3 230 B12R0.5 C#CCCCSCCCCCCC 62a_100011215417_100000210316 [0,0,0,0,0,0|2,0,1]=3 231 B12R0.5 C#CCCCSCCCCCCF 62a_100011215417_100015922095 [0,0,0,0,0,0|2,0,2]=4 232 B12R0.5 C#CCCCSCCCCCCF 62a_100015922095_100011215417 [0,0,0,0,0,0|2,0,2]=4 233 B12R0.5 C#CCCCSCCCCCCO 62a_100000766143_100011215417 [0,0,0,0,0,0|1,0,2]=3 234 B12R0.5 C#CCCCSCCCCCCO 62a_100011215417_100000766143 [0,0,0,0,0,0|1,0,2]=3 235 B12R0.5 C#CCCCSCCOCCCC 62a_100000743108_100011215417 [0,0,0,0,0,0|3,0,1]=4 236 B12R0.5 C#CCCCSCCOCCCC 62a_100011215417_100000743108 [0,0,0,0,0,0|3,0,1]=4 237 B12R0.5 C#CCCNCCCCCCCC 2230a_100000229939_100000688953 [0,0,0,0,0,0|2,0,1]=3 238 B12R0.5 C#CCCNCCCCCCCC 34a_100000229939_100000688953 [0,0,0,0,0,0|2,0,1]=3 239 B12R0.5 C#CCCNCCCCCCCC 34a_100000755551_100000210759 [0,0,0,0,0,0|2,0,1]=3 240 B12R0.5 C#CCCNCCCCCCCO 2230a_100011996573_100000688953 [0,0,0,0,0,0|1,0,2]=3 241 B12R0.5 C#CCCNCCCCCCCO 34a_100000755551_100000760002 [0,0,0,0,0,0|1,0,2]=3 242 B12R0.5 C#CCCNCCCCCCCO 34a_100011996573_100000688953 [0,0,0,0,0,0|1,0,2]=3 243 B12R0.5 C#CCCNCCCCCCOC 34a_100000755551_100011998445 [0,0,0,0,0,0|3,0,1]=4 244 B12R0.5 C#CCCNCCCOCCCC 2230a_200000211371_100000688953 [0,0,0,0,0,0|3,0,1]=4 245 B12R0.5 C#CCCNCCCOCCCC 34a_200000211371_100000688953 [0,0,0,0,0,0|3,0,1]=4 246 B12R0.5 C#CCCNCCCOCCCO 2230a_100011310245_100000688953 [0,0,0,0,0,0|2,0,2]=4 247 B12R0.5 C#CCCNCCCOCCCO 34a_100011310245_100000688953 [0,0,0,0,0,0|2,0,2]=4 248 B12R0.5 C#CCCOCCCCCCCBr 34a_100000760002_100000688953 [0,0,0,0,0,0|2,0,2]=4 249 B12R0.5 C#CCCOCCCCCCCBr 7a_100000760002_100000688953 [0,0,0,0,0,0|2,0,2]=4 250 B12R0.5 C#CCCOCCCCCCCC 34a_100000210232_100000688953 [0,0,0,0,0,0|2,0,1]=3 251 B12R0.5 C#CCCOCCCCCCCC 34a_100011215631_100000210759 [0,0,0,0,0,0|2,0,1]=3 252 B12R0.5 C#CCCOCCCCCCCC 7a_100000210232_100000688953 [0,0,0,0,0,0|2,0,1]=3 253 B12R0.5 C#CCCOCCCCCCCN 34a_100011996573_100000688953 [0,0,0,0,0,0|2,0,2]=4 254 B12R0.5 C#CCCOCCCCCCCO 34a_100011215631_100000760002 [0,0,0,0,0,0|1,0,2]=3 255 B12R0.5 C#CCCOCCCCCCOC 34a_100011215631_100011998445 [0,0,0,0,0,0|3,0,1]=4 256 B12R0.5 C#CCCOCCCCCCOC 34a_200012092642_100000688953 [0,0,0,0,0,0|3,0,1]=4 257 B12R0.5 C#CCCOCCCCCCOC 7a_200012092642_100000688953 [0,0,0,0,0,0|3,0,1]=4 258 B12R0.5 C#CCCOCCCOCCCC 34a_200011215613_100000688953 [0,0,0,0,0,0|3,0,1]=4 259 B12R0.5 C#CCCOCCCOCCCC 7a_200011215613_100000688953 [0,0,0,0,0,0|3,0,1]=4 260 B12R0.5 C#CCCOCCNCCCCC 34a_100000224656_100000688953 [0,0,0,0,0,0|3,0,1]=4 261 B12R0.5 C#CCCOCCOCCCCC 34a_100011215259_100000688953 [0,0,0,0,0,0|3,0,1]=4 262 B12R0.5 C#CCCOCCOCCCCC 7a_100011215259_100000688953 [0,0,0,0,0,0|3,0,1]=4 263 B12R0.5 C#CCCSCCCCCCCC 62a_100000210759_100000688953 [0,0,0,0,0,0|2,0,1]=3 264 B12R0.5 C#CCCSCCCCCCCC 62a_100000688953_100000210317 [0,0,0,0,0,0|2,0,1]=3 265 B12R0.5 C#CCCSCCCCCCCO 62a_100000688953_100000760002 [0,0,0,0,0,0|1,0,2]=3 266 B12R0.5 C#CCCSCCCCCCCO 62a_100000760002_100000688953 [0,0,0,0,0,0|1,0,2]=3 267 B12R0.5 C#CCCSCCCCCCOC 62a_100000688953_100011998445 [0,0,0,0,0,0|3,0,1]=4 268 B12R0.5 C#CCCSCCCCCCOC 62a_100011998445_100000688953 [0,0,0,0,0,0|3,0,1]=4 269 B12R0.5 C#CCNCCCCCCCCC 2230a_100000212291_100000038162 [0,0,0,0,0,0|2,0,1]=3 270 B12R0.5 C#CCNCCCCCCCCC 34a_100000212058_100011214924 [0,0,0,0,0,0|2,0,1]=3 271 B12R0.5 C#CCNCCCCCCCCC 34a_100000212291_100000184674 [0,0,0,0,0,0|2,0,1]=3 272 B12R0.5 C#CCNCCCCCCCCO 2230a_102515433106_100000038162 [0,0,0,0,0,0|1,0,2]=3 273 B12R0.5 C#CCNCCCCCCCCO 34a_100000212058_100000033203 [0,0,0,0,0,0|1,0,2]=3 274 B12R0.5 C#CCNCCCCCCCCO 34a_102515433106_100000184674 [0,0,0,0,0,0|1,0,2]=3 275 B12R0.5 C#CCOCCCCCCCCBr 34a_100009813846_100000184674 [0,0,0,0,0,0|2,0,2]=4 276 B12R0.5 C#CCOCCCCCCCCBr 7a_100009813846_100000038162 [0,0,0,0,0,0|2,0,2]=4 277 B12R0.5 C#CCOCCCCCCCCC 34a_100000210247_100011214924 [0,0,0,0,0,0|2,0,1]=3 278 B12R0.5 C#CCOCCCCCCCCC 34a_100000210712_100000184674 [0,0,0,0,0,0|2,0,1]=3 279 B12R0.5 C#CCOCCCCCCCCC 7a_100000210712_100000038162 [0,0,0,0,0,0|2,0,1]=3 280 B12R0.5 C#CCOCCCCCCCCCl 34a_100000033203_100000184674 [0,0,0,0,0,0|2,0,2]=4 281 B12R0.5 C#CCOCCCCCCCCCl 7a_100000033203_100000038162 [0,0,0,0,0,0|2,0,2]=4 282 B12R0.5 C#CCOCCCCCCCCN 34a_102515433106_100000184674 [0,0,0,0,0,0|2,0,2]=4 283 B12R0.5 C#CCOCCCCCCCCO 34a_100000210247_100000033203 [0,0,0,0,0,0|1,0,2]=3 284 B12R0.5 C#CCOCCCCCCOCC 34a_200011021349_100000210202 [0,0,0,0,0,0|3,0,1]=4 285 B12R0.5 C#CCOCCCCCCOCC 7a_200011021349_100000210202 [0,0,0,0,0,0|3,0,1]=4 286 B12R0.5 C#CCOCCCCNCCCC 34a_200011216965_100000184674 [0,0,0,0,0,0|3,0,1]=4 287 B12R0.5 C#CCOCCCCOCCCC 34a_200000760531_100000184674 [0,0,0,0,0,0|3,0,1]=4 288 B12R0.5 C#CCOCCCCOCCCC 7a_200000760531_100000038162 [0,0,0,0,0,0|3,0,1]=4 289 B12R0.5 C#CCOCCNCCCCCC 2230a_100000210581_100010402529 [0,0,0,0,0,0|3,0,1]=4 290 B12R0.5 C#CCOCCNCCCCCC 2230a_100000700922_100000210314 [0,0,0,0,0,0|3,0,1]=4 291 B12R0.5 C#CCOCCNCCCCCC 34a_100000700922_100000210314 [0,0,0,0,0,0|3,0,1]=4 292 B12R0.5 C#CCOCCNCCCCCO 2230a_100000700922_100000746330 [0,0,0,0,0,0|2,0,2]=4 293 B12R0.5 C#CCOCCNCCCCCO 2230a_100000762737_100010402529 [0,0,0,0,0,0|2,0,2]=4 294 B12R0.5 C#CCOCCNCCCCCO 34a_100000700922_100000746330 [0,0,0,0,0,0|2,0,2]=4 295 B12R0.5 C#CCOCCNCCCCCO 34a_100000762737_100010402529 [0,0,0,0,0,0|2,0,2]=4 296 B12R0.5 C#CCOCCOCCCCCC 34a_100000054580_100000210314 [0,0,0,0,0,0|3,0,1]=4 297 B12R0.5 C#CCOCCOCCCCCC 34a_100000210259_100010402529 [0,0,0,0,0,0|3,0,1]=4 298 B12R0.5 C#CCOCCOCCCCCC 34a_100000691444_100000184674 [0,0,0,0,0,0|3,0,1]=4 299 B12R0.5 C#CCOCCOCCCCCC 7a_100000054580_100000210314 [0,0,0,0,0,0|3,0,1]=4 300 B12R0.5 C#CCOCCOCCCCCC 7a_100000210259_100010402529 [0,0,0,0,0,0|3,0,1]=4 301 B12R0.5 C#CCOCCOCCCCCC 7a_100000691444_100000038162 [0,0,0,0,0,0|3,0,1]=4 302 B12R0.5 C#CCOCCOCCCCCO 34a_100000054580_100000746330 [0,0,0,0,0,0|2,0,2]=4 303 B12R0.5 C#CCOCCOCCCCCO 7a_100000054580_100000746330 [0,0,0,0,0,0|2,0,2]=4 304 B12R0.5 C#CCOCCSCCCCCC 62a_100000210314_100010402529 [0,0,0,0,0,0|3,0,1]=4 305 B12R0.5 C#CCOCCSCCCCCC 62a_100010402529_100000210757 [0,0,0,0,0,0|3,0,1]=4 306 B12R0.5 C#CCOCCSCCCCCO 62a_100000746330_100010402529 [0,0,0,0,0,0|2,0,2]=4 307 B12R0.5 C#CCOCCSCCCCCO 62a_100010402529_100000746330 [0,0,0,0,0,0|2,0,2]=4 308 B12R0.5 C#CCSCCCCCCCCC 62a_100000038162_100000210670 [0,0,0,0,0,0|2,0,1]=3 309 B12R0.5 C#CCSCCCCCCCCO 62a_100000038162_100000033203 [0,0,0,0,0,0|1,0,2]=3 310 B12R0.5 C/C=C/CCOCCCCCCC 34a_100016278192_100000210614 [0,0,0,0,0,0|2,0,2]=4 311 B12R0.5 C/C=C/CCOCCCCCCF 34a_100016278192_100015922095 [0,0,0,0,0,0|2,0,2]=4 312 B12R0.5 C/C=C/CCOCCCCCCO 34a_100016278192_100000766143 [0,0,0,0,0,0|1,0,2]=3 313 B12R0.5 C/C=C/CNCCCCCCCC 34a_100000229939_100102629194 [0,0,0,0,0,0|2,0,2]=4 314 B12R0.5 C/C=C/CNCCCCCCCO 34a_100011996573_100102629194 [0,0,0,0,0,0|1,0,2]=3 315 B12R0.5 C/C=C/CNCCCOCCCO 34a_100011310245_100102629194 [0,0,0,0,0,0|2,0,2]=4 316 B12R0.5 C/C=C/COCCCCCCCBr 34a_100000760002_100102629194 [0,0,0,0,0,0|2,0,2]=4 317 B12R0.5 C/C=C/COCCCCCCCBr 7a_100000760002_100102629194 [0,0,0,0,0,0|2,0,2]=4 318 B12R0.5 C/C=C/COCCCCCCCC 34a_100000210232_100102629194 [0,0,0,0,0,0|2,0,2]=4 319 B12R0.5 C/C=C/COCCCCCCCC 34a_100016270725_100000210759 [0,0,0,0,0,0|2,0,2]=4 320 B12R0.5 C/C=C/COCCCCCCCC 7a_100000210232_100102629194 [0,0,0,0,0,0|2,0,2]=4 321 B12R0.5 C/C=C/COCCCCCCCN 34a_100011996573_100102629194 [0,0,0,0,0,0|2,0,2]=4 322 B12R0.5 C/C=C/COCCCCCCCO 34a_100016270725_100000760002 [0,0,0,0,0,0|1,0,2]=3 323 B12R0.5 C/C=C/CSCCCCCCCC 62a_100000210759_100102629194 [0,0,0,0,0,0|2,0,2]=4 324 B12R0.5 C/C=C/CSCCCCCCCC 62a_100102629194_100000210317 [0,0,0,0,0,0|2,0,2]=4 325 B12R0.5 C/C=C/CSCCCCCCCO 62a_100000760002_100102629194 [0,0,0,0,0,0|1,0,2]=3 326 B12R0.5 C/C=C/CSCCCCCCCO 62a_100102629194_100000760002 [0,0,0,0,0,0|1,0,2]=3 327 B12R0.5 C=CCCCCCCCCCNC 2230a_100000081888_200000210301 [0,0,0,0,0,0|2,0,1]=3 328 B12R0.5 C=CCCCCCCCCCNC 2230a_106832991635_100009814027 [0,0,0,0,0,0|2,0,1]=3 329 B12R0.5 C=CCCCCCCCCCNC 34a_100000081888_200000210301 [0,0,0,0,0,0|2,0,1]=3 330 B12R0.5 C=CCCCCCCCCCNC 34a_100102657272_100009814027 [0,0,0,0,0,0|2,0,1]=3 331 B12R0.5 C=CCCCCCCCCCNC 7a_106832991635_100009814027 [0,0,0,0,0,0|2,0,1]=3 332 B12R0.5 C=CCCCCCCCCCN[13CH3] 2230a_100000081888_200025704644 [0,0,0,0,0,0|2,0,1]=3 333 B12R0.5 C=CCCCCCCCCCN[13CH3] 34a_100000081888_200025704644 [0,0,0,0,0,0|2,0,1]=3 334 B12R0.5 C=CCCCCCCCCCOC 34a_100000038209_200000210301 [0,0,0,0,0,0|2,0,1]=3 335 B12R0.5 C=CCCCCCCCCCOC 34a_100138415774_100009814027 [0,0,0,0,0,0|2,0,1]=3 336 B12R0.5 C=CCCCCCCCCCOC 7a_100000038209_200000210301 [0,0,0,0,0,0|2,0,1]=3 337 B12R0.5 C=CCCCCCCCCCO[13CH3] 34a_100000038209_200025704644 [0,0,0,0,0,0|2,0,1]=3 338 B12R0.5 C=CCCCCCCCCCO[13CH3] 7a_100000038209_200025704644 [0,0,0,0,0,0|2,0,1]=3 339 B12R0.5 C=CCCCCCCCCCSC 62a_100009814027_200000210301 [0,0,0,0,0,0|2,0,1]=3 340 B12R0.5 C=CCCCCCCCCCSC 62a_200000210301_100009814027 [0,0,0,0,0,0|2,0,1]=3 341 B12R0.5 C=CCCCCCCCCCS[13CH3] 62a_100009814027_200025704644 [0,0,0,0,0,0|2,0,1]=3 342 B12R0.5 C=CCCCCCCCCCS[13CH3] 62a_200025704644_100009814027 [0,0,0,0,0,0|2,0,1]=3 343 B12R0.5 C=CCCCCCCCCNCC 2230a_100015525214_100011933949 [0,0,0,0,0,0|2,0,1]=3 344 B12R0.5 C=CCCCCCCCCOCC 34a_100011215194_100000210202 [0,0,0,0,0,0|2,0,1]=3 345 B12R0.5 C=CCCCCCCCCOCC 34a_100121572206_100011933949 [0,0,0,0,0,0|2,0,1]=3 346 B12R0.5 C=CCCCCCCCCOCC 7a_100011215194_100000210202 [0,0,0,0,0,0|2,0,1]=3 347 B12R0.5 C=CCCCCCCCCOCF 34a_100011215194_100015361967 [0,0,0,0,0,0|2,0,2]=4 348 B12R0.5 C=CCCCCCCCCOCF 7a_100011215194_100015361967 [0,0,0,0,0,0|2,0,2]=4 349 B12R0.5 C=CCCCCCCCCSCC 62a_100000210202_100011933949 [0,0,0,0,0,0|2,0,1]=3 350 B12R0.5 C=CCCCCCCCCSCC 62a_100011933949_100000210202 [0,0,0,0,0,0|2,0,1]=3 351 B12R0.5 C=CCCCCCCCCSCF 62a_100011933949_100015361967 [0,0,0,0,0,0|2,0,2]=4 352 B12R0.5 C=CCCCCCCCCSCF 62a_100015361967_100011933949 [0,0,0,0,0,0|2,0,2]=4 353 B12R0.5 C=CCCCCCCCNCCF 34a_100000724931_100012355270 [0,0,0,0,0,0|2,0,2]=4 354 B12R0.5 C=CCCCCCCCNCCO 2230a_100016997473_100012355270 [0,0,0,0,0,0|1,0,2]=3 355 B12R0.5 C=CCCCCCCCNCCO 34a_100016990907_100012355270 [0,0,0,0,0,0|1,0,2]=3 356 B12R0.5 C=CCCCCCCCOCCBr 34a_100000211926_100012355270 [0,0,0,0,0,0|2,0,2]=4 357 B12R0.5 C=CCCCCCCCOCCC 34a_100000210258_100012355270 [0,0,0,0,0,0|2,0,1]=3 358 B12R0.5 C=CCCCCCCCOCCC 34a_100000730831_100000210303 [0,0,0,0,0,0|2,0,1]=3 359 B12R0.5 C=CCCCCCCCOCCC 7a_100000730831_100000210303 [0,0,0,0,0,0|2,0,1]=3 360 B12R0.5 C=CCCCCCCCOCCF 34a_100000730831_100011217306 [0,0,0,0,0,0|2,0,2]=4 361 B12R0.5 C=CCCCCCCCOCCF 7a_100000730831_100011217306 [0,0,0,0,0,0|2,0,2]=4 362 B12R0.5 C=CCCCCCCCOCCN 34a_100000210304_100012355270 [0,0,0,0,0,0|2,0,2]=4 363 B12R0.5 C=CCCCCCCCOCCO 34a_100000730831_100000211926 [0,0,0,0,0,0|1,0,2]=3 364 B12R0.5 C=CCCCCCCCOCCO 7a_100000730831_100000211926 [0,0,0,0,0,0|1,0,2]=3 365 B12R0.5 C=CCCCCCCCOCSC 34a_100000730831_100011218213 [0,0,0,0,0,0|3,0,1]=4 366 B12R0.5 C=CCCCCCCCSCCC 62a_100000210303_100012355270 [0,0,0,0,0,0|2,0,1]=3 367 B12R0.5 C=CCCCCCCCSCCC 62a_100012355270_100000210303 [0,0,0,0,0,0|2,0,1]=3 368 B12R0.5 C=CCCCCCCCSCCF 62a_100011217306_100012355270 [0,0,0,0,0,0|2,0,2]=4 369 B12R0.5 C=CCCCCCCCSCCF 62a_100012355270_100011217306 [0,0,0,0,0,0|2,0,2]=4 370 B12R0.5 C=CCCCCCCCSCCO 62a_100000211926_100012355270 [0,0,0,0,0,0|1,0,2]=3 371 B12R0.5 C=CCCCCCCCSCCO 62a_100012355270_100000211926 [0,0,0,0,0,0|1,0,2]=3 372 B12R0.5 C=CCCCCCCCSCOC 62a_100000766300_100012355270 [0,0,0,0,0,0|3,0,1]=4 373 B12R0.5 C=CCCCCCCCSCOC 62a_100012355270_100000766300 [0,0,0,0,0,0|3,0,1]=4 374 B12R0.5 C=CCCCCCCCSCSC 62a_100011218213_100012355270 [0,0,0,0,0,0|3,0,1]=4 375 B12R0.5 C=CCCCCCCCSCSC 62a_100012355270_100011218213 [0,0,0,0,0,0|3,0,1]=4 376 B12R0.5 C=CCCCCCCNCCCC 2230a_100000102301_100011215473 [0,0,0,0,0,0|2,0,1]=3 377 B12R0.5 C=CCCCCCCNCCCC 7a_106832991798_100011215473 [0,0,0,0,0,0|2,0,1]=3 378 B12R0.5 C=CCCCCCCNCCCF 2230a_100015189416_100011215473 [0,0,0,0,0,0|2,0,2]=4 379 B12R0.5 C=CCCCCCCNCCCF 34a_100015189416_100011215473 [0,0,0,0,0,0|2,0,2]=4 380 B12R0.5 C=CCCCCCCNCCOC 2230a_100000209980_100011215473 [0,0,0,0,0,0|3,0,1]=4 381 B12R0.5 C=CCCCCCCNCCSC 2230a_100020590264_100011215473 [0,0,0,0,0,0|3,0,1]=4 382 B12R0.5 C=CCCCCCCOCCCBr 34a_100011217188_100011215473 [0,0,0,0,0,0|2,0,2]=4 383 B12R0.5 C=CCCCCCCOCCCC 34a_100000210227_100011215473 [0,0,0,0,0,0|2,0,1]=3 384 B12R0.5 C=CCCCCCCOCCCC 34a_200011216477_100000210210 [0,0,0,0,0,0|2,0,1]=3 385 B12R0.5 C=CCCCCCCOCCCC 7a_100000210227_100011215473 [0,0,0,0,0,0|2,0,1]=3 386 B12R0.5 C=CCCCCCCOCCCC 7a_200011216477_100000210211 [0,0,0,0,0,0|2,0,1]=3 387 B12R0.5 C=CCCCCCCOCCCCl 34a_100000230001_100011215473 [0,0,0,0,0,0|2,0,2]=4 388 B12R0.5 C=CCCCCCCOCCCF 34a_100000759539_100011215473 [0,0,0,0,0,0|2,0,2]=4 389 B12R0.5 C=CCCCCCCOCCCF 34a_200011216477_100011934791 [0,0,0,0,0,0|2,0,2]=4 390 B12R0.5 C=CCCCCCCOCCCF 7a_200011216477_100011934791 [0,0,0,0,0,0|2,0,2]=4 391 B12R0.5 C=CCCCCCCOCCCN 34a_100000182051_100011215473 [0,0,0,0,0,0|2,0,2]=4 392 B12R0.5 C=CCCCCCCOCCCO 34a_200011216477_100000230001 [0,0,0,0,0,0|1,0,2]=3 393 B12R0.5 C=CCCCCCCOCCCO 7a_200011216477_100011215043 [0,0,0,0,0,0|1,0,2]=3 394 B12R0.5 C=CCCCCCCOCCOC 34a_100000210237_100011215473 [0,0,0,0,0,0|3,0,1]=4 395 B12R0.5 C=CCCCCCCOCCOC 34a_200011216477_100011201679 [0,0,0,0,0,0|3,0,1]=4 396 B12R0.5 C=CCCCCCCOCCOC 7a_200011216477_100000233755 [0,0,0,0,0,0|3,0,1]=4 397 B12R0.5 C=CCCCCCCOCCSC 34a_100000230434_100011215473 [0,0,0,0,0,0|3,0,1]=4 398 B12R0.5 C=CCCCCCCOCCSC 34a_200011216477_100000212216 [0,0,0,0,0,0|3,0,1]=4 399 B12R0.5 C=CCCCCCCOCCSC 7a_100000230434_100011215473 [0,0,0,0,0,0|3,0,1]=4 400 B12R0.5 C=CCCCCCCOCCSC 7a_200011216477_100000212216 [0,0,0,0,0,0|3,0,1]=4 401 B12R0.5 C=CCCCCCCSCCCC 62a_100000210211_100011215473 [0,0,0,0,0,0|2,0,1]=3 402 B12R0.5 C=CCCCCCCSCCCC 62a_100011215473_100000210210 [0,0,0,0,0,0|2,0,1]=3 403 B12R0.5 C=CCCCCCCSCCCF 62a_100011215473_100011934791 [0,0,0,0,0,0|2,0,2]=4 404 B12R0.5 C=CCCCCCCSCCCF 62a_100011934791_100011215473 [0,0,0,0,0,0|2,0,2]=4 405 B12R0.5 C=CCCCCCCSCCCO 62a_100011215043_100011215473 [0,0,0,0,0,0|1,0,2]=3 406 B12R0.5 C=CCCCCCCSCCCO 62a_100011215473_100011215043 [0,0,0,0,0,0|1,0,2]=3 407 B12R0.5 C=CCCCCCCSCCOC 62a_100000233755_100011215473 [0,0,0,0,0,0|3,0,1]=4 408 B12R0.5 C=CCCCCCCSCCOC 62a_100011215473_100000233755 [0,0,0,0,0,0|3,0,1]=4 409 B12R0.5 C=CCCCCCCSCCSC 62a_100000212216_100011215473 [0,0,0,0,0,0|3,0,1]=4 410 B12R0.5 C=CCCCCCCSCCSC 62a_100011215473_100000751147 [0,0,0,0,0,0|3,0,1]=4 411 B12R0.5 C=CCCCCCCSCOCC 62a_100000739092_100011215473 [0,0,0,0,0,0|3,0,1]=4 412 B12R0.5 C=CCCCCCCSCOCC 62a_100011215473_100000739092 [0,0,0,0,0,0|3,0,1]=4 413 B12R0.5 C=CCCCCCNCCCCC 2230a_100000209983_100000700193 [0,0,0,0,0,0|2,0,1]=3 414 B12R0.5 C=CCCCCCNCCCCO 2230a_100000750430_100000700193 [0,0,0,0,0,0|1,0,2]=3 415 B12R0.5 C=CCCCCCNCCCCO 34a_100000750430_100000700193 [0,0,0,0,0,0|1,0,2]=3 416 B12R0.5 C=CCCCCCNCCCOC 34a_100150723488_100000700193 [0,0,0,0,0,0|3,0,1]=4 417 B12R0.5 C=CCCCCCNCCCSC 2230a_100000749238_100000700193 [0,0,0,0,0,0|3,0,1]=4 418 B12R0.5 C=CCCCCCNCCOCC 2230a_102516460346_100000700193 [0,0,0,0,0,0|3,0,1]=4 419 B12R0.5 C=CCCCCCNCCOCC 34a_102516460346_100000700193 [0,0,0,0,0,0|3,0,1]=4 420 B12R0.5 C=CCCCCCNCCSCC 2230a_100000106463_100000700193 [0,0,0,0,0,0|3,0,1]=4 421 B12R0.5 C=CCCCCCOCCCCBr 34a_100011216708_100000700193 [0,0,0,0,0,0|2,0,2]=4 422 B12R0.5 C=CCCCCCOCCCCC 34a_100000210253_100000700193 [0,0,0,0,0,0|2,0,1]=3 423 B12R0.5 C=CCCCCCOCCCCC 34a_100011216702_100000718602 [0,0,0,0,0,0|2,0,1]=3 424 B12R0.5 C=CCCCCCOCCCCC 7a_100000210253_100000700193 [0,0,0,0,0,0|2,0,1]=3 425 B12R0.5 C=CCCCCCOCCCCC 7a_100011216702_100000210326 [0,0,0,0,0,0|2,0,1]=3 426 B12R0.5 C=CCCCCCOCCCCCl 34a_100000210776_100000700193 [0,0,0,0,0,0|2,0,2]=4 427 B12R0.5 C=CCCCCCOCCCCCl 7a_100000210776_100000700193 [0,0,0,0,0,0|2,0,2]=4 428 B12R0.5 C=CCCCCCOCCCCF 34a_100011216702_100000729493 [0,0,0,0,0,0|2,0,2]=4 429 B12R0.5 C=CCCCCCOCCCCF 34a_100011995726_100000700193 [0,0,0,0,0,0|2,0,2]=4 430 B12R0.5 C=CCCCCCOCCCCF 7a_100011216702_100000729493 [0,0,0,0,0,0|2,0,2]=4 431 B12R0.5 C=CCCCCCOCCCCF 7a_100011995726_100000700193 [0,0,0,0,0,0|2,0,2]=4 432 B12R0.5 C=CCCCCCOCCCCI 34a_200012148704_100000700193 [0,0,0,0,0,0|2,0,2]=4 433 B12R0.5 C=CCCCCCOCCCCN 34a_100000750430_100000700193 [0,0,0,0,0,0|2,0,2]=4 434 B12R0.5 C=CCCCCCOCCCCO 34a_100011216702_100011216708 [0,0,0,0,0,0|1,0,2]=3 435 B12R0.5 C=CCCCCCOCCCCO 7a_100011216702_100000210776 [0,0,0,0,0,0|1,0,2]=3 436 B12R0.5 C=CCCCCCOCCCNC 34a_100000213112_100000700193 [0,0,0,0,0,0|3,0,1]=4 437 B12R0.5 C=CCCCCCOCCCOC 34a_100000740835_100000700193 [0,0,0,0,0,0|3,0,1]=4 438 B12R0.5 C=CCCCCCOCCCOC 34a_100011216702_100000740836 [0,0,0,0,0,0|3,0,1]=4 439 B12R0.5 C=CCCCCCOCCCOC 7a_100011216702_100000740836 [0,0,0,0,0,0|3,0,1]=4 440 B12R0.5 C=CCCCCCOCCCSC 34a_100000690336_100000700193 [0,0,0,0,0,0|3,0,1]=4 441 B12R0.5 C=CCCCCCOCCCSC 7a_100000690336_100000700193 [0,0,0,0,0,0|3,0,1]=4 442 B12R0.5 C=CCCCCCOCCOCC 34a_100000210136_100000700193 [0,0,0,0,0,0|3,0,1]=4 443 B12R0.5 C=CCCCCCOCCOCC 34a_100011216702_100000210147 [0,0,0,0,0,0|3,0,1]=4 444 B12R0.5 C=CCCCCCOCCOCC 7a_100000210136_100000700193 [0,0,0,0,0,0|3,0,1]=4 445 B12R0.5 C=CCCCCCOCCOCC 7a_100011216702_100011215890 [0,0,0,0,0,0|3,0,1]=4 446 B12R0.5 C=CCCCCCOCCSCC 34a_100000212035_100000700193 [0,0,0,0,0,0|3,0,1]=4 447 B12R0.5 C=CCCCCCOCCSCC 34a_100011216702_100000757381 [0,0,0,0,0,0|3,0,1]=4 448 B12R0.5 C=CCCCCCOCCSCC 7a_100000212035_100000700193 [0,0,0,0,0,0|3,0,1]=4 449 B12R0.5 C=CCCCCCOCCSCC 7a_100011216702_100000757381 [0,0,0,0,0,0|3,0,1]=4 450 B12R0.5 C=CCCCCCSCCCCC 62a_100000210326_100000700193 [0,0,0,0,0,0|2,0,1]=3 451 B12R0.5 C=CCCCCCSCCCCC 62a_100000700193_100000210326 [0,0,0,0,0,0|2,0,1]=3 452 B12R0.5 C=CCCCCCSCCCCF 62a_100000700193_100000729493 [0,0,0,0,0,0|2,0,2]=4 453 B12R0.5 C=CCCCCCSCCCCF 62a_100000729493_100000700193 [0,0,0,0,0,0|2,0,2]=4 454 B12R0.5 C=CCCCCCSCCCCO 62a_100000210776_100000700193 [0,0,0,0,0,0|1,0,2]=3 455 B12R0.5 C=CCCCCCSCCCCO 62a_100000700193_100000210776 [0,0,0,0,0,0|1,0,2]=3 456 B12R0.5 C=CCCCCCSCCCOC 62a_100000700193_100000709357 [0,0,0,0,0,0|3,0,1]=4 457 B12R0.5 C=CCCCCCSCCCOC 62a_100000709357_100000700193 [0,0,0,0,0,0|3,0,1]=4 458 B12R0.5 C=CCCCCCSCCOCC 62a_100000210147_100000700193 [0,0,0,0,0,0|3,0,1]=4 459 B12R0.5 C=CCCCCCSCCOCC 62a_100000700193_100011215890 [0,0,0,0,0,0|3,0,1]=4 460 B12R0.5 C=CCCCCCSCCSCC 62a_100000700193_100000757381 [0,0,0,0,0,0|3,0,1]=4 461 B12R0.5 C=CCCCCCSCCSCC 62a_100000757381_100000700193 [0,0,0,0,0,0|3,0,1]=4 462 B12R0.5 C=CCCCCNCCCCCC 2230a_100000210581_100011215482 [0,0,0,0,0,0|2,0,1]=3 463 B12R0.5 C=CCCCCNCCCCCC 2230a_100000703577_100000210314 [0,0,0,0,0,0|2,0,1]=3 464 B12R0.5 C=CCCCCNCCCCCC 34a_100000703577_100000210314 [0,0,0,0,0,0|2,0,1]=3 465 B12R0.5 C=CCCCCNCCCCCF 2230a_100000703577_100000729378 [0,0,0,0,0,0|2,0,2]=4 466 B12R0.5 C=CCCCCNCCCCCF 34a_100000703577_100000729378 [0,0,0,0,0,0|2,0,2]=4 467 B12R0.5 C=CCCCCNCCCCCO 2230a_100000703577_100000746330 [0,0,0,0,0,0|1,0,2]=3 468 B12R0.5 C=CCCCCNCCCCCO 2230a_100000762737_100011215482 [0,0,0,0,0,0|1,0,2]=3 469 B12R0.5 C=CCCCCNCCCCCO 34a_100000703577_100000746330 [0,0,0,0,0,0|1,0,2]=3 470 B12R0.5 C=CCCCCNCCCCCO 34a_100000762737_100011215482 [0,0,0,0,0,0|1,0,2]=3 471 B12R0.5 C=CCCCCNCCCCOC 2230a_100000703577_100000730899 [0,0,0,0,0,0|3,0,1]=4 472 B12R0.5 C=CCCCCNCCCCOC 34a_100000703577_100000755781 [0,0,0,0,0,0|3,0,1]=4 473 B12R0.5 C=CCCCCNCCCOCC 2230a_100000210961_100011215482 [0,0,0,0,0,0|3,0,1]=4 474 B12R0.5 C=CCCCCNCCCOCC 2230a_100000703577_100012232248 [0,0,0,0,0,0|3,0,1]=4 475 B12R0.5 C=CCCCCNCCCOCC 34a_100000210961_100011215482 [0,0,0,0,0,0|3,0,1]=4 476 B12R0.5 C=CCCCCNCCCOCC 34a_100000703577_100012232248 [0,0,0,0,0,0|3,0,1]=4 477 B12R0.5 C=CCCCCNCCOCCC 2230a_100000703577_100011215938 [0,0,0,0,0,0|3,0,1]=4 478 B12R0.5 C=CCCCCNCCOCCC 2230a_100161115042_100011215482 [0,0,0,0,0,0|3,0,1]=4 479 B12R0.5 C=CCCCCNCCOCCC 34a_100000703577_100011215938 [0,0,0,0,0,0|3,0,1]=4 480 B12R0.5 C=CCCCCNCCOCCC 34a_100161115042_100011215482 [0,0,0,0,0,0|3,0,1]=4 481 B12R0.5 C=CCCCCNCCOCCO 2230a_100000211614_100011215482 [0,0,0,0,0,0|2,0,2]=4 482 B12R0.5 C=CCCCCNCCOCCO 2230a_100000703577_100011215305 [0,0,0,0,0,0|2,0,2]=4 483 B12R0.5 C=CCCCCNCCOCCO 34a_100000211614_100011215482 [0,0,0,0,0,0|2,0,2]=4 484 B12R0.5 C=CCCCCNCCOCCO 34a_100000703577_100000692535 [0,0,0,0,0,0|2,0,2]=4 485 B12R0.5 C=CCCCCNCCSCCC 2230a_100020603323_100011215482 [0,0,0,0,0,0|3,0,1]=4 486 B12R0.5 C=CCCCCNCCSCCO 2230a_100011219999_100011215482 [0,0,0,0,0,0|2,0,2]=4 487 B12R0.5 C=CCCCCNCOCCCC 2230a_100000703577_100011995733 [0,0,0,0,0,0|3,0,1]=4 488 B12R0.5 C=CCCCCNCOCCCC 34a_100000703577_100011995733 [0,0,0,0,0,0|3,0,1]=4 489 B12R0.5 C=CCCCCOCCCCCBr 34a_100000746331_100011215482 [0,0,0,0,0,0|2,0,2]=4 490 B12R0.5 C=CCCCCOCCCCCBr 7a_100000746331_100011215482 [0,0,0,0,0,0|2,0,2]=4 491 B12R0.5 C=CCCCCOCCCCCC 34a_100000210259_100011215482 [0,0,0,0,0,0|2,0,1]=3 492 B12R0.5 C=CCCCCOCCCCCC 34a_100000766645_100000210314 [0,0,0,0,0,0|2,0,1]=3 493 B12R0.5 C=CCCCCOCCCCCC 7a_100000210259_100011215482 [0,0,0,0,0,0|2,0,1]=3 494 B12R0.5 C=CCCCCOCCCCCC 7a_100000766645_100000210314 [0,0,0,0,0,0|2,0,1]=3 495 B12R0.5 C=CCCCCOCCCCCCl 34a_100000746330_100011215482 [0,0,0,0,0,0|2,0,2]=4 496 B12R0.5 C=CCCCCOCCCCCCl 7a_100000746330_100011215482 [0,0,0,0,0,0|2,0,2]=4 497 B12R0.5 C=CCCCCOCCCCCF 34a_100000766645_100000729378 [0,0,0,0,0,0|2,0,2]=4 498 B12R0.5 C=CCCCCOCCCCCF 7a_100000766645_100000729378 [0,0,0,0,0,0|2,0,2]=4 499 B12R0.5 C=CCCCCOCCCCCI 34a_200012148887_100011215482 [0,0,0,0,0,0|2,0,2]=4 500 B12R0.5 C=CCCCCOCCCCCI 7a_200012148887_100011215482 [0,0,0,0,0,0|2,0,2]=4 501 B12R0.5 C=CCCCCOCCCCCN 34a_100000762737_100011215482 [0,0,0,0,0,0|2,0,2]=4 502 B12R0.5 C=CCCCCOCCCCCO 34a_100000766645_100000746330 [0,0,0,0,0,0|1,0,2]=3 503 B12R0.5 C=CCCCCOCCCCCO 7a_100000766645_100000746330 [0,0,0,0,0,0|1,0,2]=3 504 B12R0.5 C=CCCCCOCCCCOC 34a_100000740925_100011215482 [0,0,0,0,0,0|3,0,1]=4 505 B12R0.5 C=CCCCCOCCCCOC 34a_100000766645_100000755781 [0,0,0,0,0,0|3,0,1]=4 506 B12R0.5 C=CCCCCOCCCCOC 7a_100000766645_100000730899 [0,0,0,0,0,0|3,0,1]=4 507 B12R0.5 C=CCCCCOCCCCSC 34a_100011217163_100011215482 [0,0,0,0,0,0|3,0,1]=4 508 B12R0.5 C=CCCCCOCCCCSC 7a_100011217163_100011215482 [0,0,0,0,0,0|3,0,1]=4 509 B12R0.5 C=CCCCCOCCCOCC 34a_100000757476_100011215482 [0,0,0,0,0,0|3,0,1]=4 510 B12R0.5 C=CCCCCOCCCOCC 34a_100000766645_100012232248 [0,0,0,0,0,0|3,0,1]=4 511 B12R0.5 C=CCCCCOCCCOCC 7a_100000757476_100011215482 [0,0,0,0,0,0|3,0,1]=4 512 B12R0.5 C=CCCCCOCCCOCC 7a_100000766645_100012232248 [0,0,0,0,0,0|3,0,1]=4 513 B12R0.5 C=CCCCCOCCCSCC 34a_100011216438_100011215482 [0,0,0,0,0,0|3,0,1]=4 514 B12R0.5 C=CCCCCOCCCSCC 7a_100011216438_100011215482 [0,0,0,0,0,0|3,0,1]=4 515 B12R0.5 C=CCCCCOCCOCCC 34a_100000752267_100011215482 [0,0,0,0,0,0|3,0,1]=4 516 B12R0.5 C=CCCCCOCCOCCC 34a_100000766645_100011215938 [0,0,0,0,0,0|3,0,1]=4 517 B12R0.5 C=CCCCCOCCOCCC 7a_100000752267_100011215482 [0,0,0,0,0,0|3,0,1]=4 518 B12R0.5 C=CCCCCOCCOCCC 7a_100000766645_100011215938 [0,0,0,0,0,0|3,0,1]=4 519 B12R0.5 C=CCCCCOCCOCCO 34a_100000766645_100000692535 [0,0,0,0,0,0|2,0,2]=4 520 B12R0.5 C=CCCCCOCCOCCO 7a_100000766645_100011215305 [0,0,0,0,0,0|2,0,2]=4 521 B12R0.5 C=CCCCCOCCSCCC 34a_200000230433_100011215482 [0,0,0,0,0,0|3,0,1]=4 522 B12R0.5 C=CCCCCOCCSCCC 7a_200000230433_100011215482 [0,0,0,0,0,0|3,0,1]=4 523 B12R0.5 C=CCCCCOCOCCCC 34a_100000766645_100011995733 [0,0,0,0,0,0|3,0,1]=4 524 B12R0.5 C=CCCCCSCCCCCC 62a_100000210314_100011215482 [0,0,0,0,0,0|2,0,1]=3 525 B12R0.5 C=CCCCCSCCCCCC 62a_100011215482_100000210757 [0,0,0,0,0,0|2,0,1]=3 526 B12R0.5 C=CCCCCSCCCCCF 62a_100000729378_100011215482 [0,0,0,0,0,0|2,0,2]=4 527 B12R0.5 C=CCCCCSCCCCCF 62a_100011215482_100000729378 [0,0,0,0,0,0|2,0,2]=4 528 B12R0.5 C=CCCCCSCCCCCO 62a_100000746330_100011215482 [0,0,0,0,0,0|1,0,2]=3 529 B12R0.5 C=CCCCCSCCCCCO 62a_100011215482_100000746330 [0,0,0,0,0,0|1,0,2]=3 530 B12R0.5 C=CCCCCSCCCCOC 62a_100000730899_100011215482 [0,0,0,0,0,0|3,0,1]=4 531 B12R0.5 C=CCCCCSCCCCOC 62a_100011215482_100000730899 [0,0,0,0,0,0|3,0,1]=4 532 B12R0.5 C=CCCCCSCCCOCC 62a_100011215482_100012232248 [0,0,0,0,0,0|3,0,1]=4 533 B12R0.5 C=CCCCCSCCCOCC 62a_100012232248_100011215482 [0,0,0,0,0,0|3,0,1]=4 534 B12R0.5 C=CCCCCSCCOCCC 62a_100011215482_100011215938 [0,0,0,0,0,0|3,0,1]=4 535 B12R0.5 C=CCCCCSCCOCCC 62a_100011215938_100011215482 [0,0,0,0,0,0|3,0,1]=4 536 B12R0.5 C=CCCCCSCCOCCO 62a_100011215305_100011215482 [0,0,0,0,0,0|2,0,2]=4 537 B12R0.5 C=CCCCCSCCOCCO 62a_100011215482_100011215305 [0,0,0,0,0,0|2,0,2]=4 538 B12R0.5 C=CCCCCSCOCCCC 62a_100011215482_100011995733 [0,0,0,0,0,0|3,0,1]=4 539 B12R0.5 C=CCCCCSCOCCCC 62a_100011995733_100011215482 [0,0,0,0,0,0|3,0,1]=4 540 B12R0.5 C=CCCCNCCCCCCC 2230a_100000229938_100011713584 [0,0,0,0,0,0|2,0,1]=3 541 B12R0.5 C=CCCCNCCCCCCC 2230a_100000700776_100000210681 [0,0,0,0,0,0|2,0,1]=3 542 B12R0.5 C=CCCCNCCCCCCC 34a_100000700776_100000210614 [0,0,0,0,0,0|2,0,1]=3 543 B12R0.5 C=CCCCNCCCCCCF 2230a_100000700776_100015922095 [0,0,0,0,0,0|2,0,2]=4 544 B12R0.5 C=CCCCNCCCCCCF 34a_100000700776_100015922095 [0,0,0,0,0,0|2,0,2]=4 545 B12R0.5 C=CCCCNCCCCCCO 2230a_100000686447_100011713584 [0,0,0,0,0,0|1,0,2]=3 546 B12R0.5 C=CCCCNCCCCCCO 2230a_100000700776_100000766143 [0,0,0,0,0,0|1,0,2]=3 547 B12R0.5 C=CCCCNCCCCCCO 34a_100000686447_100000757094 [0,0,0,0,0,0|1,0,2]=3 548 B12R0.5 C=CCCCNCCCCCCO 34a_100000700776_100000766143 [0,0,0,0,0,0|1,0,2]=3 549 B12R0.5 C=CCCCNCCCCCOC 2230a_100000747528_100011713584 [0,0,0,0,0,0|3,0,1]=4 550 B12R0.5 C=CCCCNCCCCCOC 34a_100000747528_100000757094 [0,0,0,0,0,0|3,0,1]=4 551 B12R0.5 C=CCCCNCCCOCCC 2230a_100011217757_100011713584 [0,0,0,0,0,0|3,0,1]=4 552 B12R0.5 C=CCCCNCCCOCCC 34a_100011217757_100000757094 [0,0,0,0,0,0|3,0,1]=4 553 B12R0.5 C=CCCCNCCOCCCC 2230a_100000700776_100000743108 [0,0,0,0,0,0|3,0,1]=4 554 B12R0.5 C=CCCCNCCOCCCC 34a_100000700776_100000743108 [0,0,0,0,0,0|3,0,1]=4 555 B12R0.5 C=CCCCNCCSCCCC 2230a_100025743550_100011713584 [0,0,0,0,0,0|3,0,1]=4 556 B12R0.5 C=CCCCOCCCCCCBr 34a_100011215345_100000757094 [0,0,0,0,0,0|2,0,2]=4 557 B12R0.5 C=CCCCOCCCCCCBr 7a_100011215345_100000757094 [0,0,0,0,0,0|2,0,2]=4 558 B12R0.5 C=CCCCOCCCCCCC 34a_100000210272_100000757094 [0,0,0,0,0,0|2,0,1]=3 559 B12R0.5 C=CCCCOCCCCCCC 34a_100000758997_100000210614 [0,0,0,0,0,0|2,0,1]=3 560 B12R0.5 C=CCCCOCCCCCCC 7a_100000210272_100000757094 [0,0,0,0,0,0|2,0,1]=3 561 B12R0.5 C=CCCCOCCCCCCC 7a_100000758997_100000210614 [0,0,0,0,0,0|2,0,1]=3 562 B12R0.5 C=CCCCOCCCCCCCl 34a_100000766143_100000757094 [0,0,0,0,0,0|2,0,2]=4 563 B12R0.5 C=CCCCOCCCCCCCl 7a_100000766143_100000757094 [0,0,0,0,0,0|2,0,2]=4 564 B12R0.5 C=CCCCOCCCCCCF 34a_100000732779_100000757094 [0,0,0,0,0,0|2,0,2]=4 565 B12R0.5 C=CCCCOCCCCCCF 34a_100000758997_100015922095 [0,0,0,0,0,0|2,0,2]=4 566 B12R0.5 C=CCCCOCCCCCCF 7a_100000732779_100000757094 [0,0,0,0,0,0|2,0,2]=4 567 B12R0.5 C=CCCCOCCCCCCF 7a_100000758997_100015922095 [0,0,0,0,0,0|2,0,2]=4 568 B12R0.5 C=CCCCOCCCCCCN 34a_100000686447_100000757094 [0,0,0,0,0,0|2,0,2]=4 569 B12R0.5 C=CCCCOCCCCCCO 34a_100000758997_100000766143 [0,0,0,0,0,0|1,0,2]=3 570 B12R0.5 C=CCCCOCCCCCCO 7a_100000758997_100000766143 [0,0,0,0,0,0|1,0,2]=3 571 B12R0.5 C=CCCCOCCCCCNC 34a_100000722520_100000757094 [0,0,0,0,0,0|3,0,1]=4 572 B12R0.5 C=CCCCOCCOCCCC 34a_100000210238_100000757094 [0,0,0,0,0,0|3,0,1]=4 573 B12R0.5 C=CCCCOCCOCCCC 34a_100000758997_100000743108 [0,0,0,0,0,0|3,0,1]=4 574 B12R0.5 C=CCCCOCCOCCCC 7a_100000210238_100000757094 [0,0,0,0,0,0|3,0,1]=4 575 B12R0.5 C=CCCCOCCOCCCC 7a_100000758997_100000743108 [0,0,0,0,0,0|3,0,1]=4 576 B12R0.5 C=CCCCOCCSCCCC 34a_200000230436_100000757094 [0,0,0,0,0,0|3,0,1]=4 577 B12R0.5 C=CCCCOCCSCCCC 7a_200000230436_100000757094 [0,0,0,0,0,0|3,0,1]=4 578 B12R0.5 C=CCCCSCCCCCCC 62a_100000210614_100000757094 [0,0,0,0,0,0|2,0,1]=3 579 B12R0.5 C=CCCCSCCCCCCC 62a_100011713584_100000210316 [0,0,0,0,0,0|2,0,1]=3 580 B12R0.5 C=CCCCSCCCCCCF 62a_100011713584_100015922095 [0,0,0,0,0,0|2,0,2]=4 581 B12R0.5 C=CCCCSCCCCCCF 62a_100015922095_100000757094 [0,0,0,0,0,0|2,0,2]=4 582 B12R0.5 C=CCCCSCCCCCCO 62a_100000766143_100000757094 [0,0,0,0,0,0|1,0,2]=3 583 B12R0.5 C=CCCCSCCCCCCO 62a_100011713584_100000766143 [0,0,0,0,0,0|1,0,2]=3 584 B12R0.5 C=CCCCSCCOCCCC 62a_100000743108_100000757094 [0,0,0,0,0,0|3,0,1]=4 585 B12R0.5 C=CCCCSCCOCCCC 62a_100011713584_100000743108 [0,0,0,0,0,0|3,0,1]=4 586 B12R0.5 C=CCCNCCCCCCCC 2230a_100000229939_100000754431 [0,0,0,0,0,0|2,0,1]=3 587 B12R0.5 C=CCCNCCCCCCCC 2230a_100015191253_100000210759 [0,0,0,0,0,0|2,0,1]=3 588 B12R0.5 C=CCCNCCCCCCCC 34a_100000229939_100000754431 [0,0,0,0,0,0|2,0,1]=3 589 B12R0.5 C=CCCNCCCCCCCO 2230a_100011996573_100000754431 [0,0,0,0,0,0|1,0,2]=3 590 B12R0.5 C=CCCNCCCCCCCO 2230a_100015191253_100000760002 [0,0,0,0,0,0|1,0,2]=3 591 B12R0.5 C=CCCNCCCCCCCO 34a_100011996573_100000754431 [0,0,0,0,0,0|1,0,2]=3 592 B12R0.5 C=CCCNCCCCCCOC 2230a_100015191253_100011998445 [0,0,0,0,0,0|3,0,1]=4 593 B12R0.5 C=CCCNCCCOCCCC 2230a_200000211371_100000754431 [0,0,0,0,0,0|3,0,1]=4 594 B12R0.5 C=CCCNCCCOCCCC 34a_200000211371_100000754431 [0,0,0,0,0,0|3,0,1]=4 595 B12R0.5 C=CCCNCCCOCCCO 2230a_100011310245_100000754431 [0,0,0,0,0,0|2,0,2]=4 596 B12R0.5 C=CCCNCCCOCCCO 34a_100011310245_100000754431 [0,0,0,0,0,0|2,0,2]=4 597 B12R0.5 C=CCCOCCCCCCCBr 34a_100000760002_100000754431 [0,0,0,0,0,0|2,0,2]=4 598 B12R0.5 C=CCCOCCCCCCCBr 7a_100000760002_100000754431 [0,0,0,0,0,0|2,0,2]=4 599 B12R0.5 C=CCCOCCCCCCCC 34a_100000210232_100000754431 [0,0,0,0,0,0|2,0,1]=3 600 B12R0.5 C=CCCOCCCCCCCC 34a_100011205117_100000210759 [0,0,0,0,0,0|2,0,1]=3 601 B12R0.5 C=CCCOCCCCCCCC 7a_100000210232_100000754431 [0,0,0,0,0,0|2,0,1]=3 602 B12R0.5 C=CCCOCCCCCCCN 34a_100011996573_100000754431 [0,0,0,0,0,0|2,0,2]=4 603 B12R0.5 C=CCCOCCCCCCCO 34a_100011205117_100000760002 [0,0,0,0,0,0|1,0,2]=3 604 B12R0.5 C=CCCOCCCCCCOC 34a_100011205117_100011998445 [0,0,0,0,0,0|3,0,1]=4 605 B12R0.5 C=CCCOCCCCCCOC 34a_200012092642_100000754431 [0,0,0,0,0,0|3,0,1]=4 606 B12R0.5 C=CCCOCCCCCCOC 7a_200012092642_100000754431 [0,0,0,0,0,0|3,0,1]=4 607 B12R0.5 C=CCCOCCCOCCCC 34a_200011215613_100000754431 [0,0,0,0,0,0|3,0,1]=4 608 B12R0.5 C=CCCOCCCOCCCC 7a_200011215613_100000754431 [0,0,0,0,0,0|3,0,1]=4 609 B12R0.5 C=CCCOCCNCCCCC 34a_100000224656_100000754431 [0,0,0,0,0,0|3,0,1]=4 610 B12R0.5 C=CCCOCCOCCCCC 34a_100011215259_100000754431 [0,0,0,0,0,0|3,0,1]=4 611 B12R0.5 C=CCCOCCOCCCCC 7a_100011215259_100000754431 [0,0,0,0,0,0|3,0,1]=4 612 B12R0.5 C=CCCSCCCCCCCC 62a_100000210759_100000754431 [0,0,0,0,0,0|2,0,1]=3 613 B12R0.5 C=CCCSCCCCCCCC 62a_100000754431_100000210317 [0,0,0,0,0,0|2,0,1]=3 614 B12R0.5 C=CCCSCCCCCCCO 62a_100000754431_100000760002 [0,0,0,0,0,0|1,0,2]=3 615 B12R0.5 C=CCCSCCCCCCCO 62a_100000760002_100000754431 [0,0,0,0,0,0|1,0,2]=3 616 B12R0.5 C=CCCSCCCCCCOC 62a_100000754431_100011998445 [0,0,0,0,0,0|3,0,1]=4 617 B12R0.5 C=CCCSCCCCCCOC 62a_100011998445_100000754431 [0,0,0,0,0,0|3,0,1]=4 618 B12R0.5 C=CCNCCCCCCCCC 2230a_100000212291_100000210623 [0,0,0,0,0,0|2,0,1]=3 619 B12R0.5 C=CCNCCCCCCCCC 2230a_100020586998_100011214924 [0,0,0,0,0,0|2,0,1]=3 620 B12R0.5 C=CCNCCCCCCCCC 34a_100000212291_100015514636 [0,0,0,0,0,0|2,0,1]=3 621 B12R0.5 C=CCNCCCCCCCCO 2230a_100020586998_100000033203 [0,0,0,0,0,0|1,0,2]=3 622 B12R0.5 C=CCNCCCCCCCCO 2230a_102515433106_100000210623 [0,0,0,0,0,0|1,0,2]=3 623 B12R0.5 C=CCNCCCCCCCCO 34a_102515433106_100015514636 [0,0,0,0,0,0|1,0,2]=3 624 B12R0.5 C=CCOCCCCCCCCBr 34a_100009813846_100015514636 [0,0,0,0,0,0|2,0,2]=4 625 B12R0.5 C=CCOCCCCCCCCBr 7a_100009813846_100015514636 [0,0,0,0,0,0|2,0,2]=4 626 B12R0.5 C=CCOCCCCCCCCC 34a_100000210712_100015514636 [0,0,0,0,0,0|2,0,1]=3 627 B12R0.5 C=CCOCCCCCCCCC 34a_200000210373_100011214924 [0,0,0,0,0,0|2,0,1]=3 628 B12R0.5 C=CCOCCCCCCCCC 7a_100000210712_100015514636 [0,0,0,0,0,0|2,0,1]=3 629 B12R0.5 C=CCOCCCCCCCCCl 34a_100000033203_100015514636 [0,0,0,0,0,0|2,0,2]=4 630 B12R0.5 C=CCOCCCCCCCCCl 7a_100000033203_100015514636 [0,0,0,0,0,0|2,0,2]=4 631 B12R0.5 C=CCOCCCCCCCCN 34a_102515433106_100015514636 [0,0,0,0,0,0|2,0,2]=4 632 B12R0.5 C=CCOCCCCCCCCO 34a_200000210373_100000033203 [0,0,0,0,0,0|1,0,2]=3 633 B12R0.5 C=CCOCCCCNCCCC 34a_200011216965_100015514636 [0,0,0,0,0,0|3,0,1]=4 634 B12R0.5 C=CCOCCCCOCCCC 34a_200000760531_100015514636 [0,0,0,0,0,0|3,0,1]=4 635 B12R0.5 C=CCOCCCCOCCCC 7a_200000760531_100015514636 [0,0,0,0,0,0|3,0,1]=4 636 B12R0.5 C=CCOCCOCCCCCC 34a_100000037705_100000210314 [0,0,0,0,0,0|3,0,1]=4 637 B12R0.5 C=CCOCCOCCCCCC 34a_100000691444_100015514636 [0,0,0,0,0,0|3,0,1]=4 638 B12R0.5 C=CCOCCOCCCCCC 7a_100000037705_100000210314 [0,0,0,0,0,0|3,0,1]=4 639 B12R0.5 C=CCOCCOCCCCCC 7a_100000691444_100015514636 [0,0,0,0,0,0|3,0,1]=4 640 B12R0.5 C=CCOCCOCCCCCO 34a_100000037705_100000746330 [0,0,0,0,0,0|2,0,2]=4 641 B12R0.5 C=CCOCCOCCCCCO 7a_100000037705_100000746330 [0,0,0,0,0,0|2,0,2]=4 642 B12R0.5 C=CCSCCCCCCCCC 62a_100000210623_100000210670 [0,0,0,0,0,0|2,0,1]=3 643 B12R0.5 C=CCSCCCCCCCCO 62a_100000033203_100000210623 [0,0,0,0,0,0|1,0,2]=3 644 B12R0.5 C=CCSCCCCCCCCO 62a_100000210623_100000033203 [0,0,0,0,0,0|1,0,2]=3 645 B12R0.5 C=COCCCCOCCCCC 34a_100000031558_100000718602 [0,0,0,0,0,0|3,0,1]=4 646 B12R0.5 C=COCCCCOCCCCC 7a_100000031558_100000210326 [0,0,0,0,0,0|3,0,1]=4 647 B12R0.5 C=COCCCCOCCCCO 34a_100000031558_100011216708 [0,0,0,0,0,0|2,0,2]=4 648 B12R0.5 C=COCCCCOCCCCO 7a_100000031558_100000210776 [0,0,0,0,0,0|2,0,2]=4 649 B12R0.5 C=COCCCNCCCCCC 2230a_100000210767_100000210314 [0,0,0,0,0,0|3,0,1]=4 650 B12R0.5 C=COCCCNCCCCCC 34a_100000210767_100000210314 [0,0,0,0,0,0|3,0,1]=4 651 B12R0.5 C=COCCCNCCCCCO 2230a_100000210767_100000746330 [0,0,0,0,0,0|2,0,2]=4 652 B12R0.5 C=COCCCNCCCCCO 34a_100000210767_100000746330 [0,0,0,0,0,0|2,0,2]=4 653 B12R0.5 C=COCCNCCCCCCC 2230a_100000229938_100000039644 [0,0,0,0,0,0|3,0,1]=4 654 B12R0.5 C=COCCNCCCCCCO 2230a_100000686447_100000039644 [0,0,0,0,0,0|2,0,2]=4 655 B12R0.5 C=COCCNCCCCCCO 34a_100000686447_100000039644 [0,0,0,0,0,0|2,0,2]=4 656 B12R0.5 C=COCCOCCCCCCC 34a_100000033082_100000210614 [0,0,0,0,0,0|3,0,1]=4 657 B12R0.5 C=COCCOCCCCCCC 34a_100000210272_100000039644 [0,0,0,0,0,0|3,0,1]=4 658 B12R0.5 C=COCCOCCCCCCC 7a_100000210272_100000039644 [0,0,0,0,0,0|3,0,1]=4 659 B12R0.5 C=COCCOCCCCCCO 34a_100000033082_100000766143 [0,0,0,0,0,0|2,0,2]=4 660 B12R0.5 C=COCCSCCCCCCC 62a_100000039644_100000210316 [0,0,0,0,0,0|3,0,1]=4 661 B12R0.5 C=COCCSCCCCCCC 62a_100000210614_100000039644 [0,0,0,0,0,0|3,0,1]=4 662 B12R0.5 C=COCCSCCCCCCO 62a_100000039644_100000766143 [0,0,0,0,0,0|2,0,2]=4 663 B12R0.5 C=COCCSCCCCCCO 62a_100000766143_100000039644 [0,0,0,0,0,0|2,0,2]=4 664 B12R0.5 CC#CCCOCCCCCCC 34a_100000750427_100000210614 [0,0,0,0,0,0|2,0,2]=4 665 B12R0.5 CC#CCCOCCCCCCF 34a_100000750427_100015922095 [0,0,0,0,0,0|2,0,2]=4 666 B12R0.5 CC#CCCOCCCCCCO 34a_100000750427_100000766143 [0,0,0,0,0,0|1,0,2]=3 667 B12R0.5 CC#CCNCCCCCCCC 2230a_100000229939_100000748600 [0,0,0,0,0,0|2,0,2]=4 668 B12R0.5 CC#CCNCCCCCCCC 2230a_100000685387_100000210759 [0,0,0,0,0,0|2,0,2]=4 669 B12R0.5 CC#CCNCCCCCCCC 34a_100000229939_100000748600 [0,0,0,0,0,0|2,0,2]=4 670 B12R0.5 CC#CCNCCCCCCCC 34a_100000685387_100000210759 [0,0,0,0,0,0|2,0,2]=4 671 B12R0.5 CC#CCNCCCCCCCO 2230a_100000685387_100000760002 [0,0,0,0,0,0|1,0,2]=3 672 B12R0.5 CC#CCNCCCCCCCO 2230a_100011996573_100000748600 [0,0,0,0,0,0|1,0,2]=3 673 B12R0.5 CC#CCNCCCCCCCO 34a_100000685387_100000760002 [0,0,0,0,0,0|1,0,2]=3 674 B12R0.5 CC#CCNCCCCCCCO 34a_100011996573_100000748600 [0,0,0,0,0,0|1,0,2]=3 675 B12R0.5 CC#CCNCCCOCCCO 2230a_100011310245_100000748600 [0,0,0,0,0,0|2,0,2]=4 676 B12R0.5 CC#CCNCCCOCCCO 34a_100011310245_100000748600 [0,0,0,0,0,0|2,0,2]=4 677 B12R0.5 CC#CCOCCCCCCCBr 34a_100000760002_100000748600 [0,0,0,0,0,0|2,0,2]=4 678 B12R0.5 CC#CCOCCCCCCCBr 7a_100000760002_100000748600 [0,0,0,0,0,0|2,0,2]=4 679 B12R0.5 CC#CCOCCCCCCCC 34a_100000210232_100000748600 [0,0,0,0,0,0|2,0,2]=4 680 B12R0.5 CC#CCOCCCCCCCC 34a_100000761923_100000210759 [0,0,0,0,0,0|2,0,2]=4 681 B12R0.5 CC#CCOCCCCCCCC 7a_100000210232_100000748600 [0,0,0,0,0,0|2,0,2]=4 682 B12R0.5 CC#CCOCCCCCCCN 34a_100011996573_100000748600 [0,0,0,0,0,0|2,0,2]=4 683 B12R0.5 CC#CCOCCCCCCCO 34a_100000761923_100000760002 [0,0,0,0,0,0|1,0,2]=3 684 B12R0.5 CC#CCSCCCCCCCC 62a_100000210759_100000748600 [0,0,0,0,0,0|2,0,2]=4 685 B12R0.5 CC#CCSCCCCCCCC 62a_100000748600_100000210317 [0,0,0,0,0,0|2,0,2]=4 686 B12R0.5 CC#CCSCCCCCCCO 62a_100000748600_100000760002 [0,0,0,0,0,0|1,0,2]=3 687 B12R0.5 CC#CCSCCCCCCCO 62a_100000760002_100000748600 [0,0,0,0,0,0|1,0,2]=3 688 B12R0.5 CC/C=C/CCCOCCCCC 34a_100016287902_100000718602 [0,0,0,0,0,0|2,0,2]=4 689 B12R0.5 CC/C=C/CCCOCCCCC 7a_100016287902_100000210326 [0,0,0,0,0,0|2,0,2]=4 690 B12R0.5 CC/C=C/CCCOCCCCF 34a_100016287902_100000729493 [0,0,0,0,0,0|2,0,2]=4 691 B12R0.5 CC/C=C/CCCOCCCCF 7a_100016287902_100000729493 [0,0,0,0,0,0|2,0,2]=4 692 B12R0.5 CC/C=C/CCCOCCCCO 34a_100016287902_100011216708 [0,0,0,0,0,0|1,0,2]=3 693 B12R0.5 CC/C=C/CCCOCCCCO 7a_100016287902_100000210776 [0,0,0,0,0,0|1,0,2]=3 694 B12R0.5 CC/C=C\CCCCCCCNC 269862a_106832991636_200025770492 [0,0,0,0,0,0|2,0,2]=4 695 B12R0.5 CC/C=C\CCCCCNCCC 269862a_100020643023_100016288537 [0,0,0,0,0,0|2,0,2]=4 696 B12R0.5 CC/C=C\CCCCCNCCF 269862a_100000724931_100016288537 [0,0,0,0,0,0|2,0,2]=4 697 B12R0.5 CC/C=C\CCCCCNCCO 269862a_100000210304_100016288537 [0,0,0,0,0,0|1,0,2]=3 698 B12R0.5 CC/C=C\CCCCCOCCC 34a_100016268722_100000210303 [0,0,0,0,0,0|2,0,2]=4 699 B12R0.5 CC/C=C\CCCCCOCCC 7a_100016268722_100000210303 [0,0,0,0,0,0|2,0,2]=4 700 B12R0.5 CC/C=C\CCCCCOCCF 34a_100016268722_100011217306 [0,0,0,0,0,0|2,0,2]=4 701 B12R0.5 CC/C=C\CCCCCOCCF 7a_100016268722_100011217306 [0,0,0,0,0,0|2,0,2]=4 702 B12R0.5 CC/C=C\CCCCCOCCO 34a_100016268722_100000211926 [0,0,0,0,0,0|1,0,2]=3 703 B12R0.5 CC/C=C\CCCCCOCCO 7a_100016268722_100000211926 [0,0,0,0,0,0|1,0,2]=3 704 B12R0.5 CC/C=C\CCCCOCCCC 34a_100016287862_100000210210 [0,0,0,0,0,0|2,0,2]=4 705 B12R0.5 CC/C=C\CCCCOCCCC 7a_100016287862_100000210211 [0,0,0,0,0,0|2,0,2]=4 706 B12R0.5 CC/C=C\CCCCOCCCF 34a_100016287862_100011934791 [0,0,0,0,0,0|2,0,2]=4 707 B12R0.5 CC/C=C\CCCCOCCCF 7a_100016287862_100011934791 [0,0,0,0,0,0|2,0,2]=4 708 B12R0.5 CC/C=C\CCCCOCCCO 34a_100016287862_100000230001 [0,0,0,0,0,0|1,0,2]=3 709 B12R0.5 CC/C=C\CCCCOCCCO 7a_100016287862_100011215043 [0,0,0,0,0,0|1,0,2]=3 710 B12R0.5 CC/C=C\CCNCCCCCC 2230a_100000210581_100015370543 [0,0,0,0,0,0|2,0,2]=4 711 B12R0.5 CC/C=C\CCNCCCCCO 2230a_100000762737_100015370543 [0,0,0,0,0,0|1,0,2]=3 712 B12R0.5 CC/C=C\CCNCCCCCO 34a_100000762737_100015370543 [0,0,0,0,0,0|1,0,2]=3 713 B12R0.5 CC/C=C\CCNCCOCCO 2230a_100000211614_100015370543 [0,0,0,0,0,0|2,0,2]=4 714 B12R0.5 CC/C=C\CCNCCOCCO 34a_100000211614_100015370543 [0,0,0,0,0,0|2,0,2]=4 715 B12R0.5 CC/C=C\CCNCCSCCO 2230a_100011219999_100015370543 [0,0,0,0,0,0|2,0,2]=4 716 B12R0.5 CC/C=C\CCOCCCCCBr 34a_100000746331_100015370543 [0,0,0,0,0,0|2,0,2]=4 717 B12R0.5 CC/C=C\CCOCCCCCBr 7a_100000746331_100015370543 [0,0,0,0,0,0|2,0,2]=4 718 B12R0.5 CC/C=C\CCOCCCCCC 34a_100000210259_100015370543 [0,0,0,0,0,0|2,0,2]=4 719 B12R0.5 CC/C=C\CCOCCCCCC 34a_100016288707_100000210314 [0,0,0,0,0,0|2,0,2]=4 720 B12R0.5 CC/C=C\CCOCCCCCC 7a_100000210259_100015370543 [0,0,0,0,0,0|2,0,2]=4 721 B12R0.5 CC/C=C\CCOCCCCCC 7a_100016288707_100000210314 [0,0,0,0,0,0|2,0,2]=4 722 B12R0.5 CC/C=C\CCOCCCCCCl 34a_100000746330_100015370543 [0,0,0,0,0,0|2,0,2]=4 723 B12R0.5 CC/C=C\CCOCCCCCCl 7a_100000746330_100015370543 [0,0,0,0,0,0|2,0,2]=4 724 B12R0.5 CC/C=C\CCOCCCCCF 34a_100016288707_100000729378 [0,0,0,0,0,0|2,0,2]=4 725 B12R0.5 CC/C=C\CCOCCCCCF 7a_100016288707_100000729378 [0,0,0,0,0,0|2,0,2]=4 726 B12R0.5 CC/C=C\CCOCCCCCI 34a_200012148887_100015370543 [0,0,0,0,0,0|2,0,2]=4 727 B12R0.5 CC/C=C\CCOCCCCCI 7a_200012148887_100015370543 [0,0,0,0,0,0|2,0,2]=4 728 B12R0.5 CC/C=C\CCOCCCCCN 34a_100000762737_100015370543 [0,0,0,0,0,0|2,0,2]=4 729 B12R0.5 CC/C=C\CCOCCCCCO 34a_100016288707_100000746330 [0,0,0,0,0,0|1,0,2]=3 730 B12R0.5 CC/C=C\CCOCCCCCO 7a_100016288707_100000746330 [0,0,0,0,0,0|1,0,2]=3 731 B12R0.5 CC/C=C\CCOCCOCCO 34a_100016288707_100000692535 [0,0,0,0,0,0|2,0,2]=4 732 B12R0.5 CC/C=C\CCOCCOCCO 7a_100016288707_100011215305 [0,0,0,0,0,0|2,0,2]=4 733 B12R0.5 CC/C=C\CCSCCCCCC 62a_100000210314_100015370543 [0,0,0,0,0,0|2,0,2]=4 734 B12R0.5 CC/C=C\CCSCCCCCC 62a_100015370543_100000210757 [0,0,0,0,0,0|2,0,2]=4 735 B12R0.5 CC/C=C\CCSCCCCCF 62a_100000729378_100015370543 [0,0,0,0,0,0|2,0,2]=4 736 B12R0.5 CC/C=C\CCSCCCCCF 62a_100015370543_100000729378 [0,0,0,0,0,0|2,0,2]=4 737 B12R0.5 CC/C=C\CCSCCCCCO 62a_100000746330_100015370543 [0,0,0,0,0,0|1,0,2]=3 738 B12R0.5 CC/C=C\CCSCCCCCO 62a_100015370543_100000746330 [0,0,0,0,0,0|1,0,2]=3 739 B12R0.5 CC/C=C\CCSCCOCCO 62a_100011215305_100015370543 [0,0,0,0,0,0|2,0,2]=4 740 B12R0.5 CC/C=C\CCSCCOCCO 62a_100015370543_100011215305 [0,0,0,0,0,0|2,0,2]=4 741 B12R0.5 CC/C=C\CNCCCCCCC 2230a_100000229938_100103147603 [0,0,0,0,0,0|2,0,2]=4 742 B12R0.5 CC/C=C\CNCCCCCCO 2230a_100000686447_100103147603 [0,0,0,0,0,0|1,0,2]=3 743 B12R0.5 CC/C=C\CNCCCCCCO 34a_100000686447_100103147603 [0,0,0,0,0,0|1,0,2]=3 744 B12R0.5 CC/C=C\COCCCCCCBr 34a_100011215345_100103147603 [0,0,0,0,0,0|2,0,2]=4 745 B12R0.5 CC/C=C\COCCCCCCBr 7a_100011215345_100103147603 [0,0,0,0,0,0|2,0,2]=4 746 B12R0.5 CC/C=C\COCCCCCCC 34a_100000210272_100103147603 [0,0,0,0,0,0|2,0,2]=4 747 B12R0.5 CC/C=C\COCCCCCCC 34a_100016268518_100000210614 [0,0,0,0,0,0|2,0,2]=4 748 B12R0.5 CC/C=C\COCCCCCCC 7a_100000210272_100103147603 [0,0,0,0,0,0|2,0,2]=4 749 B12R0.5 CC/C=C\COCCCCCCCl 34a_100000766143_100103147603 [0,0,0,0,0,0|2,0,2]=4 750 B12R0.5 CC/C=C\COCCCCCCCl 7a_100000766143_100103147603 [0,0,0,0,0,0|2,0,2]=4 751 B12R0.5 CC/C=C\COCCCCCCF 34a_100000732779_100103147603 [0,0,0,0,0,0|2,0,2]=4 752 B12R0.5 CC/C=C\COCCCCCCF 34a_100016268518_100015922095 [0,0,0,0,0,0|2,0,2]=4 753 B12R0.5 CC/C=C\COCCCCCCF 7a_100000732779_100103147603 [0,0,0,0,0,0|2,0,2]=4 754 B12R0.5 CC/C=C\COCCCCCCN 34a_100000686447_100103147603 [0,0,0,0,0,0|2,0,2]=4 755 B12R0.5 CC/C=C\COCCCCCCO 34a_100016268518_100000766143 [0,0,0,0,0,0|1,0,2]=3 756 B12R0.5 CC/C=C\CSCCCCCCC 62a_100000210614_100103147603 [0,0,0,0,0,0|2,0,2]=4 757 B12R0.5 CC/C=C\CSCCCCCCC 62a_100103147603_100000210316 [0,0,0,0,0,0|2,0,2]=4 758 B12R0.5 CC/C=C\CSCCCCCCF 62a_100015922095_100103147603 [0,0,0,0,0,0|2,0,2]=4 759 B12R0.5 CC/C=C\CSCCCCCCF 62a_100103147603_100015922095 [0,0,0,0,0,0|2,0,2]=4 760 B12R0.5 CC/C=C\CSCCCCCCO 62a_100000766143_100103147603 [0,0,0,0,0,0|1,0,2]=3 761 B12R0.5 CC/C=C\CSCCCCCCO 62a_100103147603_100000766143 [0,0,0,0,0,0|1,0,2]=3 762 B12R0.5 CC=C=CCCOCCCCCO 34a_100011020354_100000746330 [0,0,0,0,0,0|1,0,3]=4 763 B12R0.5 CC=CCCCOCCCCCC 34a_100020645299_100000210314 [0,0,0,0,0,0|2,0,2]=4 764 B12R0.5 CC=CCCCOCCCCCF 34a_100020645299_100000729378 [0,0,0,0,0,0|2,0,2]=4 765 B12R0.5 CC=CCCCOCCCCCO 34a_100020645299_100000746330 [0,0,0,0,0,0|1,0,2]=3 766 B12R0.5 CC=CCCCOCCOCCO 34a_100020645299_100000692535 [0,0,0,0,0,0|2,0,2]=4 767 B12R0.5 CC=CCNCCCCCCCC 2230a_100000229939_100000070051 [0,0,0,0,0,0|2,0,2]=4 768 B12R0.5 CC=CCNCCCCCCCC 34a_100000229939_100000070051 [0,0,0,0,0,0|2,0,2]=4 769 B12R0.5 CC=CCNCCCCCCCO 2230a_100011996573_100000070051 [0,0,0,0,0,0|1,0,2]=3 770 B12R0.5 CC=CCNCCCCCCCO 34a_100011996573_100000070051 [0,0,0,0,0,0|1,0,2]=3 771 B12R0.5 CC=CCNCCCOCCCO 2230a_100011310245_100000070051 [0,0,0,0,0,0|2,0,2]=4 772 B12R0.5 CC=CCNCCCOCCCO 34a_100011310245_100000070051 [0,0,0,0,0,0|2,0,2]=4 773 B12R0.5 CC=CCOCCCCCCCBr 34a_100000760002_100000070051 [0,0,0,0,0,0|2,0,2]=4 774 B12R0.5 CC=CCOCCCCCCCBr 7a_100000760002_100000070051 [0,0,0,0,0,0|2,0,2]=4 775 B12R0.5 CC=CCOCCCCCCCC 34a_100000210232_100000070051 [0,0,0,0,0,0|2,0,2]=4 776 B12R0.5 CC=CCOCCCCCCCC 7a_100000210232_100000070051 [0,0,0,0,0,0|2,0,2]=4 777 B12R0.5 CC=CCOCCCCCCCN 34a_100011996573_100000070051 [0,0,0,0,0,0|2,0,2]=4 778 B12R0.5 CC=CCSCCCCCCCC 62a_100000070051_100000210317 [0,0,0,0,0,0|2,0,2]=4 779 B12R0.5 CC=CCSCCCCCCCC 62a_100000210759_100000070051 [0,0,0,0,0,0|2,0,2]=4 780 B12R0.5 CC=CCSCCCCCCCO 62a_100000070051_100000760002 [0,0,0,0,0,0|1,0,2]=3 781 B12R0.5 CC=CCSCCCCCCCO 62a_100000760002_100000070051 [0,0,0,0,0,0|1,0,2]=3 782 B12R0.5 CCC#CCCCCCCNCC 2230a_100015525214_200000036426 [0,0,0,0,0,0|2,0,2]=4 783 B12R0.5 CCC#CCCCCCCOCC 34a_100121572206_200000036426 [0,0,0,0,0,0|2,0,2]=4 784 B12R0.5 CCC#CCCCCCCSCC 62a_100000210202_200000036426 [0,0,0,0,0,0|2,0,2]=4 785 B12R0.5 CCC#CCCCCCCSCC 62a_200000036426_100000210202 [0,0,0,0,0,0|2,0,2]=4 786 B12R0.5 CCC#CCCCCCCSCF 62a_100015361967_200000036426 [0,0,0,0,0,0|2,0,2]=4 787 B12R0.5 CCC#CCCCCCCSCF 62a_200000036426_100015361967 [0,0,0,0,0,0|2,0,2]=4 788 B12R0.5 CCC#CCCOCCCCCC 34a_100000036655_100000210314 [0,0,0,0,0,0|2,0,2]=4 789 B12R0.5 CCC#CCCOCCCCCC 7a_100000036655_100000210314 [0,0,0,0,0,0|2,0,2]=4 790 B12R0.5 CCC#CCCOCCCCCF 34a_100000036655_100000729378 [0,0,0,0,0,0|2,0,2]=4 791 B12R0.5 CCC#CCCOCCCCCF 7a_100000036655_100000729378 [0,0,0,0,0,0|2,0,2]=4 792 B12R0.5 CCC#CCCOCCCCCO 34a_100000036655_100000746330 [0,0,0,0,0,0|1,0,2]=3 793 B12R0.5 CCC#CCCOCCCCCO 7a_100000036655_100000746330 [0,0,0,0,0,0|1,0,2]=3 794 B12R0.5 CCC#CCCOCCOCCO 34a_100000036655_100000692535 [0,0,0,0,0,0|2,0,2]=4 795 B12R0.5 CCC#CCCOCCOCCO 7a_100000036655_100011215305 [0,0,0,0,0,0|2,0,2]=4 796 B12R0.5 CCC#CCNCCCCCCC 2230a_100000229938_100009813939 [0,0,0,0,0,0|2,0,2]=4 797 B12R0.5 CCC#CCNCCCCCCO 2230a_100000686447_100009813939 [0,0,0,0,0,0|1,0,2]=3 798 B12R0.5 CCC#CCNCCCCCCO 34a_100000686447_100009813939 [0,0,0,0,0,0|1,0,2]=3 799 B12R0.5 CCC#CCOCCCCCCBr 34a_100011215345_100009813939 [0,0,0,0,0,0|2,0,2]=4 800 B12R0.5 CCC#CCOCCCCCCBr 7a_100011215345_100009813939 [0,0,0,0,0,0|2,0,2]=4 801 B12R0.5 CCC#CCOCCCCCCC 34a_100000032950_100000210614 [0,0,0,0,0,0|2,0,2]=4 802 B12R0.5 CCC#CCOCCCCCCC 34a_100000210272_100009813939 [0,0,0,0,0,0|2,0,2]=4 803 B12R0.5 CCC#CCOCCCCCCC 7a_100000210272_100009813939 [0,0,0,0,0,0|2,0,2]=4 804 B12R0.5 CCC#CCOCCCCCCCl 34a_100000766143_100009813939 [0,0,0,0,0,0|2,0,2]=4 805 B12R0.5 CCC#CCOCCCCCCCl 7a_100000766143_100009813939 [0,0,0,0,0,0|2,0,2]=4 806 B12R0.5 CCC#CCOCCCCCCF 34a_100000032950_100015922095 [0,0,0,0,0,0|2,0,2]=4 807 B12R0.5 CCC#CCOCCCCCCF 34a_100000732779_100009813939 [0,0,0,0,0,0|2,0,2]=4 808 B12R0.5 CCC#CCOCCCCCCF 7a_100000732779_100009813939 [0,0,0,0,0,0|2,0,2]=4 809 B12R0.5 CCC#CCOCCCCCCN 34a_100000686447_100009813939 [0,0,0,0,0,0|2,0,2]=4 810 B12R0.5 CCC#CCOCCCCCCO 34a_100000032950_100000766143 [0,0,0,0,0,0|1,0,2]=3 811 B12R0.5 CCC#CCSCCCCCCC 62a_100000210614_100009813939 [0,0,0,0,0,0|2,0,2]=4 812 B12R0.5 CCC#CCSCCCCCCC 62a_100009813939_100000210316 [0,0,0,0,0,0|2,0,2]=4 813 B12R0.5 CCC#CCSCCCCCCF 62a_100009813939_100015922095 [0,0,0,0,0,0|2,0,2]=4 814 B12R0.5 CCC#CCSCCCCCCF 62a_100015922095_100009813939 [0,0,0,0,0,0|2,0,2]=4 815 B12R0.5 CCC#CCSCCCCCCO 62a_100000766143_100009813939 [0,0,0,0,0,0|1,0,2]=3 816 B12R0.5 CCC#CCSCCCCCCO 62a_100009813939_100000766143 [0,0,0,0,0,0|1,0,2]=3 817 B12R0.5 CCC/C=C/COCCCCCC 34a_100016278788_100000210314 [0,0,0,0,0,0|2,0,2]=4 818 B12R0.5 CCC/C=C/COCCCCCC 7a_100016278788_100000210314 [0,0,0,0,0,0|2,0,2]=4 819 B12R0.5 CCC/C=C/COCCCCCF 34a_100016278788_100000729378 [0,0,0,0,0,0|2,0,2]=4 820 B12R0.5 CCC/C=C/COCCCCCF 7a_100016278788_100000729378 [0,0,0,0,0,0|2,0,2]=4 821 B12R0.5 CCC/C=C/COCCCCCO 34a_100016278788_100000746330 [0,0,0,0,0,0|1,0,2]=3 822 B12R0.5 CCC/C=C/COCCCCCO 7a_100016278788_100000746330 [0,0,0,0,0,0|1,0,2]=3 823 B12R0.5 CCC/C=C/COCCOCCO 34a_100016278788_100000692535 [0,0,0,0,0,0|2,0,2]=4 824 B12R0.5 CCC/C=C/COCCOCCO 7a_100016278788_100011215305 [0,0,0,0,0,0|2,0,2]=4 825 B12R0.5 CCCC#CCCOCCCCC 34a_100000042726_100000718602 [0,0,0,0,0,0|2,0,2]=4 826 B12R0.5 CCCC#CCCOCCCCC 7a_100000042726_100000210326 [0,0,0,0,0,0|2,0,2]=4 827 B12R0.5 CCCC#CCCOCCCCF 34a_100000042726_100000729493 [0,0,0,0,0,0|2,0,2]=4 828 B12R0.5 CCCC#CCCOCCCCF 7a_100000042726_100000729493 [0,0,0,0,0,0|2,0,2]=4 829 B12R0.5 CCCC#CCCOCCCCO 34a_100000042726_100011216708 [0,0,0,0,0,0|1,0,2]=3 830 B12R0.5 CCCC#CCCOCCCCO 7a_100000042726_100000210776 [0,0,0,0,0,0|1,0,2]=3 831 B12R0.5 CCCC#CCOCCCCCC 34a_100000034806_100000210314 [0,0,0,0,0,0|2,0,2]=4 832 B12R0.5 CCCC#CCOCCCCCC 7a_100000034806_100000210314 [0,0,0,0,0,0|2,0,2]=4 833 B12R0.5 CCCC#CCOCCCCCF 34a_100000034806_100000729378 [0,0,0,0,0,0|2,0,2]=4 834 B12R0.5 CCCC#CCOCCCCCF 7a_100000034806_100000729378 [0,0,0,0,0,0|2,0,2]=4 835 B12R0.5 CCCC#CCOCCCCCO 34a_100000034806_100000746330 [0,0,0,0,0,0|1,0,2]=3 836 B12R0.5 CCCC#CCOCCCCCO 7a_100000034806_100000746330 [0,0,0,0,0,0|1,0,2]=3 837 B12R0.5 CCCC#CCOCCOCCO 34a_100000034806_100000692535 [0,0,0,0,0,0|2,0,2]=4 838 B12R0.5 CCCC#CCOCCOCCO 7a_100000034806_100011215305 [0,0,0,0,0,0|2,0,2]=4 839 B12R0.5 CCCC/C=C/CCCCOCC 34a_200020645093_100000210202 [0,0,0,0,0,0|2,0,2]=4 840 B12R0.5 CCCC/C=C/CCCCOCC 7a_200020645093_100000210202 [0,0,0,0,0,0|2,0,2]=4 841 B12R0.5 CCCC/C=C/CCCCOCF 34a_200020645093_100015361967 [0,0,0,0,0,0|2,0,2]=4 842 B12R0.5 CCCC/C=C/CCCCOCF 7a_200020645093_100015361967 [0,0,0,0,0,0|2,0,2]=4 843 B12R0.5 CCCC/C=C/COCCCCC 34a_200016272032_100000718602 [0,0,0,0,0,0|2,0,2]=4 844 B12R0.5 CCCC/C=C/COCCCCC 7a_200016272032_100000210326 [0,0,0,0,0,0|2,0,2]=4 845 B12R0.5 CCCC/C=C/COCCCCF 34a_200016272032_100000729493 [0,0,0,0,0,0|2,0,2]=4 846 B12R0.5 CCCC/C=C/COCCCCF 7a_200016272032_100000729493 [0,0,0,0,0,0|2,0,2]=4 847 B12R0.5 CCCC/C=C/COCCCCO 34a_200016272032_100011216708 [0,0,0,0,0,0|1,0,2]=3 848 B12R0.5 CCCC/C=C/COCCCCO 7a_200016272032_100000210776 [0,0,0,0,0,0|1,0,2]=3 849 B12R0.5 CCCC/C=C\CCOCCCC 34a_200016286491_100000210210 [0,0,0,0,0,0|2,0,2]=4 850 B12R0.5 CCCC/C=C\CCOCCCC 7a_200016286491_100000210211 [0,0,0,0,0,0|2,0,2]=4 851 B12R0.5 CCCC/C=C\CCOCCCF 34a_200016286491_100011934791 [0,0,0,0,0,0|2,0,2]=4 852 B12R0.5 CCCC/C=C\CCOCCCF 7a_200016286491_100011934791 [0,0,0,0,0,0|2,0,2]=4 853 B12R0.5 CCCC/C=C\CCOCCCO 34a_200016286491_100000230001 [0,0,0,0,0,0|1,0,2]=3 854 B12R0.5 CCCC/C=C\CCOCCCO 7a_200016286491_100011215043 [0,0,0,0,0,0|1,0,2]=3 855 B12R0.5 CCCCC#CCCCCOCC 34a_200000066234_100000210202 [0,0,0,0,0,0|2,0,2]=4 856 B12R0.5 CCCCC#CCCCCOCC 7a_200000066234_100000210202 [0,0,0,0,0,0|2,0,2]=4 857 B12R0.5 CCCCC#CCCCCOCF 34a_200000066234_100015361967 [0,0,0,0,0,0|2,0,2]=4 858 B12R0.5 CCCCC#CCCCCOCF 7a_200000066234_100015361967 [0,0,0,0,0,0|2,0,2]=4 859 B12R0.5 CCCCC#CCCCNCCF 34a_100000724931_200000047210 [0,0,0,0,0,0|2,0,2]=4 860 B12R0.5 CCCCC#CCCCNCCO 2230a_100016997473_200000047210 [0,0,0,0,0,0|1,0,2]=3 861 B12R0.5 CCCCC#CCCCNCCO 34a_100016990907_200000047210 [0,0,0,0,0,0|1,0,2]=3 862 B12R0.5 CCCCC#CCCCOCCBr 34a_100000211926_200000047210 [0,0,0,0,0,0|2,0,2]=4 863 B12R0.5 CCCCC#CCCCOCCC 34a_100000210258_200000047210 [0,0,0,0,0,0|2,0,2]=4 864 B12R0.5 CCCCC#CCCCOCCN 34a_100000210304_200000047210 [0,0,0,0,0,0|2,0,2]=4 865 B12R0.5 CCCCC#CCCCSCCC 62a_100000210303_200000047210 [0,0,0,0,0,0|2,0,2]=4 866 B12R0.5 CCCCC#CCCCSCCC 62a_200000047210_100000210303 [0,0,0,0,0,0|2,0,2]=4 867 B12R0.5 CCCCC#CCCCSCCF 62a_100011217306_200000047210 [0,0,0,0,0,0|2,0,2]=4 868 B12R0.5 CCCCC#CCCCSCCF 62a_200000047210_100011217306 [0,0,0,0,0,0|2,0,2]=4 869 B12R0.5 CCCCC#CCCCSCCO 62a_100000211926_200000047210 [0,0,0,0,0,0|1,0,2]=3 870 B12R0.5 CCCCC#CCCCSCCO 62a_200000047210_100000211926 [0,0,0,0,0,0|1,0,2]=3 871 B12R0.5 CCCCC#CCCOCCCC 34a_100000037610_100000210210 [0,0,0,0,0,0|2,0,2]=4 872 B12R0.5 CCCCC#CCCOCCCC 7a_100000037610_100000210211 [0,0,0,0,0,0|2,0,2]=4 873 B12R0.5 CCCCC#CCCOCCCF 34a_100000037610_100011934791 [0,0,0,0,0,0|2,0,2]=4 874 B12R0.5 CCCCC#CCCOCCCF 7a_100000037610_100011934791 [0,0,0,0,0,0|2,0,2]=4 875 B12R0.5 CCCCC#CCCOCCCO 34a_100000037610_100000230001 [0,0,0,0,0,0|1,0,2]=3 876 B12R0.5 CCCCC#CCCOCCCO 7a_100000037610_100011215043 [0,0,0,0,0,0|1,0,2]=3 877 B12R0.5 CCCCC#CCOCCCCC 34a_200000034558_100000718602 [0,0,0,0,0,0|2,0,2]=4 878 B12R0.5 CCCCC#CCOCCCCC 7a_200000034558_100000210326 [0,0,0,0,0,0|2,0,2]=4 879 B12R0.5 CCCCC#CCOCCCCF 34a_200000034558_100000729493 [0,0,0,0,0,0|2,0,2]=4 880 B12R0.5 CCCCC#CCOCCCCF 7a_200000034558_100000729493 [0,0,0,0,0,0|2,0,2]=4 881 B12R0.5 CCCCC#CCOCCCCO 34a_200000034558_100011216708 [0,0,0,0,0,0|1,0,2]=3 882 B12R0.5 CCCCC#CCOCCCCO 7a_200000034558_100000210776 [0,0,0,0,0,0|1,0,2]=3 883 B12R0.5 CCCCC/C=C/COCCCC 34a_100016258190_100000210210 [0,0,0,0,0,0|2,0,2]=4 884 B12R0.5 CCCCC/C=C/COCCCC 7a_100016258190_100000210211 [0,0,0,0,0,0|2,0,2]=4 885 B12R0.5 CCCCC/C=C/COCCCF 34a_100016258190_100011934791 [0,0,0,0,0,0|2,0,2]=4 886 B12R0.5 CCCCC/C=C/COCCCF 7a_100016258190_100011934791 [0,0,0,0,0,0|2,0,2]=4 887 B12R0.5 CCCCC/C=C/COCCCO 34a_100016258190_100000230001 [0,0,0,0,0,0|1,0,2]=3 888 B12R0.5 CCCCC/C=C/COCCCO 7a_100016258190_100011215043 [0,0,0,0,0,0|1,0,2]=3 889 B12R0.5 CCCCC/C=C\CCCOCC 34a_100020655193_100000210202 [0,0,0,0,0,0|2,0,2]=4 890 B12R0.5 CCCCC/C=C\CCCOCC 7a_100020655193_100000210202 [0,0,0,0,0,0|2,0,2]=4 891 B12R0.5 CCCCC/C=C\CCCOCF 34a_100020655193_100015361967 [0,0,0,0,0,0|2,0,2]=4 892 B12R0.5 CCCCC/C=C\CCCOCF 7a_100020655193_100015361967 [0,0,0,0,0,0|2,0,2]=4 893 B12R0.5 CCCCC/C=C\CCOCCC 34a_100016277358_100000210303 [0,0,0,0,0,0|2,0,2]=4 894 B12R0.5 CCCCC/C=C\CCOCCC 7a_100016277358_100000210303 [0,0,0,0,0,0|2,0,2]=4 895 B12R0.5 CCCCC/C=C\CCOCCF 34a_100016277358_100011217306 [0,0,0,0,0,0|2,0,2]=4 896 B12R0.5 CCCCC/C=C\CCOCCF 7a_100016277358_100011217306 [0,0,0,0,0,0|2,0,2]=4 897 B12R0.5 CCCCC/C=C\CCOCCO 34a_100016277358_100000211926 [0,0,0,0,0,0|1,0,2]=3 898 B12R0.5 CCCCC/C=C\CCOCCO 7a_100016277358_100000211926 [0,0,0,0,0,0|1,0,2]=3 899 B12R0.5 CCCCCC#CCCOCCC 34a_200000042877_100000210303 [0,0,0,0,0,0|2,0,2]=4 900 B12R0.5 CCCCCC#CCCOCCC 7a_200000042877_100000210303 [0,0,0,0,0,0|2,0,2]=4 901 B12R0.5 CCCCCC#CCCOCCF 34a_200000042877_100011217306 [0,0,0,0,0,0|2,0,2]=4 902 B12R0.5 CCCCCC#CCCOCCF 7a_200000042877_100011217306 [0,0,0,0,0,0|2,0,2]=4 903 B12R0.5 CCCCCC#CCCOCCO 34a_200000042877_100000211926 [0,0,0,0,0,0|1,0,2]=3 904 B12R0.5 CCCCCC#CCCOCCO 7a_200000042877_100000211926 [0,0,0,0,0,0|1,0,2]=3 905 B12R0.5 CCCCCC#CCNCCCC 2230a_100000102301_100009816472 [0,0,0,0,0,0|2,0,2]=4 906 B12R0.5 CCCCCC#CCNCCCC 7a_106832991798_100009816472 [0,0,0,0,0,0|2,0,2]=4 907 B12R0.5 CCCCCC#CCNCCCF 2230a_100015189416_100009816472 [0,0,0,0,0,0|2,0,2]=4 908 B12R0.5 CCCCCC#CCNCCCF 34a_100015189416_100009816472 [0,0,0,0,0,0|2,0,2]=4 909 B12R0.5 CCCCCC#CCOCCCBr 34a_100011217188_100009816472 [0,0,0,0,0,0|2,0,2]=4 910 B12R0.5 CCCCCC#CCOCCCC 34a_100000210227_100009816472 [0,0,0,0,0,0|2,0,2]=4 911 B12R0.5 CCCCCC#CCOCCCC 34a_200000033628_100000210210 [0,0,0,0,0,0|2,0,2]=4 912 B12R0.5 CCCCCC#CCOCCCC 7a_100000210227_100009816472 [0,0,0,0,0,0|2,0,2]=4 913 B12R0.5 CCCCCC#CCOCCCC 7a_200000033628_100000210211 [0,0,0,0,0,0|2,0,2]=4 914 B12R0.5 CCCCCC#CCOCCCCl 34a_100000230001_100009816472 [0,0,0,0,0,0|2,0,2]=4 915 B12R0.5 CCCCCC#CCOCCCF 34a_100000759539_100009816472 [0,0,0,0,0,0|2,0,2]=4 916 B12R0.5 CCCCCC#CCOCCCF 34a_200000033628_100011934791 [0,0,0,0,0,0|2,0,2]=4 917 B12R0.5 CCCCCC#CCOCCCF 7a_200000033628_100011934791 [0,0,0,0,0,0|2,0,2]=4 918 B12R0.5 CCCCCC#CCOCCCN 34a_100000182051_100009816472 [0,0,0,0,0,0|2,0,2]=4 919 B12R0.5 CCCCCC#CCOCCCO 34a_200000033628_100000230001 [0,0,0,0,0,0|1,0,2]=3 920 B12R0.5 CCCCCC#CCOCCCO 7a_200000033628_100011215043 [0,0,0,0,0,0|1,0,2]=3 921 B12R0.5 CCCCCC#CCSCCCC 62a_100000210211_100009816472 [0,0,0,0,0,0|2,0,2]=4 922 B12R0.5 CCCCCC#CCSCCCC 62a_100009816472_100000210210 [0,0,0,0,0,0|2,0,2]=4 923 B12R0.5 CCCCCC#CCSCCCF 62a_100009816472_100011934791 [0,0,0,0,0,0|2,0,2]=4 924 B12R0.5 CCCCCC#CCSCCCF 62a_100011934791_100009816472 [0,0,0,0,0,0|2,0,2]=4 925 B12R0.5 CCCCCC#CCSCCCO 62a_100009816472_100011215043 [0,0,0,0,0,0|1,0,2]=3 926 B12R0.5 CCCCCC#CCSCCCO 62a_100011215043_100009816472 [0,0,0,0,0,0|1,0,2]=3 927 B12R0.5 CCCCCC/C=C/COCCC 34a_200016276170_100000210303 [0,0,0,0,0,0|2,0,2]=4 928 B12R0.5 CCCCCC/C=C/COCCC 7a_200016276170_100000210303 [0,0,0,0,0,0|2,0,2]=4 929 B12R0.5 CCCCCC/C=C/COCCF 34a_200016276170_100011217306 [0,0,0,0,0,0|2,0,2]=4 930 B12R0.5 CCCCCC/C=C/COCCF 7a_200016276170_100011217306 [0,0,0,0,0,0|2,0,2]=4 931 B12R0.5 CCCCCC/C=C/COCCO 34a_200016276170_100000211926 [0,0,0,0,0,0|1,0,2]=3 932 B12R0.5 CCCCCC/C=C/COCCO 7a_200016276170_100000211926 [0,0,0,0,0,0|1,0,2]=3 933 B12R0.5 CCCCCC=NNCCCCC 4a_100000694160_100000737632 [0,0,0,0,0,0|3,0,1]=4 934 B12R0.5 CCCCCCC#CCCOCC 34a_200000033163_100000210202 [0,0,0,0,0,0|2,0,2]=4 935 B12R0.5 CCCCCCC#CCCOCC 7a_200000033163_100000210202 [0,0,0,0,0,0|2,0,2]=4 936 B12R0.5 CCCCCCC#CCCOCF 34a_200000033163_100015361967 [0,0,0,0,0,0|2,0,2]=4 937 B12R0.5 CCCCCCC#CCCOCF 7a_200000033163_100015361967 [0,0,0,0,0,0|2,0,2]=4 938 B12R0.5 CCCCCCC#CCOCCC 34a_200000037284_100000210303 [0,0,0,0,0,0|2,0,2]=4 939 B12R0.5 CCCCCCC#CCOCCC 7a_200000037284_100000210303 [0,0,0,0,0,0|2,0,2]=4 940 B12R0.5 CCCCCCC#CCOCCF 34a_200000037284_100011217306 [0,0,0,0,0,0|2,0,2]=4 941 B12R0.5 CCCCCCC#CCOCCF 7a_200000037284_100011217306 [0,0,0,0,0,0|2,0,2]=4 942 B12R0.5 CCCCCCC#CCOCCO 34a_200000037284_100000211926 [0,0,0,0,0,0|1,0,2]=3 943 B12R0.5 CCCCCCC#CCOCCO 7a_200000037284_100000211926 [0,0,0,0,0,0|1,0,2]=3 944 B12R0.5 CCCCCCC=NNCCCC 4a_100025702795_100000234349 [0,0,0,0,0,0|3,0,1]=4 945 B12R0.5 CCCCCCCC#CCOCC 34a_200000061759_100000210202 [0,0,0,0,0,0|2,0,2]=4 946 B12R0.5 CCCCCCCC#CCOCC 7a_200000061759_100000210202 [0,0,0,0,0,0|2,0,2]=4 947 B12R0.5 CCCCCCCC#CCOCF 34a_200000061759_100015361967 [0,0,0,0,0,0|2,0,2]=4 948 B12R0.5 CCCCCCCC#CCOCF 7a_200000061759_100015361967 [0,0,0,0,0,0|2,0,2]=4 949 B12R0.5 CCCCCCCC/C=C/COC 34a_200020667288_200000210301 [0,0,0,0,0,0|2,0,2]=4 950 B12R0.5 CCCCCCCC/C=C/COC 7a_200020667288_200000210301 [0,0,0,0,0,0|2,0,2]=4 951 B12R0.5 CCCCCCCC/C=C/CO[13CH3] 34a_200020667288_200025704644 [0,0,0,0,0,0|2,0,2]=4 952 B12R0.5 CCCCCCCC/C=C/CO[13CH3] 7a_200020667288_200025704644 [0,0,0,0,0,0|2,0,2]=4 953 B12R0.5 CCCCCCCC=NNCCC 4a_100000740057_100000210592 [0,0,0,0,0,0|3,0,1]=4 954 B12R0.5 CCCCCCCC=NNCCO 4a_100000210001_100000210592 [0,0,0,0,0,0|2,0,1]=3 955 B12R0.5 CCCCCCCCC=NNCC 4a_100000756455_100011218696 [0,0,0,0,0,0|3,0,1]=4 956 B12R0.5 CCCCCCCCCCCNC 2230a_106832991635_100011215454 [0,0,0,0,0,0|2,0,0]=2 957 B12R0.5 CCCCCCCCCCCNC 2230a_200011215754_200000210301 [0,0,0,0,0,0|2,0,0]=2 958 B12R0.5 CCCCCCCCCCCNC 34a_100102657272_100011215454 [0,0,0,0,0,0|2,0,0]=2 959 B12R0.5 CCCCCCCCCCCNC 34a_200011215754_200000210301 [0,0,0,0,0,0|2,0,0]=2 960 B12R0.5 CCCCCCCCCCCNC 7a_106832991635_100011215454 [0,0,0,0,0,0|2,0,0]=2 961 B12R0.5 CCCCCCCCCCCN[13CH3] 2230a_200011215754_200025704644 [0,0,0,0,0,0|2,0,0]=2 962 B12R0.5 CCCCCCCCCCCN[13CH3] 34a_200011215754_200025704644 [0,0,0,0,0,0|2,0,0]=2 963 B12R0.5 CCCCCCCCCCCOC 34a_100000210809_200000210301 [0,0,0,0,0,0|2,0,0]=2 964 B12R0.5 CCCCCCCCCCCOC 34a_100138415774_100011215454 [0,0,0,0,0,0|2,0,0]=2 965 B12R0.5 CCCCCCCCCCCOC 7a_100000210809_200000210301 [0,0,0,0,0,0|2,0,0]=2 966 B12R0.5 CCCCCCCCCCCO[13CH3] 34a_100000210809_200025704644 [0,0,0,0,0,0|2,0,0]=2 967 B12R0.5 CCCCCCCCCCCO[13CH3] 7a_100000210809_200025704644 [0,0,0,0,0,0|2,0,0]=2 968 B12R0.5 CCCCCCCCCCCSC 62a_200000210301_100011215454 [0,0,0,0,0,0|2,0,0]=2 969 B12R0.5 CCCCCCCCCCCS[13CH3] 62a_200025704644_100011215454 [0,0,0,0,0,0|2,0,0]=2 970 B12R0.5 CCCCCCCCCCNCC 2230a_100000684558_100000210202 [0,0,0,0,0,0|2,0,0]=2 971 B12R0.5 CCCCCCCCCCNCC 2230a_100015525214_100000210320 [0,0,0,0,0,0|2,0,0]=2 972 B12R0.5 CCCCCCCCCCNCC 34a_100000684558_100000210202 [0,0,0,0,0,0|2,0,0]=2 973 B12R0.5 CCCCCCCCCCNCF 34a_100000684558_100015361967 [0,0,0,0,0,0|2,0,0]=2 974 B12R0.5 CCCCCCCCCCOCC 34a_100000210711_100000210202 [0,0,0,0,0,0|2,0,0]=2 975 B12R0.5 CCCCCCCCCCOCC 34a_100121572206_100000210320 [0,0,0,0,0,0|2,0,0]=2 976 B12R0.5 CCCCCCCCCCOCC 7a_100000210711_100000210202 [0,0,0,0,0,0|2,0,0]=2 977 B12R0.5 CCCCCCCCCCOCF 34a_100000210711_100015361967 [0,0,0,0,0,0|2,0,0]=2 978 B12R0.5 CCCCCCCCCCOCF 7a_100000210711_100015361967 [0,0,0,0,0,0|2,0,0]=2 979 B12R0.5 CCCCCCCCCCSCC 62a_100000210202_100000210320 [0,0,0,0,0,0|2,0,0]=2 980 B12R0.5 CCCCCCCCCCSCF 62a_100015361967_100000210320 [0,0,0,0,0,0|2,0,0]=2 981 B12R0.5 CCCCCCCCCNCC#N 2230a_100000212291_100011215382 [0,0,0,0,0,0|2,0,1]=3 982 B12R0.5 CCCCCCCCCNCC=O 2230a_100000212291_200015260668 [0,0,0,0,0,0|1,0,2]=3 983 B12R0.5 CCCCCCCCCNCC=O 34a_100000212291_200009817547 [0,0,0,0,0,0|1,0,2]=3 984 B12R0.5 CCCCCCCCCNCCC 2230a_100000212291_100000210303 [0,0,0,0,0,0|2,0,0]=2 985 B12R0.5 CCCCCCCCCNCCC 34a_100000212291_100000210303 [0,0,0,0,0,0|2,0,0]=2 986 B12R0.5 CCCCCCCCCNCCF 2230a_100000212291_100011217306 [0,0,0,0,0,0|2,0,0]=2 987 B12R0.5 CCCCCCCCCNCCF 34a_100000212291_100011217306 [0,0,0,0,0,0|2,0,0]=2 988 B12R0.5 CCCCCCCCCNCCF 34a_100000724931_100011214924 [0,0,0,0,0,0|2,0,0]=2 989 B12R0.5 CCCCCCCCCNCCO 2230a_100000212291_100000211926 [0,0,0,0,0,0|1,0,0]=1 990 B12R0.5 CCCCCCCCCNCCO 2230a_100016997473_100011214924 [0,0,0,0,0,0|1,0,0]=1 991 B12R0.5 CCCCCCCCCNCCO 34a_100000212291_100000211926 [0,0,0,0,0,0|1,0,0]=1 992 B12R0.5 CCCCCCCCCNCCO 34a_100016990907_100011214924 [0,0,0,0,0,0|1,0,0]=1 993 B12R0.5 CCCCCCCCCNCOC 2230a_100000212291_100000766300 [0,0,0,0,0,0|3,0,0]=3 994 B12R0.5 CCCCCCCCCNCSC 2230a_100000212291_100011218213 [0,0,0,0,0,0|3,0,0]=3 995 B12R0.5 CCCCCCCCCNCSC 34a_100000212291_100011218213 [0,0,0,0,0,0|3,0,0]=3 996 B12R0.5 CCCCCCCCCOCC#N 7a_100000210712_100011215382 [0,0,0,0,0,0|2,0,1]=3 997 B12R0.5 CCCCCCCCCOCC=O 34a_100000210712_200009817547 [0,0,0,0,0,0|1,0,2]=3 998 B12R0.5 CCCCCCCCCOCC=O 7a_100000210712_200015260668 [0,0,0,0,0,0|1,0,2]=3 999 B12R0.5 CCCCCCCCCOCCBr 34a_100000211926_100011214924 [0,0,0,0,0,0|2,0,0]=2 1000 B12R0.5 CCCCCCCCCOCCC 34a_100000210258_100011214924 [0,0,0,0,0,0|2,0,0]=2 1001 B12R0.5 CCCCCCCCCOCCC 34a_100000210712_100000210303 [0,0,0,0,0,0|2,0,0]=2 1002 B12R0.5 CCCCCCCCCOCCC 7a_100000210712_100000210303 [0,0,0,0,0,0|2,0,0]=2 1003 B12R0.5 CCCCCCCCCOCCF 34a_100000210712_100011217306 [0,0,0,0,0,0|2,0,0]=2 1004 B12R0.5 CCCCCCCCCOCCF 7a_100000210712_100011217306 [0,0,0,0,0,0|2,0,0]=2 1005 B12R0.5 CCCCCCCCCOCCN 34a_100000210304_100011214924 [0,0,0,0,0,0|2,0,0]=2 1006 B12R0.5 CCCCCCCCCOCCO 34a_100000210712_100000211926 [0,0,0,0,0,0|1,0,0]=1 1007 B12R0.5 CCCCCCCCCOCCO 7a_100000210712_100000211926 [0,0,0,0,0,0|1,0,0]=1 1008 B12R0.5 CCCCCCCCCOCSC 34a_100000210712_100011218213 [0,0,0,0,0,0|3,0,0]=3 1009 B12R0.5 CCCCCCCCCSCC#N 62a_100011215382_100000210670 [0,0,0,0,0,0|2,0,1]=3 1010 B12R0.5 CCCCCCCCCSCC=O 62a_200015260668_100000210670 [0,0,0,0,0,0|1,0,2]=3 1011 B12R0.5 CCCCCCCCCSCCC 62a_100000210303_100000210670 [0,0,0,0,0,0|2,0,0]=2 1012 B12R0.5 CCCCCCCCCSCCF 62a_100011217306_100000210670 [0,0,0,0,0,0|2,0,0]=2 1013 B12R0.5 CCCCCCCCCSCCO 62a_100000211926_100000210670 [0,0,0,0,0,0|1,0,0]=1 1014 B12R0.5 CCCCCCCCCSCOC 62a_100000766300_100000210670 [0,0,0,0,0,0|3,0,0]=3 1015 B12R0.5 CCCCCCCCCSCSC 62a_100011218213_100000210670 [0,0,0,0,0,0|3,0,0]=3 1016 B12R0.5 CCCCCCCCNCCC#N 2230a_100000229939_100011215226 [0,0,0,0,0,0|2,0,1]=3 1017 B12R0.5 CCCCCCCCNCCCC 2230a_100000102301_100000210759 [0,0,0,0,0,0|2,0,0]=2 1018 B12R0.5 CCCCCCCCNCCCC 2230a_100000229939_100000210211 [0,0,0,0,0,0|2,0,0]=2 1019 B12R0.5 CCCCCCCCNCCCC 34a_100000229939_100000210210 [0,0,0,0,0,0|2,0,0]=2 1020 B12R0.5 CCCCCCCCNCCCC 7a_106832991798_100000210759 [0,0,0,0,0,0|2,0,0]=2 1021 B12R0.5 CCCCCCCCNCCCF 2230a_100000229939_100011934791 [0,0,0,0,0,0|2,0,0]=2 1022 B12R0.5 CCCCCCCCNCCCF 2230a_100015189416_100000210759 [0,0,0,0,0,0|2,0,0]=2 1023 B12R0.5 CCCCCCCCNCCCF 34a_100000229939_100011934791 [0,0,0,0,0,0|2,0,0]=2 1024 B12R0.5 CCCCCCCCNCCCF 34a_100015189416_100000210759 [0,0,0,0,0,0|2,0,0]=2 1025 B12R0.5 CCCCCCCCNCCCO 2230a_100000229939_100000230001 [0,0,0,0,0,0|1,0,0]=1 1026 B12R0.5 CCCCCCCCNCCCO 34a_100000229939_100000230001 [0,0,0,0,0,0|1,0,0]=1 1027 B12R0.5 CCCCCCCCNCCOC 2230a_100000209980_100000210759 [0,0,0,0,0,0|3,0,0]=3 1028 B12R0.5 CCCCCCCCNCCOC 2230a_100000229939_100011201679 [0,0,0,0,0,0|3,0,0]=3 1029 B12R0.5 CCCCCCCCNCCOC 34a_100000229939_100011201679 [0,0,0,0,0,0|3,0,0]=3 1030 B12R0.5 CCCCCCCCNCCSC 2230a_100000229939_100000751147 [0,0,0,0,0,0|3,0,0]=3 1031 B12R0.5 CCCCCCCCNCCSC 2230a_100020590264_100000210759 [0,0,0,0,0,0|3,0,0]=3 1032 B12R0.5 CCCCCCCCNCCSC 34a_100000229939_100000212216 [0,0,0,0,0,0|3,0,0]=3 1033 B12R0.5 CCCCCCCCOCCC#N 7a_100000210232_100000184422 [0,0,0,0,0,0|2,0,1]=3 1034 B12R0.5 CCCCCCCCOCCCBr 34a_100011217188_100000210759 [0,0,0,0,0,0|2,0,0]=2 1035 B12R0.5 CCCCCCCCOCCCC 34a_100000210227_100000210759 [0,0,0,0,0,0|2,0,0]=2 1036 B12R0.5 CCCCCCCCOCCCC 34a_100000210232_100000210210 [0,0,0,0,0,0|2,0,0]=2 1037 B12R0.5 CCCCCCCCOCCCC 7a_100000210227_100000210759 [0,0,0,0,0,0|2,0,0]=2 1038 B12R0.5 CCCCCCCCOCCCC 7a_100000210232_100000210211 [0,0,0,0,0,0|2,0,0]=2 1039 B12R0.5 CCCCCCCCOCCCCl 34a_100000230001_100000210759 [0,0,0,0,0,0|2,0,0]=2 1040 B12R0.5 CCCCCCCCOCCCF 34a_100000210232_100011934791 [0,0,0,0,0,0|2,0,0]=2 1041 B12R0.5 CCCCCCCCOCCCF 34a_100000759539_100000210759 [0,0,0,0,0,0|2,0,0]=2 1042 B12R0.5 CCCCCCCCOCCCF 7a_100000210232_100011934791 [0,0,0,0,0,0|2,0,0]=2 1043 B12R0.5 CCCCCCCCOCCCN 34a_100000182051_100000210759 [0,0,0,0,0,0|2,0,0]=2 1044 B12R0.5 CCCCCCCCOCCCO 34a_100000210232_100000230001 [0,0,0,0,0,0|1,0,0]=1 1045 B12R0.5 CCCCCCCCOCCCO 7a_100000210232_100011215043 [0,0,0,0,0,0|1,0,0]=1 1046 B12R0.5 CCCCCCCCOCCOC 34a_100000210232_100011201679 [0,0,0,0,0,0|3,0,0]=3 1047 B12R0.5 CCCCCCCCOCCOC 34a_100000210237_100000210759 [0,0,0,0,0,0|3,0,0]=3 1048 B12R0.5 CCCCCCCCOCCOC 7a_100000210232_100000233755 [0,0,0,0,0,0|3,0,0]=3 1049 B12R0.5 CCCCCCCCOCCON 34a_100000700252_100000210759 [0,0,0,0,0,0|3,0,0]=3 1050 B12R0.5 CCCCCCCCOCCSC 34a_100000210232_100000212216 [0,0,0,0,0,0|3,0,0]=3 1051 B12R0.5 CCCCCCCCOCCSC 34a_100000230434_100000210759 [0,0,0,0,0,0|3,0,0]=3 1052 B12R0.5 CCCCCCCCOCCSC 7a_100000210232_100000212216 [0,0,0,0,0,0|3,0,0]=3 1053 B12R0.5 CCCCCCCCOCCSC 7a_100000230434_100000210759 [0,0,0,0,0,0|3,0,0]=3 1054 B12R0.5 CCCCCCCCSCCC#N 62a_100000210759_100011215226 [0,0,0,0,0,0|2,0,1]=3 1055 B12R0.5 CCCCCCCCSCCC#N 62a_100011215226_100000210317 [0,0,0,0,0,0|2,0,1]=3 1056 B12R0.5 CCCCCCCCSCCCC 62a_100000210211_100000210317 [0,0,0,0,0,0|2,0,0]=2 1057 B12R0.5 CCCCCCCCSCCCC 62a_100000210759_100000210210 [0,0,0,0,0,0|2,0,0]=2 1058 B12R0.5 CCCCCCCCSCCCF 62a_100000210759_100011934791 [0,0,0,0,0,0|2,0,0]=2 1059 B12R0.5 CCCCCCCCSCCCF 62a_100011934791_100000210317 [0,0,0,0,0,0|2,0,0]=2 1060 B12R0.5 CCCCCCCCSCCCO 62a_100000210759_100011215043 [0,0,0,0,0,0|1,0,0]=1 1061 B12R0.5 CCCCCCCCSCCCO 62a_100011215043_100000210317 [0,0,0,0,0,0|1,0,0]=1 1062 B12R0.5 CCCCCCCCSCCOC 62a_100000210759_100000233755 [0,0,0,0,0,0|3,0,0]=3 1063 B12R0.5 CCCCCCCCSCCOC 62a_100000233755_100000210317 [0,0,0,0,0,0|3,0,0]=3 1064 B12R0.5 CCCCCCCCSCCSC 62a_100000210759_100000751147 [0,0,0,0,0,0|3,0,0]=3 1065 B12R0.5 CCCCCCCCSCCSC 62a_100000212216_100000210317 [0,0,0,0,0,0|3,0,0]=3 1066 B12R0.5 CCCCCCCCSCOCC 62a_100000210759_100000739092 [0,0,0,0,0,0|3,0,0]=3 1067 B12R0.5 CCCCCCCCSCOCC 62a_100000739092_100000210317 [0,0,0,0,0,0|3,0,0]=3 1068 B12R0.5 CCCCCCCCSCSC#N 62a_100000210759_100000211825 [0,0,0,0,0,0|3,0,1]=4 1069 B12R0.5 CCCCCCCCSCSC#N 62a_100000211825_100000210317 [0,0,0,0,0,0|3,0,1]=4 1070 B12R0.5 CCCCCCCNCC#CCO 2230a_100000229938_200000047223 [0,0,0,0,0,0|1,0,2]=3 1071 B12R0.5 CCCCCCCNCCCC#N 2230a_100000229938_100000687738 [0,0,0,0,0,0|2,0,1]=3 1072 B12R0.5 CCCCCCCNCCCC=O 2230a_100000229938_200011292268 [0,0,0,0,0,0|1,0,2]=3 1073 B12R0.5 CCCCCCCNCCCCC 2230a_100000209983_100000210681 [0,0,0,0,0,0|2,0,0]=2 1074 B12R0.5 CCCCCCCNCCCCC 2230a_100000229938_100000210326 [0,0,0,0,0,0|2,0,0]=2 1075 B12R0.5 CCCCCCCNCCCCF 2230a_100000229938_100000729493 [0,0,0,0,0,0|2,0,0]=2 1076 B12R0.5 CCCCCCCNCCCCO 2230a_100000229938_100000210776 [0,0,0,0,0,0|1,0,0]=1 1077 B12R0.5 CCCCCCCNCCCCO 2230a_100000750430_100000210681 [0,0,0,0,0,0|1,0,0]=1 1078 B12R0.5 CCCCCCCNCCCCO 34a_100000750430_100000210614 [0,0,0,0,0,0|1,0,0]=1 1079 B12R0.5 CCCCCCCNCCCOC 2230a_100000229938_100000740836 [0,0,0,0,0,0|3,0,0]=3 1080 B12R0.5 CCCCCCCNCCCOC 34a_100150723488_100000210614 [0,0,0,0,0,0|3,0,0]=3 1081 B12R0.5 CCCCCCCNCCCSC 2230a_100000749238_100000210681 [0,0,0,0,0,0|3,0,0]=3 1082 B12R0.5 CCCCCCCNCCOCC 2230a_100000229938_100011215890 [0,0,0,0,0,0|3,0,0]=3 1083 B12R0.5 CCCCCCCNCCOCC 2230a_102516460346_100000210681 [0,0,0,0,0,0|3,0,0]=3 1084 B12R0.5 CCCCCCCNCCOCC 34a_102516460346_100000210614 [0,0,0,0,0,0|3,0,0]=3 1085 B12R0.5 CCCCCCCNCCSCC 2230a_100000106463_100000210681 [0,0,0,0,0,0|3,0,0]=3 1086 B12R0.5 CCCCCCCNCCSCC 2230a_100000229938_100000757381 [0,0,0,0,0,0|3,0,0]=3 1087 B12R0.5 CCCCCCCOCC#CCCl 34a_200000047223_100000210614 [0,0,0,0,0,0|2,0,2]=4 1088 B12R0.5 CCCCCCCOCC#CCO 34a_100000210272_200000047223 [0,0,0,0,0,0|1,0,2]=3 1089 B12R0.5 CCCCCCCOCC#CCO 7a_100000210272_200000047223 [0,0,0,0,0,0|1,0,2]=3 1090 B12R0.5 CCCCCCCOCCCC#N 7a_100000210272_100000687738 [0,0,0,0,0,0|2,0,1]=3 1091 B12R0.5 CCCCCCCOCCCC=O 7a_100000210272_200011292268 [0,0,0,0,0,0|1,0,2]=3 1092 B12R0.5 CCCCCCCOCCCCBr 34a_100011216708_100000210614 [0,0,0,0,0,0|2,0,0]=2 1093 B12R0.5 CCCCCCCOCCCCC 34a_100000210253_100000210614 [0,0,0,0,0,0|2,0,0]=2 1094 B12R0.5 CCCCCCCOCCCCC 34a_100000210272_100000718602 [0,0,0,0,0,0|2,0,0]=2 1095 B12R0.5 CCCCCCCOCCCCC 7a_100000210253_100000210614 [0,0,0,0,0,0|2,0,0]=2 1096 B12R0.5 CCCCCCCOCCCCC 7a_100000210272_100000210326 [0,0,0,0,0,0|2,0,0]=2 1097 B12R0.5 CCCCCCCOCCCCCl 34a_100000210776_100000210614 [0,0,0,0,0,0|2,0,0]=2 1098 B12R0.5 CCCCCCCOCCCCCl 7a_100000210776_100000210614 [0,0,0,0,0,0|2,0,0]=2 1099 B12R0.5 CCCCCCCOCCCCF 34a_100000210272_100000729493 [0,0,0,0,0,0|2,0,0]=2 1100 B12R0.5 CCCCCCCOCCCCF 34a_100011995726_100000210614 [0,0,0,0,0,0|2,0,0]=2 1101 B12R0.5 CCCCCCCOCCCCF 7a_100000210272_100000729493 [0,0,0,0,0,0|2,0,0]=2 1102 B12R0.5 CCCCCCCOCCCCF 7a_100011995726_100000210614 [0,0,0,0,0,0|2,0,0]=2 1103 B12R0.5 CCCCCCCOCCCCI 34a_200012148704_100000210614 [0,0,0,0,0,0|2,0,0]=2 1104 B12R0.5 CCCCCCCOCCCCN 34a_100000750430_100000210614 [0,0,0,0,0,0|2,0,0]=2 1105 B12R0.5 CCCCCCCOCCCCO 34a_100000210272_100011216708 [0,0,0,0,0,0|1,0,0]=1 1106 B12R0.5 CCCCCCCOCCCCO 7a_100000210272_100000210776 [0,0,0,0,0,0|1,0,0]=1 1107 B12R0.5 CCCCCCCOCCCNC 34a_100000213112_100000210614 [0,0,0,0,0,0|3,0,0]=3 1108 B12R0.5 CCCCCCCOCCCOC 34a_100000210272_100000740836 [0,0,0,0,0,0|3,0,0]=3 1109 B12R0.5 CCCCCCCOCCCOC 34a_100000740835_100000210614 [0,0,0,0,0,0|3,0,0]=3 1110 B12R0.5 CCCCCCCOCCCOC 7a_100000210272_100000740836 [0,0,0,0,0,0|3,0,0]=3 1111 B12R0.5 CCCCCCCOCCCSC 34a_100000690336_100000210614 [0,0,0,0,0,0|3,0,0]=3 1112 B12R0.5 CCCCCCCOCCCSC 7a_100000690336_100000210614 [0,0,0,0,0,0|3,0,0]=3 1113 B12R0.5 CCCCCCCOCCOCC 34a_100000210136_100000210614 [0,0,0,0,0,0|3,0,0]=3 1114 B12R0.5 CCCCCCCOCCOCC 34a_100000210272_100000210147 [0,0,0,0,0,0|3,0,0]=3 1115 B12R0.5 CCCCCCCOCCOCC 7a_100000210136_100000210614 [0,0,0,0,0,0|3,0,0]=3 1116 B12R0.5 CCCCCCCOCCOCC 7a_100000210272_100011215890 [0,0,0,0,0,0|3,0,0]=3 1117 B12R0.5 CCCCCCCOCCSCC 34a_100000210272_100000757381 [0,0,0,0,0,0|3,0,0]=3 1118 B12R0.5 CCCCCCCOCCSCC 34a_100000212035_100000210614 [0,0,0,0,0,0|3,0,0]=3 1119 B12R0.5 CCCCCCCOCCSCC 7a_100000210272_100000757381 [0,0,0,0,0,0|3,0,0]=3 1120 B12R0.5 CCCCCCCOCCSCC 7a_100000212035_100000210614 [0,0,0,0,0,0|3,0,0]=3 1121 B12R0.5 CCCCCCCSCC#CCO 62a_100000210614_200000047223 [0,0,0,0,0,0|1,0,2]=3 1122 B12R0.5 CCCCCCCSCC#CCO 62a_200000047223_100000210316 [0,0,0,0,0,0|1,0,2]=3 1123 B12R0.5 CCCCCCCSCCCC#N 62a_100000210614_100000687738 [0,0,0,0,0,0|2,0,1]=3 1124 B12R0.5 CCCCCCCSCCCC#N 62a_100000687738_100000210316 [0,0,0,0,0,0|2,0,1]=3 1125 B12R0.5 CCCCCCCSCCCC=O 62a_100000210614_200011292268 [0,0,0,0,0,0|1,0,2]=3 1126 B12R0.5 CCCCCCCSCCCC=O 62a_200011292268_100000210316 [0,0,0,0,0,0|1,0,2]=3 1127 B12R0.5 CCCCCCCSCCCCC 62a_100000210326_100000210316 [0,0,0,0,0,0|2,0,0]=2 1128 B12R0.5 CCCCCCCSCCCCC 62a_100000210614_100000210326 [0,0,0,0,0,0|2,0,0]=2 1129 B12R0.5 CCCCCCCSCCCCF 62a_100000210614_100000729493 [0,0,0,0,0,0|2,0,0]=2 1130 B12R0.5 CCCCCCCSCCCCF 62a_100000729493_100000210316 [0,0,0,0,0,0|2,0,0]=2 1131 B12R0.5 CCCCCCCSCCCCO 62a_100000210614_100000210776 [0,0,0,0,0,0|1,0,0]=1 1132 B12R0.5 CCCCCCCSCCCCO 62a_100000210776_100000210316 [0,0,0,0,0,0|1,0,0]=1 1133 B12R0.5 CCCCCCCSCCCOC 62a_100000210614_100000709357 [0,0,0,0,0,0|3,0,0]=3 1134 B12R0.5 CCCCCCCSCCCOC 62a_100000709357_100000210316 [0,0,0,0,0,0|3,0,0]=3 1135 B12R0.5 CCCCCCCSCCOCC 62a_100000210147_100000210316 [0,0,0,0,0,0|3,0,0]=3 1136 B12R0.5 CCCCCCCSCCOCC 62a_100000210614_100011215890 [0,0,0,0,0,0|3,0,0]=3 1137 B12R0.5 CCCCCCCSCCSC#N 62a_100000034367_100000210316 [0,0,0,0,0,0|3,0,1]=4 1138 B12R0.5 CCCCCCCSCCSC#N 62a_100000210614_100000034367 [0,0,0,0,0,0|3,0,1]=4 1139 B12R0.5 CCCCCCCSCCSCC 62a_100000210614_100000757381 [0,0,0,0,0,0|3,0,0]=3 1140 B12R0.5 CCCCCCCSCCSCC 62a_100000757381_100000210316 [0,0,0,0,0,0|3,0,0]=3 1141 B12R0.5 CCCCCCNCCCCC#N 2230a_100000210581_100000211819 [0,0,0,0,0,0|2,0,1]=3 1142 B12R0.5 CCCCCCNCCCCC=O 2230a_100000210581_100000139335 [0,0,0,0,0,0|1,0,2]=3 1143 B12R0.5 CCCCCCNCCCCCC 2230a_100000210581_100000210314 [0,0,0,0,0,0|2,0,0]=2 1144 B12R0.5 CCCCCCNCCCCCF 2230a_100000210581_100000729378 [0,0,0,0,0,0|2,0,0]=2 1145 B12R0.5 CCCCCCNCCCCCO 2230a_100000210581_100000746330 [0,0,0,0,0,0|1,0,0]=1 1146 B12R0.5 CCCCCCNCCCCCO 2230a_100000762737_100000210314 [0,0,0,0,0,0|1,0,0]=1 1147 B12R0.5 CCCCCCNCCCCCO 34a_100000762737_100000210314 [0,0,0,0,0,0|1,0,0]=1 1148 B12R0.5 CCCCCCNCCCCOC 2230a_100000210581_100000730899 [0,0,0,0,0,0|3,0,0]=3 1149 B12R0.5 CCCCCCNCCCN=[N+]=[N-] 2230a_100000744732_100000210314 [0,0,0,0,0,0|4,0,0]=4 1150 B12R0.5 CCCCCCNCCCOCC 2230a_100000210581_100012232248 [0,0,0,0,0,0|3,0,0]=3 1151 B12R0.5 CCCCCCNCCCOCC 2230a_100000210961_100000210314 [0,0,0,0,0,0|3,0,0]=3 1152 B12R0.5 CCCCCCNCCCOCC 34a_100000210961_100000210314 [0,0,0,0,0,0|3,0,0]=3 1153 B12R0.5 CCCCCCNCCOCC#N 2230a_100000210581_200000047693 [0,0,0,0,0,0|3,0,1]=4 1154 B12R0.5 CCCCCCNCCOCCC 2230a_100000210581_100011215938 [0,0,0,0,0,0|3,0,0]=3 1155 B12R0.5 CCCCCCNCCOCCC 2230a_100161115042_100000210314 [0,0,0,0,0,0|3,0,0]=3 1156 B12R0.5 CCCCCCNCCOCCC 34a_100161115042_100000210314 [0,0,0,0,0,0|3,0,0]=3 1157 B12R0.5 CCCCCCNCCOCCO 2230a_100000210581_100011215305 [0,0,0,0,0,0|2,0,0]=2 1158 B12R0.5 CCCCCCNCCOCCO 2230a_100000211614_100000210314 [0,0,0,0,0,0|2,0,0]=2 1159 B12R0.5 CCCCCCNCCOCCO 34a_100000211614_100000210314 [0,0,0,0,0,0|2,0,0]=2 1160 B12R0.5 CCCCCCNCCSCCC 2230a_100020603323_100000210314 [0,0,0,0,0,0|3,0,0]=3 1161 B12R0.5 CCCCCCNCCSCCO 2230a_100011219999_100000210314 [0,0,0,0,0,0|2,0,0]=2 1162 B12R0.5 CCCCCCNCOCCCC 2230a_100000210581_100011995733 [0,0,0,0,0,0|3,0,0]=3 1163 B12R0.5 CCCCCCNCOCCOC 2230a_100000210581_100000231047 [0,0,0,0,0,0|4,0,0]=4 1164 B12R0.5 CCCCCCOCCCCC#N 7a_100000210259_100000211819 [0,0,0,0,0,0|2,0,1]=3 1165 B12R0.5 CCCCCCOCCCCC=O 7a_100000210259_100000139335 [0,0,0,0,0,0|1,0,2]=3 1166 B12R0.5 CCCCCCOCCCCCBr 34a_100000746331_100000210314 [0,0,0,0,0,0|2,0,0]=2 1167 B12R0.5 CCCCCCOCCCCCBr 7a_100000746331_100000210314 [0,0,0,0,0,0|2,0,0]=2 1168 B12R0.5 CCCCCCOCCCCCC 34a_100000210259_100000210314 [0,0,0,0,0,0|2,0,0]=2 1169 B12R0.5 CCCCCCOCCCCCC 7a_100000210259_100000210314 [0,0,0,0,0,0|2,0,0]=2 1170 B12R0.5 CCCCCCOCCCCCCl 34a_100000746330_100000210314 [0,0,0,0,0,0|2,0,0]=2 1171 B12R0.5 CCCCCCOCCCCCCl 7a_100000746330_100000210314 [0,0,0,0,0,0|2,0,0]=2 1172 B12R0.5 CCCCCCOCCCCCF 34a_100000210259_100000729378 [0,0,0,0,0,0|2,0,0]=2 1173 B12R0.5 CCCCCCOCCCCCF 7a_100000210259_100000729378 [0,0,0,0,0,0|2,0,0]=2 1174 B12R0.5 CCCCCCOCCCCCI 34a_200012148887_100000210314 [0,0,0,0,0,0|2,0,0]=2 1175 B12R0.5 CCCCCCOCCCCCI 7a_200012148887_100000210314 [0,0,0,0,0,0|2,0,0]=2 1176 B12R0.5 CCCCCCOCCCCCN 34a_100000762737_100000210314 [0,0,0,0,0,0|2,0,0]=2 1177 B12R0.5 CCCCCCOCCCCCO 34a_100000210259_100000746330 [0,0,0,0,0,0|1,0,0]=1 1178 B12R0.5 CCCCCCOCCCCCO 7a_100000210259_100000746330 [0,0,0,0,0,0|1,0,0]=1 1179 B12R0.5 CCCCCCOCCCCOC 34a_100000210259_100000755781 [0,0,0,0,0,0|3,0,0]=3 1180 B12R0.5 CCCCCCOCCCCOC 34a_100000740925_100000210314 [0,0,0,0,0,0|3,0,0]=3 1181 B12R0.5 CCCCCCOCCCCOC 7a_100000210259_100000730899 [0,0,0,0,0,0|3,0,0]=3 1182 B12R0.5 CCCCCCOCCCCSC 34a_100011217163_100000210314 [0,0,0,0,0,0|3,0,0]=3 1183 B12R0.5 CCCCCCOCCCCSC 7a_100011217163_100000210314 [0,0,0,0,0,0|3,0,0]=3 1184 B12R0.5 CCCCCCOCCCOCC 34a_100000210259_100012232248 [0,0,0,0,0,0|3,0,0]=3 1185 B12R0.5 CCCCCCOCCCOCC 34a_100000757476_100000210314 [0,0,0,0,0,0|3,0,0]=3 1186 B12R0.5 CCCCCCOCCCOCC 7a_100000210259_100012232248 [0,0,0,0,0,0|3,0,0]=3 1187 B12R0.5 CCCCCCOCCCOCC 7a_100000757476_100000210314 [0,0,0,0,0,0|3,0,0]=3 1188 B12R0.5 CCCCCCOCCCSCC 34a_100011216438_100000210314 [0,0,0,0,0,0|3,0,0]=3 1189 B12R0.5 CCCCCCOCCCSCC 7a_100011216438_100000210314 [0,0,0,0,0,0|3,0,0]=3 1190 B12R0.5 CCCCCCOCCOCC#N 7a_100000210259_200000047693 [0,0,0,0,0,0|3,0,1]=4 1191 B12R0.5 CCCCCCOCCOCC#N 7a_100000691444_100011215382 [0,0,0,0,0,0|3,0,1]=4 1192 B12R0.5 CCCCCCOCCOCC=O 34a_100000691444_200009817547 [0,0,0,0,0,0|2,0,2]=4 1193 B12R0.5 CCCCCCOCCOCC=O 7a_100000691444_200015260668 [0,0,0,0,0,0|2,0,2]=4 1194 B12R0.5 CCCCCCOCCOCCBr 34a_100000692535_100000210314 [0,0,0,0,0,0|3,0,0]=3 1195 B12R0.5 CCCCCCOCCOCCBr 7a_100000692535_100000210314 [0,0,0,0,0,0|3,0,0]=3 1196 B12R0.5 CCCCCCOCCOCCC 34a_100000210259_100011215938 [0,0,0,0,0,0|3,0,0]=3 1197 B12R0.5 CCCCCCOCCOCCC 34a_100000691444_100000210303 [0,0,0,0,0,0|3,0,0]=3 1198 B12R0.5 CCCCCCOCCOCCC 34a_100000752267_100000210314 [0,0,0,0,0,0|3,0,0]=3 1199 B12R0.5 CCCCCCOCCOCCC 7a_100000210259_100011215938 [0,0,0,0,0,0|3,0,0]=3 1200 B12R0.5 CCCCCCOCCOCCC 7a_100000691444_100000210303 [0,0,0,0,0,0|3,0,0]=3 1201 B12R0.5 CCCCCCOCCOCCC 7a_100000752267_100000210314 [0,0,0,0,0,0|3,0,0]=3 1202 B12R0.5 CCCCCCOCCOCCCl 34a_100011215305_100000210314 [0,0,0,0,0,0|3,0,0]=3 1203 B12R0.5 CCCCCCOCCOCCCl 7a_100011215305_100000210314 [0,0,0,0,0,0|3,0,0]=3 1204 B12R0.5 CCCCCCOCCOCCF 34a_100000691444_100011217306 [0,0,0,0,0,0|3,0,0]=3 1205 B12R0.5 CCCCCCOCCOCCF 34a_200015357709_100000210314 [0,0,0,0,0,0|3,0,0]=3 1206 B12R0.5 CCCCCCOCCOCCF 7a_100000691444_100011217306 [0,0,0,0,0,0|3,0,0]=3 1207 B12R0.5 CCCCCCOCCOCCF 7a_200015357709_100000210314 [0,0,0,0,0,0|3,0,0]=3 1208 B12R0.5 CCCCCCOCCOCCI 34a_100012149058_100000210314 [0,0,0,0,0,0|3,0,0]=3 1209 B12R0.5 CCCCCCOCCOCCI 7a_100012149058_100000210314 [0,0,0,0,0,0|3,0,0]=3 1210 B12R0.5 CCCCCCOCCOCCN 34a_100000211614_100000210314 [0,0,0,0,0,0|3,0,0]=3 1211 B12R0.5 CCCCCCOCCOCCO 34a_100000210259_100000692535 [0,0,0,0,0,0|2,0,0]=2 1212 B12R0.5 CCCCCCOCCOCCO 34a_100000691444_100000211926 [0,0,0,0,0,0|2,0,0]=2 1213 B12R0.5 CCCCCCOCCOCCO 7a_100000210259_100011215305 [0,0,0,0,0,0|2,0,0]=2 1214 B12R0.5 CCCCCCOCCOCCO 7a_100000691444_100000211926 [0,0,0,0,0,0|2,0,0]=2 1215 B12R0.5 CCCCCCOCCOCSC 34a_100000691444_100011218213 [0,0,0,0,0,0|4,0,0]=4 1216 B12R0.5 CCCCCCOCCSCCC 34a_200000230433_100000210314 [0,0,0,0,0,0|3,0,0]=3 1217 B12R0.5 CCCCCCOCCSCCC 7a_200000230433_100000210314 [0,0,0,0,0,0|3,0,0]=3 1218 B12R0.5 CCCCCCOCOCCCC 34a_100000210259_100011995733 [0,0,0,0,0,0|3,0,0]=3 1219 B12R0.5 CCCCCCSCCCCC#N 62a_100000210314_100000211819 [0,0,0,0,0,0|2,0,1]=3 1220 B12R0.5 CCCCCCSCCCCC#N 62a_100011219923_100000210757 [0,0,0,0,0,0|2,0,1]=3 1221 B12R0.5 CCCCCCSCCCCC=O 62a_100000139335_100000210757 [0,0,0,0,0,0|1,0,2]=3 1222 B12R0.5 CCCCCCSCCCCC=O 62a_100000210314_100000139335 [0,0,0,0,0,0|1,0,2]=3 1223 B12R0.5 CCCCCCSCCCCCC 62a_100000210314_100000210757 [0,0,0,0,0,0|2,0,0]=2 1224 B12R0.5 CCCCCCSCCCCCF 62a_100000210314_100000729378 [0,0,0,0,0,0|2,0,0]=2 1225 B12R0.5 CCCCCCSCCCCCF 62a_100000729378_100000210757 [0,0,0,0,0,0|2,0,0]=2 1226 B12R0.5 CCCCCCSCCCCCO 62a_100000210314_100000746330 [0,0,0,0,0,0|1,0,0]=1 1227 B12R0.5 CCCCCCSCCCCCO 62a_100000746330_100000210757 [0,0,0,0,0,0|1,0,0]=1 1228 B12R0.5 CCCCCCSCCCCOC 62a_100000210314_100000730899 [0,0,0,0,0,0|3,0,0]=3 1229 B12R0.5 CCCCCCSCCCCOC 62a_100000730899_100000210757 [0,0,0,0,0,0|3,0,0]=3 1230 B12R0.5 CCCCCCSCCCOCC 62a_100000210314_100012232248 [0,0,0,0,0,0|3,0,0]=3 1231 B12R0.5 CCCCCCSCCCOCC 62a_100012232248_100000210757 [0,0,0,0,0,0|3,0,0]=3 1232 B12R0.5 CCCCCCSCCOCC#N 62a_100000210314_200000047693 [0,0,0,0,0,0|3,0,1]=4 1233 B12R0.5 CCCCCCSCCOCC#N 62a_200000047693_100000210757 [0,0,0,0,0,0|3,0,1]=4 1234 B12R0.5 CCCCCCSCCOCCC 62a_100000210314_100011215938 [0,0,0,0,0,0|3,0,0]=3 1235 B12R0.5 CCCCCCSCCOCCC 62a_100011215938_100000210757 [0,0,0,0,0,0|3,0,0]=3 1236 B12R0.5 CCCCCCSCCOCCO 62a_100000210314_100011215305 [0,0,0,0,0,0|2,0,0]=2 1237 B12R0.5 CCCCCCSCCOCCO 62a_100011215305_100000210757 [0,0,0,0,0,0|2,0,0]=2 1238 B12R0.5 CCCCCCSCOCCCC 62a_100000210314_100011995733 [0,0,0,0,0,0|3,0,0]=3 1239 B12R0.5 CCCCCCSCOCCCC 62a_100011995733_100000210757 [0,0,0,0,0,0|3,0,0]=3 1240 B12R0.5 CCCCCCSCOCCOC 62a_100000210314_100000231047 [0,0,0,0,0,0|4,0,0]=4 1241 B12R0.5 CCCCCCSCOCCOC 62a_100000231047_100000210757 [0,0,0,0,0,0|4,0,0]=4 1242 B12R0.5 CCCCCNCCCCCC#N 2230a_100000209983_100009813376 [0,0,0,0,0,0|2,0,1]=3 1243 B12R0.5 CCCCCNCCCCCC=O 2230a_100000209983_100000139337 [0,0,0,0,0,0|1,0,2]=3 1244 B12R0.5 CCCCCNCCCCCCF 2230a_100000209983_100015922095 [0,0,0,0,0,0|2,0,0]=2 1245 B12R0.5 CCCCCNCCCCCCO 2230a_100000209983_100000766143 [0,0,0,0,0,0|1,0,0]=1 1246 B12R0.5 CCCCCNCCCCCCO 2230a_100000686447_100000210326 [0,0,0,0,0,0|1,0,0]=1 1247 B12R0.5 CCCCCNCCCCCCO 34a_100000686447_100000718602 [0,0,0,0,0,0|1,0,0]=1 1248 B12R0.5 CCCCCNCCCCCOC 2230a_100000747528_100000210326 [0,0,0,0,0,0|3,0,0]=3 1249 B12R0.5 CCCCCNCCCCCOC 34a_100000747528_100000718602 [0,0,0,0,0,0|3,0,0]=3 1250 B12R0.5 CCCCCNCCCCN=[N+]=[N-] 2230a_100000101370_100000210326 [0,0,0,0,0,0|4,0,0]=4 1251 B12R0.5 CCCCCNCCCOCCC 2230a_100011217757_100000210326 [0,0,0,0,0,0|3,0,0]=3 1252 B12R0.5 CCCCCNCCCOCCC 34a_100011217757_100000718602 [0,0,0,0,0,0|3,0,0]=3 1253 B12R0.5 CCCCCNCCOCCCC 2230a_100000209983_100000743108 [0,0,0,0,0,0|3,0,0]=3 1254 B12R0.5 CCCCCNCCOCCCC 34a_100000224656_100000210210 [0,0,0,0,0,0|3,0,0]=3 1255 B12R0.5 CCCCCNCCOCCCF 34a_100000224656_100011934791 [0,0,0,0,0,0|3,0,0]=3 1256 B12R0.5 CCCCCNCCOCCCO 34a_100000224656_100000230001 [0,0,0,0,0,0|2,0,0]=2 1257 B12R0.5 CCCCCNCCOCCOC 2230a_100000209983_100000695917 [0,0,0,0,0,0|4,0,0]=4 1258 B12R0.5 CCCCCNCCOCCOC 2230a_100000745349_100000210326 [0,0,0,0,0,0|4,0,0]=4 1259 B12R0.5 CCCCCNCCOCCOC 34a_100000224656_100011201679 [0,0,0,0,0,0|4,0,0]=4 1260 B12R0.5 CCCCCNCCOCCOC 34a_100000745349_100000718602 [0,0,0,0,0,0|4,0,0]=4 1261 B12R0.5 CCCCCNCCOCCSC 34a_100000224656_100000212216 [0,0,0,0,0,0|4,0,0]=4 1262 B12R0.5 CCCCCNCCSCCCC 2230a_100025743550_100000210326 [0,0,0,0,0,0|3,0,0]=3 1263 B12R0.5 CCCCCNN=CCCCCO 4a_100000694160_100000031955 [0,0,0,0,0,0|2,0,1]=3 1264 B12R0.5 CCCCCOCCCCCC#N 7a_100000210253_100009813376 [0,0,0,0,0,0|2,0,1]=3 1265 B12R0.5 CCCCCOCCCCCC=O 7a_100000210253_100000139337 [0,0,0,0,0,0|1,0,2]=3 1266 B12R0.5 CCCCCOCCCCCCBr 34a_100011215345_100000718602 [0,0,0,0,0,0|2,0,0]=2 1267 B12R0.5 CCCCCOCCCCCCBr 7a_100011215345_100000210326 [0,0,0,0,0,0|2,0,0]=2 1268 B12R0.5 CCCCCOCCCCCCCl 34a_100000766143_100000718602 [0,0,0,0,0,0|2,0,0]=2 1269 B12R0.5 CCCCCOCCCCCCCl 7a_100000766143_100000210326 [0,0,0,0,0,0|2,0,0]=2 1270 B12R0.5 CCCCCOCCCCCCF 34a_100000210253_100015922095 [0,0,0,0,0,0|2,0,0]=2 1271 B12R0.5 CCCCCOCCCCCCF 34a_100000732779_100000718602 [0,0,0,0,0,0|2,0,0]=2 1272 B12R0.5 CCCCCOCCCCCCF 7a_100000210253_100015922095 [0,0,0,0,0,0|2,0,0]=2 1273 B12R0.5 CCCCCOCCCCCCF 7a_100000732779_100000210326 [0,0,0,0,0,0|2,0,0]=2 1274 B12R0.5 CCCCCOCCCCCCN 34a_100000686447_100000718602 [0,0,0,0,0,0|2,0,0]=2 1275 B12R0.5 CCCCCOCCCCCCO 34a_100000210253_100000766143 [0,0,0,0,0,0|1,0,0]=1 1276 B12R0.5 CCCCCOCCCCCCO 7a_100000210253_100000766143 [0,0,0,0,0,0|1,0,0]=1 1277 B12R0.5 CCCCCOCCCCCNC 34a_100000722520_100000718602 [0,0,0,0,0,0|3,0,0]=3 1278 B12R0.5 CCCCCOCCOCCC#N 7a_100011215259_100000184422 [0,0,0,0,0,0|3,0,1]=4 1279 B12R0.5 CCCCCOCCOCCCC 34a_100000210238_100000718602 [0,0,0,0,0,0|3,0,0]=3 1280 B12R0.5 CCCCCOCCOCCCC 34a_100000210253_100000743108 [0,0,0,0,0,0|3,0,0]=3 1281 B12R0.5 CCCCCOCCOCCCC 34a_100011215259_100000210210 [0,0,0,0,0,0|3,0,0]=3 1282 B12R0.5 CCCCCOCCOCCCC 7a_100000210238_100000210326 [0,0,0,0,0,0|3,0,0]=3 1283 B12R0.5 CCCCCOCCOCCCC 7a_100000210253_100000743108 [0,0,0,0,0,0|3,0,0]=3 1284 B12R0.5 CCCCCOCCOCCCC 7a_100011215259_100000210211 [0,0,0,0,0,0|3,0,0]=3 1285 B12R0.5 CCCCCOCCOCCCF 34a_100011215259_100011934791 [0,0,0,0,0,0|3,0,0]=3 1286 B12R0.5 CCCCCOCCOCCCF 7a_100011215259_100011934791 [0,0,0,0,0,0|3,0,0]=3 1287 B12R0.5 CCCCCOCCOCCCO 34a_100011215259_100000230001 [0,0,0,0,0,0|2,0,0]=2 1288 B12R0.5 CCCCCOCCOCCCO 7a_100011215259_100011215043 [0,0,0,0,0,0|2,0,0]=2 1289 B12R0.5 CCCCCOCCOCCNC 34a_100000228057_100000718602 [0,0,0,0,0,0|4,0,0]=4 1290 B12R0.5 CCCCCOCCOCCOC 34a_100000210253_100000695917 [0,0,0,0,0,0|4,0,0]=4 1291 B12R0.5 CCCCCOCCOCCOC 34a_100011215163_100000718602 [0,0,0,0,0,0|4,0,0]=4 1292 B12R0.5 CCCCCOCCOCCOC 34a_100011215259_100011201679 [0,0,0,0,0,0|4,0,0]=4 1293 B12R0.5 CCCCCOCCOCCOC 7a_100000210253_100000695917 [0,0,0,0,0,0|4,0,0]=4 1294 B12R0.5 CCCCCOCCOCCOC 7a_100011215163_100000210326 [0,0,0,0,0,0|4,0,0]=4 1295 B12R0.5 CCCCCOCCOCCOC 7a_100011215259_100000233755 [0,0,0,0,0,0|4,0,0]=4 1296 B12R0.5 CCCCCOCCOCCSC 34a_100011215259_100000212216 [0,0,0,0,0,0|4,0,0]=4 1297 B12R0.5 CCCCCOCCOCCSC 7a_100011215259_100000212216 [0,0,0,0,0,0|4,0,0]=4 1298 B12R0.5 CCCCCOCCSCCCC 34a_200000230436_100000718602 [0,0,0,0,0,0|3,0,0]=3 1299 B12R0.5 CCCCCOCCSCCCC 7a_200000230436_100000210326 [0,0,0,0,0,0|3,0,0]=3 1300 B12R0.5 CCCCCSCCCCCC#N 62a_100000210326_100009813376 [0,0,0,0,0,0|2,0,1]=3 1301 B12R0.5 CCCCCSCCCCCC#N 62a_100009813376_100000210326 [0,0,0,0,0,0|2,0,1]=3 1302 B12R0.5 CCCCCSCCCCCC=O 62a_100000139337_100000210326 [0,0,0,0,0,0|1,0,2]=3 1303 B12R0.5 CCCCCSCCCCCC=O 62a_100000210326_100000139337 [0,0,0,0,0,0|1,0,2]=3 1304 B12R0.5 CCCCCSCCCCCCF 62a_100000210326_100015922095 [0,0,0,0,0,0|2,0,0]=2 1305 B12R0.5 CCCCCSCCCCCCF 62a_100015922095_100000210326 [0,0,0,0,0,0|2,0,0]=2 1306 B12R0.5 CCCCCSCCCCCCO 62a_100000210326_100000766143 [0,0,0,0,0,0|1,0,0]=1 1307 B12R0.5 CCCCCSCCCCCCO 62a_100000766143_100000210326 [0,0,0,0,0,0|1,0,0]=1 1308 B12R0.5 CCCCCSCCOCCCC 62a_100000210326_100000743108 [0,0,0,0,0,0|3,0,0]=3 1309 B12R0.5 CCCCCSCCOCCCC 62a_100000743108_100000210326 [0,0,0,0,0,0|3,0,0]=3 1310 B12R0.5 CCCCCSCCOCCOC 62a_100000210326_100000695917 [0,0,0,0,0,0|4,0,0]=4 1311 B12R0.5 CCCCCSCCOCCOC 62a_100000695917_100000210326 [0,0,0,0,0,0|4,0,0]=4 1312 B12R0.5 CCCCNCCCCCCC#N 2230a_100000102301_100009813337 [0,0,0,0,0,0|2,0,1]=3 1313 B12R0.5 CCCCNCCCCCCC#N 7a_106832991798_100009813337 [0,0,0,0,0,0|2,0,1]=3 1314 B12R0.5 CCCCNCCCCCCCO 2230a_100000102301_100000760002 [0,0,0,0,0,0|1,0,0]=1 1315 B12R0.5 CCCCNCCCCCCCO 2230a_100011996573_100000210211 [0,0,0,0,0,0|1,0,0]=1 1316 B12R0.5 CCCCNCCCCCCCO 34a_100011996573_100000210210 [0,0,0,0,0,0|1,0,0]=1 1317 B12R0.5 CCCCNCCCCCCCO 7a_106832991798_100000760002 [0,0,0,0,0,0|1,0,0]=1 1318 B12R0.5 CCCCNCCCCCCOC 2230a_100000102301_100011998445 [0,0,0,0,0,0|3,0,0]=3 1319 B12R0.5 CCCCNCCCCCCOC 7a_106832991798_100011998445 [0,0,0,0,0,0|3,0,0]=3 1320 B12R0.5 CCCCNCCCCOCC=O 34a_200011216965_200009817547 [0,0,0,0,0,0|2,0,2]=4 1321 B12R0.5 CCCCNCCCCOCCC 34a_200011216965_100000210303 [0,0,0,0,0,0|3,0,0]=3 1322 B12R0.5 CCCCNCCCCOCCF 34a_200011216965_100011217306 [0,0,0,0,0,0|3,0,0]=3 1323 B12R0.5 CCCCNCCCCOCCO 34a_200011216965_100000211926 [0,0,0,0,0,0|2,0,0]=2 1324 B12R0.5 CCCCNCCCCOCSC 34a_200011216965_100011218213 [0,0,0,0,0,0|4,0,0]=4 1325 B12R0.5 CCCCNCCCOCCCC 2230a_200000211371_100000210211 [0,0,0,0,0,0|3,0,0]=3 1326 B12R0.5 CCCCNCCCOCCCC 34a_200000211371_100000210210 [0,0,0,0,0,0|3,0,0]=3 1327 B12R0.5 CCCCNCCCOCCCO 2230a_100011310245_100000210211 [0,0,0,0,0,0|2,0,0]=2 1328 B12R0.5 CCCCNCCCOCCCO 34a_100011310245_100000210210 [0,0,0,0,0,0|2,0,0]=2 1329 B12R0.5 CCCCNCCCOCCOC 2230a_100000102301_100011216529 [0,0,0,0,0,0|4,0,0]=4 1330 B12R0.5 CCCCNCCCOCCOC 2230a_100000206027_100000210211 [0,0,0,0,0,0|4,0,0]=4 1331 B12R0.5 CCCCNCCCOCCOC 34a_100000206027_100000210210 [0,0,0,0,0,0|4,0,0]=4 1332 B12R0.5 CCCCNCCCOCCOC 7a_106832991798_100011216529 [0,0,0,0,0,0|4,0,0]=4 1333 B12R0.5 CCCCNCCOCCOCC 2230a_100000102301_100011211534 [0,0,0,0,0,0|4,0,0]=4 1334 B12R0.5 CCCCNCCOCCOCC 2230a_100102712874_100000210211 [0,0,0,0,0,0|4,0,0]=4 1335 B12R0.5 CCCCNCCOCCOCC 34a_100102712874_100000210210 [0,0,0,0,0,0|4,0,0]=4 1336 B12R0.5 CCCCNCCOCCOCC 7a_106832991798_100011211534 [0,0,0,0,0,0|4,0,0]=4 1337 B12R0.5 CCCCOCCCCCCC#N 7a_100000210227_100009813337 [0,0,0,0,0,0|2,0,1]=3 1338 B12R0.5 CCCCOCCCCCCCBr 34a_100000760002_100000210210 [0,0,0,0,0,0|2,0,0]=2 1339 B12R0.5 CCCCOCCCCCCCBr 7a_100000760002_100000210211 [0,0,0,0,0,0|2,0,0]=2 1340 B12R0.5 CCCCOCCCCCCCN 34a_100011996573_100000210210 [0,0,0,0,0,0|2,0,0]=2 1341 B12R0.5 CCCCOCCCCCCCO 34a_100000210227_100000760002 [0,0,0,0,0,0|1,0,0]=1 1342 B12R0.5 CCCCOCCCCCCCO 7a_100000210227_100000760002 [0,0,0,0,0,0|1,0,0]=1 1343 B12R0.5 CCCCOCCCCCCOC 34a_100000210227_100011998445 [0,0,0,0,0,0|3,0,0]=3 1344 B12R0.5 CCCCOCCCCCCOC 34a_200012092642_100000210210 [0,0,0,0,0,0|3,0,0]=3 1345 B12R0.5 CCCCOCCCCCCOC 7a_100000210227_100011998445 [0,0,0,0,0,0|3,0,0]=3 1346 B12R0.5 CCCCOCCCCCCOC 7a_200012092642_100000210211 [0,0,0,0,0,0|3,0,0]=3 1347 B12R0.5 CCCCOCCCCOCC#N 7a_200000760531_100011215382 [0,0,0,0,0,0|3,0,1]=4 1348 B12R0.5 CCCCOCCCCOCC=O 34a_200000760531_200009817547 [0,0,0,0,0,0|2,0,2]=4 1349 B12R0.5 CCCCOCCCCOCC=O 7a_200000760531_200015260668 [0,0,0,0,0,0|2,0,2]=4 1350 B12R0.5 CCCCOCCCCOCCC 34a_200000760531_100000210303 [0,0,0,0,0,0|3,0,0]=3 1351 B12R0.5 CCCCOCCCCOCCC 7a_200000760531_100000210303 [0,0,0,0,0,0|3,0,0]=3 1352 B12R0.5 CCCCOCCCCOCCF 34a_200000760531_100011217306 [0,0,0,0,0,0|3,0,0]=3 1353 B12R0.5 CCCCOCCCCOCCF 7a_200000760531_100011217306 [0,0,0,0,0,0|3,0,0]=3 1354 B12R0.5 CCCCOCCCCOCCO 34a_200000760531_100000211926 [0,0,0,0,0,0|2,0,0]=2 1355 B12R0.5 CCCCOCCCCOCCO 7a_200000760531_100000211926 [0,0,0,0,0,0|2,0,0]=2 1356 B12R0.5 CCCCOCCCCOCSC 34a_200000760531_100011218213 [0,0,0,0,0,0|4,0,0]=4 1357 B12R0.5 CCCCOCCCNCCC#N 2230a_200000211371_100011215226 [0,0,0,0,0,0|3,0,1]=4 1358 B12R0.5 CCCCOCCCNCCCF 2230a_200000211371_100011934791 [0,0,0,0,0,0|3,0,0]=3 1359 B12R0.5 CCCCOCCCNCCCF 34a_200000211371_100011934791 [0,0,0,0,0,0|3,0,0]=3 1360 B12R0.5 CCCCOCCCNCCCO 2230a_200000211371_100000230001 [0,0,0,0,0,0|2,0,0]=2 1361 B12R0.5 CCCCOCCCNCCCO 34a_200000211371_100000230001 [0,0,0,0,0,0|2,0,0]=2 1362 B12R0.5 CCCCOCCCNCCOC 2230a_200000211371_100011201679 [0,0,0,0,0,0|4,0,0]=4 1363 B12R0.5 CCCCOCCCNCCOC 34a_200000211371_100011201679 [0,0,0,0,0,0|4,0,0]=4 1364 B12R0.5 CCCCOCCCNCCSC 2230a_200000211371_100000751147 [0,0,0,0,0,0|4,0,0]=4 1365 B12R0.5 CCCCOCCCNCCSC 34a_200000211371_100000212216 [0,0,0,0,0,0|4,0,0]=4 1366 B12R0.5 CCCCOCCCOCCC#N 7a_200011215613_100000184422 [0,0,0,0,0,0|3,0,1]=4 1367 B12R0.5 CCCCOCCCOCCCC 34a_200011215613_100000210210 [0,0,0,0,0,0|3,0,0]=3 1368 B12R0.5 CCCCOCCCOCCCC 7a_200011215613_100000210211 [0,0,0,0,0,0|3,0,0]=3 1369 B12R0.5 CCCCOCCCOCCCF 34a_200011215613_100011934791 [0,0,0,0,0,0|3,0,0]=3 1370 B12R0.5 CCCCOCCCOCCCF 7a_200011215613_100011934791 [0,0,0,0,0,0|3,0,0]=3 1371 B12R0.5 CCCCOCCCOCCCN 34a_100011310245_100000210210 [0,0,0,0,0,0|3,0,0]=3 1372 B12R0.5 CCCCOCCCOCCCO 34a_200011215613_100000230001 [0,0,0,0,0,0|2,0,0]=2 1373 B12R0.5 CCCCOCCCOCCCO 7a_200011215613_100011215043 [0,0,0,0,0,0|2,0,0]=2 1374 B12R0.5 CCCCOCCCOCCOC 34a_100000210227_100011216529 [0,0,0,0,0,0|4,0,0]=4 1375 B12R0.5 CCCCOCCCOCCOC 34a_200011215613_100011201679 [0,0,0,0,0,0|4,0,0]=4 1376 B12R0.5 CCCCOCCCOCCOC 7a_100000210227_100011216529 [0,0,0,0,0,0|4,0,0]=4 1377 B12R0.5 CCCCOCCCOCCOC 7a_200011215613_100000233755 [0,0,0,0,0,0|4,0,0]=4 1378 B12R0.5 CCCCOCCCOCCSC 34a_200011215613_100000212216 [0,0,0,0,0,0|4,0,0]=4 1379 B12R0.5 CCCCOCCCOCCSC 7a_200011215613_100000212216 [0,0,0,0,0,0|4,0,0]=4 1380 B12R0.5 CCCCOCCNCCCCO 2230a_100000750430_100000743108 [0,0,0,0,0,0|2,0,0]=2 1381 B12R0.5 CCCCOCCNCCCCO 34a_100000750430_100000743108 [0,0,0,0,0,0|2,0,0]=2 1382 B12R0.5 CCCCOCCNCCCOC 34a_100150723488_100000743108 [0,0,0,0,0,0|4,0,0]=4 1383 B12R0.5 CCCCOCCNCCCSC 2230a_100000749238_100000743108 [0,0,0,0,0,0|4,0,0]=4 1384 B12R0.5 CCCCOCCNCCOCC 2230a_102516460346_100000743108 [0,0,0,0,0,0|4,0,0]=4 1385 B12R0.5 CCCCOCCNCCOCC 34a_102516460346_100000743108 [0,0,0,0,0,0|4,0,0]=4 1386 B12R0.5 CCCCOCCNCCSCC 2230a_100000106463_100000743108 [0,0,0,0,0,0|4,0,0]=4 1387 B12R0.5 CCCCOCCOCC#CCO 34a_100000210238_200000047223 [0,0,0,0,0,0|2,0,2]=4 1388 B12R0.5 CCCCOCCOCC#CCO 7a_100000210238_200000047223 [0,0,0,0,0,0|2,0,2]=4 1389 B12R0.5 CCCCOCCOCCCC#N 7a_100000210238_100000687738 [0,0,0,0,0,0|3,0,1]=4 1390 B12R0.5 CCCCOCCOCCCC=O 7a_100000210238_200011292268 [0,0,0,0,0,0|2,0,2]=4 1391 B12R0.5 CCCCOCCOCCCCBr 34a_100011216708_100000743108 [0,0,0,0,0,0|3,0,0]=3 1392 B12R0.5 CCCCOCCOCCCCCl 34a_100000210776_100000743108 [0,0,0,0,0,0|3,0,0]=3 1393 B12R0.5 CCCCOCCOCCCCCl 7a_100000210776_100000743108 [0,0,0,0,0,0|3,0,0]=3 1394 B12R0.5 CCCCOCCOCCCCF 34a_100000210238_100000729493 [0,0,0,0,0,0|3,0,0]=3 1395 B12R0.5 CCCCOCCOCCCCF 34a_100011995726_100000743108 [0,0,0,0,0,0|3,0,0]=3 1396 B12R0.5 CCCCOCCOCCCCF 7a_100000210238_100000729493 [0,0,0,0,0,0|3,0,0]=3 1397 B12R0.5 CCCCOCCOCCCCF 7a_100011995726_100000743108 [0,0,0,0,0,0|3,0,0]=3 1398 B12R0.5 CCCCOCCOCCCCI 34a_200012148704_100000743108 [0,0,0,0,0,0|3,0,0]=3 1399 B12R0.5 CCCCOCCOCCCCN 34a_100000750430_100000743108 [0,0,0,0,0,0|3,0,0]=3 1400 B12R0.5 CCCCOCCOCCCCO 34a_100000210238_100011216708 [0,0,0,0,0,0|2,0,0]=2 1401 B12R0.5 CCCCOCCOCCCCO 7a_100000210238_100000210776 [0,0,0,0,0,0|2,0,0]=2 1402 B12R0.5 CCCCOCCOCCCNC 34a_100000213112_100000743108 [0,0,0,0,0,0|4,0,0]=4 1403 B12R0.5 CCCCOCCOCCCOC 34a_100000210238_100000740836 [0,0,0,0,0,0|4,0,0]=4 1404 B12R0.5 CCCCOCCOCCCOC 34a_100000740835_100000743108 [0,0,0,0,0,0|4,0,0]=4 1405 B12R0.5 CCCCOCCOCCCOC 7a_100000210238_100000740836 [0,0,0,0,0,0|4,0,0]=4 1406 B12R0.5 CCCCOCCOCCCSC 34a_100000690336_100000743108 [0,0,0,0,0,0|4,0,0]=4 1407 B12R0.5 CCCCOCCOCCCSC 7a_100000690336_100000743108 [0,0,0,0,0,0|4,0,0]=4 1408 B12R0.5 CCCCOCCOCCOCC 34a_100000210136_100000743108 [0,0,0,0,0,0|4,0,0]=4 1409 B12R0.5 CCCCOCCOCCOCC 34a_100000210227_100011211534 [0,0,0,0,0,0|4,0,0]=4 1410 B12R0.5 CCCCOCCOCCOCC 34a_100000210238_100000210147 [0,0,0,0,0,0|4,0,0]=4 1411 B12R0.5 CCCCOCCOCCOCC 34a_100000210240_100000210210 [0,0,0,0,0,0|4,0,0]=4 1412 B12R0.5 CCCCOCCOCCOCC 34a_100011215186_100000210202 [0,0,0,0,0,0|4,0,0]=4 1413 B12R0.5 CCCCOCCOCCOCC 7a_100000210136_100000743108 [0,0,0,0,0,0|4,0,0]=4 1414 B12R0.5 CCCCOCCOCCOCC 7a_100000210227_100011211534 [0,0,0,0,0,0|4,0,0]=4 1415 B12R0.5 CCCCOCCOCCOCC 7a_100000210238_100011215890 [0,0,0,0,0,0|4,0,0]=4 1416 B12R0.5 CCCCOCCOCCOCC 7a_100000210240_100000210211 [0,0,0,0,0,0|4,0,0]=4 1417 B12R0.5 CCCCOCCOCCOCC 7a_100011215186_100000210202 [0,0,0,0,0,0|4,0,0]=4 1418 B12R0.5 CCCCOCCOCCOCF 34a_100011215186_100015361967 [0,0,0,0,0,0|4,0,0]=4 1419 B12R0.5 CCCCOCCOCCOCF 7a_100011215186_100015361967 [0,0,0,0,0,0|4,0,0]=4 1420 B12R0.5 CCCCOCCOCCSCC 34a_100000210238_100000757381 [0,0,0,0,0,0|4,0,0]=4 1421 B12R0.5 CCCCOCCOCCSCC 34a_100000212035_100000743108 [0,0,0,0,0,0|4,0,0]=4 1422 B12R0.5 CCCCOCCOCCSCC 7a_100000210238_100000757381 [0,0,0,0,0,0|4,0,0]=4 1423 B12R0.5 CCCCOCCOCCSCC 7a_100000212035_100000743108 [0,0,0,0,0,0|4,0,0]=4 1424 B12R0.5 CCCCOCCSCC#CCO 62a_100000743108_200000047223 [0,0,0,0,0,0|2,0,2]=4 1425 B12R0.5 CCCCOCCSCC#CCO 62a_200000047223_100000743108 [0,0,0,0,0,0|2,0,2]=4 1426 B12R0.5 CCCCOCCSCCCC#N 62a_100000687738_100000743108 [0,0,0,0,0,0|3,0,1]=4 1427 B12R0.5 CCCCOCCSCCCC#N 62a_100000743108_100000687738 [0,0,0,0,0,0|3,0,1]=4 1428 B12R0.5 CCCCOCCSCCCC=O 62a_100000743108_200011292268 [0,0,0,0,0,0|2,0,2]=4 1429 B12R0.5 CCCCOCCSCCCC=O 62a_200011292268_100000743108 [0,0,0,0,0,0|2,0,2]=4 1430 B12R0.5 CCCCOCCSCCCCF 62a_100000729493_100000743108 [0,0,0,0,0,0|3,0,0]=3 1431 B12R0.5 CCCCOCCSCCCCF 62a_100000743108_100000729493 [0,0,0,0,0,0|3,0,0]=3 1432 B12R0.5 CCCCOCCSCCCCO 62a_100000210776_100000743108 [0,0,0,0,0,0|2,0,0]=2 1433 B12R0.5 CCCCOCCSCCCCO 62a_100000743108_100000210776 [0,0,0,0,0,0|2,0,0]=2 1434 B12R0.5 CCCCOCCSCCCOC 62a_100000709357_100000743108 [0,0,0,0,0,0|4,0,0]=4 1435 B12R0.5 CCCCOCCSCCCOC 62a_100000743108_100000709357 [0,0,0,0,0,0|4,0,0]=4 1436 B12R0.5 CCCCOCCSCCOCC 62a_100000210147_100000743108 [0,0,0,0,0,0|4,0,0]=4 1437 B12R0.5 CCCCOCCSCCOCC 62a_100000743108_100011215890 [0,0,0,0,0,0|4,0,0]=4 1438 B12R0.5 CCCCOCCSCCSCC 62a_100000743108_100000757381 [0,0,0,0,0,0|4,0,0]=4 1439 B12R0.5 CCCCOCCSCCSCC 62a_100000757381_100000743108 [0,0,0,0,0,0|4,0,0]=4 1440 B12R0.5 CCCCOCNCCCCCO 2230a_100000762737_100011995733 [0,0,0,0,0,0|2,0,0]=2 1441 B12R0.5 CCCCOCNCCCCCO 34a_100000762737_100011995733 [0,0,0,0,0,0|2,0,0]=2 1442 B12R0.5 CCCCOCNCCCOCC 2230a_100000210961_100011995733 [0,0,0,0,0,0|4,0,0]=4 1443 B12R0.5 CCCCOCNCCCOCC 34a_100000210961_100011995733 [0,0,0,0,0,0|4,0,0]=4 1444 B12R0.5 CCCCOCNCCOCCC 2230a_100161115042_100011995733 [0,0,0,0,0,0|4,0,0]=4 1445 B12R0.5 CCCCOCNCCOCCC 34a_100161115042_100011995733 [0,0,0,0,0,0|4,0,0]=4 1446 B12R0.5 CCCCOCNCCOCCO 2230a_100000211614_100011995733 [0,0,0,0,0,0|3,0,0]=3 1447 B12R0.5 CCCCOCNCCOCCO 34a_100000211614_100011995733 [0,0,0,0,0,0|3,0,0]=3 1448 B12R0.5 CCCCOCNCCSCCC 2230a_100020603323_100011995733 [0,0,0,0,0,0|4,0,0]=4 1449 B12R0.5 CCCCOCNCCSCCO 2230a_100011219999_100011995733 [0,0,0,0,0,0|3,0,0]=3 1450 B12R0.5 CCCCOCOCCCCCBr 34a_100000746331_100011995733 [0,0,0,0,0,0|3,0,0]=3 1451 B12R0.5 CCCCOCOCCCCCCl 34a_100000746330_100011995733 [0,0,0,0,0,0|3,0,0]=3 1452 B12R0.5 CCCCOCOCCCCCI 34a_200012148887_100011995733 [0,0,0,0,0,0|3,0,0]=3 1453 B12R0.5 CCCCOCOCCCCCN 34a_100000762737_100011995733 [0,0,0,0,0,0|3,0,0]=3 1454 B12R0.5 CCCCOCOCCCCOC 34a_100000740925_100011995733 [0,0,0,0,0,0|4,0,0]=4 1455 B12R0.5 CCCCOCOCCCCSC 34a_100011217163_100011995733 [0,0,0,0,0,0|4,0,0]=4 1456 B12R0.5 CCCCOCOCCCOCC 34a_100000757476_100011995733 [0,0,0,0,0,0|4,0,0]=4 1457 B12R0.5 CCCCOCOCCCSCC 34a_100011216438_100011995733 [0,0,0,0,0,0|4,0,0]=4 1458 B12R0.5 CCCCOCOCCOCCBr 34a_100000692535_100011995733 [0,0,0,0,0,0|4,0,0]=4 1459 B12R0.5 CCCCOCOCCOCCC 34a_100000752267_100011995733 [0,0,0,0,0,0|4,0,0]=4 1460 B12R0.5 CCCCOCOCCOCCCl 34a_100011215305_100011995733 [0,0,0,0,0,0|4,0,0]=4 1461 B12R0.5 CCCCOCOCCOCCF 34a_200015357709_100011995733 [0,0,0,0,0,0|4,0,0]=4 1462 B12R0.5 CCCCOCOCCOCCI 34a_100012149058_100011995733 [0,0,0,0,0,0|4,0,0]=4 1463 B12R0.5 CCCCOCOCCOCCN 34a_100000211614_100011995733 [0,0,0,0,0,0|4,0,0]=4 1464 B12R0.5 CCCCOCOCCSCCC 34a_200000230433_100011995733 [0,0,0,0,0,0|4,0,0]=4 1465 B12R0.5 CCCCOCSCCCCC#N 62a_100011219923_100011995733 [0,0,0,0,0,0|3,0,1]=4 1466 B12R0.5 CCCCOCSCCCCC#N 62a_100011995733_100000211819 [0,0,0,0,0,0|3,0,1]=4 1467 B12R0.5 CCCCOCSCCCCC=O 62a_100000139335_100011995733 [0,0,0,0,0,0|2,0,2]=4 1468 B12R0.5 CCCCOCSCCCCC=O 62a_100011995733_100000139335 [0,0,0,0,0,0|2,0,2]=4 1469 B12R0.5 CCCCOCSCCCCCF 62a_100000729378_100011995733 [0,0,0,0,0,0|3,0,0]=3 1470 B12R0.5 CCCCOCSCCCCCF 62a_100011995733_100000729378 [0,0,0,0,0,0|3,0,0]=3 1471 B12R0.5 CCCCOCSCCCCCO 62a_100000746330_100011995733 [0,0,0,0,0,0|2,0,0]=2 1472 B12R0.5 CCCCOCSCCCCCO 62a_100011995733_100000746330 [0,0,0,0,0,0|2,0,0]=2 1473 B12R0.5 CCCCOCSCCCCOC 62a_100000730899_100011995733 [0,0,0,0,0,0|4,0,0]=4 1474 B12R0.5 CCCCOCSCCCCOC 62a_100011995733_100000730899 [0,0,0,0,0,0|4,0,0]=4 1475 B12R0.5 CCCCOCSCCCOCC 62a_100011995733_100012232248 [0,0,0,0,0,0|4,0,0]=4 1476 B12R0.5 CCCCOCSCCCOCC 62a_100012232248_100011995733 [0,0,0,0,0,0|4,0,0]=4 1477 B12R0.5 CCCCOCSCCOCCC 62a_100011215938_100011995733 [0,0,0,0,0,0|4,0,0]=4 1478 B12R0.5 CCCCOCSCCOCCC 62a_100011995733_100011215938 [0,0,0,0,0,0|4,0,0]=4 1479 B12R0.5 CCCCOCSCCOCCO 62a_100011215305_100011995733 [0,0,0,0,0,0|3,0,0]=3 1480 B12R0.5 CCCCOCSCCOCCO 62a_100011995733_100011215305 [0,0,0,0,0,0|3,0,0]=3 1481 B12R0.5 CCCCOCSCOCCCC 62a_100011995733_100011995733 [0,0,0,0,0,0|4,0,0]=4 1482 B12R0.5 CCCCSCCCCCCC#N 62a_100000210211_100009813337 [0,0,0,0,0,0|2,0,1]=3 1483 B12R0.5 CCCCSCCCCCCC#N 62a_100009813337_100000210210 [0,0,0,0,0,0|2,0,1]=3 1484 B12R0.5 CCCCSCCCCCCCO 62a_100000210211_100000760002 [0,0,0,0,0,0|1,0,0]=1 1485 B12R0.5 CCCCSCCCCCCCO 62a_100000760002_100000210210 [0,0,0,0,0,0|1,0,0]=1 1486 B12R0.5 CCCCSCCCCCCOC 62a_100000210211_100011998445 [0,0,0,0,0,0|3,0,0]=3 1487 B12R0.5 CCCCSCCCCCCOC 62a_100011998445_100000210210 [0,0,0,0,0,0|3,0,0]=3 1488 B12R0.5 CCCCSCCCOCCOC 62a_100000210211_100011216529 [0,0,0,0,0,0|4,0,0]=4 1489 B12R0.5 CCCCSCCCOCCOC 62a_100011216529_100000210210 [0,0,0,0,0,0|4,0,0]=4 1490 B12R0.5 CCCCSCCNCC#CCO 2230a_100025743550_200000047223 [0,0,0,0,0,0|2,0,2]=4 1491 B12R0.5 CCCCSCCNCCCC#N 2230a_100025743550_100000687738 [0,0,0,0,0,0|3,0,1]=4 1492 B12R0.5 CCCCSCCNCCCC=O 2230a_100025743550_200011292268 [0,0,0,0,0,0|2,0,2]=4 1493 B12R0.5 CCCCSCCNCCCCF 2230a_100025743550_100000729493 [0,0,0,0,0,0|3,0,0]=3 1494 B12R0.5 CCCCSCCNCCCCO 2230a_100025743550_100000210776 [0,0,0,0,0,0|2,0,0]=2 1495 B12R0.5 CCCCSCCNCCCOC 2230a_100025743550_100000740836 [0,0,0,0,0,0|4,0,0]=4 1496 B12R0.5 CCCCSCCNCCOCC 2230a_100025743550_100011215890 [0,0,0,0,0,0|4,0,0]=4 1497 B12R0.5 CCCCSCCNCCSCC 2230a_100025743550_100000757381 [0,0,0,0,0,0|4,0,0]=4 1498 B12R0.5 CCCCSCCOCC#CCO 34a_200000230436_200000047223 [0,0,0,0,0,0|2,0,2]=4 1499 B12R0.5 CCCCSCCOCC#CCO 7a_200000230436_200000047223 [0,0,0,0,0,0|2,0,2]=4 1500 B12R0.5 CCCCSCCOCCCC#N 7a_200000230436_100000687738 [0,0,0,0,0,0|3,0,1]=4 1501 B12R0.5 CCCCSCCOCCCC=O 7a_200000230436_200011292268 [0,0,0,0,0,0|2,0,2]=4 1502 B12R0.5 CCCCSCCOCCCCF 34a_200000230436_100000729493 [0,0,0,0,0,0|3,0,0]=3 1503 B12R0.5 CCCCSCCOCCCCF 7a_200000230436_100000729493 [0,0,0,0,0,0|3,0,0]=3 1504 B12R0.5 CCCCSCCOCCCCO 34a_200000230436_100011216708 [0,0,0,0,0,0|2,0,0]=2 1505 B12R0.5 CCCCSCCOCCCCO 7a_200000230436_100000210776 [0,0,0,0,0,0|2,0,0]=2 1506 B12R0.5 CCCCSCCOCCCOC 34a_200000230436_100000740836 [0,0,0,0,0,0|4,0,0]=4 1507 B12R0.5 CCCCSCCOCCCOC 7a_200000230436_100000740836 [0,0,0,0,0,0|4,0,0]=4 1508 B12R0.5 CCCCSCCOCCOCC 34a_200000230436_100000210147 [0,0,0,0,0,0|4,0,0]=4 1509 B12R0.5 CCCCSCCOCCOCC 62a_100000210211_100011211534 [0,0,0,0,0,0|4,0,0]=4 1510 B12R0.5 CCCCSCCOCCOCC 62a_100011211534_100000210210 [0,0,0,0,0,0|4,0,0]=4 1511 B12R0.5 CCCCSCCOCCOCC 7a_200000230436_100011215890 [0,0,0,0,0,0|4,0,0]=4 1512 B12R0.5 CCCCSCCOCCSCC 34a_200000230436_100000757381 [0,0,0,0,0,0|4,0,0]=4 1513 B12R0.5 CCCCSCCOCCSCC 7a_200000230436_100000757381 [0,0,0,0,0,0|4,0,0]=4 1514 B12R0.5 CCCNCCCCCCCCO 2230a_102515433106_100000210303 [0,0,0,0,0,0|1,0,0]=1 1515 B12R0.5 CCCNCCCCCCCCO 34a_102515433106_100000210303 [0,0,0,0,0,0|1,0,0]=1 1516 B12R0.5 CCCNCCCCCCN=[N+]=[N-] 2230a_200000049180_100000210303 [0,0,0,0,0,0|4,0,0]=4 1517 B12R0.5 CCCNCCOCCOCCC 2230a_200011904461_100000210303 [0,0,0,0,0,0|4,0,0]=4 1518 B12R0.5 CCCNCCOCCOCCC 34a_200011904461_100000210303 [0,0,0,0,0,0|4,0,0]=4 1519 B12R0.5 CCCNCCOCCOCCO 2230a_100011998139_100000210303 [0,0,0,0,0,0|3,0,0]=3 1520 B12R0.5 CCCNCCOCCOCCO 34a_100011998139_100000210303 [0,0,0,0,0,0|3,0,0]=3 1521 B12R0.5 CCCOCCCCCCCCBr 34a_100009813846_100000210303 [0,0,0,0,0,0|2,0,0]=2 1522 B12R0.5 CCCOCCCCCCCCBr 7a_100009813846_100000210303 [0,0,0,0,0,0|2,0,0]=2 1523 B12R0.5 CCCOCCCCCCCCCl 34a_100000033203_100000210303 [0,0,0,0,0,0|2,0,0]=2 1524 B12R0.5 CCCOCCCCCCCCCl 7a_100000033203_100000210303 [0,0,0,0,0,0|2,0,0]=2 1525 B12R0.5 CCCOCCCCCCCCN 34a_102515433106_100000210303 [0,0,0,0,0,0|2,0,0]=2 1526 B12R0.5 CCCOCCCCCCCCO 34a_100000210258_100000033203 [0,0,0,0,0,0|1,0,0]=1 1527 B12R0.5 CCCOCCCCCNCCN 34a_103619048469_100000210303 [0,0,0,0,0,0|3,0,0]=3 1528 B12R0.5 CCCOCCCNCC#CCO 2230a_100011217757_200000047223 [0,0,0,0,0,0|2,0,2]=4 1529 B12R0.5 CCCOCCCNCC#CCO 34a_100011217757_200000047223 [0,0,0,0,0,0|2,0,2]=4 1530 B12R0.5 CCCOCCCNCCCC#N 2230a_100011217757_100000687738 [0,0,0,0,0,0|3,0,1]=4 1531 B12R0.5 CCCOCCCNCCCC=O 2230a_100011217757_200011292268 [0,0,0,0,0,0|2,0,2]=4 1532 B12R0.5 CCCOCCCNCCCCF 2230a_100011217757_100000729493 [0,0,0,0,0,0|3,0,0]=3 1533 B12R0.5 CCCOCCCNCCCCF 34a_100011217757_100000729493 [0,0,0,0,0,0|3,0,0]=3 1534 B12R0.5 CCCOCCCNCCCCO 2230a_100011217757_100000210776 [0,0,0,0,0,0|2,0,0]=2 1535 B12R0.5 CCCOCCCNCCCCO 34a_100011217757_100011216708 [0,0,0,0,0,0|2,0,0]=2 1536 B12R0.5 CCCOCCCNCCCOC 2230a_100011217757_100000740836 [0,0,0,0,0,0|4,0,0]=4 1537 B12R0.5 CCCOCCCNCCCOC 34a_100011217757_100000740836 [0,0,0,0,0,0|4,0,0]=4 1538 B12R0.5 CCCOCCCNCCOCC 2230a_100011217757_100011215890 [0,0,0,0,0,0|4,0,0]=4 1539 B12R0.5 CCCOCCCNCCOCC 34a_100011217757_100000210147 [0,0,0,0,0,0|4,0,0]=4 1540 B12R0.5 CCCOCCCNCCSCC 2230a_100011217757_100000757381 [0,0,0,0,0,0|4,0,0]=4 1541 B12R0.5 CCCOCCCNCCSCC 34a_100011217757_100000757381 [0,0,0,0,0,0|4,0,0]=4 1542 B12R0.5 CCCOCCCOCCCOC 34a_200011215475_100000210303 [0,0,0,0,0,0|4,0,0]=4 1543 B12R0.5 CCCOCCCOCCCOC 7a_200011215475_100000210303 [0,0,0,0,0,0|4,0,0]=4 1544 B12R0.5 CCCOCCNCCCCC#N 2230a_100161115042_100000211819 [0,0,0,0,0,0|3,0,1]=4 1545 B12R0.5 CCCOCCNCCCCC=O 2230a_100161115042_100000139335 [0,0,0,0,0,0|2,0,2]=4 1546 B12R0.5 CCCOCCNCCCCCF 2230a_100161115042_100000729378 [0,0,0,0,0,0|3,0,0]=3 1547 B12R0.5 CCCOCCNCCCCCF 34a_100161115042_100000729378 [0,0,0,0,0,0|3,0,0]=3 1548 B12R0.5 CCCOCCNCCCCCO 2230a_100000762737_100011215938 [0,0,0,0,0,0|2,0,0]=2 1549 B12R0.5 CCCOCCNCCCCCO 2230a_100161115042_100000746330 [0,0,0,0,0,0|2,0,0]=2 1550 B12R0.5 CCCOCCNCCCCCO 34a_100000762737_100011215938 [0,0,0,0,0,0|2,0,0]=2 1551 B12R0.5 CCCOCCNCCCCCO 34a_100161115042_100000746330 [0,0,0,0,0,0|2,0,0]=2 1552 B12R0.5 CCCOCCNCCCCOC 2230a_100161115042_100000730899 [0,0,0,0,0,0|4,0,0]=4 1553 B12R0.5 CCCOCCNCCCCOC 34a_100161115042_100000755781 [0,0,0,0,0,0|4,0,0]=4 1554 B12R0.5 CCCOCCNCCCOCC 2230a_100000210961_100011215938 [0,0,0,0,0,0|4,0,0]=4 1555 B12R0.5 CCCOCCNCCCOCC 2230a_100161115042_100012232248 [0,0,0,0,0,0|4,0,0]=4 1556 B12R0.5 CCCOCCNCCCOCC 34a_100000210961_100011215938 [0,0,0,0,0,0|4,0,0]=4 1557 B12R0.5 CCCOCCNCCCOCC 34a_100161115042_100012232248 [0,0,0,0,0,0|4,0,0]=4 1558 B12R0.5 CCCOCCNCCOCCC 2230a_100161115042_100011215938 [0,0,0,0,0,0|4,0,0]=4 1559 B12R0.5 CCCOCCNCCOCCC 34a_100161115042_100011215938 [0,0,0,0,0,0|4,0,0]=4 1560 B12R0.5 CCCOCCNCCOCCO 2230a_100000211614_100011215938 [0,0,0,0,0,0|3,0,0]=3 1561 B12R0.5 CCCOCCNCCOCCO 2230a_100161115042_100011215305 [0,0,0,0,0,0|3,0,0]=3 1562 B12R0.5 CCCOCCNCCOCCO 34a_100000211614_100011215938 [0,0,0,0,0,0|3,0,0]=3 1563 B12R0.5 CCCOCCNCCOCCO 34a_100161115042_100000692535 [0,0,0,0,0,0|3,0,0]=3 1564 B12R0.5 CCCOCCNCCSCCC 2230a_100020603323_100011215938 [0,0,0,0,0,0|4,0,0]=4 1565 B12R0.5 CCCOCCNCCSCCO 2230a_100011219999_100011215938 [0,0,0,0,0,0|3,0,0]=3 1566 B12R0.5 CCCOCCOCCCCC#N 7a_100000752267_100000211819 [0,0,0,0,0,0|3,0,1]=4 1567 B12R0.5 CCCOCCOCCCCC=O 7a_100000752267_100000139335 [0,0,0,0,0,0|2,0,2]=4 1568 B12R0.5 CCCOCCOCCCCCBr 34a_100000746331_100011215938 [0,0,0,0,0,0|3,0,0]=3 1569 B12R0.5 CCCOCCOCCCCCBr 7a_100000746331_100011215938 [0,0,0,0,0,0|3,0,0]=3 1570 B12R0.5 CCCOCCOCCCCCCl 34a_100000746330_100011215938 [0,0,0,0,0,0|3,0,0]=3 1571 B12R0.5 CCCOCCOCCCCCCl 7a_100000746330_100011215938 [0,0,0,0,0,0|3,0,0]=3 1572 B12R0.5 CCCOCCOCCCCCF 34a_100000752267_100000729378 [0,0,0,0,0,0|3,0,0]=3 1573 B12R0.5 CCCOCCOCCCCCF 7a_100000752267_100000729378 [0,0,0,0,0,0|3,0,0]=3 1574 B12R0.5 CCCOCCOCCCCCI 34a_200012148887_100011215938 [0,0,0,0,0,0|3,0,0]=3 1575 B12R0.5 CCCOCCOCCCCCI 7a_200012148887_100011215938 [0,0,0,0,0,0|3,0,0]=3 1576 B12R0.5 CCCOCCOCCCCCN 34a_100000762737_100011215938 [0,0,0,0,0,0|3,0,0]=3 1577 B12R0.5 CCCOCCOCCCCCO 34a_100000752267_100000746330 [0,0,0,0,0,0|2,0,0]=2 1578 B12R0.5 CCCOCCOCCCCCO 7a_100000752267_100000746330 [0,0,0,0,0,0|2,0,0]=2 1579 B12R0.5 CCCOCCOCCCCOC 34a_100000740925_100011215938 [0,0,0,0,0,0|4,0,0]=4 1580 B12R0.5 CCCOCCOCCCCOC 34a_100000752267_100000755781 [0,0,0,0,0,0|4,0,0]=4 1581 B12R0.5 CCCOCCOCCCCOC 7a_100000752267_100000730899 [0,0,0,0,0,0|4,0,0]=4 1582 B12R0.5 CCCOCCOCCCCSC 34a_100011217163_100011215938 [0,0,0,0,0,0|4,0,0]=4 1583 B12R0.5 CCCOCCOCCCCSC 7a_100011217163_100011215938 [0,0,0,0,0,0|4,0,0]=4 1584 B12R0.5 CCCOCCOCCCOCC 34a_100000752267_100012232248 [0,0,0,0,0,0|4,0,0]=4 1585 B12R0.5 CCCOCCOCCCOCC 34a_100000757476_100011215938 [0,0,0,0,0,0|4,0,0]=4 1586 B12R0.5 CCCOCCOCCCOCC 7a_100000752267_100012232248 [0,0,0,0,0,0|4,0,0]=4 1587 B12R0.5 CCCOCCOCCCOCC 7a_100000757476_100011215938 [0,0,0,0,0,0|4,0,0]=4 1588 B12R0.5 CCCOCCOCCCSCC 34a_100011216438_100011215938 [0,0,0,0,0,0|4,0,0]=4 1589 B12R0.5 CCCOCCOCCCSCC 7a_100011216438_100011215938 [0,0,0,0,0,0|4,0,0]=4 1590 B12R0.5 CCCOCCOCCNCCF 2230a_200011904461_100011217306 [0,0,0,0,0,0|4,0,0]=4 1591 B12R0.5 CCCOCCOCCNCCF 34a_200011904461_100011217306 [0,0,0,0,0,0|4,0,0]=4 1592 B12R0.5 CCCOCCOCCNCCO 2230a_200011904461_100000211926 [0,0,0,0,0,0|3,0,0]=3 1593 B12R0.5 CCCOCCOCCNCCO 34a_200011904461_100000211926 [0,0,0,0,0,0|3,0,0]=3 1594 B12R0.5 CCCOCCOCCOCCBr 34a_100000692535_100011215938 [0,0,0,0,0,0|4,0,0]=4 1595 B12R0.5 CCCOCCOCCOCCBr 34a_100010132937_100000210303 [0,0,0,0,0,0|4,0,0]=4 1596 B12R0.5 CCCOCCOCCOCCBr 7a_100000692535_100011215938 [0,0,0,0,0,0|4,0,0]=4 1597 B12R0.5 CCCOCCOCCOCCBr 7a_100010132937_100000210303 [0,0,0,0,0,0|4,0,0]=4 1598 B12R0.5 CCCOCCOCCOCCC 34a_100000752267_100011215938 [0,0,0,0,0,0|4,0,0]=4 1599 B12R0.5 CCCOCCOCCOCCC 7a_100000752267_100011215938 [0,0,0,0,0,0|4,0,0]=4 1600 B12R0.5 CCCOCCOCCOCCCl 34a_100000032323_100000210303 [0,0,0,0,0,0|4,0,0]=4 1601 B12R0.5 CCCOCCOCCOCCCl 34a_100011215305_100011215938 [0,0,0,0,0,0|4,0,0]=4 1602 B12R0.5 CCCOCCOCCOCCCl 7a_100000032323_100000210303 [0,0,0,0,0,0|4,0,0]=4 1603 B12R0.5 CCCOCCOCCOCCCl 7a_100011215305_100011215938 [0,0,0,0,0,0|4,0,0]=4 1604 B12R0.5 CCCOCCOCCOCCF 34a_200015357709_100011215938 [0,0,0,0,0,0|4,0,0]=4 1605 B12R0.5 CCCOCCOCCOCCF 7a_200015357709_100011215938 [0,0,0,0,0,0|4,0,0]=4 1606 B12R0.5 CCCOCCOCCOCCI 34a_100012149058_100011215938 [0,0,0,0,0,0|4,0,0]=4 1607 B12R0.5 CCCOCCOCCOCCI 7a_100012149058_100011215938 [0,0,0,0,0,0|4,0,0]=4 1608 B12R0.5 CCCOCCOCCOCCN 34a_100000211614_100011215938 [0,0,0,0,0,0|4,0,0]=4 1609 B12R0.5 CCCOCCOCCOCCN 34a_100011998139_100000210303 [0,0,0,0,0,0|4,0,0]=4 1610 B12R0.5 CCCOCCOCCOCCO 34a_100000210258_100000032323 [0,0,0,0,0,0|3,0,0]=3 1611 B12R0.5 CCCOCCOCCOCCO 34a_100000752267_100000692535 [0,0,0,0,0,0|3,0,0]=3 1612 B12R0.5 CCCOCCOCCOCCO 7a_100000752267_100011215305 [0,0,0,0,0,0|3,0,0]=3 1613 B12R0.5 CCCOCCOCCSCCC 34a_200000230433_100011215938 [0,0,0,0,0,0|4,0,0]=4 1614 B12R0.5 CCCOCCOCCSCCC 7a_200000230433_100011215938 [0,0,0,0,0,0|4,0,0]=4 1615 B12R0.5 CCCOCCSCCCCC#N 62a_100011215938_100000211819 [0,0,0,0,0,0|3,0,1]=4 1616 B12R0.5 CCCOCCSCCCCC#N 62a_100011219923_100011215938 [0,0,0,0,0,0|3,0,1]=4 1617 B12R0.5 CCCOCCSCCCCC=O 62a_100000139335_100011215938 [0,0,0,0,0,0|2,0,2]=4 1618 B12R0.5 CCCOCCSCCCCC=O 62a_100011215938_100000139335 [0,0,0,0,0,0|2,0,2]=4 1619 B12R0.5 CCCOCCSCCCCCF 62a_100000729378_100011215938 [0,0,0,0,0,0|3,0,0]=3 1620 B12R0.5 CCCOCCSCCCCCF 62a_100011215938_100000729378 [0,0,0,0,0,0|3,0,0]=3 1621 B12R0.5 CCCOCCSCCCCCO 62a_100000746330_100011215938 [0,0,0,0,0,0|2,0,0]=2 1622 B12R0.5 CCCOCCSCCCCCO 62a_100011215938_100000746330 [0,0,0,0,0,0|2,0,0]=2 1623 B12R0.5 CCCOCCSCCCCOC 62a_100000730899_100011215938 [0,0,0,0,0,0|4,0,0]=4 1624 B12R0.5 CCCOCCSCCCCOC 62a_100011215938_100000730899 [0,0,0,0,0,0|4,0,0]=4 1625 B12R0.5 CCCOCCSCCCOCC 62a_100011215938_100012232248 [0,0,0,0,0,0|4,0,0]=4 1626 B12R0.5 CCCOCCSCCCOCC 62a_100012232248_100011215938 [0,0,0,0,0,0|4,0,0]=4 1627 B12R0.5 CCCOCCSCCOCCC 62a_100011215938_100011215938 [0,0,0,0,0,0|4,0,0]=4 1628 B12R0.5 CCCOCCSCCOCCO 62a_100011215305_100011215938 [0,0,0,0,0,0|3,0,0]=3 1629 B12R0.5 CCCOCCSCCOCCO 62a_100011215938_100011215305 [0,0,0,0,0,0|3,0,0]=3 1630 B12R0.5 CCCSCCCCCCCCO 62a_100000033203_100000210303 [0,0,0,0,0,0|1,0,0]=1 1631 B12R0.5 CCCSCCCCCCCCO 62a_100000210303_100000033203 [0,0,0,0,0,0|1,0,0]=1 1632 B12R0.5 CCCSCCNCCCCC#N 2230a_100020603323_100000211819 [0,0,0,0,0,0|3,0,1]=4 1633 B12R0.5 CCCSCCNCCCCC=O 2230a_100020603323_100000139335 [0,0,0,0,0,0|2,0,2]=4 1634 B12R0.5 CCCSCCNCCCCCF 2230a_100020603323_100000729378 [0,0,0,0,0,0|3,0,0]=3 1635 B12R0.5 CCCSCCNCCCCCO 2230a_100020603323_100000746330 [0,0,0,0,0,0|2,0,0]=2 1636 B12R0.5 CCCSCCNCCCCOC 2230a_100020603323_100000730899 [0,0,0,0,0,0|4,0,0]=4 1637 B12R0.5 CCCSCCNCCCOCC 2230a_100020603323_100012232248 [0,0,0,0,0,0|4,0,0]=4 1638 B12R0.5 CCCSCCNCCOCCO 2230a_100020603323_100011215305 [0,0,0,0,0,0|3,0,0]=3 1639 B12R0.5 CCCSCCOCCCCC#N 7a_200000230433_100000211819 [0,0,0,0,0,0|3,0,1]=4 1640 B12R0.5 CCCSCCOCCCCC=O 7a_200000230433_100000139335 [0,0,0,0,0,0|2,0,2]=4 1641 B12R0.5 CCCSCCOCCCCCF 34a_200000230433_100000729378 [0,0,0,0,0,0|3,0,0]=3 1642 B12R0.5 CCCSCCOCCCCCF 7a_200000230433_100000729378 [0,0,0,0,0,0|3,0,0]=3 1643 B12R0.5 CCCSCCOCCCCCO 34a_200000230433_100000746330 [0,0,0,0,0,0|2,0,0]=2 1644 B12R0.5 CCCSCCOCCCCCO 7a_200000230433_100000746330 [0,0,0,0,0,0|2,0,0]=2 1645 B12R0.5 CCCSCCOCCCCOC 34a_200000230433_100000755781 [0,0,0,0,0,0|4,0,0]=4 1646 B12R0.5 CCCSCCOCCCCOC 7a_200000230433_100000730899 [0,0,0,0,0,0|4,0,0]=4 1647 B12R0.5 CCCSCCOCCCOCC 34a_200000230433_100012232248 [0,0,0,0,0,0|4,0,0]=4 1648 B12R0.5 CCCSCCOCCCOCC 7a_200000230433_100012232248 [0,0,0,0,0,0|4,0,0]=4 1649 B12R0.5 CCCSCCOCCOCCO 34a_200000230433_100000692535 [0,0,0,0,0,0|3,0,0]=3 1650 B12R0.5 CCCSCCOCCOCCO 62a_100000032323_100000210303 [0,0,0,0,0,0|3,0,0]=3 1651 B12R0.5 CCCSCCOCCOCCO 62a_100000210303_100000032323 [0,0,0,0,0,0|3,0,0]=3 1652 B12R0.5 CCCSCCOCCOCCO 7a_200000230433_100011215305 [0,0,0,0,0,0|3,0,0]=3 1653 B12R0.5 CCNCCCCCCCCCO 2230a_100000078944_100000210202 [0,0,0,0,0,0|1,0,0]=1 1654 B12R0.5 CCNCCCCCCCCCO 2230a_100015525214_100009813782 [0,0,0,0,0,0|1,0,0]=1 1655 B12R0.5 CCNCCCCCCCCCO 34a_100000078944_100000210202 [0,0,0,0,0,0|1,0,0]=1 1656 B12R0.5 CCNCCCOCCOCCO 2230a_100011996194_100000210202 [0,0,0,0,0,0|3,0,0]=3 1657 B12R0.5 CCNCCCOCCOCCO 34a_100011996194_100000210202 [0,0,0,0,0,0|3,0,0]=3 1658 B12R0.5 CCOCCCCCCCCCBr 34a_100009813782_100000210202 [0,0,0,0,0,0|2,0,0]=2 1659 B12R0.5 CCOCCCCCCCCCBr 7a_100009813782_100000210202 [0,0,0,0,0,0|2,0,0]=2 1660 B12R0.5 CCOCCCCCCCCCCl 34a_100009868337_100000210202 [0,0,0,0,0,0|2,0,0]=2 1661 B12R0.5 CCOCCCCCCCCCCl 7a_100009868337_100000210202 [0,0,0,0,0,0|2,0,0]=2 1662 B12R0.5 CCOCCCCCCCCCN 34a_100000078944_100000210202 [0,0,0,0,0,0|2,0,0]=2 1663 B12R0.5 CCOCCCCCCCCCO 34a_100121572206_100009813782 [0,0,0,0,0,0|1,0,0]=1 1664 B12R0.5 CCOCCCNCCCCC#N 2230a_100000210961_100000211819 [0,0,0,0,0,0|3,0,1]=4 1665 B12R0.5 CCOCCCNCCCCC=O 2230a_100000210961_100000139335 [0,0,0,0,0,0|2,0,2]=4 1666 B12R0.5 CCOCCCNCCCCCF 2230a_100000210961_100000729378 [0,0,0,0,0,0|3,0,0]=3 1667 B12R0.5 CCOCCCNCCCCCF 34a_100000210961_100000729378 [0,0,0,0,0,0|3,0,0]=3 1668 B12R0.5 CCOCCCNCCCCCO 2230a_100000210961_100000746330 [0,0,0,0,0,0|2,0,0]=2 1669 B12R0.5 CCOCCCNCCCCCO 2230a_100000762737_100012232248 [0,0,0,0,0,0|2,0,0]=2 1670 B12R0.5 CCOCCCNCCCCCO 34a_100000210961_100000746330 [0,0,0,0,0,0|2,0,0]=2 1671 B12R0.5 CCOCCCNCCCCCO 34a_100000762737_100012232248 [0,0,0,0,0,0|2,0,0]=2 1672 B12R0.5 CCOCCCNCCCCOC 2230a_100000210961_100000730899 [0,0,0,0,0,0|4,0,0]=4 1673 B12R0.5 CCOCCCNCCCCOC 34a_100000210961_100000755781 [0,0,0,0,0,0|4,0,0]=4 1674 B12R0.5 CCOCCCNCCCOCC 2230a_100000210961_100012232248 [0,0,0,0,0,0|4,0,0]=4 1675 B12R0.5 CCOCCCNCCCOCC 34a_100000210961_100012232248 [0,0,0,0,0,0|4,0,0]=4 1676 B12R0.5 CCOCCCNCCOCCO 2230a_100000210961_100011215305 [0,0,0,0,0,0|3,0,0]=3 1677 B12R0.5 CCOCCCNCCOCCO 2230a_100000211614_100012232248 [0,0,0,0,0,0|3,0,0]=3 1678 B12R0.5 CCOCCCNCCOCCO 34a_100000210961_100000692535 [0,0,0,0,0,0|3,0,0]=3 1679 B12R0.5 CCOCCCNCCOCCO 34a_100000211614_100012232248 [0,0,0,0,0,0|3,0,0]=3 1680 B12R0.5 CCOCCCNCCSCCO 2230a_100011219999_100012232248 [0,0,0,0,0,0|3,0,0]=3 1681 B12R0.5 CCOCCCOCCCCC#N 7a_100000757476_100000211819 [0,0,0,0,0,0|3,0,1]=4 1682 B12R0.5 CCOCCCOCCCCC=O 7a_100000757476_100000139335 [0,0,0,0,0,0|2,0,2]=4 1683 B12R0.5 CCOCCCOCCCCCBr 34a_100000746331_100012232248 [0,0,0,0,0,0|3,0,0]=3 1684 B12R0.5 CCOCCCOCCCCCBr 7a_100000746331_100012232248 [0,0,0,0,0,0|3,0,0]=3 1685 B12R0.5 CCOCCCOCCCCCCl 34a_100000746330_100012232248 [0,0,0,0,0,0|3,0,0]=3 1686 B12R0.5 CCOCCCOCCCCCCl 7a_100000746330_100012232248 [0,0,0,0,0,0|3,0,0]=3 1687 B12R0.5 CCOCCCOCCCCCF 34a_100000757476_100000729378 [0,0,0,0,0,0|3,0,0]=3 1688 B12R0.5 CCOCCCOCCCCCF 7a_100000757476_100000729378 [0,0,0,0,0,0|3,0,0]=3 1689 B12R0.5 CCOCCCOCCCCCI 34a_200012148887_100012232248 [0,0,0,0,0,0|3,0,0]=3 1690 B12R0.5 CCOCCCOCCCCCI 7a_200012148887_100012232248 [0,0,0,0,0,0|3,0,0]=3 1691 B12R0.5 CCOCCCOCCCCCN 34a_100000762737_100012232248 [0,0,0,0,0,0|3,0,0]=3 1692 B12R0.5 CCOCCCOCCCCCO 34a_100000757476_100000746330 [0,0,0,0,0,0|2,0,0]=2 1693 B12R0.5 CCOCCCOCCCCCO 7a_100000757476_100000746330 [0,0,0,0,0,0|2,0,0]=2 1694 B12R0.5 CCOCCCOCCCCOC 34a_100000740925_100012232248 [0,0,0,0,0,0|4,0,0]=4 1695 B12R0.5 CCOCCCOCCCCOC 34a_100000757476_100000755781 [0,0,0,0,0,0|4,0,0]=4 1696 B12R0.5 CCOCCCOCCCCOC 7a_100000757476_100000730899 [0,0,0,0,0,0|4,0,0]=4 1697 B12R0.5 CCOCCCOCCCCSC 34a_100011217163_100012232248 [0,0,0,0,0,0|4,0,0]=4 1698 B12R0.5 CCOCCCOCCCCSC 7a_100011217163_100012232248 [0,0,0,0,0,0|4,0,0]=4 1699 B12R0.5 CCOCCCOCCCOCC 34a_100000757476_100012232248 [0,0,0,0,0,0|4,0,0]=4 1700 B12R0.5 CCOCCCOCCCOCC 7a_100000757476_100012232248 [0,0,0,0,0,0|4,0,0]=4 1701 B12R0.5 CCOCCCOCCCSCC 34a_100011216438_100012232248 [0,0,0,0,0,0|4,0,0]=4 1702 B12R0.5 CCOCCCOCCCSCC 7a_100011216438_100012232248 [0,0,0,0,0,0|4,0,0]=4 1703 B12R0.5 CCOCCCOCCOCCBr 34a_100000692535_100012232248 [0,0,0,0,0,0|4,0,0]=4 1704 B12R0.5 CCOCCCOCCOCCBr 7a_100000692535_100012232248 [0,0,0,0,0,0|4,0,0]=4 1705 B12R0.5 CCOCCCOCCOCCCl 34a_100011215305_100012232248 [0,0,0,0,0,0|4,0,0]=4 1706 B12R0.5 CCOCCCOCCOCCCl 7a_100011215305_100012232248 [0,0,0,0,0,0|4,0,0]=4 1707 B12R0.5 CCOCCCOCCOCCF 34a_200015357709_100012232248 [0,0,0,0,0,0|4,0,0]=4 1708 B12R0.5 CCOCCCOCCOCCF 7a_200015357709_100012232248 [0,0,0,0,0,0|4,0,0]=4 1709 B12R0.5 CCOCCCOCCOCCI 34a_100012149058_100012232248 [0,0,0,0,0,0|4,0,0]=4 1710 B12R0.5 CCOCCCOCCOCCI 7a_100012149058_100012232248 [0,0,0,0,0,0|4,0,0]=4 1711 B12R0.5 CCOCCCOCCOCCN 34a_100000211614_100012232248 [0,0,0,0,0,0|4,0,0]=4 1712 B12R0.5 CCOCCCOCCOCCO 34a_100000757476_100000692535 [0,0,0,0,0,0|3,0,0]=3 1713 B12R0.5 CCOCCCOCCOCCO 7a_100000757476_100011215305 [0,0,0,0,0,0|3,0,0]=3 1714 B12R0.5 CCOCCCSCCCCC#N 62a_100011219923_100012232248 [0,0,0,0,0,0|3,0,1]=4 1715 B12R0.5 CCOCCCSCCCCC#N 62a_100012232248_100000211819 [0,0,0,0,0,0|3,0,1]=4 1716 B12R0.5 CCOCCCSCCCCC=O 62a_100000139335_100012232248 [0,0,0,0,0,0|2,0,2]=4 1717 B12R0.5 CCOCCCSCCCCC=O 62a_100012232248_100000139335 [0,0,0,0,0,0|2,0,2]=4 1718 B12R0.5 CCOCCCSCCCCCF 62a_100000729378_100012232248 [0,0,0,0,0,0|3,0,0]=3 1719 B12R0.5 CCOCCCSCCCCCF 62a_100012232248_100000729378 [0,0,0,0,0,0|3,0,0]=3 1720 B12R0.5 CCOCCCSCCCCCO 62a_100000746330_100012232248 [0,0,0,0,0,0|2,0,0]=2 1721 B12R0.5 CCOCCCSCCCCCO 62a_100012232248_100000746330 [0,0,0,0,0,0|2,0,0]=2 1722 B12R0.5 CCOCCCSCCCCOC 62a_100000730899_100012232248 [0,0,0,0,0,0|4,0,0]=4 1723 B12R0.5 CCOCCCSCCCCOC 62a_100012232248_100000730899 [0,0,0,0,0,0|4,0,0]=4 1724 B12R0.5 CCOCCCSCCCOCC 62a_100012232248_100012232248 [0,0,0,0,0,0|4,0,0]=4 1725 B12R0.5 CCOCCCSCCOCCO 62a_100011215305_100012232248 [0,0,0,0,0,0|3,0,0]=3 1726 B12R0.5 CCOCCCSCCOCCO 62a_100012232248_100011215305 [0,0,0,0,0,0|3,0,0]=3 1727 B12R0.5 CCOCCNCCCCCC#N 2230a_102516460346_100009813376 [0,0,0,0,0,0|3,0,1]=4 1728 B12R0.5 CCOCCNCCCCCC=O 2230a_102516460346_100000139337 [0,0,0,0,0,0|2,0,2]=4 1729 B12R0.5 CCOCCNCCCCCCF 2230a_102516460346_100015922095 [0,0,0,0,0,0|3,0,0]=3 1730 B12R0.5 CCOCCNCCCCCCF 34a_102516460346_100015922095 [0,0,0,0,0,0|3,0,0]=3 1731 B12R0.5 CCOCCNCCCCCCO 2230a_100000686447_100011215890 [0,0,0,0,0,0|2,0,0]=2 1732 B12R0.5 CCOCCNCCCCCCO 2230a_102516460346_100000766143 [0,0,0,0,0,0|2,0,0]=2 1733 B12R0.5 CCOCCNCCCCCCO 34a_100000686447_100000210147 [0,0,0,0,0,0|2,0,0]=2 1734 B12R0.5 CCOCCNCCCCCCO 34a_102516460346_100000766143 [0,0,0,0,0,0|2,0,0]=2 1735 B12R0.5 CCOCCNCCCCCOC 2230a_100000747528_100011215890 [0,0,0,0,0,0|4,0,0]=4 1736 B12R0.5 CCOCCNCCCCCOC 34a_100000747528_100000210147 [0,0,0,0,0,0|4,0,0]=4 1737 B12R0.5 CCOCCNN=CCCCCO 4a_100000732670_100000031955 [0,0,0,0,0,0|3,0,1]=4 1738 B12R0.5 CCOCCOCCCCCC#N 7a_100000210136_100009813376 [0,0,0,0,0,0|3,0,1]=4 1739 B12R0.5 CCOCCOCCCCCC=O 7a_100000210136_100000139337 [0,0,0,0,0,0|2,0,2]=4 1740 B12R0.5 CCOCCOCCCCCCBr 34a_100011215345_100000210147 [0,0,0,0,0,0|3,0,0]=3 1741 B12R0.5 CCOCCOCCCCCCBr 7a_100011215345_100011215890 [0,0,0,0,0,0|3,0,0]=3 1742 B12R0.5 CCOCCOCCCCCCCl 34a_100000766143_100000210147 [0,0,0,0,0,0|3,0,0]=3 1743 B12R0.5 CCOCCOCCCCCCCl 7a_100000766143_100011215890 [0,0,0,0,0,0|3,0,0]=3 1744 B12R0.5 CCOCCOCCCCCCF 34a_100000210136_100015922095 [0,0,0,0,0,0|3,0,0]=3 1745 B12R0.5 CCOCCOCCCCCCF 34a_100000732779_100000210147 [0,0,0,0,0,0|3,0,0]=3 1746 B12R0.5 CCOCCOCCCCCCF 7a_100000210136_100015922095 [0,0,0,0,0,0|3,0,0]=3 1747 B12R0.5 CCOCCOCCCCCCF 7a_100000732779_100011215890 [0,0,0,0,0,0|3,0,0]=3 1748 B12R0.5 CCOCCOCCCCCCN 34a_100000686447_100000210147 [0,0,0,0,0,0|3,0,0]=3 1749 B12R0.5 CCOCCOCCCCCCO 34a_100000210136_100000766143 [0,0,0,0,0,0|2,0,0]=2 1750 B12R0.5 CCOCCOCCCCCCO 7a_100000210136_100000766143 [0,0,0,0,0,0|2,0,0]=2 1751 B12R0.5 CCOCCOCCCCCNC 34a_100000722520_100000210147 [0,0,0,0,0,0|4,0,0]=4 1752 B12R0.5 CCOCCOCCNCCCF 2230a_100015189416_100011211534 [0,0,0,0,0,0|4,0,0]=4 1753 B12R0.5 CCOCCOCCNCCCF 2230a_100102712874_100011934791 [0,0,0,0,0,0|4,0,0]=4 1754 B12R0.5 CCOCCOCCNCCCF 34a_100015189416_100011211534 [0,0,0,0,0,0|4,0,0]=4 1755 B12R0.5 CCOCCOCCNCCCF 34a_100102712874_100011934791 [0,0,0,0,0,0|4,0,0]=4 1756 B12R0.5 CCOCCOCCNCCCO 2230a_100102712874_100000230001 [0,0,0,0,0,0|3,0,0]=3 1757 B12R0.5 CCOCCOCCNCCCO 34a_100102712874_100000230001 [0,0,0,0,0,0|3,0,0]=3 1758 B12R0.5 CCOCCOCCOCCCBr 34a_100011217188_100011211534 [0,0,0,0,0,0|4,0,0]=4 1759 B12R0.5 CCOCCOCCOCCCCl 34a_100000230001_100011211534 [0,0,0,0,0,0|4,0,0]=4 1760 B12R0.5 CCOCCOCCOCCCF 34a_100000210240_100011934791 [0,0,0,0,0,0|4,0,0]=4 1761 B12R0.5 CCOCCOCCOCCCF 34a_100000759539_100011211534 [0,0,0,0,0,0|4,0,0]=4 1762 B12R0.5 CCOCCOCCOCCCF 7a_100000210240_100011934791 [0,0,0,0,0,0|4,0,0]=4 1763 B12R0.5 CCOCCOCCOCCCN 34a_100000182051_100011211534 [0,0,0,0,0,0|4,0,0]=4 1764 B12R0.5 CCOCCOCCOCCCN 34a_100011996194_100000210202 [0,0,0,0,0,0|4,0,0]=4 1765 B12R0.5 CCOCCOCCOCCCO 34a_100000210240_100000230001 [0,0,0,0,0,0|3,0,0]=3 1766 B12R0.5 CCOCCOCCOCCCO 7a_100000210240_100011215043 [0,0,0,0,0,0|3,0,0]=3 1767 B12R0.5 CCOCCOCCSCCCF 62a_100011211534_100011934791 [0,0,0,0,0,0|4,0,0]=4 1768 B12R0.5 CCOCCOCCSCCCF 62a_100011934791_100011211534 [0,0,0,0,0,0|4,0,0]=4 1769 B12R0.5 CCOCCOCCSCCCO 62a_100011211534_100011215043 [0,0,0,0,0,0|3,0,0]=3 1770 B12R0.5 CCOCCOCCSCCCO 62a_100011215043_100011211534 [0,0,0,0,0,0|3,0,0]=3 1771 B12R0.5 CCOCCSCCCCCC#N 62a_100000210147_100009813376 [0,0,0,0,0,0|3,0,1]=4 1772 B12R0.5 CCOCCSCCCCCC#N 62a_100009813376_100011215890 [0,0,0,0,0,0|3,0,1]=4 1773 B12R0.5 CCOCCSCCCCCC=O 62a_100000139337_100011215890 [0,0,0,0,0,0|2,0,2]=4 1774 B12R0.5 CCOCCSCCCCCC=O 62a_100000210147_100000139337 [0,0,0,0,0,0|2,0,2]=4 1775 B12R0.5 CCOCCSCCCCCCF 62a_100000210147_100015922095 [0,0,0,0,0,0|3,0,0]=3 1776 B12R0.5 CCOCCSCCCCCCF 62a_100015922095_100011215890 [0,0,0,0,0,0|3,0,0]=3 1777 B12R0.5 CCOCCSCCCCCCO 62a_100000210147_100000766143 [0,0,0,0,0,0|2,0,0]=2 1778 B12R0.5 CCOCCSCCCCCCO 62a_100000766143_100011215890 [0,0,0,0,0,0|2,0,0]=2 1779 B12R0.5 CCOCSCCCCCCC#N 62a_100000739092_100009813337 [0,0,0,0,0,0|3,0,1]=4 1780 B12R0.5 CCOCSCCCCCCC#N 62a_100009813337_100000739092 [0,0,0,0,0,0|3,0,1]=4 1781 B12R0.5 CCOCSCCCCCCCO 62a_100000739092_100000760002 [0,0,0,0,0,0|2,0,0]=2 1782 B12R0.5 CCOCSCCCCCCCO 62a_100000760002_100000739092 [0,0,0,0,0,0|2,0,0]=2 1783 B12R0.5 CCOCSCCCCCCOC 62a_100000739092_100011998445 [0,0,0,0,0,0|4,0,0]=4 1784 B12R0.5 CCOCSCCCCCCOC 62a_100011998445_100000739092 [0,0,0,0,0,0|4,0,0]=4 1785 B12R0.5 CCSCCCCCCCCCO 62a_100000210202_100009813782 [0,0,0,0,0,0|1,0,0]=1 1786 B12R0.5 CCSCCCCCCCCCO 62a_100009813782_100000210202 [0,0,0,0,0,0|1,0,0]=1 1787 B12R0.5 CCSCCCOCCCCC#N 7a_100011216438_100000211819 [0,0,0,0,0,0|3,0,1]=4 1788 B12R0.5 CCSCCCOCCCCC=O 7a_100011216438_100000139335 [0,0,0,0,0,0|2,0,2]=4 1789 B12R0.5 CCSCCCOCCCCCF 34a_100011216438_100000729378 [0,0,0,0,0,0|3,0,0]=3 1790 B12R0.5 CCSCCCOCCCCCF 7a_100011216438_100000729378 [0,0,0,0,0,0|3,0,0]=3 1791 B12R0.5 CCSCCCOCCCCCO 34a_100011216438_100000746330 [0,0,0,0,0,0|2,0,0]=2 1792 B12R0.5 CCSCCCOCCCCCO 7a_100011216438_100000746330 [0,0,0,0,0,0|2,0,0]=2 1793 B12R0.5 CCSCCCOCCCCOC 34a_100011216438_100000755781 [0,0,0,0,0,0|4,0,0]=4 1794 B12R0.5 CCSCCCOCCCCOC 7a_100011216438_100000730899 [0,0,0,0,0,0|4,0,0]=4 1795 B12R0.5 CCSCCCOCCOCCO 34a_100011216438_100000692535 [0,0,0,0,0,0|3,0,0]=3 1796 B12R0.5 CCSCCCOCCOCCO 7a_100011216438_100011215305 [0,0,0,0,0,0|3,0,0]=3 1797 B12R0.5 CCSCCNCCCCCC#N 2230a_100000106463_100009813376 [0,0,0,0,0,0|3,0,1]=4 1798 B12R0.5 CCSCCNCCCCCC=O 2230a_100000106463_100000139337 [0,0,0,0,0,0|2,0,2]=4 1799 B12R0.5 CCSCCNCCCCCCF 2230a_100000106463_100015922095 [0,0,0,0,0,0|3,0,0]=3 1800 B12R0.5 CCSCCNCCCCCCO 2230a_100000106463_100000766143 [0,0,0,0,0,0|2,0,0]=2 1801 B12R0.5 CCSCCNCCCCCCO 2230a_100000686447_100000757381 [0,0,0,0,0,0|2,0,0]=2 1802 B12R0.5 CCSCCNCCCCCCO 34a_100000686447_100000757381 [0,0,0,0,0,0|2,0,0]=2 1803 B12R0.5 CCSCCNCCCCCOC 2230a_100000747528_100000757381 [0,0,0,0,0,0|4,0,0]=4 1804 B12R0.5 CCSCCNCCCCCOC 34a_100000747528_100000757381 [0,0,0,0,0,0|4,0,0]=4 1805 B12R0.5 CCSCCOCCCCCC#N 7a_100000212035_100009813376 [0,0,0,0,0,0|3,0,1]=4 1806 B12R0.5 CCSCCOCCCCCC=O 7a_100000212035_100000139337 [0,0,0,0,0,0|2,0,2]=4 1807 B12R0.5 CCSCCOCCCCCCBr 34a_100011215345_100000757381 [0,0,0,0,0,0|3,0,0]=3 1808 B12R0.5 CCSCCOCCCCCCBr 7a_100011215345_100000757381 [0,0,0,0,0,0|3,0,0]=3 1809 B12R0.5 CCSCCOCCCCCCCl 34a_100000766143_100000757381 [0,0,0,0,0,0|3,0,0]=3 1810 B12R0.5 CCSCCOCCCCCCCl 7a_100000766143_100000757381 [0,0,0,0,0,0|3,0,0]=3 1811 B12R0.5 CCSCCOCCCCCCF 34a_100000212035_100015922095 [0,0,0,0,0,0|3,0,0]=3 1812 B12R0.5 CCSCCOCCCCCCF 34a_100000732779_100000757381 [0,0,0,0,0,0|3,0,0]=3 1813 B12R0.5 CCSCCOCCCCCCF 7a_100000212035_100015922095 [0,0,0,0,0,0|3,0,0]=3 1814 B12R0.5 CCSCCOCCCCCCF 7a_100000732779_100000757381 [0,0,0,0,0,0|3,0,0]=3 1815 B12R0.5 CCSCCOCCCCCCN 34a_100000686447_100000757381 [0,0,0,0,0,0|3,0,0]=3 1816 B12R0.5 CCSCCOCCCCCCO 34a_100000212035_100000766143 [0,0,0,0,0,0|2,0,0]=2 1817 B12R0.5 CCSCCOCCCCCCO 7a_100000212035_100000766143 [0,0,0,0,0,0|2,0,0]=2 1818 B12R0.5 CCSCCOCCCCCNC 34a_100000722520_100000757381 [0,0,0,0,0,0|4,0,0]=4 1819 B12R0.5 CCSCCSCCCCCC#N 62a_100000757381_100009813376 [0,0,0,0,0,0|3,0,1]=4 1820 B12R0.5 CCSCCSCCCCCC#N 62a_100009813376_100000757381 [0,0,0,0,0,0|3,0,1]=4 1821 B12R0.5 CCSCCSCCCCCC=O 62a_100000139337_100000757381 [0,0,0,0,0,0|2,0,2]=4 1822 B12R0.5 CCSCCSCCCCCC=O 62a_100000757381_100000139337 [0,0,0,0,0,0|2,0,2]=4 1823 B12R0.5 CCSCCSCCCCCCF 62a_100000757381_100015922095 [0,0,0,0,0,0|3,0,0]=3 1824 B12R0.5 CCSCCSCCCCCCF 62a_100015922095_100000757381 [0,0,0,0,0,0|3,0,0]=3 1825 B12R0.5 CCSCCSCCCCCCO 62a_100000757381_100000766143 [0,0,0,0,0,0|2,0,0]=2 1826 B12R0.5 CCSCCSCCCCCCO 62a_100000766143_100000757381 [0,0,0,0,0,0|2,0,0]=2 1827 B12R0.5 CNCCCCCCCCCCO 2230a_100000066964_200000210301 [0,0,0,0,0,0|1,0,0]=1 1828 B12R0.5 CNCCCCCCCCCCO 2230a_106832991635_100009813290 [0,0,0,0,0,0|1,0,0]=1 1829 B12R0.5 CNCCCCCCCCCCO 34a_100000066964_200000210301 [0,0,0,0,0,0|1,0,0]=1 1830 B12R0.5 CNCCCCCCCCCCO 34a_100102657272_100009813290 [0,0,0,0,0,0|1,0,0]=1 1831 B12R0.5 CNCCCCCCCCCCO 7a_106832991635_100009813290 [0,0,0,0,0,0|1,0,0]=1 1832 B12R0.5 CNCCCCCOCC#CCO 34a_100000722520_200000047223 [0,0,0,0,0,0|2,0,2]=4 1833 B12R0.5 CNCCCCCOCCCCF 34a_100000722520_100000729493 [0,0,0,0,0,0|3,0,0]=3 1834 B12R0.5 CNCCCCCOCCCCO 34a_100000722520_100011216708 [0,0,0,0,0,0|2,0,0]=2 1835 B12R0.5 CNCCCCCOCCCOC 34a_100000722520_100000740836 [0,0,0,0,0,0|4,0,0]=4 1836 B12R0.5 CNCCCOCCCCCCF 34a_100000213112_100015922095 [0,0,0,0,0,0|3,0,0]=3 1837 B12R0.5 CNCCCOCCCCCCO 34a_100000213112_100000766143 [0,0,0,0,0,0|2,0,0]=2 1838 B12R0.5 CNCCOCCOCCCCF 34a_100000228057_100000729493 [0,0,0,0,0,0|4,0,0]=4 1839 B12R0.5 CNCCOCCOCCCCO 34a_100000228057_100011216708 [0,0,0,0,0,0|3,0,0]=3 1840 B12R0.5 COCCCCCCCCCCBr 34a_100009813290_200000210301 [0,0,0,0,0,0|2,0,0]=2 1841 B12R0.5 COCCCCCCCCCCBr 7a_100009813290_200000210301 [0,0,0,0,0,0|2,0,0]=2 1842 B12R0.5 COCCCCCCCCCCCl 34a_200000033068_200000210301 [0,0,0,0,0,0|2,0,0]=2 1843 B12R0.5 COCCCCCCCCCCCl 7a_200000033068_200000210301 [0,0,0,0,0,0|2,0,0]=2 1844 B12R0.5 COCCCCCCCCCCN 34a_100000066964_200000210301 [0,0,0,0,0,0|2,0,0]=2 1845 B12R0.5 COCCCCCCCCCCO 34a_100138415774_100009813290 [0,0,0,0,0,0|1,0,0]=1 1846 B12R0.5 COCCCCCCNCCCF 2230a_100015189416_100011998445 [0,0,0,0,0,0|3,0,0]=3 1847 B12R0.5 COCCCCCCNCCCF 34a_100015189416_100011998445 [0,0,0,0,0,0|3,0,0]=3 1848 B12R0.5 COCCCCCCNCCOC 2230a_100000209980_100011998445 [0,0,0,0,0,0|4,0,0]=4 1849 B12R0.5 COCCCCCCNCCSC 2230a_100020590264_100011998445 [0,0,0,0,0,0|4,0,0]=4 1850 B12R0.5 COCCCCCCOCCC#N 7a_200012092642_100000184422 [0,0,0,0,0,0|3,0,1]=4 1851 B12R0.5 COCCCCCCOCCCBr 34a_100011217188_100011998445 [0,0,0,0,0,0|3,0,0]=3 1852 B12R0.5 COCCCCCCOCCCCl 34a_100000230001_100011998445 [0,0,0,0,0,0|3,0,0]=3 1853 B12R0.5 COCCCCCCOCCCF 34a_100000759539_100011998445 [0,0,0,0,0,0|3,0,0]=3 1854 B12R0.5 COCCCCCCOCCCF 34a_200012092642_100011934791 [0,0,0,0,0,0|3,0,0]=3 1855 B12R0.5 COCCCCCCOCCCF 7a_200012092642_100011934791 [0,0,0,0,0,0|3,0,0]=3 1856 B12R0.5 COCCCCCCOCCCN 34a_100000182051_100011998445 [0,0,0,0,0,0|3,0,0]=3 1857 B12R0.5 COCCCCCCOCCCO 34a_200012092642_100000230001 [0,0,0,0,0,0|2,0,0]=2 1858 B12R0.5 COCCCCCCOCCCO 7a_200012092642_100011215043 [0,0,0,0,0,0|2,0,0]=2 1859 B12R0.5 COCCCCCCOCCOC 34a_100000210237_100011998445 [0,0,0,0,0,0|4,0,0]=4 1860 B12R0.5 COCCCCCCOCCOC 34a_200012092642_100011201679 [0,0,0,0,0,0|4,0,0]=4 1861 B12R0.5 COCCCCCCOCCOC 7a_200012092642_100000233755 [0,0,0,0,0,0|4,0,0]=4 1862 B12R0.5 COCCCCCCOCCON 34a_100000700252_100011998445 [0,0,0,0,0,0|4,0,0]=4 1863 B12R0.5 COCCCCCCOCCSC 34a_100000230434_100011998445 [0,0,0,0,0,0|4,0,0]=4 1864 B12R0.5 COCCCCCCOCCSC 34a_200012092642_100000212216 [0,0,0,0,0,0|4,0,0]=4 1865 B12R0.5 COCCCCCCOCCSC 7a_100000230434_100011998445 [0,0,0,0,0,0|4,0,0]=4 1866 B12R0.5 COCCCCCCOCCSC 7a_200012092642_100000212216 [0,0,0,0,0,0|4,0,0]=4 1867 B12R0.5 COCCCCCCSCCC#N 62a_100011215226_100011998445 [0,0,0,0,0,0|3,0,1]=4 1868 B12R0.5 COCCCCCCSCCC#N 62a_100011998445_100011215226 [0,0,0,0,0,0|3,0,1]=4 1869 B12R0.5 COCCCCCCSCCCF 62a_100011934791_100011998445 [0,0,0,0,0,0|3,0,0]=3 1870 B12R0.5 COCCCCCCSCCCF 62a_100011998445_100011934791 [0,0,0,0,0,0|3,0,0]=3 1871 B12R0.5 COCCCCCCSCCCO 62a_100011215043_100011998445 [0,0,0,0,0,0|2,0,0]=2 1872 B12R0.5 COCCCCCCSCCCO 62a_100011998445_100011215043 [0,0,0,0,0,0|2,0,0]=2 1873 B12R0.5 COCCCCCCSCCOC 62a_100000233755_100011998445 [0,0,0,0,0,0|4,0,0]=4 1874 B12R0.5 COCCCCCCSCCOC 62a_100011998445_100000233755 [0,0,0,0,0,0|4,0,0]=4 1875 B12R0.5 COCCCCCCSCCSC 62a_100000212216_100011998445 [0,0,0,0,0,0|4,0,0]=4 1876 B12R0.5 COCCCCCCSCCSC 62a_100011998445_100000751147 [0,0,0,0,0,0|4,0,0]=4 1877 B12R0.5 COCCCCCNCC#CCO 2230a_100000747528_200000047223 [0,0,0,0,0,0|2,0,2]=4 1878 B12R0.5 COCCCCCNCC#CCO 34a_100000747528_200000047223 [0,0,0,0,0,0|2,0,2]=4 1879 B12R0.5 COCCCCCNCCCC#N 2230a_100000747528_100000687738 [0,0,0,0,0,0|3,0,1]=4 1880 B12R0.5 COCCCCCNCCCC=O 2230a_100000747528_200011292268 [0,0,0,0,0,0|2,0,2]=4 1881 B12R0.5 COCCCCCNCCCCF 2230a_100000747528_100000729493 [0,0,0,0,0,0|3,0,0]=3 1882 B12R0.5 COCCCCCNCCCCF 34a_100000747528_100000729493 [0,0,0,0,0,0|3,0,0]=3 1883 B12R0.5 COCCCCCNCCCCO 2230a_100000747528_100000210776 [0,0,0,0,0,0|2,0,0]=2 1884 B12R0.5 COCCCCCNCCCCO 34a_100000747528_100011216708 [0,0,0,0,0,0|2,0,0]=2 1885 B12R0.5 COCCCCCNCCCOC 2230a_100000747528_100000740836 [0,0,0,0,0,0|4,0,0]=4 1886 B12R0.5 COCCCCCNCCCOC 34a_100000747528_100000740836 [0,0,0,0,0,0|4,0,0]=4 1887 B12R0.5 COCCCCNCCCCCO 2230a_100000762737_100000730899 [0,0,0,0,0,0|2,0,0]=2 1888 B12R0.5 COCCCCNCCCCCO 34a_100000762737_100000755781 [0,0,0,0,0,0|2,0,0]=2 1889 B12R0.5 COCCCCNCCOCCO 2230a_100000211614_100000730899 [0,0,0,0,0,0|3,0,0]=3 1890 B12R0.5 COCCCCNCCOCCO 34a_100000211614_100000755781 [0,0,0,0,0,0|3,0,0]=3 1891 B12R0.5 COCCCCNCCSCCO 2230a_100011219999_100000730899 [0,0,0,0,0,0|3,0,0]=3 1892 B12R0.5 COCCCCOCCCCCBr 34a_100000746331_100000755781 [0,0,0,0,0,0|3,0,0]=3 1893 B12R0.5 COCCCCOCCCCCBr 7a_100000746331_100000730899 [0,0,0,0,0,0|3,0,0]=3 1894 B12R0.5 COCCCCOCCCCCCl 34a_100000746330_100000755781 [0,0,0,0,0,0|3,0,0]=3 1895 B12R0.5 COCCCCOCCCCCCl 7a_100000746330_100000730899 [0,0,0,0,0,0|3,0,0]=3 1896 B12R0.5 COCCCCOCCCCCF 34a_100000740925_100000729378 [0,0,0,0,0,0|3,0,0]=3 1897 B12R0.5 COCCCCOCCCCCI 34a_200012148887_100000755781 [0,0,0,0,0,0|3,0,0]=3 1898 B12R0.5 COCCCCOCCCCCI 7a_200012148887_100000730899 [0,0,0,0,0,0|3,0,0]=3 1899 B12R0.5 COCCCCOCCCCCN 34a_100000762737_100000755781 [0,0,0,0,0,0|3,0,0]=3 1900 B12R0.5 COCCCCOCCCCCO 34a_100000740925_100000746330 [0,0,0,0,0,0|2,0,0]=2 1901 B12R0.5 COCCCCOCCCCOC 34a_100000740925_100000755781 [0,0,0,0,0,0|4,0,0]=4 1902 B12R0.5 COCCCCOCCCCSC 34a_100011217163_100000755781 [0,0,0,0,0,0|4,0,0]=4 1903 B12R0.5 COCCCCOCCCCSC 7a_100011217163_100000730899 [0,0,0,0,0,0|4,0,0]=4 1904 B12R0.5 COCCCCOCCOCCBr 34a_100000692535_100000755781 [0,0,0,0,0,0|4,0,0]=4 1905 B12R0.5 COCCCCOCCOCCBr 7a_100000692535_100000730899 [0,0,0,0,0,0|4,0,0]=4 1906 B12R0.5 COCCCCOCCOCCCl 34a_100011215305_100000755781 [0,0,0,0,0,0|4,0,0]=4 1907 B12R0.5 COCCCCOCCOCCCl 7a_100011215305_100000730899 [0,0,0,0,0,0|4,0,0]=4 1908 B12R0.5 COCCCCOCCOCCF 34a_200015357709_100000755781 [0,0,0,0,0,0|4,0,0]=4 1909 B12R0.5 COCCCCOCCOCCF 7a_200015357709_100000730899 [0,0,0,0,0,0|4,0,0]=4 1910 B12R0.5 COCCCCOCCOCCI 34a_100012149058_100000755781 [0,0,0,0,0,0|4,0,0]=4 1911 B12R0.5 COCCCCOCCOCCI 7a_100012149058_100000730899 [0,0,0,0,0,0|4,0,0]=4 1912 B12R0.5 COCCCCOCCOCCN 34a_100000211614_100000755781 [0,0,0,0,0,0|4,0,0]=4 1913 B12R0.5 COCCCCOCCOCCO 34a_100000740925_100000692535 [0,0,0,0,0,0|3,0,0]=3 1914 B12R0.5 COCCCCSCCCCC#N 62a_100000730899_100000211819 [0,0,0,0,0,0|3,0,1]=4 1915 B12R0.5 COCCCCSCCCCC#N 62a_100011219923_100000730899 [0,0,0,0,0,0|3,0,1]=4 1916 B12R0.5 COCCCCSCCCCC=O 62a_100000139335_100000730899 [0,0,0,0,0,0|2,0,2]=4 1917 B12R0.5 COCCCCSCCCCC=O 62a_100000730899_100000139335 [0,0,0,0,0,0|2,0,2]=4 1918 B12R0.5 COCCCCSCCCCCF 62a_100000729378_100000730899 [0,0,0,0,0,0|3,0,0]=3 1919 B12R0.5 COCCCCSCCCCCF 62a_100000730899_100000729378 [0,0,0,0,0,0|3,0,0]=3 1920 B12R0.5 COCCCCSCCCCCO 62a_100000730899_100000746330 [0,0,0,0,0,0|2,0,0]=2 1921 B12R0.5 COCCCCSCCCCCO 62a_100000746330_100000730899 [0,0,0,0,0,0|2,0,0]=2 1922 B12R0.5 COCCCCSCCCCOC 62a_100000730899_100000730899 [0,0,0,0,0,0|4,0,0]=4 1923 B12R0.5 COCCCCSCCOCCO 62a_100000730899_100011215305 [0,0,0,0,0,0|3,0,0]=3 1924 B12R0.5 COCCCCSCCOCCO 62a_100011215305_100000730899 [0,0,0,0,0,0|3,0,0]=3 1925 B12R0.5 COCCCNCCCCCCF 34a_100150723488_100015922095 [0,0,0,0,0,0|3,0,0]=3 1926 B12R0.5 COCCCNCCCCCCO 2230a_100000686447_100000740836 [0,0,0,0,0,0|2,0,0]=2 1927 B12R0.5 COCCCNCCCCCCO 34a_100000686447_100000740836 [0,0,0,0,0,0|2,0,0]=2 1928 B12R0.5 COCCCNCCCCCCO 34a_100150723488_100000766143 [0,0,0,0,0,0|2,0,0]=2 1929 B12R0.5 COCCCOCCCCCCBr 34a_100011215345_100000740836 [0,0,0,0,0,0|3,0,0]=3 1930 B12R0.5 COCCCOCCCCCCBr 7a_100011215345_100000740836 [0,0,0,0,0,0|3,0,0]=3 1931 B12R0.5 COCCCOCCCCCCCl 34a_100000766143_100000740836 [0,0,0,0,0,0|3,0,0]=3 1932 B12R0.5 COCCCOCCCCCCCl 7a_100000766143_100000740836 [0,0,0,0,0,0|3,0,0]=3 1933 B12R0.5 COCCCOCCCCCCF 34a_100000732779_100000740836 [0,0,0,0,0,0|3,0,0]=3 1934 B12R0.5 COCCCOCCCCCCF 34a_100000740835_100015922095 [0,0,0,0,0,0|3,0,0]=3 1935 B12R0.5 COCCCOCCCCCCF 7a_100000732779_100000740836 [0,0,0,0,0,0|3,0,0]=3 1936 B12R0.5 COCCCOCCCCCCN 34a_100000686447_100000740836 [0,0,0,0,0,0|3,0,0]=3 1937 B12R0.5 COCCCOCCCCCCO 34a_100000740835_100000766143 [0,0,0,0,0,0|2,0,0]=2 1938 B12R0.5 COCCCOCCCOCCF 34a_200011215475_100011217306 [0,0,0,0,0,0|4,0,0]=4 1939 B12R0.5 COCCCOCCCOCCF 7a_200011215475_100011217306 [0,0,0,0,0,0|4,0,0]=4 1940 B12R0.5 COCCCOCCCOCCO 34a_200011215475_100000211926 [0,0,0,0,0,0|3,0,0]=3 1941 B12R0.5 COCCCOCCCOCCO 7a_200011215475_100000211926 [0,0,0,0,0,0|3,0,0]=3 1942 B12R0.5 COCCCSCCCCCC#N 62a_100000709357_100009813376 [0,0,0,0,0,0|3,0,1]=4 1943 B12R0.5 COCCCSCCCCCC#N 62a_100009813376_100000709357 [0,0,0,0,0,0|3,0,1]=4 1944 B12R0.5 COCCCSCCCCCC=O 62a_100000139337_100000709357 [0,0,0,0,0,0|2,0,2]=4 1945 B12R0.5 COCCCSCCCCCC=O 62a_100000709357_100000139337 [0,0,0,0,0,0|2,0,2]=4 1946 B12R0.5 COCCCSCCCCCCF 62a_100000709357_100015922095 [0,0,0,0,0,0|3,0,0]=3 1947 B12R0.5 COCCCSCCCCCCF 62a_100015922095_100000709357 [0,0,0,0,0,0|3,0,0]=3 1948 B12R0.5 COCCCSCCCCCCO 62a_100000709357_100000766143 [0,0,0,0,0,0|2,0,0]=2 1949 B12R0.5 COCCCSCCCCCCO 62a_100000766143_100000709357 [0,0,0,0,0,0|2,0,0]=2 1950 B12R0.5 COCCNCCCCCCC#N 2230a_100000209980_100009813337 [0,0,0,0,0,0|3,0,1]=4 1951 B12R0.5 COCCNCCCCCCCO 2230a_100000209980_100000760002 [0,0,0,0,0,0|2,0,0]=2 1952 B12R0.5 COCCNCCCCCCCO 2230a_100011996573_100011201679 [0,0,0,0,0,0|2,0,0]=2 1953 B12R0.5 COCCNCCCCCCCO 34a_100011996573_100011201679 [0,0,0,0,0,0|2,0,0]=2 1954 B12R0.5 COCCNCCCOCCCO 2230a_100011310245_100011201679 [0,0,0,0,0,0|3,0,0]=3 1955 B12R0.5 COCCNCCCOCCCO 34a_100011310245_100011201679 [0,0,0,0,0,0|3,0,0]=3 1956 B12R0.5 COCCOCCCCCCCBr 34a_100000760002_100011201679 [0,0,0,0,0,0|3,0,0]=3 1957 B12R0.5 COCCOCCCCCCCBr 7a_100000760002_100000233755 [0,0,0,0,0,0|3,0,0]=3 1958 B12R0.5 COCCOCCCCCCCN 34a_100011996573_100011201679 [0,0,0,0,0,0|3,0,0]=3 1959 B12R0.5 COCCOCCCCCCCO 34a_100000210237_100000760002 [0,0,0,0,0,0|2,0,0]=2 1960 B12R0.5 COCCOCCCNCCCF 2230a_100000206027_100011934791 [0,0,0,0,0,0|4,0,0]=4 1961 B12R0.5 COCCOCCCNCCCF 2230a_100015189416_100011216529 [0,0,0,0,0,0|4,0,0]=4 1962 B12R0.5 COCCOCCCNCCCF 34a_100000206027_100011934791 [0,0,0,0,0,0|4,0,0]=4 1963 B12R0.5 COCCOCCCNCCCF 34a_100015189416_100011216529 [0,0,0,0,0,0|4,0,0]=4 1964 B12R0.5 COCCOCCCNCCCO 2230a_100000206027_100000230001 [0,0,0,0,0,0|3,0,0]=3 1965 B12R0.5 COCCOCCCNCCCO 34a_100000206027_100000230001 [0,0,0,0,0,0|3,0,0]=3 1966 B12R0.5 COCCOCCCOCCCBr 34a_100011217188_100011216529 [0,0,0,0,0,0|4,0,0]=4 1967 B12R0.5 COCCOCCCOCCCCl 34a_100000230001_100011216529 [0,0,0,0,0,0|4,0,0]=4 1968 B12R0.5 COCCOCCCOCCCF 34a_100000759539_100011216529 [0,0,0,0,0,0|4,0,0]=4 1969 B12R0.5 COCCOCCCOCCCN 34a_100000182051_100011216529 [0,0,0,0,0,0|4,0,0]=4 1970 B12R0.5 COCCOCCCOCCCN 34a_100011310245_100011201679 [0,0,0,0,0,0|4,0,0]=4 1971 B12R0.5 COCCOCCCSCCCF 62a_100011216529_100011934791 [0,0,0,0,0,0|4,0,0]=4 1972 B12R0.5 COCCOCCCSCCCF 62a_100011934791_100011216529 [0,0,0,0,0,0|4,0,0]=4 1973 B12R0.5 COCCOCCCSCCCO 62a_100011215043_100011216529 [0,0,0,0,0,0|3,0,0]=3 1974 B12R0.5 COCCOCCCSCCCO 62a_100011216529_100011215043 [0,0,0,0,0,0|3,0,0]=3 1975 B12R0.5 COCCOCCNCCCCF 2230a_100000745349_100000729493 [0,0,0,0,0,0|4,0,0]=4 1976 B12R0.5 COCCOCCNCCCCF 34a_100000745349_100000729493 [0,0,0,0,0,0|4,0,0]=4 1977 B12R0.5 COCCOCCNCCCCO 2230a_100000745349_100000210776 [0,0,0,0,0,0|3,0,0]=3 1978 B12R0.5 COCCOCCNCCCCO 2230a_100000750430_100000695917 [0,0,0,0,0,0|3,0,0]=3 1979 B12R0.5 COCCOCCNCCCCO 34a_100000745349_100011216708 [0,0,0,0,0,0|3,0,0]=3 1980 B12R0.5 COCCOCCNCCCCO 34a_100000750430_100000695917 [0,0,0,0,0,0|3,0,0]=3 1981 B12R0.5 COCCOCCOCCCCBr 34a_100011216708_100000695917 [0,0,0,0,0,0|4,0,0]=4 1982 B12R0.5 COCCOCCOCCCCCl 34a_100000210776_100000695917 [0,0,0,0,0,0|4,0,0]=4 1983 B12R0.5 COCCOCCOCCCCCl 7a_100000210776_100000695917 [0,0,0,0,0,0|4,0,0]=4 1984 B12R0.5 COCCOCCOCCCCF 34a_100011215163_100000729493 [0,0,0,0,0,0|4,0,0]=4 1985 B12R0.5 COCCOCCOCCCCF 34a_100011995726_100000695917 [0,0,0,0,0,0|4,0,0]=4 1986 B12R0.5 COCCOCCOCCCCF 7a_100011215163_100000729493 [0,0,0,0,0,0|4,0,0]=4 1987 B12R0.5 COCCOCCOCCCCF 7a_100011995726_100000695917 [0,0,0,0,0,0|4,0,0]=4 1988 B12R0.5 COCCOCCOCCCCI 34a_200012148704_100000695917 [0,0,0,0,0,0|4,0,0]=4 1989 B12R0.5 COCCOCCOCCCCN 34a_100000750430_100000695917 [0,0,0,0,0,0|4,0,0]=4 1990 B12R0.5 COCCOCCOCCCCO 34a_100011215163_100011216708 [0,0,0,0,0,0|3,0,0]=3 1991 B12R0.5 COCCOCCOCCCCO 7a_100011215163_100000210776 [0,0,0,0,0,0|3,0,0]=3 1992 B12R0.5 COCCOCCSCCCCF 62a_100000695917_100000729493 [0,0,0,0,0,0|4,0,0]=4 1993 B12R0.5 COCCOCCSCCCCF 62a_100000729493_100000695917 [0,0,0,0,0,0|4,0,0]=4 1994 B12R0.5 COCCOCCSCCCCO 62a_100000210776_100000695917 [0,0,0,0,0,0|3,0,0]=3 1995 B12R0.5 COCCOCCSCCCCO 62a_100000695917_100000210776 [0,0,0,0,0,0|3,0,0]=3 1996 B12R0.5 COCCOCNCCCCCO 2230a_100000762737_100000231047 [0,0,0,0,0,0|3,0,0]=3 1997 B12R0.5 COCCOCNCCOCCO 2230a_100000211614_100000231047 [0,0,0,0,0,0|4,0,0]=4 1998 B12R0.5 COCCOCNCCSCCO 2230a_100011219999_100000231047 [0,0,0,0,0,0|4,0,0]=4 1999 B12R0.5 COCCOCSCCCCCF 62a_100000231047_100000729378 [0,0,0,0,0,0|4,0,0]=4 2000 B12R0.5 COCCOCSCCCCCF 62a_100000729378_100000231047 [0,0,0,0,0,0|4,0,0]=4 2001 B12R0.5 COCCOCSCCCCCO 62a_100000231047_100000746330 [0,0,0,0,0,0|3,0,0]=3 2002 B12R0.5 COCCOCSCCCCCO 62a_100000746330_100000231047 [0,0,0,0,0,0|3,0,0]=3 2003 B12R0.5 COCCOCSCCOCCO 62a_100000231047_100011215305 [0,0,0,0,0,0|4,0,0]=4 2004 B12R0.5 COCCOCSCCOCCO 62a_100011215305_100000231047 [0,0,0,0,0,0|4,0,0]=4 2005 B12R0.5 COCCSCCCCCCC#N 62a_100000233755_100009813337 [0,0,0,0,0,0|3,0,1]=4 2006 B12R0.5 COCCSCCCCCCC#N 62a_100009813337_100000233755 [0,0,0,0,0,0|3,0,1]=4 2007 B12R0.5 COCCSCCCCCCCO 62a_100000233755_100000760002 [0,0,0,0,0,0|2,0,0]=2 2008 B12R0.5 COCCSCCCCCCCO 62a_100000760002_100000233755 [0,0,0,0,0,0|2,0,0]=2 2009 B12R0.5 COCNCCCCCCCCO 2230a_102515433106_100000766300 [0,0,0,0,0,0|2,0,0]=2 2010 B12R0.5 COCNCCOCCOCCO 2230a_100011998139_100000766300 [0,0,0,0,0,0|4,0,0]=4 2011 B12R0.5 COCSCCCCCCCCO 62a_100000033203_100000766300 [0,0,0,0,0,0|2,0,0]=2 2012 B12R0.5 COCSCCCCCCCCO 62a_100000766300_100000033203 [0,0,0,0,0,0|2,0,0]=2 2013 B12R0.5 COCSCCOCCOCCO 62a_100000032323_100000766300 [0,0,0,0,0,0|4,0,0]=4 2014 B12R0.5 COCSCCOCCOCCO 62a_100000766300_100000032323 [0,0,0,0,0,0|4,0,0]=4 2015 B12R0.5 CSCCCCCCCCCCO 62a_100009813290_200000210301 [0,0,0,0,0,0|1,0,0]=1 2016 B12R0.5 CSCCCCCCCCCCO 62a_200000210301_200000033068 [0,0,0,0,0,0|1,0,0]=1 2017 B12R0.5 CSCCCCOCCCCC#N 7a_100011217163_100000211819 [0,0,0,0,0,0|3,0,1]=4 2018 B12R0.5 CSCCCCOCCCCC=O 7a_100011217163_100000139335 [0,0,0,0,0,0|2,0,2]=4 2019 B12R0.5 CSCCCCOCCCCCF 34a_100011217163_100000729378 [0,0,0,0,0,0|3,0,0]=3 2020 B12R0.5 CSCCCCOCCCCCF 7a_100011217163_100000729378 [0,0,0,0,0,0|3,0,0]=3 2021 B12R0.5 CSCCCCOCCCCCO 34a_100011217163_100000746330 [0,0,0,0,0,0|2,0,0]=2 2022 B12R0.5 CSCCCCOCCCCCO 7a_100011217163_100000746330 [0,0,0,0,0,0|2,0,0]=2 2023 B12R0.5 CSCCCCOCCOCCO 34a_100011217163_100000692535 [0,0,0,0,0,0|3,0,0]=3 2024 B12R0.5 CSCCCCOCCOCCO 7a_100011217163_100011215305 [0,0,0,0,0,0|3,0,0]=3 2025 B12R0.5 CSCCCNCCCCCC#N 2230a_100000749238_100009813376 [0,0,0,0,0,0|3,0,1]=4 2026 B12R0.5 CSCCCNCCCCCC=O 2230a_100000749238_100000139337 [0,0,0,0,0,0|2,0,2]=4 2027 B12R0.5 CSCCCNCCCCCCF 2230a_100000749238_100015922095 [0,0,0,0,0,0|3,0,0]=3 2028 B12R0.5 CSCCCNCCCCCCO 2230a_100000749238_100000766143 [0,0,0,0,0,0|2,0,0]=2 2029 B12R0.5 CSCCCOCCCCCC#N 7a_100000690336_100009813376 [0,0,0,0,0,0|3,0,1]=4 2030 B12R0.5 CSCCCOCCCCCC=O 7a_100000690336_100000139337 [0,0,0,0,0,0|2,0,2]=4 2031 B12R0.5 CSCCCOCCCCCCF 34a_100000690336_100015922095 [0,0,0,0,0,0|3,0,0]=3 2032 B12R0.5 CSCCCOCCCCCCF 7a_100000690336_100015922095 [0,0,0,0,0,0|3,0,0]=3 2033 B12R0.5 CSCCCOCCCCCCO 34a_100000690336_100000766143 [0,0,0,0,0,0|2,0,0]=2 2034 B12R0.5 CSCCCOCCCCCCO 7a_100000690336_100000766143 [0,0,0,0,0,0|2,0,0]=2 2035 B12R0.5 CSCCNCCCCCCC#N 2230a_100020590264_100009813337 [0,0,0,0,0,0|3,0,1]=4 2036 B12R0.5 CSCCNCCCCCCCO 2230a_100011996573_100000751147 [0,0,0,0,0,0|2,0,0]=2 2037 B12R0.5 CSCCNCCCCCCCO 2230a_100020590264_100000760002 [0,0,0,0,0,0|2,0,0]=2 2038 B12R0.5 CSCCNCCCCCCCO 34a_100011996573_100000212216 [0,0,0,0,0,0|2,0,0]=2 2039 B12R0.5 CSCCNCCCOCCCO 2230a_100011310245_100000751147 [0,0,0,0,0,0|3,0,0]=3 2040 B12R0.5 CSCCNCCCOCCCO 34a_100011310245_100000212216 [0,0,0,0,0,0|3,0,0]=3 2041 B12R0.5 CSCCOCCCCCCC#N 7a_100000230434_100009813337 [0,0,0,0,0,0|3,0,1]=4 2042 B12R0.5 CSCCOCCCCCCCBr 34a_100000760002_100000212216 [0,0,0,0,0,0|3,0,0]=3 2043 B12R0.5 CSCCOCCCCCCCBr 7a_100000760002_100000212216 [0,0,0,0,0,0|3,0,0]=3 2044 B12R0.5 CSCCOCCCCCCCN 34a_100011996573_100000212216 [0,0,0,0,0,0|3,0,0]=3 2045 B12R0.5 CSCCOCCCCCCCO 34a_100000230434_100000760002 [0,0,0,0,0,0|2,0,0]=2 2046 B12R0.5 CSCCOCCCCCCCO 7a_100000230434_100000760002 [0,0,0,0,0,0|2,0,0]=2 2047 B12R0.5 CSCCOCCCOCCCN 34a_100011310245_100000212216 [0,0,0,0,0,0|4,0,0]=4 2048 B12R0.5 CSCCSCCCCCCC#N 62a_100000212216_100009813337 [0,0,0,0,0,0|3,0,1]=4 2049 B12R0.5 CSCCSCCCCCCC#N 62a_100009813337_100000751147 [0,0,0,0,0,0|3,0,1]=4 2050 B12R0.5 CSCCSCCCCCCCO 62a_100000212216_100000760002 [0,0,0,0,0,0|2,0,0]=2 2051 B12R0.5 CSCCSCCCCCCCO 62a_100000760002_100000751147 [0,0,0,0,0,0|2,0,0]=2 2052 B12R0.5 CSCNCCCCCCCCO 2230a_102515433106_100011218213 [0,0,0,0,0,0|2,0,0]=2 2053 B12R0.5 CSCNCCCCCCCCO 34a_102515433106_100011218213 [0,0,0,0,0,0|2,0,0]=2 2054 B12R0.5 CSCNCCOCCOCCO 2230a_100011998139_100011218213 [0,0,0,0,0,0|4,0,0]=4 2055 B12R0.5 CSCNCCOCCOCCO 34a_100011998139_100011218213 [0,0,0,0,0,0|4,0,0]=4 2056 B12R0.5 CSCOCCCCCCCCBr 34a_100009813846_100011218213 [0,0,0,0,0,0|3,0,0]=3 2057 B12R0.5 CSCOCCCCCCCCCl 34a_100000033203_100011218213 [0,0,0,0,0,0|3,0,0]=3 2058 B12R0.5 CSCOCCCCCCCCN 34a_102515433106_100011218213 [0,0,0,0,0,0|3,0,0]=3 2059 B12R0.5 CSCOCCCCCNCCN 34a_103619048469_100011218213 [0,0,0,0,0,0|4,0,0]=4 2060 B12R0.5 CSCSCCCCCCCCO 62a_100000033203_100011218213 [0,0,0,0,0,0|2,0,0]=2 2061 B12R0.5 CSCSCCCCCCCCO 62a_100011218213_100000033203 [0,0,0,0,0,0|2,0,0]=2 2062 B12R0.5 CSCSCCOCCOCCO 62a_100000032323_100011218213 [0,0,0,0,0,0|4,0,0]=4 2063 B12R0.5 CSCSCCOCCOCCO 62a_100011218213_100000032323 [0,0,0,0,0,0|4,0,0]=4 2064 B12R0.5 FCCCCCCOCCCCBr 34a_100011216708_100015922095 [0,0,0,0,0,0|3,0,0]=3 2065 B12R0.5 FCCCCCCOCCCCCl 34a_100000210776_100015922095 [0,0,0,0,0,0|3,0,0]=3 2066 B12R0.5 FCCCCCCOCCCCCl 7a_100000210776_100015922095 [0,0,0,0,0,0|3,0,0]=3 2067 B12R0.5 FCCCCCCOCCCCF 34a_100000732779_100000729493 [0,0,0,0,0,0|3,0,0]=3 2068 B12R0.5 FCCCCCCOCCCCF 34a_100011995726_100015922095 [0,0,0,0,0,0|3,0,0]=3 2069 B12R0.5 FCCCCCCOCCCCF 7a_100000732779_100000729493 [0,0,0,0,0,0|3,0,0]=3 2070 B12R0.5 FCCCCCCOCCCCF 7a_100011995726_100015922095 [0,0,0,0,0,0|3,0,0]=3 2071 B12R0.5 FCCCCCCOCCCCI 34a_200012148704_100015922095 [0,0,0,0,0,0|3,0,0]=3 2072 B12R0.5 FCCCCCCSCCCCF 62a_100000729493_100015922095 [0,0,0,0,0,0|3,0,0]=3 2073 B12R0.5 FCCCCCCSCCCCF 62a_100015922095_100000729493 [0,0,0,0,0,0|3,0,0]=3 2074 B12R0.5 FCCCCCOCCCCCBr 34a_100000746331_100000729378 [0,0,0,0,0,0|3,0,0]=3 2075 B12R0.5 FCCCCCOCCCCCBr 7a_100000746331_100000729378 [0,0,0,0,0,0|3,0,0]=3 2076 B12R0.5 FCCCCCOCCCCCCl 34a_100000746330_100000729378 [0,0,0,0,0,0|3,0,0]=3 2077 B12R0.5 FCCCCCOCCCCCCl 7a_100000746330_100000729378 [0,0,0,0,0,0|3,0,0]=3 2078 B12R0.5 FCCCCCOCCCCCI 34a_200012148887_100000729378 [0,0,0,0,0,0|3,0,0]=3 2079 B12R0.5 FCCCCCOCCCCCI 7a_200012148887_100000729378 [0,0,0,0,0,0|3,0,0]=3 2080 B12R0.5 FCCCCCOCCOCCBr 34a_100000692535_100000729378 [0,0,0,0,0,0|4,0,0]=4 2081 B12R0.5 FCCCCCOCCOCCBr 7a_100000692535_100000729378 [0,0,0,0,0,0|4,0,0]=4 2082 B12R0.5 FCCCCCOCCOCCCl 34a_100011215305_100000729378 [0,0,0,0,0,0|4,0,0]=4 2083 B12R0.5 FCCCCCOCCOCCCl 7a_100011215305_100000729378 [0,0,0,0,0,0|4,0,0]=4 2084 B12R0.5 FCCCCCOCCOCCF 34a_200015357709_100000729378 [0,0,0,0,0,0|4,0,0]=4 2085 B12R0.5 FCCCCCOCCOCCF 7a_200015357709_100000729378 [0,0,0,0,0,0|4,0,0]=4 2086 B12R0.5 FCCCCCOCCOCCI 34a_100012149058_100000729378 [0,0,0,0,0,0|4,0,0]=4 2087 B12R0.5 FCCCCCOCCOCCI 7a_100012149058_100000729378 [0,0,0,0,0,0|4,0,0]=4 2088 B12R0.5 FCCCCCSCCCCCF 62a_100000729378_100000729378 [0,0,0,0,0,0|3,0,0]=3 2089 B12R0.5 FCCCCOCCCCCCBr 34a_100011215345_100000729493 [0,0,0,0,0,0|3,0,0]=3 2090 B12R0.5 FCCCCOCCCCCCBr 7a_100011215345_100000729493 [0,0,0,0,0,0|3,0,0]=3 2091 B12R0.5 FCCCCOCCCCCCCl 34a_100000766143_100000729493 [0,0,0,0,0,0|3,0,0]=3 2092 B12R0.5 FCCCCOCCCCCCCl 7a_100000766143_100000729493 [0,0,0,0,0,0|3,0,0]=3 2093 B12R0.5 FCCCOCCCCCCCBr 34a_100000760002_100011934791 [0,0,0,0,0,0|3,0,0]=3 2094 B12R0.5 FCCCOCCCCCCCBr 7a_100000760002_100011934791 [0,0,0,0,0,0|3,0,0]=3 2095 B12R0.5 FCCOCCCCCCCCBr 34a_100009813846_100011217306 [0,0,0,0,0,0|3,0,0]=3 2096 B12R0.5 FCCOCCCCCCCCBr 7a_100009813846_100011217306 [0,0,0,0,0,0|3,0,0]=3 2097 B12R0.5 FCCOCCCCCCCCCl 34a_100000033203_100011217306 [0,0,0,0,0,0|3,0,0]=3 2098 B12R0.5 FCCOCCCCCCCCCl 7a_100000033203_100011217306 [0,0,0,0,0,0|3,0,0]=3 2099 B12R0.5 FCOCCCCCCCCCBr 34a_100009813782_100015361967 [0,0,0,0,0,0|3,0,0]=3 2100 B12R0.5 FCOCCCCCCCCCBr 7a_100009813782_100015361967 [0,0,0,0,0,0|3,0,0]=3 2101 B12R0.5 FCOCCCCCCCCCCl 34a_100009868337_100015361967 [0,0,0,0,0,0|3,0,0]=3 2102 B12R0.5 FCOCCCCCCCCCCl 7a_100009868337_100015361967 [0,0,0,0,0,0|3,0,0]=3 2103 B12R0.5 N#CCCCCCCNCCCF 2230a_100015189416_100009813337 [0,0,0,0,0,0|3,0,1]=4 2104 B12R0.5 N#CCCCCCCSCCCF 62a_100009813337_100011934791 [0,0,0,0,0,0|3,0,1]=4 2105 B12R0.5 N#CCCCCCCSCCCF 62a_100011934791_100009813337 [0,0,0,0,0,0|3,0,1]=4 2106 B12R0.5 N#CCCCCCCSCCCO 62a_100009813337_100011215043 [0,0,0,0,0,0|2,0,1]=3 2107 B12R0.5 N#CCCCCCCSCCCO 62a_100011215043_100009813337 [0,0,0,0,0,0|2,0,1]=3 2108 B12R0.5 N#CCCCCCNCCCCO 2230a_100000750430_100009813376 [0,0,0,0,0,0|2,0,1]=3 2109 B12R0.5 N#CCCCCCOCCCCCl 7a_100000210776_100009813376 [0,0,0,0,0,0|3,0,1]=4 2110 B12R0.5 N#CCCCCCOCCCCF 7a_100011995726_100009813376 [0,0,0,0,0,0|3,0,1]=4 2111 B12R0.5 N#CCCCCCSCCCCF 62a_100000729493_100009813376 [0,0,0,0,0,0|3,0,1]=4 2112 B12R0.5 N#CCCCCCSCCCCF 62a_100009813376_100000729493 [0,0,0,0,0,0|3,0,1]=4 2113 B12R0.5 N#CCCCCCSCCCCO 62a_100000210776_100009813376 [0,0,0,0,0,0|2,0,1]=3 2114 B12R0.5 N#CCCCCCSCCCCO 62a_100009813376_100000210776 [0,0,0,0,0,0|2,0,1]=3 2115 B12R0.5 N#CCCCCNCCCCCO 2230a_100000762737_100000211819 [0,0,0,0,0,0|2,0,1]=3 2116 B12R0.5 N#CCCCCNCCOCCO 2230a_100000211614_100000211819 [0,0,0,0,0,0|3,0,1]=4 2117 B12R0.5 N#CCCCCNCCSCCO 2230a_100011219999_100000211819 [0,0,0,0,0,0|3,0,1]=4 2118 B12R0.5 N#CCCCCOCCCCCBr 7a_100000746331_100000211819 [0,0,0,0,0,0|3,0,1]=4 2119 B12R0.5 N#CCCCCOCCCCCCl 7a_100000746330_100000211819 [0,0,0,0,0,0|3,0,1]=4 2120 B12R0.5 N#CCCCCOCCCCCI 7a_200012148887_100000211819 [0,0,0,0,0,0|3,0,1]=4 2121 B12R0.5 N#CCCCCSCCCCCF 62a_100000729378_100000211819 [0,0,0,0,0,0|3,0,1]=4 2122 B12R0.5 N#CCCCCSCCCCCF 62a_100011219923_100000729378 [0,0,0,0,0,0|3,0,1]=4 2123 B12R0.5 N#CCCCCSCCCCCO 62a_100000746330_100000211819 [0,0,0,0,0,0|2,0,1]=3 2124 B12R0.5 N#CCCCCSCCCCCO 62a_100011219923_100000746330 [0,0,0,0,0,0|2,0,1]=3 2125 B12R0.5 N#CCCCCSCCOCCO 62a_100011215305_100000211819 [0,0,0,0,0,0|3,0,1]=4 2126 B12R0.5 N#CCCCCSCCOCCO 62a_100011219923_100011215305 [0,0,0,0,0,0|3,0,1]=4 2127 B12R0.5 N#CCCCNCCCCCCO 2230a_100000686447_100000687738 [0,0,0,0,0,0|2,0,1]=3 2128 B12R0.5 N#CCCCOCCCCCCBr 7a_100011215345_100000687738 [0,0,0,0,0,0|3,0,1]=4 2129 B12R0.5 N#CCCCOCCCCCCCl 7a_100000766143_100000687738 [0,0,0,0,0,0|3,0,1]=4 2130 B12R0.5 N#CCCCOCCCCCCF 7a_100000732779_100000687738 [0,0,0,0,0,0|3,0,1]=4 2131 B12R0.5 N#CCCCSCCCCCCF 62a_100000687738_100015922095 [0,0,0,0,0,0|3,0,1]=4 2132 B12R0.5 N#CCCCSCCCCCCF 62a_100015922095_100000687738 [0,0,0,0,0,0|3,0,1]=4 2133 B12R0.5 N#CCCCSCCCCCCO 62a_100000687738_100000766143 [0,0,0,0,0,0|2,0,1]=3 2134 B12R0.5 N#CCCCSCCCCCCO 62a_100000766143_100000687738 [0,0,0,0,0,0|2,0,1]=3 2135 B12R0.5 N#CCCNCCCCCCCO 2230a_100011996573_100011215226 [0,0,0,0,0,0|2,0,1]=3 2136 B12R0.5 N#CCCNCCCOCCCO 2230a_100011310245_100011215226 [0,0,0,0,0,0|3,0,1]=4 2137 B12R0.5 N#CCCOCCCCCCCBr 7a_100000760002_100000184422 [0,0,0,0,0,0|3,0,1]=4 2138 B12R0.5 N#CCCSCCCCCCCO 62a_100000760002_100011215226 [0,0,0,0,0,0|2,0,1]=3 2139 B12R0.5 N#CCCSCCCCCCCO 62a_100011215226_100000760002 [0,0,0,0,0,0|2,0,1]=3 2140 B12R0.5 N#CCNCCCCCCCCO 2230a_102515433106_100011215382 [0,0,0,0,0,0|2,0,1]=3 2141 B12R0.5 N#CCOCCCCCCCCBr 7a_100009813846_100011215382 [0,0,0,0,0,0|3,0,1]=4 2142 B12R0.5 N#CCOCCCCCCCCCl 7a_100000033203_100011215382 [0,0,0,0,0,0|3,0,1]=4 2143 B12R0.5 N#CCOCCNCCCCCO 2230a_100000762737_200000047693 [0,0,0,0,0,0|3,0,1]=4 2144 B12R0.5 N#CCOCCSCCCCCO 62a_100000746330_200000047693 [0,0,0,0,0,0|3,0,1]=4 2145 B12R0.5 N#CCOCCSCCCCCO 62a_200000047693_100000746330 [0,0,0,0,0,0|3,0,1]=4 2146 B12R0.5 N#CCSCCCCCCCCO 62a_100000033203_100011215382 [0,0,0,0,0,0|2,0,1]=3 2147 B12R0.5 N#CCSCCCCCCCCO 62a_100011215382_100000033203 [0,0,0,0,0,0|2,0,1]=3 2148 B12R0.5 N#CSCCSCCCCCCO 62a_100000034367_100000766143 [0,0,0,0,0,0|3,0,1]=4 2149 B12R0.5 N#CSCCSCCCCCCO 62a_100000766143_100000034367 [0,0,0,0,0,0|3,0,1]=4 2150 B12R0.5 N#CSCSCCCCCCCO 62a_100000211825_100000760002 [0,0,0,0,0,0|3,0,1]=4 2151 B12R0.5 N#CSCSCCCCCCCO 62a_100000760002_100000211825 [0,0,0,0,0,0|3,0,1]=4 2152 B12R0.5 NCCCCCCCCCOCF 34a_100000078944_100015361967 [0,0,0,0,0,0|3,0,0]=3 2153 B12R0.5 NCCCCCCCCOCC=O 34a_102515433106_200009817547 [0,0,0,0,0,0|2,0,2]=4 2154 B12R0.5 NCCCCCCCCOCCF 34a_102515433106_100011217306 [0,0,0,0,0,0|3,0,0]=3 2155 B12R0.5 NCCCCCCCCOCCO 34a_102515433106_100000211926 [0,0,0,0,0,0|2,0,0]=2 2156 B12R0.5 NCCCCCCCOCCCF 34a_100011996573_100011934791 [0,0,0,0,0,0|3,0,0]=3 2157 B12R0.5 NCCCCCCCOCCCO 34a_100011996573_100000230001 [0,0,0,0,0,0|2,0,0]=2 2158 B12R0.5 NCCCCCCOCC#CCO 34a_100000686447_200000047223 [0,0,0,0,0,0|2,0,2]=4 2159 B12R0.5 NCCCCCCOCCCCF 34a_100000686447_100000729493 [0,0,0,0,0,0|3,0,0]=3 2160 B12R0.5 NCCCCCCOCCCCO 34a_100000686447_100011216708 [0,0,0,0,0,0|2,0,0]=2 2161 B12R0.5 NCCCCCOCCCCCF 34a_100000762737_100000729378 [0,0,0,0,0,0|3,0,0]=3 2162 B12R0.5 NCCCCCOCCCCCO 34a_100000762737_100000746330 [0,0,0,0,0,0|2,0,0]=2 2163 B12R0.5 NCCCCCOCCOCCO 34a_100000762737_100000692535 [0,0,0,0,0,0|3,0,0]=3 2164 B12R0.5 NCCCCOCCCCCCF 34a_100000750430_100015922095 [0,0,0,0,0,0|3,0,0]=3 2165 B12R0.5 NCCCCOCCCCCCO 34a_100000750430_100000766143 [0,0,0,0,0,0|2,0,0]=2 2166 B12R0.5 NCCCOCCCCCCCO 34a_100000182051_100000760002 [0,0,0,0,0,0|2,0,0]=2 2167 B12R0.5 NCCCOCCCOCCCF 34a_100011310245_100011934791 [0,0,0,0,0,0|4,0,0]=4 2168 B12R0.5 NCCCOCCCOCCCO 34a_100011310245_100000230001 [0,0,0,0,0,0|3,0,0]=3 2169 B12R0.5 NCCNCCCCCOCCF 34a_103619048469_100011217306 [0,0,0,0,0,0|4,0,0]=4 2170 B12R0.5 NCCNCCCCCOCCO 34a_103619048469_100000211926 [0,0,0,0,0,0|3,0,0]=3 2171 B12R0.5 NCCOCCCCCCCCO 34a_100000210304_100000033203 [0,0,0,0,0,0|2,0,0]=2 2172 B12R0.5 NCCOCCOCCCCCF 34a_100000211614_100000729378 [0,0,0,0,0,0|4,0,0]=4 2173 B12R0.5 NCCOCCOCCCCCO 34a_100000211614_100000746330 [0,0,0,0,0,0|3,0,0]=3 2174 B12R0.5 NCCOCCOCCOCCO 34a_100000210304_100000032323 [0,0,0,0,0,0|4,0,0]=4 2175 B12R0.5 NCCOCCOCCOCCO 34a_100000211614_100000692535 [0,0,0,0,0,0|4,0,0]=4 2176 B12R0.5 NCCOCCOCCOCCO 34a_100011998139_100000211926 [0,0,0,0,0,0|4,0,0]=4 2177 B12R0.5 NOCCOCCCCCCCO 34a_100000700252_100000760002 [0,0,0,0,0,0|3,0,0]=3 2178 B12R0.5 O=CCCCCCNCCCCO 2230a_100000750430_100000139337 [0,0,0,0,0,0|2,0,1]=3 2179 B12R0.5 O=CCCCCCOCCCCCl 7a_100000210776_100000139337 [0,0,0,0,0,0|2,0,2]=4 2180 B12R0.5 O=CCCCCCOCCCCF 7a_100011995726_100000139337 [0,0,0,0,0,0|2,0,2]=4 2181 B12R0.5 O=CCCCCCSCCCCF 62a_100000139337_100000729493 [0,0,0,0,0,0|2,0,2]=4 2182 B12R0.5 O=CCCCCCSCCCCF 62a_100000729493_100000139337 [0,0,0,0,0,0|2,0,2]=4 2183 B12R0.5 O=CCCCCCSCCCCO 62a_100000139337_100000210776 [0,0,0,0,0,0|2,0,1]=3 2184 B12R0.5 O=CCCCCCSCCCCO 62a_100000210776_100000139337 [0,0,0,0,0,0|2,0,1]=3 2185 B12R0.5 O=CCCCCNCCCCCO 2230a_100000762737_100000139335 [0,0,0,0,0,0|2,0,1]=3 2186 B12R0.5 O=CCCCCNCCOCCO 2230a_100000211614_100000139335 [0,0,0,0,0,0|3,0,1]=4 2187 B12R0.5 O=CCCCCNCCSCCO 2230a_100011219999_100000139335 [0,0,0,0,0,0|3,0,1]=4 2188 B12R0.5 O=CCCCCOCCCCCBr 7a_100000746331_100000139335 [0,0,0,0,0,0|2,0,2]=4 2189 B12R0.5 O=CCCCCOCCCCCCl 7a_100000746330_100000139335 [0,0,0,0,0,0|2,0,2]=4 2190 B12R0.5 O=CCCCCOCCCCCI 7a_200012148887_100000139335 [0,0,0,0,0,0|2,0,2]=4 2191 B12R0.5 O=CCCCCSCCCCCF 62a_100000139335_100000729378 [0,0,0,0,0,0|2,0,2]=4 2192 B12R0.5 O=CCCCCSCCCCCF 62a_100000729378_100000139335 [0,0,0,0,0,0|2,0,2]=4 2193 B12R0.5 O=CCCCCSCCCCCO 62a_100000139335_100000746330 [0,0,0,0,0,0|2,0,1]=3 2194 B12R0.5 O=CCCCCSCCCCCO 62a_100000746330_100000139335 [0,0,0,0,0,0|2,0,1]=3 2195 B12R0.5 O=CCCCCSCCOCCO 62a_100000139335_100011215305 [0,0,0,0,0,0|3,0,1]=4 2196 B12R0.5 O=CCCCCSCCOCCO 62a_100011215305_100000139335 [0,0,0,0,0,0|3,0,1]=4 2197 B12R0.5 O=CCCCNCCCCCCO 2230a_100000686447_200011292268 [0,0,0,0,0,0|2,0,1]=3 2198 B12R0.5 O=CCCCOCCCCCCBr 7a_100011215345_200011292268 [0,0,0,0,0,0|2,0,2]=4 2199 B12R0.5 O=CCCCOCCCCCCCl 7a_100000766143_200011292268 [0,0,0,0,0,0|2,0,2]=4 2200 B12R0.5 O=CCCCOCCCCCCF 7a_100000732779_200011292268 [0,0,0,0,0,0|2,0,2]=4 2201 B12R0.5 O=CCCCSCCCCCCF 62a_100015922095_200011292268 [0,0,0,0,0,0|2,0,2]=4 2202 B12R0.5 O=CCCCSCCCCCCF 62a_200011292268_100015922095 [0,0,0,0,0,0|2,0,2]=4 2203 B12R0.5 O=CCCCSCCCCCCO 62a_100000766143_200011292268 [0,0,0,0,0,0|2,0,1]=3 2204 B12R0.5 O=CCCCSCCCCCCO 62a_200011292268_100000766143 [0,0,0,0,0,0|2,0,1]=3 2205 B12R0.5 O=CCNCCCCCCCCO 2230a_102515433106_200015260668 [0,0,0,0,0,0|2,0,1]=3 2206 B12R0.5 O=CCNCCCCCCCCO 34a_102515433106_200009817547 [0,0,0,0,0,0|2,0,1]=3 2207 B12R0.5 O=CCOCCCCCCCCBr 34a_100009813846_200009817547 [0,0,0,0,0,0|2,0,2]=4 2208 B12R0.5 O=CCOCCCCCCCCBr 7a_100009813846_200015260668 [0,0,0,0,0,0|2,0,2]=4 2209 B12R0.5 O=CCOCCCCCCCCCl 34a_100000033203_200009817547 [0,0,0,0,0,0|2,0,2]=4 2210 B12R0.5 O=CCOCCCCCCCCCl 7a_100000033203_200015260668 [0,0,0,0,0,0|2,0,2]=4 2211 B12R0.5 O=CCSCCCCCCCCO 62a_100000033203_200015260668 [0,0,0,0,0,0|2,0,1]=3 2212 B12R0.5 O=CCSCCCCCCCCO 62a_200015260668_100000033203 [0,0,0,0,0,0|2,0,1]=3 2213 B12R0.5 OCC#CCNCCCCCCO 2230a_100000686447_200000047223 [0,0,0,0,0,0|2,0,2]=4 2214 B12R0.5 OCC#CCNCCCCCCO 34a_100000686447_200000047223 [0,0,0,0,0,0|2,0,2]=4 2215 B12R0.5 OCC#CCOCCCCCCBr 34a_100011215345_200000047223 [0,0,0,0,0,0|2,0,2]=4 2216 B12R0.5 OCC#CCOCCCCCCBr 7a_100011215345_200000047223 [0,0,0,0,0,0|2,0,2]=4 2217 B12R0.5 OCC#CCOCCCCCCCl 34a_100000766143_200000047223 [0,0,0,0,0,0|2,0,2]=4 2218 B12R0.5 OCC#CCOCCCCCCCl 7a_100000766143_200000047223 [0,0,0,0,0,0|2,0,2]=4 2219 B12R0.5 OCC#CCOCCCCCCF 34a_100000732779_200000047223 [0,0,0,0,0,0|2,0,2]=4 2220 B12R0.5 OCC#CCOCCCCCCF 7a_100000732779_200000047223 [0,0,0,0,0,0|2,0,2]=4 2221 B12R0.5 OCC#CCSCCCCCCF 62a_100015922095_200000047223 [0,0,0,0,0,0|2,0,2]=4 2222 B12R0.5 OCC#CCSCCCCCCF 62a_200000047223_100015922095 [0,0,0,0,0,0|2,0,2]=4 2223 B12R0.5 OCC#CCSCCCCCCO 62a_100000766143_200000047223 [0,0,0,0,0,0|2,0,2]=4 2224 B12R0.5 OCC#CCSCCCCCCO 62a_200000047223_100000766143 [0,0,0,0,0,0|2,0,2]=4 2225 B12R0.5 OCCCCCCCCCNCF 34a_100000078944_100015361967 [0,0,0,0,0,0|2,0,0]=2 2226 B12R0.5 OCCCCCCCCCSCF 62a_100009813782_100015361967 [0,0,0,0,0,0|2,0,0]=2 2227 B12R0.5 OCCCCCCCCCSCF 62a_100015361967_100009813782 [0,0,0,0,0,0|2,0,0]=2 2228 B12R0.5 OCCCCCCCCNCCF 2230a_102515433106_100011217306 [0,0,0,0,0,0|2,0,0]=2 2229 B12R0.5 OCCCCCCCCNCCF 34a_100000724931_100000033203 [0,0,0,0,0,0|2,0,0]=2 2230 B12R0.5 OCCCCCCCCNCCF 34a_102515433106_100011217306 [0,0,0,0,0,0|2,0,0]=2 2231 B12R0.5 OCCCCCCCCNCCO 2230a_100016997473_100000033203 [0,0,0,0,0,0|2,0,0]=2 2232 B12R0.5 OCCCCCCCCNCCO 2230a_102515433106_100000211926 [0,0,0,0,0,0|2,0,0]=2 2233 B12R0.5 OCCCCCCCCNCCO 34a_100016990907_100000033203 [0,0,0,0,0,0|2,0,0]=2 2234 B12R0.5 OCCCCCCCCNCCO 34a_102515433106_100000211926 [0,0,0,0,0,0|2,0,0]=2 2235 B12R0.5 OCCCCCCCCOCCBr 34a_100000211926_100000033203 [0,0,0,0,0,0|2,0,0]=2 2236 B12R0.5 OCCCCCCCCSCCF 62a_100000033203_100011217306 [0,0,0,0,0,0|2,0,0]=2 2237 B12R0.5 OCCCCCCCCSCCF 62a_100011217306_100000033203 [0,0,0,0,0,0|2,0,0]=2 2238 B12R0.5 OCCCCCCCCSCCO 62a_100000033203_100000211926 [0,0,0,0,0,0|2,0,0]=2 2239 B12R0.5 OCCCCCCCCSCCO 62a_100000211926_100000033203 [0,0,0,0,0,0|2,0,0]=2 2240 B12R0.5 OCCCCCCCNCCCF 2230a_100011996573_100011934791 [0,0,0,0,0,0|2,0,0]=2 2241 B12R0.5 OCCCCCCCNCCCF 2230a_100015189416_100000760002 [0,0,0,0,0,0|2,0,0]=2 2242 B12R0.5 OCCCCCCCNCCCF 34a_100011996573_100011934791 [0,0,0,0,0,0|2,0,0]=2 2243 B12R0.5 OCCCCCCCNCCCF 34a_100015189416_100000760002 [0,0,0,0,0,0|2,0,0]=2 2244 B12R0.5 OCCCCCCCNCCCO 2230a_100011996573_100000230001 [0,0,0,0,0,0|2,0,0]=2 2245 B12R0.5 OCCCCCCCNCCCO 34a_100011996573_100000230001 [0,0,0,0,0,0|2,0,0]=2 2246 B12R0.5 OCCCCCCCOCCCBr 34a_100011217188_100000760002 [0,0,0,0,0,0|2,0,0]=2 2247 B12R0.5 OCCCCCCCOCCCCl 34a_100000230001_100000760002 [0,0,0,0,0,0|2,0,0]=2 2248 B12R0.5 OCCCCCCCOCCCF 34a_100000759539_100000760002 [0,0,0,0,0,0|2,0,0]=2 2249 B12R0.5 OCCCCCCCSCCCF 62a_100000760002_100011934791 [0,0,0,0,0,0|2,0,0]=2 2250 B12R0.5 OCCCCCCCSCCCF 62a_100011934791_100000760002 [0,0,0,0,0,0|2,0,0]=2 2251 B12R0.5 OCCCCCCCSCCCO 62a_100000760002_100011215043 [0,0,0,0,0,0|2,0,0]=2 2252 B12R0.5 OCCCCCCCSCCCO 62a_100011215043_100000760002 [0,0,0,0,0,0|2,0,0]=2 2253 B12R0.5 OCCCCCCNCCCCF 2230a_100000686447_100000729493 [0,0,0,0,0,0|2,0,0]=2 2254 B12R0.5 OCCCCCCNCCCCF 34a_100000686447_100000729493 [0,0,0,0,0,0|2,0,0]=2 2255 B12R0.5 OCCCCCCNCCCCO 2230a_100000686447_100000210776 [0,0,0,0,0,0|2,0,0]=2 2256 B12R0.5 OCCCCCCNCCCCO 2230a_100000750430_100000766143 [0,0,0,0,0,0|2,0,0]=2 2257 B12R0.5 OCCCCCCNCCCCO 34a_100000686447_100011216708 [0,0,0,0,0,0|2,0,0]=2 2258 B12R0.5 OCCCCCCNCCCCO 34a_100000750430_100000766143 [0,0,0,0,0,0|2,0,0]=2 2259 B12R0.5 OCCCCCCOCC#CCCl 34a_200000047223_100000766143 [0,0,0,0,0,0|2,0,2]=4 2260 B12R0.5 OCCCCCCOCCCCBr 34a_100011216708_100000766143 [0,0,0,0,0,0|2,0,0]=2 2261 B12R0.5 OCCCCCCOCCCCCl 34a_100000210776_100000766143 [0,0,0,0,0,0|2,0,0]=2 2262 B12R0.5 OCCCCCCOCCCCCl 7a_100000210776_100000766143 [0,0,0,0,0,0|2,0,0]=2 2263 B12R0.5 OCCCCCCOCCCCF 34a_100011995726_100000766143 [0,0,0,0,0,0|2,0,0]=2 2264 B12R0.5 OCCCCCCOCCCCF 7a_100011995726_100000766143 [0,0,0,0,0,0|2,0,0]=2 2265 B12R0.5 OCCCCCCOCCCCI 34a_200012148704_100000766143 [0,0,0,0,0,0|2,0,0]=2 2266 B12R0.5 OCCCCCCSCCCCF 62a_100000729493_100000766143 [0,0,0,0,0,0|2,0,0]=2 2267 B12R0.5 OCCCCCCSCCCCF 62a_100000766143_100000729493 [0,0,0,0,0,0|2,0,0]=2 2268 B12R0.5 OCCCCCCSCCCCO 62a_100000210776_100000766143 [0,0,0,0,0,0|2,0,0]=2 2269 B12R0.5 OCCCCCCSCCCCO 62a_100000766143_100000210776 [0,0,0,0,0,0|2,0,0]=2 2270 B12R0.5 OCCCCCNCCCCCF 2230a_100000762737_100000729378 [0,0,0,0,0,0|2,0,0]=2 2271 B12R0.5 OCCCCCNCCCCCF 34a_100000762737_100000729378 [0,0,0,0,0,0|2,0,0]=2 2272 B12R0.5 OCCCCCNCCCCCO 2230a_100000762737_100000746330 [0,0,0,0,0,0|2,0,0]=2 2273 B12R0.5 OCCCCCNCCCCCO 34a_100000762737_100000746330 [0,0,0,0,0,0|2,0,0]=2 2274 B12R0.5 OCCCCCNCCOCCO 2230a_100000211614_100000746330 [0,0,0,0,0,0|3,0,0]=3 2275 B12R0.5 OCCCCCNCCOCCO 2230a_100000762737_100011215305 [0,0,0,0,0,0|3,0,0]=3 2276 B12R0.5 OCCCCCNCCOCCO 34a_100000211614_100000746330 [0,0,0,0,0,0|3,0,0]=3 2277 B12R0.5 OCCCCCNCCOCCO 34a_100000762737_100000692535 [0,0,0,0,0,0|3,0,0]=3 2278 B12R0.5 OCCCCCNCCSCCO 2230a_100011219999_100000746330 [0,0,0,0,0,0|3,0,0]=3 2279 B12R0.5 OCCCCCOCCCCCBr 34a_100000746331_100000746330 [0,0,0,0,0,0|2,0,0]=2 2280 B12R0.5 OCCCCCOCCCCCBr 7a_100000746331_100000746330 [0,0,0,0,0,0|2,0,0]=2 2281 B12R0.5 OCCCCCOCCCCCCl 34a_100000746330_100000746330 [0,0,0,0,0,0|2,0,0]=2 2282 B12R0.5 OCCCCCOCCCCCCl 7a_100000746330_100000746330 [0,0,0,0,0,0|2,0,0]=2 2283 B12R0.5 OCCCCCOCCCCCI 34a_200012148887_100000746330 [0,0,0,0,0,0|2,0,0]=2 2284 B12R0.5 OCCCCCOCCCCCI 7a_200012148887_100000746330 [0,0,0,0,0,0|2,0,0]=2 2285 B12R0.5 OCCCCCOCCOCCBr 34a_100000692535_100000746330 [0,0,0,0,0,0|3,0,0]=3 2286 B12R0.5 OCCCCCOCCOCCBr 7a_100000692535_100000746330 [0,0,0,0,0,0|3,0,0]=3 2287 B12R0.5 OCCCCCOCCOCCCl 34a_100011215305_100000746330 [0,0,0,0,0,0|3,0,0]=3 2288 B12R0.5 OCCCCCOCCOCCCl 7a_100011215305_100000746330 [0,0,0,0,0,0|3,0,0]=3 2289 B12R0.5 OCCCCCOCCOCCF 34a_200015357709_100000746330 [0,0,0,0,0,0|3,0,0]=3 2290 B12R0.5 OCCCCCOCCOCCF 7a_200015357709_100000746330 [0,0,0,0,0,0|3,0,0]=3 2291 B12R0.5 OCCCCCOCCOCCI 34a_100012149058_100000746330 [0,0,0,0,0,0|3,0,0]=3 2292 B12R0.5 OCCCCCOCCOCCI 7a_100012149058_100000746330 [0,0,0,0,0,0|3,0,0]=3 2293 B12R0.5 OCCCCCSCCCCCF 62a_100000729378_100000746330 [0,0,0,0,0,0|2,0,0]=2 2294 B12R0.5 OCCCCCSCCCCCF 62a_100000746330_100000729378 [0,0,0,0,0,0|2,0,0]=2 2295 B12R0.5 OCCCCCSCCCCCO 62a_100000746330_100000746330 [0,0,0,0,0,0|2,0,0]=2 2296 B12R0.5 OCCCCCSCCOCCO 62a_100000746330_100011215305 [0,0,0,0,0,0|3,0,0]=3 2297 B12R0.5 OCCCCCSCCOCCO 62a_100011215305_100000746330 [0,0,0,0,0,0|3,0,0]=3 2298 B12R0.5 OCCCCNCCCCCCF 2230a_100000750430_100015922095 [0,0,0,0,0,0|2,0,0]=2 2299 B12R0.5 OCCCCNCCCCCCF 34a_100000750430_100015922095 [0,0,0,0,0,0|2,0,0]=2 2300 B12R0.5 OCCCCOCCCCCCBr 34a_100011215345_100011216708 [0,0,0,0,0,0|2,0,0]=2 2301 B12R0.5 OCCCCOCCCCCCBr 7a_100011215345_100000210776 [0,0,0,0,0,0|2,0,0]=2 2302 B12R0.5 OCCCCOCCCCCCCl 34a_100000766143_100011216708 [0,0,0,0,0,0|2,0,0]=2 2303 B12R0.5 OCCCCOCCCCCCCl 7a_100000766143_100000210776 [0,0,0,0,0,0|2,0,0]=2 2304 B12R0.5 OCCCCOCCCCCCF 34a_100000732779_100011216708 [0,0,0,0,0,0|2,0,0]=2 2305 B12R0.5 OCCCCOCCCCCCF 7a_100000732779_100000210776 [0,0,0,0,0,0|2,0,0]=2 2306 B12R0.5 OCCCCSCCCCCCF 62a_100000210776_100015922095 [0,0,0,0,0,0|2,0,0]=2 2307 B12R0.5 OCCCCSCCCCCCF 62a_100015922095_100000210776 [0,0,0,0,0,0|2,0,0]=2 2308 B12R0.5 OCCCNCCCOCCCO 2230a_100011310245_100000230001 [0,0,0,0,0,0|3,0,0]=3 2309 B12R0.5 OCCCNCCCOCCCO 34a_100011310245_100000230001 [0,0,0,0,0,0|3,0,0]=3 2310 B12R0.5 OCCCOCCCCCCCBr 34a_100000760002_100000230001 [0,0,0,0,0,0|2,0,0]=2 2311 B12R0.5 OCCCOCCCCCCCBr 7a_100000760002_100011215043 [0,0,0,0,0,0|2,0,0]=2 2312 B12R0.5 OCCCOCCCNCCCF 2230a_100011310245_100011934791 [0,0,0,0,0,0|3,0,0]=3 2313 B12R0.5 OCCCOCCCNCCCF 34a_100011310245_100011934791 [0,0,0,0,0,0|3,0,0]=3 2314 B12R0.5 OCCNCCOCCOCCO 2230a_100011998139_100000211926 [0,0,0,0,0,0|4,0,0]=4 2315 B12R0.5 OCCNCCOCCOCCO 2230a_100016997473_100000032323 [0,0,0,0,0,0|4,0,0]=4 2316 B12R0.5 OCCNCCOCCOCCO 34a_100011998139_100000211926 [0,0,0,0,0,0|4,0,0]=4 2317 B12R0.5 OCCNCCOCCOCCO 34a_100016990907_100000032323 [0,0,0,0,0,0|4,0,0]=4 2318 B12R0.5 OCCOCCCCCCCCBr 34a_100009813846_100000211926 [0,0,0,0,0,0|2,0,0]=2 2319 B12R0.5 OCCOCCCCCCCCBr 7a_100009813846_100000211926 [0,0,0,0,0,0|2,0,0]=2 2320 B12R0.5 OCCOCCCCCCCCCl 34a_100000033203_100000211926 [0,0,0,0,0,0|2,0,0]=2 2321 B12R0.5 OCCOCCCCCCCCCl 7a_100000033203_100000211926 [0,0,0,0,0,0|2,0,0]=2 2322 B12R0.5 OCCOCCNCCCCCF 2230a_100000211614_100000729378 [0,0,0,0,0,0|3,0,0]=3 2323 B12R0.5 OCCOCCNCCCCCF 34a_100000211614_100000729378 [0,0,0,0,0,0|3,0,0]=3 2324 B12R0.5 OCCOCCNCCOCCO 2230a_100000211614_100011215305 [0,0,0,0,0,0|4,0,0]=4 2325 B12R0.5 OCCOCCNCCOCCO 34a_100000211614_100000692535 [0,0,0,0,0,0|4,0,0]=4 2326 B12R0.5 OCCOCCNCCSCCO 2230a_100011219999_100011215305 [0,0,0,0,0,0|4,0,0]=4 2327 B12R0.5 OCCOCCOCCCCCBr 34a_100000746331_100000692535 [0,0,0,0,0,0|3,0,0]=3 2328 B12R0.5 OCCOCCOCCCCCBr 7a_100000746331_100011215305 [0,0,0,0,0,0|3,0,0]=3 2329 B12R0.5 OCCOCCOCCCCCCl 34a_100000746330_100000692535 [0,0,0,0,0,0|3,0,0]=3 2330 B12R0.5 OCCOCCOCCCCCCl 7a_100000746330_100011215305 [0,0,0,0,0,0|3,0,0]=3 2331 B12R0.5 OCCOCCOCCCCCI 34a_200012148887_100000692535 [0,0,0,0,0,0|3,0,0]=3 2332 B12R0.5 OCCOCCOCCCCCI 7a_200012148887_100011215305 [0,0,0,0,0,0|3,0,0]=3 2333 B12R0.5 OCCOCCOCCCNCF 34a_100011996194_100015361967 [0,0,0,0,0,0|4,0,0]=4 2334 B12R0.5 OCCOCCOCCNCCF 2230a_100011998139_100011217306 [0,0,0,0,0,0|4,0,0]=4 2335 B12R0.5 OCCOCCOCCNCCF 34a_100000724931_100000032323 [0,0,0,0,0,0|4,0,0]=4 2336 B12R0.5 OCCOCCOCCNCCF 34a_100011998139_100011217306 [0,0,0,0,0,0|4,0,0]=4 2337 B12R0.5 OCCOCCOCCOCCBr 34a_100000211926_100000032323 [0,0,0,0,0,0|4,0,0]=4 2338 B12R0.5 OCCOCCOCCOCCBr 34a_100000692535_100000692535 [0,0,0,0,0,0|4,0,0]=4 2339 B12R0.5 OCCOCCOCCOCCBr 34a_100010132937_100000211926 [0,0,0,0,0,0|4,0,0]=4 2340 B12R0.5 OCCOCCOCCOCCBr 7a_100000692535_100011215305 [0,0,0,0,0,0|4,0,0]=4 2341 B12R0.5 OCCOCCOCCOCCBr 7a_100010132937_100000211926 [0,0,0,0,0,0|4,0,0]=4 2342 B12R0.5 OCCOCCOCCOCCCl 34a_100000032323_100000211926 [0,0,0,0,0,0|4,0,0]=4 2343 B12R0.5 OCCOCCOCCOCCCl 34a_100011215305_100000692535 [0,0,0,0,0,0|4,0,0]=4 2344 B12R0.5 OCCOCCOCCOCCCl 7a_100000032323_100000211926 [0,0,0,0,0,0|4,0,0]=4 2345 B12R0.5 OCCOCCOCCOCCCl 7a_100011215305_100011215305 [0,0,0,0,0,0|4,0,0]=4 2346 B12R0.5 OCCOCCOCCOCCF 34a_200015357709_100000692535 [0,0,0,0,0,0|4,0,0]=4 2347 B12R0.5 OCCOCCOCCOCCF 7a_200015357709_100011215305 [0,0,0,0,0,0|4,0,0]=4 2348 B12R0.5 OCCOCCOCCOCCI 34a_100012149058_100000692535 [0,0,0,0,0,0|4,0,0]=4 2349 B12R0.5 OCCOCCOCCOCCI 7a_100012149058_100011215305 [0,0,0,0,0,0|4,0,0]=4 2350 B12R0.5 OCCOCCOCCSCCF 62a_100000032323_100011217306 [0,0,0,0,0,0|4,0,0]=4 2351 B12R0.5 OCCOCCOCCSCCF 62a_100011217306_100000032323 [0,0,0,0,0,0|4,0,0]=4 2352 B12R0.5 OCCOCCOCCSCCO 62a_100000032323_100000211926 [0,0,0,0,0,0|4,0,0]=4 2353 B12R0.5 OCCOCCOCCSCCO 62a_100000211926_100000032323 [0,0,0,0,0,0|4,0,0]=4 2354 B12R0.5 OCCOCCSCCCCCF 62a_100000729378_100011215305 [0,0,0,0,0,0|3,0,0]=3 2355 B12R0.5 OCCOCCSCCCCCF 62a_100011215305_100000729378 [0,0,0,0,0,0|3,0,0]=3 2356 B12R0.5 OCCOCCSCCOCCO 62a_100011215305_100011215305 [0,0,0,0,0,0|4,0,0]=4 2357 B12R0.5 OCCSCCNCCCCCF 2230a_100011219999_100000729378 [0,0,0,0,0,0|3,0,0]=3 2358 B12R0.5 [13CH3]NCCCCCCCCCCO 2230a_100000066964_200025704644 [0,0,0,0,0,0|1,0,0]=1 2359 B12R0.5 [13CH3]NCCCCCCCCCCO 34a_100000066964_200025704644 [0,0,0,0,0,0|1,0,0]=1 2360 B12R0.5 [13CH3]OCCCCCCCCCCBr 34a_100009813290_200025704644 [0,0,0,0,0,0|2,0,0]=2 2361 B12R0.5 [13CH3]OCCCCCCCCCCBr 7a_100009813290_200025704644 [0,0,0,0,0,0|2,0,0]=2 2362 B12R0.5 [13CH3]OCCCCCCCCCCCl 34a_200000033068_200025704644 [0,0,0,0,0,0|2,0,0]=2 2363 B12R0.5 [13CH3]OCCCCCCCCCCCl 7a_200000033068_200025704644 [0,0,0,0,0,0|2,0,0]=2 2364 B12R0.5 [13CH3]OCCCCCCCCCCN 34a_100000066964_200025704644 [0,0,0,0,0,0|2,0,0]=2 2365 B12R0.5 [13CH3]SCCCCCCCCCCO 62a_100009813290_200025704644 [0,0,0,0,0,0|1,0,0]=1 2366 B12R0.5 [13CH3]SCCCCCCCCCCO 62a_200025704644_200000033068 [0,0,0,0,0,0|1,0,0]=1 2367 B12R0.5 [N-]=[N+]=NCCCCCCNCCO 2230a_200000049180_100000211926 [0,0,0,0,0,0|4,0,0]=4 2368 B12R0.5 [N-]=[N+]=NCCCCNCCCCO 2230a_100000101370_100000210776 [0,0,0,0,0,0|4,0,0]=4 2369 B12R0.5 [N-]=[N+]=NCCCNCCCCCO 2230a_100000744732_100000746330 [0,0,0,0,0,0|4,0,0]=4 2370 B11R0.3 C#CCCCCCCCCOC 34a_100000065265_200000210301 [1,0,0,0,0,0|1,0,2]=4 2371 B11R0.3 C#CCCCCCCCCOC 7a_100000065265_200000210301 [1,0,0,0,0,0|1,0,2]=4 2372 B11R0.3 C#CCCCCCCCCO[13CH3] 34a_100000065265_200025704644 [1,0,0,0,0,0|1,0,2]=4 2373 B11R0.3 C#CCCCCCCCCO[13CH3] 7a_100000065265_200025704644 [1,0,0,0,0,0|1,0,2]=4 2374 B11R0.3 C#CCCCCCCCNCC 2230a_100015525214_100153394163 [1,0,0,0,0,0|1,0,2]=4 2375 B11R0.3 C#CCCCCCCCOCC 34a_100000054614_100000210202 [1,0,0,0,0,0|1,0,2]=4 2376 B11R0.3 C#CCCCCCCCOCC 34a_100121572206_100153394163 [1,0,0,0,0,0|1,0,2]=4 2377 B11R0.3 C#CCCCCCCCOCC 7a_100000054614_100000210202 [1,0,0,0,0,0|1,0,2]=4 2378 B11R0.3 C#CCCCCCCCSCC 62a_100000210202_100153394163 [1,0,0,0,0,0|1,0,2]=4 2379 B11R0.3 C#CCCCCCCCSCC 62a_100153394163_100000210202 [1,0,0,0,0,0|1,0,2]=4 2380 B11R0.3 C#CCCCCCCNCCO 2230a_100016997473_100012276617 [1,0,0,0,0,0|1,0,2]=4 2381 B11R0.3 C#CCCCCCCNCCO 34a_100016990907_100012276617 [1,0,0,0,0,0|1,0,2]=4 2382 B11R0.3 C#CCCCCCCOCCC 34a_100000210258_100012276617 [1,0,0,0,0,0|1,0,2]=4 2383 B11R0.3 C#CCCCCCCOCCC 34a_100011217361_100000210303 [1,0,0,0,0,0|1,0,2]=4 2384 B11R0.3 C#CCCCCCCOCCC 7a_100011217361_100000210303 [1,0,0,0,0,0|1,0,2]=4 2385 B11R0.3 C#CCCCCCCOCCO 34a_100011217361_100000211926 [1,0,0,0,0,0|1,0,2]=4 2386 B11R0.3 C#CCCCCCCOCCO 7a_100011217361_100000211926 [1,0,0,0,0,0|1,0,2]=4 2387 B11R0.3 C#CCCCCCCSCCC 62a_100000210303_100012276617 [1,0,0,0,0,0|1,0,2]=4 2388 B11R0.3 C#CCCCCCCSCCC 62a_100012276617_100000210303 [1,0,0,0,0,0|1,0,2]=4 2389 B11R0.3 C#CCCCCCCSCCO 62a_100000211926_100012276617 [1,0,0,0,0,0|1,0,2]=4 2390 B11R0.3 C#CCCCCCCSCCO 62a_100012276617_100000211926 [1,0,0,0,0,0|1,0,2]=4 2391 B11R0.3 C#CCCCCCNCCCC 2230a_100000102301_100012094781 [1,0,0,0,0,0|1,0,2]=4 2392 B11R0.3 C#CCCCCCNCCCC 7a_106832991798_100012094781 [1,0,0,0,0,0|1,0,2]=4 2393 B11R0.3 C#CCCCCCOCCCC 34a_100000210227_100012094781 [1,0,0,0,0,0|1,0,2]=4 2394 B11R0.3 C#CCCCCCOCCCC 34a_100000766912_100000210210 [1,0,0,0,0,0|1,0,2]=4 2395 B11R0.3 C#CCCCCCOCCCC 7a_100000210227_100012094781 [1,0,0,0,0,0|1,0,2]=4 2396 B11R0.3 C#CCCCCCOCCCC 7a_100000766912_100000210211 [1,0,0,0,0,0|1,0,2]=4 2397 B11R0.3 C#CCCCCCOCCCO 34a_100000766912_100000230001 [1,0,0,0,0,0|1,0,2]=4 2398 B11R0.3 C#CCCCCCOCCCO 7a_100000766912_100011215043 [1,0,0,0,0,0|1,0,2]=4 2399 B11R0.3 C#CCCCCCSCCCC 62a_100000210211_100012094781 [1,0,0,0,0,0|1,0,2]=4 2400 B11R0.3 C#CCCCCCSCCCC 62a_100012094781_100000210210 [1,0,0,0,0,0|1,0,2]=4 2401 B11R0.3 C#CCCCCCSCCCO 62a_100011215043_100012094781 [1,0,0,0,0,0|1,0,2]=4 2402 B11R0.3 C#CCCCCCSCCCO 62a_100012094781_100011215043 [1,0,0,0,0,0|1,0,2]=4 2403 B11R0.3 C#CCCCCNCCCCC 2230a_100000209983_100010269958 [1,0,0,0,0,0|1,0,2]=4 2404 B11R0.3 C#CCCCCNCCCCC 2230a_100000706060_100000210326 [1,0,0,0,0,0|1,0,2]=4 2405 B11R0.3 C#CCCCCNCCCCC 34a_100000706060_100000718602 [1,0,0,0,0,0|1,0,2]=4 2406 B11R0.3 C#CCCCCNCCCCO 2230a_100000706060_100000210776 [1,0,0,0,0,0|1,0,2]=4 2407 B11R0.3 C#CCCCCNCCCCO 2230a_100000750430_100010269958 [1,0,0,0,0,0|1,0,2]=4 2408 B11R0.3 C#CCCCCNCCCCO 34a_100000706060_100011216708 [1,0,0,0,0,0|1,0,2]=4 2409 B11R0.3 C#CCCCCNCCCCO 34a_100000750430_100010269958 [1,0,0,0,0,0|1,0,2]=4 2410 B11R0.3 C#CCCCCOCCCCC 34a_100000210253_100010269958 [1,0,0,0,0,0|1,0,2]=4 2411 B11R0.3 C#CCCCCOCCCCC 34a_100000766709_100000718602 [1,0,0,0,0,0|1,0,2]=4 2412 B11R0.3 C#CCCCCOCCCCC 7a_100000210253_100010269958 [1,0,0,0,0,0|1,0,2]=4 2413 B11R0.3 C#CCCCCOCCCCC 7a_100000766709_100000210326 [1,0,0,0,0,0|1,0,2]=4 2414 B11R0.3 C#CCCCCOCCCCO 34a_100000766709_100011216708 [1,0,0,0,0,0|1,0,2]=4 2415 B11R0.3 C#CCCCCOCCCCO 7a_100000766709_100000210776 [1,0,0,0,0,0|1,0,2]=4 2416 B11R0.3 C#CCCCCSCCCCC 62a_100000210326_100010269958 [1,0,0,0,0,0|1,0,2]=4 2417 B11R0.3 C#CCCCCSCCCCC 62a_100010269958_100000210326 [1,0,0,0,0,0|1,0,2]=4 2418 B11R0.3 C#CCCCCSCCCCO 62a_100000210776_100010269958 [1,0,0,0,0,0|1,0,2]=4 2419 B11R0.3 C#CCCCCSCCCCO 62a_100010269958_100000210776 [1,0,0,0,0,0|1,0,2]=4 2420 B11R0.3 C#CCCCNCCCCCC 2230a_100000210581_100000731252 [1,0,0,0,0,0|1,0,2]=4 2421 B11R0.3 C#CCCCNCCCCCC 34a_100000718082_100000210314 [1,0,0,0,0,0|1,0,2]=4 2422 B11R0.3 C#CCCCNCCCCCO 2230a_100000762737_100000731252 [1,0,0,0,0,0|1,0,2]=4 2423 B11R0.3 C#CCCCNCCCCCO 34a_100000718082_100000746330 [1,0,0,0,0,0|1,0,2]=4 2424 B11R0.3 C#CCCCNCCCCCO 34a_100000762737_100000695029 [1,0,0,0,0,0|1,0,2]=4 2425 B11R0.3 C#CCCCOCCCCCC 34a_100000210259_100000695029 [1,0,0,0,0,0|1,0,2]=4 2426 B11R0.3 C#CCCCOCCCCCC 34a_100000215630_100000210314 [1,0,0,0,0,0|1,0,2]=4 2427 B11R0.3 C#CCCCOCCCCCC 7a_100000210259_100011215417 [1,0,0,0,0,0|1,0,2]=4 2428 B11R0.3 C#CCCCOCCCCCC 7a_100000215630_100000210314 [1,0,0,0,0,0|1,0,2]=4 2429 B11R0.3 C#CCCCOCCCCCO 34a_100000215630_100000746330 [1,0,0,0,0,0|1,0,2]=4 2430 B11R0.3 C#CCCCOCCCCCO 7a_100000215630_100000746330 [1,0,0,0,0,0|1,0,2]=4 2431 B11R0.3 C#CCCCSCCCCCC 62a_100000210314_100011215417 [1,0,0,0,0,0|1,0,2]=4 2432 B11R0.3 C#CCCCSCCCCCC 62a_100011215417_100000210757 [1,0,0,0,0,0|1,0,2]=4 2433 B11R0.3 C#CCCCSCCCCCO 62a_100000746330_100011215417 [1,0,0,0,0,0|1,0,2]=4 2434 B11R0.3 C#CCCCSCCCCCO 62a_100011215417_100000746330 [1,0,0,0,0,0|1,0,2]=4 2435 B11R0.3 C#CCCNCCCCCCC 2230a_100000229938_100000688953 [1,0,0,0,0,0|1,0,2]=4 2436 B11R0.3 C#CCCNCCCCCCC 34a_100000755551_100000210614 [1,0,0,0,0,0|1,0,2]=4 2437 B11R0.3 C#CCCNCCCCCCO 2230a_100000686447_100000688953 [1,0,0,0,0,0|1,0,2]=4 2438 B11R0.3 C#CCCNCCCCCCO 34a_100000686447_100000688953 [1,0,0,0,0,0|1,0,2]=4 2439 B11R0.3 C#CCCNCCCCCCO 34a_100000755551_100000766143 [1,0,0,0,0,0|1,0,2]=4 2440 B11R0.3 C#CCCOCCCCCCC 34a_100000210272_100000688953 [1,0,0,0,0,0|1,0,2]=4 2441 B11R0.3 C#CCCOCCCCCCC 34a_100011215631_100000210614 [1,0,0,0,0,0|1,0,2]=4 2442 B11R0.3 C#CCCOCCCCCCC 7a_100000210272_100000688953 [1,0,0,0,0,0|1,0,2]=4 2443 B11R0.3 C#CCCOCCCCCCO 34a_100011215631_100000766143 [1,0,0,0,0,0|1,0,2]=4 2444 B11R0.3 C#CCCSCCCCCCC 62a_100000210614_100000688953 [1,0,0,0,0,0|1,0,2]=4 2445 B11R0.3 C#CCCSCCCCCCC 62a_100000688953_100000210316 [1,0,0,0,0,0|1,0,2]=4 2446 B11R0.3 C#CCCSCCCCCCO 62a_100000688953_100000766143 [1,0,0,0,0,0|1,0,2]=4 2447 B11R0.3 C#CCCSCCCCCCO 62a_100000766143_100000688953 [1,0,0,0,0,0|1,0,2]=4 2448 B11R0.3 C#CCNCCCCCCCC 2230a_100000229939_100000038162 [1,0,0,0,0,0|1,0,2]=4 2449 B11R0.3 C#CCNCCCCCCCC 34a_100000212058_100000210759 [1,0,0,0,0,0|1,0,2]=4 2450 B11R0.3 C#CCNCCCCCCCC 34a_100000229939_100000184674 [1,0,0,0,0,0|1,0,2]=4 2451 B11R0.3 C#CCNCCCCCCCO 2230a_100011996573_100000038162 [1,0,0,0,0,0|1,0,2]=4 2452 B11R0.3 C#CCNCCCCCCCO 34a_100000212058_100000760002 [1,0,0,0,0,0|1,0,2]=4 2453 B11R0.3 C#CCNCCCCCCCO 34a_100011996573_100000184674 [1,0,0,0,0,0|1,0,2]=4 2454 B11R0.3 C#CCOCCCCCCCC 34a_100000210232_100000184674 [1,0,0,0,0,0|1,0,2]=4 2455 B11R0.3 C#CCOCCCCCCCC 34a_100000210247_100000210759 [1,0,0,0,0,0|1,0,2]=4 2456 B11R0.3 C#CCOCCCCCCCC 7a_100000210232_100000038162 [1,0,0,0,0,0|1,0,2]=4 2457 B11R0.3 C#CCOCCCCCCCO 34a_100000210247_100000760002 [1,0,0,0,0,0|1,0,2]=4 2458 B11R0.3 C#CCSCCCCCCCC 62a_100000038162_100000210317 [1,0,0,0,0,0|1,0,2]=4 2459 B11R0.3 C#CCSCCCCCCCO 62a_100000038162_100000760002 [1,0,0,0,0,0|1,0,2]=4 2460 B11R0.3 C/C=C/CCOCCCCCC 34a_100016278192_100000210314 [1,0,0,0,0,0|1,0,2]=4 2461 B11R0.3 C/C=C/CCOCCCCCO 34a_100016278192_100000746330 [1,0,0,0,0,0|1,0,2]=4 2462 B11R0.3 C/C=C/CNCCCCCCO 34a_100000686447_100102629194 [1,0,0,0,0,0|1,0,2]=4 2463 B11R0.3 C/C=C/COCCCCCCC 34a_100000210272_100102629194 [1,0,0,0,0,0|1,0,2]=4 2464 B11R0.3 C/C=C/COCCCCCCC 34a_100016270725_100000210614 [1,0,0,0,0,0|1,0,2]=4 2465 B11R0.3 C/C=C/COCCCCCCC 7a_100000210272_100102629194 [1,0,0,0,0,0|1,0,2]=4 2466 B11R0.3 C/C=C/COCCCCCCO 34a_100016270725_100000766143 [1,0,0,0,0,0|1,0,2]=4 2467 B11R0.3 C/C=C/CSCCCCCCC 62a_100000210614_100102629194 [1,0,0,0,0,0|1,0,2]=4 2468 B11R0.3 C/C=C/CSCCCCCCC 62a_100102629194_100000210316 [1,0,0,0,0,0|1,0,2]=4 2469 B11R0.3 C/C=C/CSCCCCCCO 62a_100000766143_100102629194 [1,0,0,0,0,0|1,0,2]=4 2470 B11R0.3 C/C=C/CSCCCCCCO 62a_100102629194_100000766143 [1,0,0,0,0,0|1,0,2]=4 2471 B11R0.3 C=CCCCCCCCCNC 2230a_106832991635_100011933949 [1,0,0,0,0,0|1,0,2]=4 2472 B11R0.3 C=CCCCCCCCCNC 34a_100102657272_100011933949 [1,0,0,0,0,0|1,0,2]=4 2473 B11R0.3 C=CCCCCCCCCNC 7a_106832991635_100011933949 [1,0,0,0,0,0|1,0,2]=4 2474 B11R0.3 C=CCCCCCCCCOC 34a_100011215194_200000210301 [1,0,0,0,0,0|1,0,2]=4 2475 B11R0.3 C=CCCCCCCCCOC 34a_100138415774_100011933949 [1,0,0,0,0,0|1,0,2]=4 2476 B11R0.3 C=CCCCCCCCCOC 7a_100011215194_200000210301 [1,0,0,0,0,0|1,0,2]=4 2477 B11R0.3 C=CCCCCCCCCO[13CH3] 34a_100011215194_200025704644 [1,0,0,0,0,0|1,0,2]=4 2478 B11R0.3 C=CCCCCCCCCO[13CH3] 7a_100011215194_200025704644 [1,0,0,0,0,0|1,0,2]=4 2479 B11R0.3 C=CCCCCCCCCSC 62a_100011933949_200000210301 [1,0,0,0,0,0|1,0,2]=4 2480 B11R0.3 C=CCCCCCCCCSC 62a_200000210301_100011933949 [1,0,0,0,0,0|1,0,2]=4 2481 B11R0.3 C=CCCCCCCCCS[13CH3] 62a_100011933949_200025704644 [1,0,0,0,0,0|1,0,2]=4 2482 B11R0.3 C=CCCCCCCCCS[13CH3] 62a_200025704644_100011933949 [1,0,0,0,0,0|1,0,2]=4 2483 B11R0.3 C=CCCCCCCCNCC 2230a_100015525214_100012355270 [1,0,0,0,0,0|1,0,2]=4 2484 B11R0.3 C=CCCCCCCCOCC 34a_100000730831_100000210202 [1,0,0,0,0,0|1,0,2]=4 2485 B11R0.3 C=CCCCCCCCOCC 34a_100121572206_100012355270 [1,0,0,0,0,0|1,0,2]=4 2486 B11R0.3 C=CCCCCCCCOCC 7a_100000730831_100000210202 [1,0,0,0,0,0|1,0,2]=4 2487 B11R0.3 C=CCCCCCCCSCC 62a_100000210202_100012355270 [1,0,0,0,0,0|1,0,2]=4 2488 B11R0.3 C=CCCCCCCCSCC 62a_100012355270_100000210202 [1,0,0,0,0,0|1,0,2]=4 2489 B11R0.3 C=CCCCCCCNCCO 2230a_100016997473_100011215473 [1,0,0,0,0,0|1,0,2]=4 2490 B11R0.3 C=CCCCCCCNCCO 34a_100016990907_100011215473 [1,0,0,0,0,0|1,0,2]=4 2491 B11R0.3 C=CCCCCCCOCCC 34a_100000210258_100011215473 [1,0,0,0,0,0|1,0,2]=4 2492 B11R0.3 C=CCCCCCCOCCC 34a_200011216477_100000210303 [1,0,0,0,0,0|1,0,2]=4 2493 B11R0.3 C=CCCCCCCOCCC 7a_200011216477_100000210303 [1,0,0,0,0,0|1,0,2]=4 2494 B11R0.3 C=CCCCCCCOCCO 34a_200011216477_100000211926 [1,0,0,0,0,0|1,0,2]=4 2495 B11R0.3 C=CCCCCCCOCCO 7a_200011216477_100000211926 [1,0,0,0,0,0|1,0,2]=4 2496 B11R0.3 C=CCCCCCCSCCC 62a_100000210303_100011215473 [1,0,0,0,0,0|1,0,2]=4 2497 B11R0.3 C=CCCCCCCSCCC 62a_100011215473_100000210303 [1,0,0,0,0,0|1,0,2]=4 2498 B11R0.3 C=CCCCCCCSCCO 62a_100000211926_100011215473 [1,0,0,0,0,0|1,0,2]=4 2499 B11R0.3 C=CCCCCCCSCCO 62a_100011215473_100000211926 [1,0,0,0,0,0|1,0,2]=4 2500 B11R0.3 C=CCCCCCNCCCC 2230a_100000102301_100000700193 [1,0,0,0,0,0|1,0,2]=4 2501 B11R0.3 C=CCCCCCNCCCC 7a_106832991798_100000700193 [1,0,0,0,0,0|1,0,2]=4 2502 B11R0.3 C=CCCCCCOCCCC 34a_100000210227_100000700193 [1,0,0,0,0,0|1,0,2]=4 2503 B11R0.3 C=CCCCCCOCCCC 34a_100011216702_100000210210 [1,0,0,0,0,0|1,0,2]=4 2504 B11R0.3 C=CCCCCCOCCCC 7a_100000210227_100000700193 [1,0,0,0,0,0|1,0,2]=4 2505 B11R0.3 C=CCCCCCOCCCC 7a_100011216702_100000210211 [1,0,0,0,0,0|1,0,2]=4 2506 B11R0.3 C=CCCCCCOCCCO 34a_100011216702_100000230001 [1,0,0,0,0,0|1,0,2]=4 2507 B11R0.3 C=CCCCCCOCCCO 7a_100011216702_100011215043 [1,0,0,0,0,0|1,0,2]=4 2508 B11R0.3 C=CCCCCCSCCCC 62a_100000210211_100000700193 [1,0,0,0,0,0|1,0,2]=4 2509 B11R0.3 C=CCCCCCSCCCC 62a_100000700193_100000210210 [1,0,0,0,0,0|1,0,2]=4 2510 B11R0.3 C=CCCCCCSCCCO 62a_100000700193_100011215043 [1,0,0,0,0,0|1,0,2]=4 2511 B11R0.3 C=CCCCCCSCCCO 62a_100011215043_100000700193 [1,0,0,0,0,0|1,0,2]=4 2512 B11R0.3 C=CCCCCNCCCCC 2230a_100000209983_100011215482 [1,0,0,0,0,0|1,0,2]=4 2513 B11R0.3 C=CCCCCNCCCCC 2230a_100000703577_100000210326 [1,0,0,0,0,0|1,0,2]=4 2514 B11R0.3 C=CCCCCNCCCCC 34a_100000703577_100000718602 [1,0,0,0,0,0|1,0,2]=4 2515 B11R0.3 C=CCCCCNCCCCO 2230a_100000703577_100000210776 [1,0,0,0,0,0|1,0,2]=4 2516 B11R0.3 C=CCCCCNCCCCO 2230a_100000750430_100011215482 [1,0,0,0,0,0|1,0,2]=4 2517 B11R0.3 C=CCCCCNCCCCO 34a_100000703577_100011216708 [1,0,0,0,0,0|1,0,2]=4 2518 B11R0.3 C=CCCCCNCCCCO 34a_100000750430_100011215482 [1,0,0,0,0,0|1,0,2]=4 2519 B11R0.3 C=CCCCCOCCCCC 34a_100000210253_100011215482 [1,0,0,0,0,0|1,0,2]=4 2520 B11R0.3 C=CCCCCOCCCCC 34a_100000766645_100000718602 [1,0,0,0,0,0|1,0,2]=4 2521 B11R0.3 C=CCCCCOCCCCC 7a_100000210253_100011215482 [1,0,0,0,0,0|1,0,2]=4 2522 B11R0.3 C=CCCCCOCCCCC 7a_100000766645_100000210326 [1,0,0,0,0,0|1,0,2]=4 2523 B11R0.3 C=CCCCCOCCCCO 34a_100000766645_100011216708 [1,0,0,0,0,0|1,0,2]=4 2524 B11R0.3 C=CCCCCOCCCCO 7a_100000766645_100000210776 [1,0,0,0,0,0|1,0,2]=4 2525 B11R0.3 C=CCCCCSCCCCC 62a_100000210326_100011215482 [1,0,0,0,0,0|1,0,2]=4 2526 B11R0.3 C=CCCCCSCCCCC 62a_100011215482_100000210326 [1,0,0,0,0,0|1,0,2]=4 2527 B11R0.3 C=CCCCCSCCCCO 62a_100000210776_100011215482 [1,0,0,0,0,0|1,0,2]=4 2528 B11R0.3 C=CCCCCSCCCCO 62a_100011215482_100000210776 [1,0,0,0,0,0|1,0,2]=4 2529 B11R0.3 C=CCCCNCCCCCC 2230a_100000210581_100011713584 [1,0,0,0,0,0|1,0,2]=4 2530 B11R0.3 C=CCCCNCCCCCC 2230a_100000700776_100000210314 [1,0,0,0,0,0|1,0,2]=4 2531 B11R0.3 C=CCCCNCCCCCC 34a_100000700776_100000210314 [1,0,0,0,0,0|1,0,2]=4 2532 B11R0.3 C=CCCCNCCCCCO 2230a_100000700776_100000746330 [1,0,0,0,0,0|1,0,2]=4 2533 B11R0.3 C=CCCCNCCCCCO 2230a_100000762737_100011713584 [1,0,0,0,0,0|1,0,2]=4 2534 B11R0.3 C=CCCCNCCCCCO 34a_100000700776_100000746330 [1,0,0,0,0,0|1,0,2]=4 2535 B11R0.3 C=CCCCNCCCCCO 34a_100000762737_100000757094 [1,0,0,0,0,0|1,0,2]=4 2536 B11R0.3 C=CCCCOCCCCCC 34a_100000210259_100000757094 [1,0,0,0,0,0|1,0,2]=4 2537 B11R0.3 C=CCCCOCCCCCC 34a_100000758997_100000210314 [1,0,0,0,0,0|1,0,2]=4 2538 B11R0.3 C=CCCCOCCCCCC 7a_100000210259_100000757094 [1,0,0,0,0,0|1,0,2]=4 2539 B11R0.3 C=CCCCOCCCCCC 7a_100000758997_100000210314 [1,0,0,0,0,0|1,0,2]=4 2540 B11R0.3 C=CCCCOCCCCCO 34a_100000758997_100000746330 [1,0,0,0,0,0|1,0,2]=4 2541 B11R0.3 C=CCCCOCCCCCO 7a_100000758997_100000746330 [1,0,0,0,0,0|1,0,2]=4 2542 B11R0.3 C=CCCCSCCCCCC 62a_100000210314_100000757094 [1,0,0,0,0,0|1,0,2]=4 2543 B11R0.3 C=CCCCSCCCCCC 62a_100011713584_100000210757 [1,0,0,0,0,0|1,0,2]=4 2544 B11R0.3 C=CCCCSCCCCCO 62a_100000746330_100000757094 [1,0,0,0,0,0|1,0,2]=4 2545 B11R0.3 C=CCCCSCCCCCO 62a_100011713584_100000746330 [1,0,0,0,0,0|1,0,2]=4 2546 B11R0.3 C=CCCNCCCCCCC 2230a_100000229938_100000754431 [1,0,0,0,0,0|1,0,2]=4 2547 B11R0.3 C=CCCNCCCCCCC 2230a_100015191253_100000210681 [1,0,0,0,0,0|1,0,2]=4 2548 B11R0.3 C=CCCNCCCCCCO 2230a_100000686447_100000754431 [1,0,0,0,0,0|1,0,2]=4 2549 B11R0.3 C=CCCNCCCCCCO 2230a_100015191253_100000766143 [1,0,0,0,0,0|1,0,2]=4 2550 B11R0.3 C=CCCNCCCCCCO 34a_100000686447_100000754431 [1,0,0,0,0,0|1,0,2]=4 2551 B11R0.3 C=CCCOCCCCCCC 34a_100000210272_100000754431 [1,0,0,0,0,0|1,0,2]=4 2552 B11R0.3 C=CCCOCCCCCCC 34a_100011205117_100000210614 [1,0,0,0,0,0|1,0,2]=4 2553 B11R0.3 C=CCCOCCCCCCC 7a_100000210272_100000754431 [1,0,0,0,0,0|1,0,2]=4 2554 B11R0.3 C=CCCOCCCCCCO 34a_100011205117_100000766143 [1,0,0,0,0,0|1,0,2]=4 2555 B11R0.3 C=CCCSCCCCCCC 62a_100000210614_100000754431 [1,0,0,0,0,0|1,0,2]=4 2556 B11R0.3 C=CCCSCCCCCCC 62a_100000754431_100000210316 [1,0,0,0,0,0|1,0,2]=4 2557 B11R0.3 C=CCCSCCCCCCO 62a_100000754431_100000766143 [1,0,0,0,0,0|1,0,2]=4 2558 B11R0.3 C=CCCSCCCCCCO 62a_100000766143_100000754431 [1,0,0,0,0,0|1,0,2]=4 2559 B11R0.3 C=CCNCCCCCCCC 2230a_100000229939_100000210623 [1,0,0,0,0,0|1,0,2]=4 2560 B11R0.3 C=CCNCCCCCCCC 2230a_100020586998_100000210759 [1,0,0,0,0,0|1,0,2]=4 2561 B11R0.3 C=CCNCCCCCCCC 34a_100000229939_100015514636 [1,0,0,0,0,0|1,0,2]=4 2562 B11R0.3 C=CCNCCCCCCCO 2230a_100011996573_100000210623 [1,0,0,0,0,0|1,0,2]=4 2563 B11R0.3 C=CCNCCCCCCCO 2230a_100020586998_100000760002 [1,0,0,0,0,0|1,0,2]=4 2564 B11R0.3 C=CCNCCCCCCCO 34a_100011996573_100015514636 [1,0,0,0,0,0|1,0,2]=4 2565 B11R0.3 C=CCOCCCCCCCC 34a_100000210232_100015514636 [1,0,0,0,0,0|1,0,2]=4 2566 B11R0.3 C=CCOCCCCCCCC 34a_200000210373_100000210759 [1,0,0,0,0,0|1,0,2]=4 2567 B11R0.3 C=CCOCCCCCCCC 7a_100000210232_100015514636 [1,0,0,0,0,0|1,0,2]=4 2568 B11R0.3 C=CCOCCCCCCCO 34a_200000210373_100000760002 [1,0,0,0,0,0|1,0,2]=4 2569 B11R0.3 C=CCSCCCCCCCC 62a_100000210623_100000210317 [1,0,0,0,0,0|1,0,2]=4 2570 B11R0.3 C=CCSCCCCCCCC 62a_100000210759_100000210623 [1,0,0,0,0,0|1,0,2]=4 2571 B11R0.3 C=CCSCCCCCCCO 62a_100000210623_100000760002 [1,0,0,0,0,0|1,0,2]=4 2572 B11R0.3 C=CCSCCCCCCCO 62a_100000760002_100000210623 [1,0,0,0,0,0|1,0,2]=4 2573 B11R0.3 CC#CCCOCCCCCC 34a_100000750427_100000210314 [1,0,0,0,0,0|1,0,2]=4 2574 B11R0.3 CC#CCCOCCCCCO 34a_100000750427_100000746330 [1,0,0,0,0,0|1,0,2]=4 2575 B11R0.3 CC#CCNCCCCCCC 2230a_100000229938_100000748600 [1,0,0,0,0,0|1,0,2]=4 2576 B11R0.3 CC#CCNCCCCCCC 2230a_100000685387_100000210681 [1,0,0,0,0,0|1,0,2]=4 2577 B11R0.3 CC#CCNCCCCCCC 34a_100000685387_100000210614 [1,0,0,0,0,0|1,0,2]=4 2578 B11R0.3 CC#CCNCCCCCCO 2230a_100000685387_100000766143 [1,0,0,0,0,0|1,0,2]=4 2579 B11R0.3 CC#CCNCCCCCCO 2230a_100000686447_100000748600 [1,0,0,0,0,0|1,0,2]=4 2580 B11R0.3 CC#CCNCCCCCCO 34a_100000685387_100000766143 [1,0,0,0,0,0|1,0,2]=4 2581 B11R0.3 CC#CCNCCCCCCO 34a_100000686447_100000748600 [1,0,0,0,0,0|1,0,2]=4 2582 B11R0.3 CC#CCOCCCCCCC 34a_100000210272_100000748600 [1,0,0,0,0,0|1,0,2]=4 2583 B11R0.3 CC#CCOCCCCCCC 34a_100000761923_100000210614 [1,0,0,0,0,0|1,0,2]=4 2584 B11R0.3 CC#CCOCCCCCCC 7a_100000210272_100000748600 [1,0,0,0,0,0|1,0,2]=4 2585 B11R0.3 CC#CCOCCCCCCO 34a_100000761923_100000766143 [1,0,0,0,0,0|1,0,2]=4 2586 B11R0.3 CC#CCSCCCCCCC 62a_100000210614_100000748600 [1,0,0,0,0,0|1,0,2]=4 2587 B11R0.3 CC#CCSCCCCCCC 62a_100000748600_100000210316 [1,0,0,0,0,0|1,0,2]=4 2588 B11R0.3 CC#CCSCCCCCCO 62a_100000748600_100000766143 [1,0,0,0,0,0|1,0,2]=4 2589 B11R0.3 CC#CCSCCCCCCO 62a_100000766143_100000748600 [1,0,0,0,0,0|1,0,2]=4 2590 B11R0.3 CC/C=C/CCCOCCCC 34a_100016287902_100000210210 [1,0,0,0,0,0|1,0,2]=4 2591 B11R0.3 CC/C=C/CCCOCCCC 7a_100016287902_100000210211 [1,0,0,0,0,0|1,0,2]=4 2592 B11R0.3 CC/C=C/CCCOCCCO 34a_100016287902_100000230001 [1,0,0,0,0,0|1,0,2]=4 2593 B11R0.3 CC/C=C/CCCOCCCO 7a_100016287902_100011215043 [1,0,0,0,0,0|1,0,2]=4 2594 B11R0.3 CC/C=C\CCCCCNCC 269862a_100015525214_100016288537 [1,0,0,0,0,0|1,0,2]=4 2595 B11R0.3 CC/C=C\CCCCCOCC 34a_100016268722_100000210202 [1,0,0,0,0,0|1,0,2]=4 2596 B11R0.3 CC/C=C\CCCCCOCC 7a_100016268722_100000210202 [1,0,0,0,0,0|1,0,2]=4 2597 B11R0.3 CC/C=C\CCCCOCCC 34a_100016287862_100000210303 [1,0,0,0,0,0|1,0,2]=4 2598 B11R0.3 CC/C=C\CCCCOCCC 7a_100016287862_100000210303 [1,0,0,0,0,0|1,0,2]=4 2599 B11R0.3 CC/C=C\CCCCOCCO 34a_100016287862_100000211926 [1,0,0,0,0,0|1,0,2]=4 2600 B11R0.3 CC/C=C\CCCCOCCO 7a_100016287862_100000211926 [1,0,0,0,0,0|1,0,2]=4 2601 B11R0.3 CC/C=C\CCNCCCCC 2230a_100000209983_100015370543 [1,0,0,0,0,0|1,0,2]=4 2602 B11R0.3 CC/C=C\CCNCCCCO 2230a_100000750430_100015370543 [1,0,0,0,0,0|1,0,2]=4 2603 B11R0.3 CC/C=C\CCNCCCCO 34a_100000750430_100015370543 [1,0,0,0,0,0|1,0,2]=4 2604 B11R0.3 CC/C=C\CCOCCCCC 34a_100000210253_100015370543 [1,0,0,0,0,0|1,0,2]=4 2605 B11R0.3 CC/C=C\CCOCCCCC 34a_100016288707_100000718602 [1,0,0,0,0,0|1,0,2]=4 2606 B11R0.3 CC/C=C\CCOCCCCC 7a_100000210253_100015370543 [1,0,0,0,0,0|1,0,2]=4 2607 B11R0.3 CC/C=C\CCOCCCCC 7a_100016288707_100000210326 [1,0,0,0,0,0|1,0,2]=4 2608 B11R0.3 CC/C=C\CCOCCCCO 34a_100016288707_100011216708 [1,0,0,0,0,0|1,0,2]=4 2609 B11R0.3 CC/C=C\CCOCCCCO 7a_100016288707_100000210776 [1,0,0,0,0,0|1,0,2]=4 2610 B11R0.3 CC/C=C\CCSCCCCC 62a_100000210326_100015370543 [1,0,0,0,0,0|1,0,2]=4 2611 B11R0.3 CC/C=C\CCSCCCCC 62a_100015370543_100000210326 [1,0,0,0,0,0|1,0,2]=4 2612 B11R0.3 CC/C=C\CCSCCCCO 62a_100000210776_100015370543 [1,0,0,0,0,0|1,0,2]=4 2613 B11R0.3 CC/C=C\CCSCCCCO 62a_100015370543_100000210776 [1,0,0,0,0,0|1,0,2]=4 2614 B11R0.3 CC/C=C\CNCCCCCC 2230a_100000210581_100103147603 [1,0,0,0,0,0|1,0,2]=4 2615 B11R0.3 CC/C=C\CNCCCCCO 2230a_100000762737_100103147603 [1,0,0,0,0,0|1,0,2]=4 2616 B11R0.3 CC/C=C\CNCCCCCO 34a_100000762737_100103147603 [1,0,0,0,0,0|1,0,2]=4 2617 B11R0.3 CC/C=C\COCCCCCC 34a_100000210259_100103147603 [1,0,0,0,0,0|1,0,2]=4 2618 B11R0.3 CC/C=C\COCCCCCC 34a_100016268518_100000210314 [1,0,0,0,0,0|1,0,2]=4 2619 B11R0.3 CC/C=C\COCCCCCC 7a_100000210259_100103147603 [1,0,0,0,0,0|1,0,2]=4 2620 B11R0.3 CC/C=C\COCCCCCO 34a_100016268518_100000746330 [1,0,0,0,0,0|1,0,2]=4 2621 B11R0.3 CC/C=C\CSCCCCCC 62a_100000210314_100103147603 [1,0,0,0,0,0|1,0,2]=4 2622 B11R0.3 CC/C=C\CSCCCCCC 62a_100103147603_100000210757 [1,0,0,0,0,0|1,0,2]=4 2623 B11R0.3 CC/C=C\CSCCCCCO 62a_100000746330_100103147603 [1,0,0,0,0,0|1,0,2]=4 2624 B11R0.3 CC/C=C\CSCCCCCO 62a_100103147603_100000746330 [1,0,0,0,0,0|1,0,2]=4 2625 B11R0.3 CC=CCCCOCCCCC 34a_100020645299_100000718602 [1,0,0,0,0,0|1,0,2]=4 2626 B11R0.3 CC=CCCCOCCCCO 34a_100020645299_100011216708 [1,0,0,0,0,0|1,0,2]=4 2627 B11R0.3 CC=CCNCCCCCCC 2230a_100000229938_100000070051 [1,0,0,0,0,0|1,0,2]=4 2628 B11R0.3 CC=CCNCCCCCCO 2230a_100000686447_100000070051 [1,0,0,0,0,0|1,0,2]=4 2629 B11R0.3 CC=CCNCCCCCCO 34a_100000686447_100000070051 [1,0,0,0,0,0|1,0,2]=4 2630 B11R0.3 CC=CCOCCCCCCC 34a_100000210272_100000070051 [1,0,0,0,0,0|1,0,2]=4 2631 B11R0.3 CC=CCOCCCCCCC 7a_100000210272_100000070051 [1,0,0,0,0,0|1,0,2]=4 2632 B11R0.3 CC=CCSCCCCCCC 62a_100000070051_100000210316 [1,0,0,0,0,0|1,0,2]=4 2633 B11R0.3 CC=CCSCCCCCCC 62a_100000210614_100000070051 [1,0,0,0,0,0|1,0,2]=4 2634 B11R0.3 CC=CCSCCCCCCO 62a_100000070051_100000766143 [1,0,0,0,0,0|1,0,2]=4 2635 B11R0.3 CC=CCSCCCCCCO 62a_100000766143_100000070051 [1,0,0,0,0,0|1,0,2]=4 2636 B11R0.3 CCC#CCCCCCCNC 2230a_106832991635_200000036426 [1,0,0,0,0,0|1,0,2]=4 2637 B11R0.3 CCC#CCCCCCCNC 34a_100102657272_200000036426 [1,0,0,0,0,0|1,0,2]=4 2638 B11R0.3 CCC#CCCCCCCNC 7a_106832991635_200000036426 [1,0,0,0,0,0|1,0,2]=4 2639 B11R0.3 CCC#CCCCCCCOC 34a_100138415774_200000036426 [1,0,0,0,0,0|1,0,2]=4 2640 B11R0.3 CCC#CCCCCCCSC 62a_200000036426_200000210301 [1,0,0,0,0,0|1,0,2]=4 2641 B11R0.3 CCC#CCCCCCCSC 62a_200000210301_200000036426 [1,0,0,0,0,0|1,0,2]=4 2642 B11R0.3 CCC#CCCCCCCS[13CH3] 62a_200000036426_200025704644 [1,0,0,0,0,0|1,0,2]=4 2643 B11R0.3 CCC#CCCCCCCS[13CH3] 62a_200025704644_200000036426 [1,0,0,0,0,0|1,0,2]=4 2644 B11R0.3 CCC#CCCOCCCCC 34a_100000036655_100000718602 [1,0,0,0,0,0|1,0,2]=4 2645 B11R0.3 CCC#CCCOCCCCC 7a_100000036655_100000210326 [1,0,0,0,0,0|1,0,2]=4 2646 B11R0.3 CCC#CCCOCCCCO 34a_100000036655_100011216708 [1,0,0,0,0,0|1,0,2]=4 2647 B11R0.3 CCC#CCCOCCCCO 7a_100000036655_100000210776 [1,0,0,0,0,0|1,0,2]=4 2648 B11R0.3 CCC#CCNCCCCCC 2230a_100000210581_100009813939 [1,0,0,0,0,0|1,0,2]=4 2649 B11R0.3 CCC#CCNCCCCCO 2230a_100000762737_100009813939 [1,0,0,0,0,0|1,0,2]=4 2650 B11R0.3 CCC#CCNCCCCCO 34a_100000762737_100009813939 [1,0,0,0,0,0|1,0,2]=4 2651 B11R0.3 CCC#CCOCCCCCC 34a_100000032950_100000210314 [1,0,0,0,0,0|1,0,2]=4 2652 B11R0.3 CCC#CCOCCCCCC 34a_100000210259_100009813939 [1,0,0,0,0,0|1,0,2]=4 2653 B11R0.3 CCC#CCOCCCCCC 7a_100000210259_100009813939 [1,0,0,0,0,0|1,0,2]=4 2654 B11R0.3 CCC#CCOCCCCCO 34a_100000032950_100000746330 [1,0,0,0,0,0|1,0,2]=4 2655 B11R0.3 CCC#CCSCCCCCC 62a_100000210314_100009813939 [1,0,0,0,0,0|1,0,2]=4 2656 B11R0.3 CCC#CCSCCCCCC 62a_100009813939_100000210757 [1,0,0,0,0,0|1,0,2]=4 2657 B11R0.3 CCC#CCSCCCCCO 62a_100000746330_100009813939 [1,0,0,0,0,0|1,0,2]=4 2658 B11R0.3 CCC#CCSCCCCCO 62a_100009813939_100000746330 [1,0,0,0,0,0|1,0,2]=4 2659 B11R0.3 CCC/C=C/COCCCCC 34a_100016278788_100000718602 [1,0,0,0,0,0|1,0,2]=4 2660 B11R0.3 CCC/C=C/COCCCCC 7a_100016278788_100000210326 [1,0,0,0,0,0|1,0,2]=4 2661 B11R0.3 CCC/C=C/COCCCCO 34a_100016278788_100011216708 [1,0,0,0,0,0|1,0,2]=4 2662 B11R0.3 CCC/C=C/COCCCCO 7a_100016278788_100000210776 [1,0,0,0,0,0|1,0,2]=4 2663 B11R0.3 CCCC#CCCOCCCC 34a_100000042726_100000210210 [1,0,0,0,0,0|1,0,2]=4 2664 B11R0.3 CCCC#CCCOCCCC 7a_100000042726_100000210211 [1,0,0,0,0,0|1,0,2]=4 2665 B11R0.3 CCCC#CCCOCCCO 34a_100000042726_100000230001 [1,0,0,0,0,0|1,0,2]=4 2666 B11R0.3 CCCC#CCCOCCCO 7a_100000042726_100011215043 [1,0,0,0,0,0|1,0,2]=4 2667 B11R0.3 CCCC#CCOCCCCC 34a_100000034806_100000718602 [1,0,0,0,0,0|1,0,2]=4 2668 B11R0.3 CCCC#CCOCCCCC 7a_100000034806_100000210326 [1,0,0,0,0,0|1,0,2]=4 2669 B11R0.3 CCCC#CCOCCCCO 34a_100000034806_100011216708 [1,0,0,0,0,0|1,0,2]=4 2670 B11R0.3 CCCC#CCOCCCCO 7a_100000034806_100000210776 [1,0,0,0,0,0|1,0,2]=4 2671 B11R0.3 CCCC/C=C/CCCCOC 34a_200020645093_200000210301 [1,0,0,0,0,0|1,0,2]=4 2672 B11R0.3 CCCC/C=C/CCCCOC 7a_200020645093_200000210301 [1,0,0,0,0,0|1,0,2]=4 2673 B11R0.3 CCCC/C=C/CCCCO[13CH3] 34a_200020645093_200025704644 [1,0,0,0,0,0|1,0,2]=4 2674 B11R0.3 CCCC/C=C/CCCCO[13CH3] 7a_200020645093_200025704644 [1,0,0,0,0,0|1,0,2]=4 2675 B11R0.3 CCCC/C=C/COCCCC 34a_200016272032_100000210210 [1,0,0,0,0,0|1,0,2]=4 2676 B11R0.3 CCCC/C=C/COCCCC 7a_200016272032_100000210211 [1,0,0,0,0,0|1,0,2]=4 2677 B11R0.3 CCCC/C=C/COCCCO 34a_200016272032_100000230001 [1,0,0,0,0,0|1,0,2]=4 2678 B11R0.3 CCCC/C=C/COCCCO 7a_200016272032_100011215043 [1,0,0,0,0,0|1,0,2]=4 2679 B11R0.3 CCCC/C=C\CCOCCC 34a_200016286491_100000210303 [1,0,0,0,0,0|1,0,2]=4 2680 B11R0.3 CCCC/C=C\CCOCCC 7a_200016286491_100000210303 [1,0,0,0,0,0|1,0,2]=4 2681 B11R0.3 CCCC/C=C\CCOCCO 34a_200016286491_100000211926 [1,0,0,0,0,0|1,0,2]=4 2682 B11R0.3 CCCC/C=C\CCOCCO 7a_200016286491_100000211926 [1,0,0,0,0,0|1,0,2]=4 2683 B11R0.3 CCCCC#CCCCCOC 34a_200000066234_200000210301 [1,0,0,0,0,0|1,0,2]=4 2684 B11R0.3 CCCCC#CCCCCOC 7a_200000066234_200000210301 [1,0,0,0,0,0|1,0,2]=4 2685 B11R0.3 CCCCC#CCCCCO[13CH3] 34a_200000066234_200025704644 [1,0,0,0,0,0|1,0,2]=4 2686 B11R0.3 CCCCC#CCCCCO[13CH3] 7a_200000066234_200025704644 [1,0,0,0,0,0|1,0,2]=4 2687 B11R0.3 CCCCC#CCCCNCC 2230a_100015525214_200000047210 [1,0,0,0,0,0|1,0,2]=4 2688 B11R0.3 CCCCC#CCCCOCC 34a_100121572206_200000047210 [1,0,0,0,0,0|1,0,2]=4 2689 B11R0.3 CCCCC#CCCCSCC 62a_100000210202_200000047210 [1,0,0,0,0,0|1,0,2]=4 2690 B11R0.3 CCCCC#CCCCSCC 62a_200000047210_100000210202 [1,0,0,0,0,0|1,0,2]=4 2691 B11R0.3 CCCCC#CCCOCCC 34a_100000037610_100000210303 [1,0,0,0,0,0|1,0,2]=4 2692 B11R0.3 CCCCC#CCCOCCC 7a_100000037610_100000210303 [1,0,0,0,0,0|1,0,2]=4 2693 B11R0.3 CCCCC#CCCOCCO 34a_100000037610_100000211926 [1,0,0,0,0,0|1,0,2]=4 2694 B11R0.3 CCCCC#CCCOCCO 7a_100000037610_100000211926 [1,0,0,0,0,0|1,0,2]=4 2695 B11R0.3 CCCCC#CCOCCCC 34a_200000034558_100000210210 [1,0,0,0,0,0|1,0,2]=4 2696 B11R0.3 CCCCC#CCOCCCC 7a_200000034558_100000210211 [1,0,0,0,0,0|1,0,2]=4 2697 B11R0.3 CCCCC#CCOCCCO 34a_200000034558_100000230001 [1,0,0,0,0,0|1,0,2]=4 2698 B11R0.3 CCCCC#CCOCCCO 7a_200000034558_100011215043 [1,0,0,0,0,0|1,0,2]=4 2699 B11R0.3 CCCCC/C=C/COCCC 34a_100016258190_100000210303 [1,0,0,0,0,0|1,0,2]=4 2700 B11R0.3 CCCCC/C=C/COCCC 7a_100016258190_100000210303 [1,0,0,0,0,0|1,0,2]=4 2701 B11R0.3 CCCCC/C=C/COCCO 34a_100016258190_100000211926 [1,0,0,0,0,0|1,0,2]=4 2702 B11R0.3 CCCCC/C=C/COCCO 7a_100016258190_100000211926 [1,0,0,0,0,0|1,0,2]=4 2703 B11R0.3 CCCCC/C=C\CCCOC 34a_100020655193_200000210301 [1,0,0,0,0,0|1,0,2]=4 2704 B11R0.3 CCCCC/C=C\CCCOC 7a_100020655193_200000210301 [1,0,0,0,0,0|1,0,2]=4 2705 B11R0.3 CCCCC/C=C\CCCO[13CH3] 34a_100020655193_200025704644 [1,0,0,0,0,0|1,0,2]=4 2706 B11R0.3 CCCCC/C=C\CCCO[13CH3] 7a_100020655193_200025704644 [1,0,0,0,0,0|1,0,2]=4 2707 B11R0.3 CCCCC/C=C\CCOCC 34a_100016277358_100000210202 [1,0,0,0,0,0|1,0,2]=4 2708 B11R0.3 CCCCC/C=C\CCOCC 7a_100016277358_100000210202 [1,0,0,0,0,0|1,0,2]=4 2709 B11R0.3 CCCCC=NNCCCCC 4a_100000694160_100000210104 [1,0,0,0,0,0|2,0,1]=4 2710 B11R0.3 CCCCCC#CCCOCC 34a_200000042877_100000210202 [1,0,0,0,0,0|1,0,2]=4 2711 B11R0.3 CCCCCC#CCCOCC 7a_200000042877_100000210202 [1,0,0,0,0,0|1,0,2]=4 2712 B11R0.3 CCCCCC#CCNCCO 2230a_100016997473_100009816472 [1,0,0,0,0,0|1,0,2]=4 2713 B11R0.3 CCCCCC#CCNCCO 34a_100016990907_100009816472 [1,0,0,0,0,0|1,0,2]=4 2714 B11R0.3 CCCCCC#CCOCCC 34a_100000210258_100009816472 [1,0,0,0,0,0|1,0,2]=4 2715 B11R0.3 CCCCCC#CCOCCC 34a_200000033628_100000210303 [1,0,0,0,0,0|1,0,2]=4 2716 B11R0.3 CCCCCC#CCOCCC 7a_200000033628_100000210303 [1,0,0,0,0,0|1,0,2]=4 2717 B11R0.3 CCCCCC#CCOCCO 34a_200000033628_100000211926 [1,0,0,0,0,0|1,0,2]=4 2718 B11R0.3 CCCCCC#CCOCCO 7a_200000033628_100000211926 [1,0,0,0,0,0|1,0,2]=4 2719 B11R0.3 CCCCCC#CCSCCC 62a_100000210303_100009816472 [1,0,0,0,0,0|1,0,2]=4 2720 B11R0.3 CCCCCC#CCSCCC 62a_100009816472_100000210303 [1,0,0,0,0,0|1,0,2]=4 2721 B11R0.3 CCCCCC#CCSCCO 62a_100000211926_100009816472 [1,0,0,0,0,0|1,0,2]=4 2722 B11R0.3 CCCCCC#CCSCCO 62a_100009816472_100000211926 [1,0,0,0,0,0|1,0,2]=4 2723 B11R0.3 CCCCCC/C=C/COCC 34a_200016276170_100000210202 [1,0,0,0,0,0|1,0,2]=4 2724 B11R0.3 CCCCCC/C=C/COCC 7a_200016276170_100000210202 [1,0,0,0,0,0|1,0,2]=4 2725 B11R0.3 CCCCCC=NNCCCC 4a_100025702795_100000737632 [1,0,0,0,0,0|2,0,1]=4 2726 B11R0.3 CCCCCCC#CCCOC 34a_200000033163_200000210301 [1,0,0,0,0,0|1,0,2]=4 2727 B11R0.3 CCCCCCC#CCCOC 7a_200000033163_200000210301 [1,0,0,0,0,0|1,0,2]=4 2728 B11R0.3 CCCCCCC#CCCO[13CH3] 34a_200000033163_200025704644 [1,0,0,0,0,0|1,0,2]=4 2729 B11R0.3 CCCCCCC#CCCO[13CH3] 7a_200000033163_200025704644 [1,0,0,0,0,0|1,0,2]=4 2730 B11R0.3 CCCCCCC#CCOCC 34a_200000037284_100000210202 [1,0,0,0,0,0|1,0,2]=4 2731 B11R0.3 CCCCCCC#CCOCC 7a_200000037284_100000210202 [1,0,0,0,0,0|1,0,2]=4 2732 B11R0.3 CCCCCCC=NNCCC 4a_100000740057_100000234349 [1,0,0,0,0,0|2,0,1]=4 2733 B11R0.3 CCCCCCC=NNCCO 4a_100000210001_100000234349 [1,0,0,0,0,0|2,0,1]=4 2734 B11R0.3 CCCCCCCC#CCOC 34a_200000061759_200000210301 [1,0,0,0,0,0|1,0,2]=4 2735 B11R0.3 CCCCCCCC#CCOC 7a_200000061759_200000210301 [1,0,0,0,0,0|1,0,2]=4 2736 B11R0.3 CCCCCCCC#CCO[13CH3] 34a_200000061759_200025704644 [1,0,0,0,0,0|1,0,2]=4 2737 B11R0.3 CCCCCCCC#CCO[13CH3] 7a_200000061759_200025704644 [1,0,0,0,0,0|1,0,2]=4 2738 B11R0.3 CCCCCCCC=NNCC 4a_100000756455_100000210592 [1,0,0,0,0,0|2,0,1]=4 2739 B11R0.3 CCCCCCCCCCNC 2230a_100000684558_200000210301 [1,0,0,0,0,0|1,0,0]=2 2740 B11R0.3 CCCCCCCCCCNC 2230a_106832991635_100000210320 [1,0,0,0,0,0|1,0,0]=2 2741 B11R0.3 CCCCCCCCCCNC 34a_100000684558_200000210301 [1,0,0,0,0,0|1,0,0]=2 2742 B11R0.3 CCCCCCCCCCNC 34a_100102657272_100000210320 [1,0,0,0,0,0|1,0,0]=2 2743 B11R0.3 CCCCCCCCCCNC 7a_106832991635_100000210320 [1,0,0,0,0,0|1,0,0]=2 2744 B11R0.3 CCCCCCCCCCN[13CH3] 2230a_100000684558_200025704644 [1,0,0,0,0,0|1,0,0]=2 2745 B11R0.3 CCCCCCCCCCN[13CH3] 34a_100000684558_200025704644 [1,0,0,0,0,0|1,0,0]=2 2746 B11R0.3 CCCCCCCCCCOC 34a_100000210711_200000210301 [1,0,0,0,0,0|1,0,0]=2 2747 B11R0.3 CCCCCCCCCCOC 34a_100138415774_100000210320 [1,0,0,0,0,0|1,0,0]=2 2748 B11R0.3 CCCCCCCCCCOC 7a_100000210711_200000210301 [1,0,0,0,0,0|1,0,0]=2 2749 B11R0.3 CCCCCCCCCCO[13CH3] 34a_100000210711_200025704644 [1,0,0,0,0,0|1,0,0]=2 2750 B11R0.3 CCCCCCCCCCO[13CH3] 7a_100000210711_200025704644 [1,0,0,0,0,0|1,0,0]=2 2751 B11R0.3 CCCCCCCCCCSC 62a_200000210301_100000210320 [1,0,0,0,0,0|1,0,0]=2 2752 B11R0.3 CCCCCCCCCCS[13CH3] 62a_200025704644_100000210320 [1,0,0,0,0,0|1,0,0]=2 2753 B11R0.3 CCCCCCCCCNCC 2230a_100000212291_100000210202 [1,0,0,0,0,0|1,0,0]=2 2754 B11R0.3 CCCCCCCCCNCC 2230a_100015525214_100011214924 [1,0,0,0,0,0|1,0,0]=2 2755 B11R0.3 CCCCCCCCCNCC 34a_100000212291_100000210202 [1,0,0,0,0,0|1,0,0]=2 2756 B11R0.3 CCCCCCCCCNCF 34a_100000212291_100015361967 [1,0,0,0,0,0|2,0,0]=3 2757 B11R0.3 CCCCCCCCCOCC 34a_100000210712_100000210202 [1,0,0,0,0,0|1,0,0]=2 2758 B11R0.3 CCCCCCCCCOCC 34a_100121572206_100011214924 [1,0,0,0,0,0|1,0,0]=2 2759 B11R0.3 CCCCCCCCCOCC 7a_100000210712_100000210202 [1,0,0,0,0,0|1,0,0]=2 2760 B11R0.3 CCCCCCCCCOCF 34a_100000210712_100015361967 [1,0,0,0,0,0|2,0,0]=3 2761 B11R0.3 CCCCCCCCCOCF 7a_100000210712_100015361967 [1,0,0,0,0,0|2,0,0]=3 2762 B11R0.3 CCCCCCCCCSCC 62a_100000210202_100000210670 [1,0,0,0,0,0|1,0,0]=2 2763 B11R0.3 CCCCCCCCCSCF 62a_100015361967_100000210670 [1,0,0,0,0,0|2,0,0]=3 2764 B11R0.3 CCCCCCCCNCC#N 2230a_100000229939_100011215382 [1,0,0,0,0,0|2,0,1]=4 2765 B11R0.3 CCCCCCCCNCC=O 2230a_100000229939_200015260668 [1,0,0,0,0,0|1,0,2]=4 2766 B11R0.3 CCCCCCCCNCC=O 34a_100000229939_200009817547 [1,0,0,0,0,0|1,0,2]=4 2767 B11R0.3 CCCCCCCCNCCC 2230a_100000229939_100000210303 [1,0,0,0,0,0|1,0,0]=2 2768 B11R0.3 CCCCCCCCNCCC 34a_100000229939_100000210303 [1,0,0,0,0,0|1,0,0]=2 2769 B11R0.3 CCCCCCCCNCCF 2230a_100000229939_100011217306 [1,0,0,0,0,0|2,0,0]=3 2770 B11R0.3 CCCCCCCCNCCF 34a_100000229939_100011217306 [1,0,0,0,0,0|2,0,0]=3 2771 B11R0.3 CCCCCCCCNCCF 34a_100000724931_100000210759 [1,0,0,0,0,0|2,0,0]=3 2772 B11R0.3 CCCCCCCCNCCO 2230a_100000229939_100000211926 [1,0,0,0,0,0|1,0,0]=2 2773 B11R0.3 CCCCCCCCNCCO 2230a_100016997473_100000210759 [1,0,0,0,0,0|1,0,0]=2 2774 B11R0.3 CCCCCCCCNCCO 34a_100000229939_100000211926 [1,0,0,0,0,0|1,0,0]=2 2775 B11R0.3 CCCCCCCCNCCO 34a_100016990907_100000210759 [1,0,0,0,0,0|1,0,0]=2 2776 B11R0.3 CCCCCCCCNCOC 2230a_100000229939_100000766300 [1,0,0,0,0,0|2,0,0]=3 2777 B11R0.3 CCCCCCCCNCSC 2230a_100000229939_100011218213 [1,0,0,0,0,0|2,0,0]=3 2778 B11R0.3 CCCCCCCCNCSC 34a_100000229939_100011218213 [1,0,0,0,0,0|2,0,0]=3 2779 B11R0.3 CCCCCCCCOCC#N 7a_100000210232_100011215382 [1,0,0,0,0,0|2,0,1]=4 2780 B11R0.3 CCCCCCCCOCC=O 34a_100000210232_200009817547 [1,0,0,0,0,0|1,0,2]=4 2781 B11R0.3 CCCCCCCCOCC=O 7a_100000210232_200015260668 [1,0,0,0,0,0|1,0,2]=4 2782 B11R0.3 CCCCCCCCOCCBr 34a_100000211926_100000210759 [1,0,0,0,0,0|2,0,0]=3 2783 B11R0.3 CCCCCCCCOCCC 34a_100000210232_100000210303 [1,0,0,0,0,0|1,0,0]=2 2784 B11R0.3 CCCCCCCCOCCC 34a_100000210258_100000210759 [1,0,0,0,0,0|1,0,0]=2 2785 B11R0.3 CCCCCCCCOCCC 7a_100000210232_100000210303 [1,0,0,0,0,0|1,0,0]=2 2786 B11R0.3 CCCCCCCCOCCF 34a_100000210232_100011217306 [1,0,0,0,0,0|2,0,0]=3 2787 B11R0.3 CCCCCCCCOCCF 7a_100000210232_100011217306 [1,0,0,0,0,0|2,0,0]=3 2788 B11R0.3 CCCCCCCCOCCN 34a_100000210304_100000210759 [1,0,0,0,0,0|2,0,0]=3 2789 B11R0.3 CCCCCCCCOCCO 34a_100000210232_100000211926 [1,0,0,0,0,0|1,0,0]=2 2790 B11R0.3 CCCCCCCCOCCO 7a_100000210232_100000211926 [1,0,0,0,0,0|1,0,0]=2 2791 B11R0.3 CCCCCCCCOCSC 34a_100000210232_100011218213 [1,0,0,0,0,0|2,0,0]=3 2792 B11R0.3 CCCCCCCCSCC#N 62a_100000210759_100011215382 [1,0,0,0,0,0|2,0,1]=4 2793 B11R0.3 CCCCCCCCSCC#N 62a_100011215382_100000210317 [1,0,0,0,0,0|2,0,1]=4 2794 B11R0.3 CCCCCCCCSCC=O 62a_100000210759_200015260668 [1,0,0,0,0,0|1,0,2]=4 2795 B11R0.3 CCCCCCCCSCC=O 62a_200015260668_100000210317 [1,0,0,0,0,0|1,0,2]=4 2796 B11R0.3 CCCCCCCCSCCC 62a_100000210303_100000210317 [1,0,0,0,0,0|1,0,0]=2 2797 B11R0.3 CCCCCCCCSCCC 62a_100000210759_100000210303 [1,0,0,0,0,0|1,0,0]=2 2798 B11R0.3 CCCCCCCCSCCF 62a_100000210759_100011217306 [1,0,0,0,0,0|2,0,0]=3 2799 B11R0.3 CCCCCCCCSCCF 62a_100011217306_100000210317 [1,0,0,0,0,0|2,0,0]=3 2800 B11R0.3 CCCCCCCCSCCO 62a_100000210759_100000211926 [1,0,0,0,0,0|1,0,0]=2 2801 B11R0.3 CCCCCCCCSCCO 62a_100000211926_100000210317 [1,0,0,0,0,0|1,0,0]=2 2802 B11R0.3 CCCCCCCCSCOC 62a_100000210759_100000766300 [1,0,0,0,0,0|2,0,0]=3 2803 B11R0.3 CCCCCCCCSCOC 62a_100000766300_100000210317 [1,0,0,0,0,0|2,0,0]=3 2804 B11R0.3 CCCCCCCCSCSC 62a_100000210759_100011218213 [1,0,0,0,0,0|2,0,0]=3 2805 B11R0.3 CCCCCCCCSCSC 62a_100011218213_100000210317 [1,0,0,0,0,0|2,0,0]=3 2806 B11R0.3 CCCCCCCNCCC#N 2230a_100000229938_100011215226 [1,0,0,0,0,0|2,0,1]=4 2807 B11R0.3 CCCCCCCNCCCC 2230a_100000102301_100000210681 [1,0,0,0,0,0|1,0,0]=2 2808 B11R0.3 CCCCCCCNCCCC 2230a_100000229938_100000210211 [1,0,0,0,0,0|1,0,0]=2 2809 B11R0.3 CCCCCCCNCCCC 7a_106832991798_100000210614 [1,0,0,0,0,0|1,0,0]=2 2810 B11R0.3 CCCCCCCNCCCF 2230a_100000229938_100011934791 [1,0,0,0,0,0|2,0,0]=3 2811 B11R0.3 CCCCCCCNCCCF 2230a_100015189416_100000210681 [1,0,0,0,0,0|2,0,0]=3 2812 B11R0.3 CCCCCCCNCCCF 34a_100015189416_100000210614 [1,0,0,0,0,0|2,0,0]=3 2813 B11R0.3 CCCCCCCNCCCO 2230a_100000229938_100000230001 [1,0,0,0,0,0|1,0,0]=2 2814 B11R0.3 CCCCCCCNCCOC 2230a_100000209980_100000210681 [1,0,0,0,0,0|2,0,0]=3 2815 B11R0.3 CCCCCCCNCCOC 2230a_100000229938_100011201679 [1,0,0,0,0,0|2,0,0]=3 2816 B11R0.3 CCCCCCCNCCSC 2230a_100000229938_100000751147 [1,0,0,0,0,0|2,0,0]=3 2817 B11R0.3 CCCCCCCNCCSC 2230a_100020590264_100000210681 [1,0,0,0,0,0|2,0,0]=3 2818 B11R0.3 CCCCCCCOCCC#N 7a_100000210272_100000184422 [1,0,0,0,0,0|2,0,1]=4 2819 B11R0.3 CCCCCCCOCCCBr 34a_100011217188_100000210614 [1,0,0,0,0,0|2,0,0]=3 2820 B11R0.3 CCCCCCCOCCCC 34a_100000210227_100000210614 [1,0,0,0,0,0|1,0,0]=2 2821 B11R0.3 CCCCCCCOCCCC 34a_100000210272_100000210210 [1,0,0,0,0,0|1,0,0]=2 2822 B11R0.3 CCCCCCCOCCCC 7a_100000210227_100000210614 [1,0,0,0,0,0|1,0,0]=2 2823 B11R0.3 CCCCCCCOCCCC 7a_100000210272_100000210211 [1,0,0,0,0,0|1,0,0]=2 2824 B11R0.3 CCCCCCCOCCCCl 34a_100000230001_100000210614 [1,0,0,0,0,0|2,0,0]=3 2825 B11R0.3 CCCCCCCOCCCF 34a_100000210272_100011934791 [1,0,0,0,0,0|2,0,0]=3 2826 B11R0.3 CCCCCCCOCCCF 34a_100000759539_100000210614 [1,0,0,0,0,0|2,0,0]=3 2827 B11R0.3 CCCCCCCOCCCF 7a_100000210272_100011934791 [1,0,0,0,0,0|2,0,0]=3 2828 B11R0.3 CCCCCCCOCCCN 34a_100000182051_100000210614 [1,0,0,0,0,0|2,0,0]=3 2829 B11R0.3 CCCCCCCOCCCO 34a_100000210272_100000230001 [1,0,0,0,0,0|1,0,0]=2 2830 B11R0.3 CCCCCCCOCCCO 7a_100000210272_100011215043 [1,0,0,0,0,0|1,0,0]=2 2831 B11R0.3 CCCCCCCOCCOC 34a_100000210237_100000210614 [1,0,0,0,0,0|2,0,0]=3 2832 B11R0.3 CCCCCCCOCCOC 34a_100000210272_100011201679 [1,0,0,0,0,0|2,0,0]=3 2833 B11R0.3 CCCCCCCOCCOC 7a_100000210272_100000233755 [1,0,0,0,0,0|2,0,0]=3 2834 B11R0.3 CCCCCCCOCCON 34a_100000700252_100000210614 [1,0,0,0,0,0|3,0,0]=4 2835 B11R0.3 CCCCCCCOCCSC 34a_100000210272_100000212216 [1,0,0,0,0,0|2,0,0]=3 2836 B11R0.3 CCCCCCCOCCSC 34a_100000230434_100000210614 [1,0,0,0,0,0|2,0,0]=3 2837 B11R0.3 CCCCCCCOCCSC 7a_100000210272_100000212216 [1,0,0,0,0,0|2,0,0]=3 2838 B11R0.3 CCCCCCCOCCSC 7a_100000230434_100000210614 [1,0,0,0,0,0|2,0,0]=3 2839 B11R0.3 CCCCCCCSCCC#N 62a_100000210614_100011215226 [1,0,0,0,0,0|2,0,1]=4 2840 B11R0.3 CCCCCCCSCCC#N 62a_100011215226_100000210316 [1,0,0,0,0,0|2,0,1]=4 2841 B11R0.3 CCCCCCCSCCCC 62a_100000210211_100000210316 [1,0,0,0,0,0|1,0,0]=2 2842 B11R0.3 CCCCCCCSCCCC 62a_100000210614_100000210210 [1,0,0,0,0,0|1,0,0]=2 2843 B11R0.3 CCCCCCCSCCCF 62a_100000210614_100011934791 [1,0,0,0,0,0|2,0,0]=3 2844 B11R0.3 CCCCCCCSCCCF 62a_100011934791_100000210316 [1,0,0,0,0,0|2,0,0]=3 2845 B11R0.3 CCCCCCCSCCCO 62a_100000210614_100011215043 [1,0,0,0,0,0|1,0,0]=2 2846 B11R0.3 CCCCCCCSCCCO 62a_100011215043_100000210316 [1,0,0,0,0,0|1,0,0]=2 2847 B11R0.3 CCCCCCCSCCOC 62a_100000210614_100000233755 [1,0,0,0,0,0|2,0,0]=3 2848 B11R0.3 CCCCCCCSCCOC 62a_100000233755_100000210316 [1,0,0,0,0,0|2,0,0]=3 2849 B11R0.3 CCCCCCCSCCSC 62a_100000210614_100000751147 [1,0,0,0,0,0|2,0,0]=3 2850 B11R0.3 CCCCCCCSCCSC 62a_100000212216_100000210316 [1,0,0,0,0,0|2,0,0]=3 2851 B11R0.3 CCCCCCCSCOCC 62a_100000210614_100000739092 [1,0,0,0,0,0|2,0,0]=3 2852 B11R0.3 CCCCCCCSCOCC 62a_100000739092_100000210316 [1,0,0,0,0,0|2,0,0]=3 2853 B11R0.3 CCCCCCNCC#CCO 2230a_100000210581_200000047223 [1,0,0,0,0,0|1,0,2]=4 2854 B11R0.3 CCCCCCNCCCC#N 2230a_100000210581_100000687738 [1,0,0,0,0,0|2,0,1]=4 2855 B11R0.3 CCCCCCNCCCC=O 2230a_100000210581_200011292268 [1,0,0,0,0,0|1,0,2]=4 2856 B11R0.3 CCCCCCNCCCCC 2230a_100000209983_100000210314 [1,0,0,0,0,0|1,0,0]=2 2857 B11R0.3 CCCCCCNCCCCC 2230a_100000210581_100000210326 [1,0,0,0,0,0|1,0,0]=2 2858 B11R0.3 CCCCCCNCCCCF 2230a_100000210581_100000729493 [1,0,0,0,0,0|2,0,0]=3 2859 B11R0.3 CCCCCCNCCCCO 2230a_100000210581_100000210776 [1,0,0,0,0,0|1,0,0]=2 2860 B11R0.3 CCCCCCNCCCCO 2230a_100000750430_100000210314 [1,0,0,0,0,0|1,0,0]=2 2861 B11R0.3 CCCCCCNCCCCO 34a_100000750430_100000210314 [1,0,0,0,0,0|1,0,0]=2 2862 B11R0.3 CCCCCCNCCCOC 2230a_100000210581_100000740836 [1,0,0,0,0,0|2,0,0]=3 2863 B11R0.3 CCCCCCNCCCOC 34a_100150723488_100000210314 [1,0,0,0,0,0|2,0,0]=3 2864 B11R0.3 CCCCCCNCCCSC 2230a_100000749238_100000210314 [1,0,0,0,0,0|2,0,0]=3 2865 B11R0.3 CCCCCCNCCOCC 2230a_100000210581_100011215890 [1,0,0,0,0,0|2,0,0]=3 2866 B11R0.3 CCCCCCNCCOCC 2230a_102516460346_100000210314 [1,0,0,0,0,0|2,0,0]=3 2867 B11R0.3 CCCCCCNCCOCC 34a_102516460346_100000210314 [1,0,0,0,0,0|2,0,0]=3 2868 B11R0.3 CCCCCCNCCSCC 2230a_100000106463_100000210314 [1,0,0,0,0,0|2,0,0]=3 2869 B11R0.3 CCCCCCNCCSCC 2230a_100000210581_100000757381 [1,0,0,0,0,0|2,0,0]=3 2870 B11R0.3 CCCCCCOCC#CCO 34a_100000210259_200000047223 [1,0,0,0,0,0|1,0,2]=4 2871 B11R0.3 CCCCCCOCC#CCO 7a_100000210259_200000047223 [1,0,0,0,0,0|1,0,2]=4 2872 B11R0.3 CCCCCCOCCCC#N 7a_100000210259_100000687738 [1,0,0,0,0,0|2,0,1]=4 2873 B11R0.3 CCCCCCOCCCC=O 7a_100000210259_200011292268 [1,0,0,0,0,0|1,0,2]=4 2874 B11R0.3 CCCCCCOCCCCBr 34a_100011216708_100000210314 [1,0,0,0,0,0|2,0,0]=3 2875 B11R0.3 CCCCCCOCCCCC 34a_100000210253_100000210314 [1,0,0,0,0,0|1,0,0]=2 2876 B11R0.3 CCCCCCOCCCCC 34a_100000210259_100000718602 [1,0,0,0,0,0|1,0,0]=2 2877 B11R0.3 CCCCCCOCCCCC 7a_100000210253_100000210314 [1,0,0,0,0,0|1,0,0]=2 2878 B11R0.3 CCCCCCOCCCCC 7a_100000210259_100000210326 [1,0,0,0,0,0|1,0,0]=2 2879 B11R0.3 CCCCCCOCCCCCl 34a_100000210776_100000210314 [1,0,0,0,0,0|2,0,0]=3 2880 B11R0.3 CCCCCCOCCCCCl 7a_100000210776_100000210314 [1,0,0,0,0,0|2,0,0]=3 2881 B11R0.3 CCCCCCOCCCCF 34a_100000210259_100000729493 [1,0,0,0,0,0|2,0,0]=3 2882 B11R0.3 CCCCCCOCCCCF 34a_100011995726_100000210314 [1,0,0,0,0,0|2,0,0]=3 2883 B11R0.3 CCCCCCOCCCCF 7a_100000210259_100000729493 [1,0,0,0,0,0|2,0,0]=3 2884 B11R0.3 CCCCCCOCCCCF 7a_100011995726_100000210314 [1,0,0,0,0,0|2,0,0]=3 2885 B11R0.3 CCCCCCOCCCCI 34a_200012148704_100000210314 [1,0,0,0,0,0|2,0,0]=3 2886 B11R0.3 CCCCCCOCCCCN 34a_100000750430_100000210314 [1,0,0,0,0,0|2,0,0]=3 2887 B11R0.3 CCCCCCOCCCCO 34a_100000210259_100011216708 [1,0,0,0,0,0|1,0,0]=2 2888 B11R0.3 CCCCCCOCCCCO 7a_100000210259_100000210776 [1,0,0,0,0,0|1,0,0]=2 2889 B11R0.3 CCCCCCOCCCNC 34a_100000213112_100000210314 [1,0,0,0,0,0|2,0,0]=3 2890 B11R0.3 CCCCCCOCCCOC 34a_100000210259_100000740836 [1,0,0,0,0,0|2,0,0]=3 2891 B11R0.3 CCCCCCOCCCOC 34a_100000740835_100000210314 [1,0,0,0,0,0|2,0,0]=3 2892 B11R0.3 CCCCCCOCCCOC 7a_100000210259_100000740836 [1,0,0,0,0,0|2,0,0]=3 2893 B11R0.3 CCCCCCOCCCSC 34a_100000690336_100000210314 [1,0,0,0,0,0|2,0,0]=3 2894 B11R0.3 CCCCCCOCCCSC 7a_100000690336_100000210314 [1,0,0,0,0,0|2,0,0]=3 2895 B11R0.3 CCCCCCOCCOCC 34a_100000210136_100000210314 [1,0,0,0,0,0|2,0,0]=3 2896 B11R0.3 CCCCCCOCCOCC 34a_100000210259_100000210147 [1,0,0,0,0,0|2,0,0]=3 2897 B11R0.3 CCCCCCOCCOCC 34a_100000691444_100000210202 [1,0,0,0,0,0|2,0,0]=3 2898 B11R0.3 CCCCCCOCCOCC 7a_100000210136_100000210314 [1,0,0,0,0,0|2,0,0]=3 2899 B11R0.3 CCCCCCOCCOCC 7a_100000210259_100011215890 [1,0,0,0,0,0|2,0,0]=3 2900 B11R0.3 CCCCCCOCCOCC 7a_100000691444_100000210202 [1,0,0,0,0,0|2,0,0]=3 2901 B11R0.3 CCCCCCOCCOCF 34a_100000691444_100015361967 [1,0,0,0,0,0|3,0,0]=4 2902 B11R0.3 CCCCCCOCCOCF 7a_100000691444_100015361967 [1,0,0,0,0,0|3,0,0]=4 2903 B11R0.3 CCCCCCOCCSCC 34a_100000210259_100000757381 [1,0,0,0,0,0|2,0,0]=3 2904 B11R0.3 CCCCCCOCCSCC 34a_100000212035_100000210314 [1,0,0,0,0,0|2,0,0]=3 2905 B11R0.3 CCCCCCOCCSCC 7a_100000210259_100000757381 [1,0,0,0,0,0|2,0,0]=3 2906 B11R0.3 CCCCCCOCCSCC 7a_100000212035_100000210314 [1,0,0,0,0,0|2,0,0]=3 2907 B11R0.3 CCCCCCSCC#CCO 62a_100000210314_200000047223 [1,0,0,0,0,0|1,0,2]=4 2908 B11R0.3 CCCCCCSCC#CCO 62a_200000047223_100000210757 [1,0,0,0,0,0|1,0,2]=4 2909 B11R0.3 CCCCCCSCCCC#N 62a_100000210314_100000687738 [1,0,0,0,0,0|2,0,1]=4 2910 B11R0.3 CCCCCCSCCCC#N 62a_100000687738_100000210757 [1,0,0,0,0,0|2,0,1]=4 2911 B11R0.3 CCCCCCSCCCC=O 62a_100000210314_200011292268 [1,0,0,0,0,0|1,0,2]=4 2912 B11R0.3 CCCCCCSCCCC=O 62a_200011292268_100000210757 [1,0,0,0,0,0|1,0,2]=4 2913 B11R0.3 CCCCCCSCCCCC 62a_100000210314_100000210326 [1,0,0,0,0,0|1,0,0]=2 2914 B11R0.3 CCCCCCSCCCCC 62a_100000210326_100000210757 [1,0,0,0,0,0|1,0,0]=2 2915 B11R0.3 CCCCCCSCCCCF 62a_100000210314_100000729493 [1,0,0,0,0,0|2,0,0]=3 2916 B11R0.3 CCCCCCSCCCCF 62a_100000729493_100000210757 [1,0,0,0,0,0|2,0,0]=3 2917 B11R0.3 CCCCCCSCCCCO 62a_100000210314_100000210776 [1,0,0,0,0,0|1,0,0]=2 2918 B11R0.3 CCCCCCSCCCCO 62a_100000210776_100000210757 [1,0,0,0,0,0|1,0,0]=2 2919 B11R0.3 CCCCCCSCCCOC 62a_100000210314_100000709357 [1,0,0,0,0,0|2,0,0]=3 2920 B11R0.3 CCCCCCSCCCOC 62a_100000709357_100000210757 [1,0,0,0,0,0|2,0,0]=3 2921 B11R0.3 CCCCCCSCCOCC 62a_100000210147_100000210757 [1,0,0,0,0,0|2,0,0]=3 2922 B11R0.3 CCCCCCSCCOCC 62a_100000210314_100011215890 [1,0,0,0,0,0|2,0,0]=3 2923 B11R0.3 CCCCCCSCCSCC 62a_100000210314_100000757381 [1,0,0,0,0,0|2,0,0]=3 2924 B11R0.3 CCCCCCSCCSCC 62a_100000757381_100000210757 [1,0,0,0,0,0|2,0,0]=3 2925 B11R0.3 CCCCCNCCCCC#N 2230a_100000209983_100000211819 [1,0,0,0,0,0|2,0,1]=4 2926 B11R0.3 CCCCCNCCCCC=O 2230a_100000209983_100000139335 [1,0,0,0,0,0|1,0,2]=4 2927 B11R0.3 CCCCCNCCCCCF 2230a_100000209983_100000729378 [1,0,0,0,0,0|2,0,0]=3 2928 B11R0.3 CCCCCNCCCCCO 2230a_100000209983_100000746330 [1,0,0,0,0,0|1,0,0]=2 2929 B11R0.3 CCCCCNCCCCCO 2230a_100000762737_100000210326 [1,0,0,0,0,0|1,0,0]=2 2930 B11R0.3 CCCCCNCCCCCO 34a_100000762737_100000718602 [1,0,0,0,0,0|1,0,0]=2 2931 B11R0.3 CCCCCNCCCCOC 2230a_100000209983_100000730899 [1,0,0,0,0,0|2,0,0]=3 2932 B11R0.3 CCCCCNCCCOCC 2230a_100000209983_100012232248 [1,0,0,0,0,0|2,0,0]=3 2933 B11R0.3 CCCCCNCCCOCC 2230a_100000210961_100000210326 [1,0,0,0,0,0|2,0,0]=3 2934 B11R0.3 CCCCCNCCCOCC 34a_100000210961_100000718602 [1,0,0,0,0,0|2,0,0]=3 2935 B11R0.3 CCCCCNCCOCCC 2230a_100000209983_100011215938 [1,0,0,0,0,0|2,0,0]=3 2936 B11R0.3 CCCCCNCCOCCC 2230a_100161115042_100000210326 [1,0,0,0,0,0|2,0,0]=3 2937 B11R0.3 CCCCCNCCOCCC 34a_100000224656_100000210303 [1,0,0,0,0,0|2,0,0]=3 2938 B11R0.3 CCCCCNCCOCCC 34a_100161115042_100000718602 [1,0,0,0,0,0|2,0,0]=3 2939 B11R0.3 CCCCCNCCOCCF 34a_100000224656_100011217306 [1,0,0,0,0,0|3,0,0]=4 2940 B11R0.3 CCCCCNCCOCCO 2230a_100000209983_100011215305 [1,0,0,0,0,0|2,0,0]=3 2941 B11R0.3 CCCCCNCCOCCO 2230a_100000211614_100000210326 [1,0,0,0,0,0|2,0,0]=3 2942 B11R0.3 CCCCCNCCOCCO 34a_100000211614_100000718602 [1,0,0,0,0,0|2,0,0]=3 2943 B11R0.3 CCCCCNCCOCCO 34a_100000224656_100000211926 [1,0,0,0,0,0|2,0,0]=3 2944 B11R0.3 CCCCCNCCOCSC 34a_100000224656_100011218213 [1,0,0,0,0,0|3,0,0]=4 2945 B11R0.3 CCCCCNCCSCCC 2230a_100020603323_100000210326 [1,0,0,0,0,0|2,0,0]=3 2946 B11R0.3 CCCCCNCCSCCO 2230a_100011219999_100000210326 [1,0,0,0,0,0|2,0,0]=3 2947 B11R0.3 CCCCCNCOCCCC 2230a_100000209983_100011995733 [1,0,0,0,0,0|2,0,0]=3 2948 B11R0.3 CCCCCNCOCCOC 2230a_100000209983_100000231047 [1,0,0,0,0,0|3,0,0]=4 2949 B11R0.3 CCCCCOCCCCC#N 7a_100000210253_100000211819 [1,0,0,0,0,0|2,0,1]=4 2950 B11R0.3 CCCCCOCCCCC=O 7a_100000210253_100000139335 [1,0,0,0,0,0|1,0,2]=4 2951 B11R0.3 CCCCCOCCCCCBr 34a_100000746331_100000718602 [1,0,0,0,0,0|2,0,0]=3 2952 B11R0.3 CCCCCOCCCCCBr 7a_100000746331_100000210326 [1,0,0,0,0,0|2,0,0]=3 2953 B11R0.3 CCCCCOCCCCCCl 34a_100000746330_100000718602 [1,0,0,0,0,0|2,0,0]=3 2954 B11R0.3 CCCCCOCCCCCCl 7a_100000746330_100000210326 [1,0,0,0,0,0|2,0,0]=3 2955 B11R0.3 CCCCCOCCCCCF 34a_100000210253_100000729378 [1,0,0,0,0,0|2,0,0]=3 2956 B11R0.3 CCCCCOCCCCCF 7a_100000210253_100000729378 [1,0,0,0,0,0|2,0,0]=3 2957 B11R0.3 CCCCCOCCCCCI 34a_200012148887_100000718602 [1,0,0,0,0,0|2,0,0]=3 2958 B11R0.3 CCCCCOCCCCCI 7a_200012148887_100000210326 [1,0,0,0,0,0|2,0,0]=3 2959 B11R0.3 CCCCCOCCCCCN 34a_100000762737_100000718602 [1,0,0,0,0,0|2,0,0]=3 2960 B11R0.3 CCCCCOCCCCCO 34a_100000210253_100000746330 [1,0,0,0,0,0|1,0,0]=2 2961 B11R0.3 CCCCCOCCCCCO 7a_100000210253_100000746330 [1,0,0,0,0,0|1,0,0]=2 2962 B11R0.3 CCCCCOCCCCOC 34a_100000210253_100000755781 [1,0,0,0,0,0|2,0,0]=3 2963 B11R0.3 CCCCCOCCCCOC 34a_100000740925_100000718602 [1,0,0,0,0,0|2,0,0]=3 2964 B11R0.3 CCCCCOCCCCOC 7a_100000210253_100000730899 [1,0,0,0,0,0|2,0,0]=3 2965 B11R0.3 CCCCCOCCCCSC 34a_100011217163_100000718602 [1,0,0,0,0,0|2,0,0]=3 2966 B11R0.3 CCCCCOCCCCSC 7a_100011217163_100000210326 [1,0,0,0,0,0|2,0,0]=3 2967 B11R0.3 CCCCCOCCCOCC 34a_100000210253_100012232248 [1,0,0,0,0,0|2,0,0]=3 2968 B11R0.3 CCCCCOCCCOCC 34a_100000757476_100000718602 [1,0,0,0,0,0|2,0,0]=3 2969 B11R0.3 CCCCCOCCCOCC 7a_100000210253_100012232248 [1,0,0,0,0,0|2,0,0]=3 2970 B11R0.3 CCCCCOCCCOCC 7a_100000757476_100000210326 [1,0,0,0,0,0|2,0,0]=3 2971 B11R0.3 CCCCCOCCCSCC 34a_100011216438_100000718602 [1,0,0,0,0,0|2,0,0]=3 2972 B11R0.3 CCCCCOCCCSCC 7a_100011216438_100000210326 [1,0,0,0,0,0|2,0,0]=3 2973 B11R0.3 CCCCCOCCOCCBr 34a_100000692535_100000718602 [1,0,0,0,0,0|3,0,0]=4 2974 B11R0.3 CCCCCOCCOCCBr 7a_100000692535_100000210326 [1,0,0,0,0,0|3,0,0]=4 2975 B11R0.3 CCCCCOCCOCCC 34a_100000210253_100011215938 [1,0,0,0,0,0|2,0,0]=3 2976 B11R0.3 CCCCCOCCOCCC 34a_100000752267_100000718602 [1,0,0,0,0,0|2,0,0]=3 2977 B11R0.3 CCCCCOCCOCCC 34a_100011215259_100000210303 [1,0,0,0,0,0|2,0,0]=3 2978 B11R0.3 CCCCCOCCOCCC 7a_100000210253_100011215938 [1,0,0,0,0,0|2,0,0]=3 2979 B11R0.3 CCCCCOCCOCCC 7a_100000752267_100000210326 [1,0,0,0,0,0|2,0,0]=3 2980 B11R0.3 CCCCCOCCOCCC 7a_100011215259_100000210303 [1,0,0,0,0,0|2,0,0]=3 2981 B11R0.3 CCCCCOCCOCCCl 34a_100011215305_100000718602 [1,0,0,0,0,0|3,0,0]=4 2982 B11R0.3 CCCCCOCCOCCCl 7a_100011215305_100000210326 [1,0,0,0,0,0|3,0,0]=4 2983 B11R0.3 CCCCCOCCOCCF 34a_100011215259_100011217306 [1,0,0,0,0,0|3,0,0]=4 2984 B11R0.3 CCCCCOCCOCCF 34a_200015357709_100000718602 [1,0,0,0,0,0|3,0,0]=4 2985 B11R0.3 CCCCCOCCOCCF 7a_100011215259_100011217306 [1,0,0,0,0,0|3,0,0]=4 2986 B11R0.3 CCCCCOCCOCCF 7a_200015357709_100000210326 [1,0,0,0,0,0|3,0,0]=4 2987 B11R0.3 CCCCCOCCOCCI 34a_100012149058_100000718602 [1,0,0,0,0,0|3,0,0]=4 2988 B11R0.3 CCCCCOCCOCCI 7a_100012149058_100000210326 [1,0,0,0,0,0|3,0,0]=4 2989 B11R0.3 CCCCCOCCOCCN 34a_100000211614_100000718602 [1,0,0,0,0,0|3,0,0]=4 2990 B11R0.3 CCCCCOCCOCCO 34a_100000210253_100000692535 [1,0,0,0,0,0|2,0,0]=3 2991 B11R0.3 CCCCCOCCOCCO 34a_100011215259_100000211926 [1,0,0,0,0,0|2,0,0]=3 2992 B11R0.3 CCCCCOCCOCCO 7a_100000210253_100011215305 [1,0,0,0,0,0|2,0,0]=3 2993 B11R0.3 CCCCCOCCOCCO 7a_100011215259_100000211926 [1,0,0,0,0,0|2,0,0]=3 2994 B11R0.3 CCCCCOCCOCSC 34a_100011215259_100011218213 [1,0,0,0,0,0|3,0,0]=4 2995 B11R0.3 CCCCCOCCSCCC 34a_200000230433_100000718602 [1,0,0,0,0,0|2,0,0]=3 2996 B11R0.3 CCCCCOCCSCCC 7a_200000230433_100000210326 [1,0,0,0,0,0|2,0,0]=3 2997 B11R0.3 CCCCCOCOCCCC 34a_100000210253_100011995733 [1,0,0,0,0,0|2,0,0]=3 2998 B11R0.3 CCCCCSCCCCC#N 62a_100000210326_100000211819 [1,0,0,0,0,0|2,0,1]=4 2999 B11R0.3 CCCCCSCCCCC#N 62a_100011219923_100000210326 [1,0,0,0,0,0|2,0,1]=4 3000 B11R0.3 CCCCCSCCCCC=O 62a_100000139335_100000210326 [1,0,0,0,0,0|1,0,2]=4 3001 B11R0.3 CCCCCSCCCCC=O 62a_100000210326_100000139335 [1,0,0,0,0,0|1,0,2]=4 3002 B11R0.3 CCCCCSCCCCCF 62a_100000210326_100000729378 [1,0,0,0,0,0|2,0,0]=3 3003 B11R0.3 CCCCCSCCCCCF 62a_100000729378_100000210326 [1,0,0,0,0,0|2,0,0]=3 3004 B11R0.3 CCCCCSCCCCCO 62a_100000210326_100000746330 [1,0,0,0,0,0|1,0,0]=2 3005 B11R0.3 CCCCCSCCCCCO 62a_100000746330_100000210326 [1,0,0,0,0,0|1,0,0]=2 3006 B11R0.3 CCCCCSCCCCOC 62a_100000210326_100000730899 [1,0,0,0,0,0|2,0,0]=3 3007 B11R0.3 CCCCCSCCCCOC 62a_100000730899_100000210326 [1,0,0,0,0,0|2,0,0]=3 3008 B11R0.3 CCCCCSCCCOCC 62a_100000210326_100012232248 [1,0,0,0,0,0|2,0,0]=3 3009 B11R0.3 CCCCCSCCCOCC 62a_100012232248_100000210326 [1,0,0,0,0,0|2,0,0]=3 3010 B11R0.3 CCCCCSCCOCCC 62a_100000210326_100011215938 [1,0,0,0,0,0|2,0,0]=3 3011 B11R0.3 CCCCCSCCOCCC 62a_100011215938_100000210326 [1,0,0,0,0,0|2,0,0]=3 3012 B11R0.3 CCCCCSCCOCCO 62a_100000210326_100011215305 [1,0,0,0,0,0|2,0,0]=3 3013 B11R0.3 CCCCCSCCOCCO 62a_100011215305_100000210326 [1,0,0,0,0,0|2,0,0]=3 3014 B11R0.3 CCCCCSCOCCCC 62a_100000210326_100011995733 [1,0,0,0,0,0|2,0,0]=3 3015 B11R0.3 CCCCCSCOCCCC 62a_100011995733_100000210326 [1,0,0,0,0,0|2,0,0]=3 3016 B11R0.3 CCCCCSCOCCOC 62a_100000210326_100000231047 [1,0,0,0,0,0|3,0,0]=4 3017 B11R0.3 CCCCCSCOCCOC 62a_100000231047_100000210326 [1,0,0,0,0,0|3,0,0]=4 3018 B11R0.3 CCCCNCCCCCC#N 2230a_100000102301_100009813376 [1,0,0,0,0,0|2,0,1]=4 3019 B11R0.3 CCCCNCCCCCC#N 7a_106832991798_100009813376 [1,0,0,0,0,0|2,0,1]=4 3020 B11R0.3 CCCCNCCCCCC=O 2230a_100000102301_100000139337 [1,0,0,0,0,0|1,0,2]=4 3021 B11R0.3 CCCCNCCCCCC=O 7a_106832991798_100000139337 [1,0,0,0,0,0|1,0,2]=4 3022 B11R0.3 CCCCNCCCCCCF 2230a_100000102301_100015922095 [1,0,0,0,0,0|2,0,0]=3 3023 B11R0.3 CCCCNCCCCCCF 7a_106832991798_100015922095 [1,0,0,0,0,0|2,0,0]=3 3024 B11R0.3 CCCCNCCCCCCO 2230a_100000102301_100000766143 [1,0,0,0,0,0|1,0,0]=2 3025 B11R0.3 CCCCNCCCCCCO 2230a_100000686447_100000210211 [1,0,0,0,0,0|1,0,0]=2 3026 B11R0.3 CCCCNCCCCCCO 34a_100000686447_100000210210 [1,0,0,0,0,0|1,0,0]=2 3027 B11R0.3 CCCCNCCCCCCO 7a_106832991798_100000766143 [1,0,0,0,0,0|1,0,0]=2 3028 B11R0.3 CCCCNCCCCCOC 2230a_100000747528_100000210211 [1,0,0,0,0,0|2,0,0]=3 3029 B11R0.3 CCCCNCCCCCOC 34a_100000747528_100000210210 [1,0,0,0,0,0|2,0,0]=3 3030 B11R0.3 CCCCNCCCCOCC 34a_200011216965_100000210202 [1,0,0,0,0,0|2,0,0]=3 3031 B11R0.3 CCCCNCCCCOCF 34a_200011216965_100015361967 [1,0,0,0,0,0|3,0,0]=4 3032 B11R0.3 CCCCNCCCOCCC 2230a_100011217757_100000210211 [1,0,0,0,0,0|2,0,0]=3 3033 B11R0.3 CCCCNCCCOCCC 34a_100011217757_100000210210 [1,0,0,0,0,0|2,0,0]=3 3034 B11R0.3 CCCCNCCOCCCC 2230a_100000102301_100000743108 [1,0,0,0,0,0|2,0,0]=3 3035 B11R0.3 CCCCNCCOCCCC 7a_106832991798_100000743108 [1,0,0,0,0,0|2,0,0]=3 3036 B11R0.3 CCCCNCCOCCOC 2230a_100000102301_100000695917 [1,0,0,0,0,0|3,0,0]=4 3037 B11R0.3 CCCCNCCOCCOC 2230a_100000745349_100000210211 [1,0,0,0,0,0|3,0,0]=4 3038 B11R0.3 CCCCNCCOCCOC 34a_100000745349_100000210210 [1,0,0,0,0,0|3,0,0]=4 3039 B11R0.3 CCCCNCCOCCOC 7a_106832991798_100000695917 [1,0,0,0,0,0|3,0,0]=4 3040 B11R0.3 CCCCNCCSCCCC 2230a_100025743550_100000210211 [1,0,0,0,0,0|2,0,0]=3 3041 B11R0.3 CCCCNN=CCCCCO 4a_100025702795_100000031955 [1,0,0,0,0,0|2,0,1]=4 3042 B11R0.3 CCCCOCCCCCC#N 7a_100000210227_100009813376 [1,0,0,0,0,0|2,0,1]=4 3043 B11R0.3 CCCCOCCCCCC=O 7a_100000210227_100000139337 [1,0,0,0,0,0|1,0,2]=4 3044 B11R0.3 CCCCOCCCCCCBr 34a_100011215345_100000210210 [1,0,0,0,0,0|2,0,0]=3 3045 B11R0.3 CCCCOCCCCCCBr 7a_100011215345_100000210211 [1,0,0,0,0,0|2,0,0]=3 3046 B11R0.3 CCCCOCCCCCCCl 34a_100000766143_100000210210 [1,0,0,0,0,0|2,0,0]=3 3047 B11R0.3 CCCCOCCCCCCCl 7a_100000766143_100000210211 [1,0,0,0,0,0|2,0,0]=3 3048 B11R0.3 CCCCOCCCCCCF 34a_100000210227_100015922095 [1,0,0,0,0,0|2,0,0]=3 3049 B11R0.3 CCCCOCCCCCCF 34a_100000732779_100000210210 [1,0,0,0,0,0|2,0,0]=3 3050 B11R0.3 CCCCOCCCCCCF 7a_100000210227_100015922095 [1,0,0,0,0,0|2,0,0]=3 3051 B11R0.3 CCCCOCCCCCCF 7a_100000732779_100000210211 [1,0,0,0,0,0|2,0,0]=3 3052 B11R0.3 CCCCOCCCCCCN 34a_100000686447_100000210210 [1,0,0,0,0,0|2,0,0]=3 3053 B11R0.3 CCCCOCCCCCCO 34a_100000210227_100000766143 [1,0,0,0,0,0|1,0,0]=2 3054 B11R0.3 CCCCOCCCCCCO 7a_100000210227_100000766143 [1,0,0,0,0,0|1,0,0]=2 3055 B11R0.3 CCCCOCCCCCNC 34a_100000722520_100000210210 [1,0,0,0,0,0|2,0,0]=3 3056 B11R0.3 CCCCOCCCCOCC 34a_200000760531_100000210202 [1,0,0,0,0,0|2,0,0]=3 3057 B11R0.3 CCCCOCCCCOCC 7a_200000760531_100000210202 [1,0,0,0,0,0|2,0,0]=3 3058 B11R0.3 CCCCOCCCCOCF 34a_200000760531_100015361967 [1,0,0,0,0,0|3,0,0]=4 3059 B11R0.3 CCCCOCCCCOCF 7a_200000760531_100015361967 [1,0,0,0,0,0|3,0,0]=4 3060 B11R0.3 CCCCOCCCNCCC 2230a_200000211371_100000210303 [1,0,0,0,0,0|2,0,0]=3 3061 B11R0.3 CCCCOCCCNCCC 34a_200000211371_100000210303 [1,0,0,0,0,0|2,0,0]=3 3062 B11R0.3 CCCCOCCCNCCF 2230a_200000211371_100011217306 [1,0,0,0,0,0|3,0,0]=4 3063 B11R0.3 CCCCOCCCNCCF 34a_200000211371_100011217306 [1,0,0,0,0,0|3,0,0]=4 3064 B11R0.3 CCCCOCCCNCCO 2230a_200000211371_100000211926 [1,0,0,0,0,0|2,0,0]=3 3065 B11R0.3 CCCCOCCCNCCO 34a_200000211371_100000211926 [1,0,0,0,0,0|2,0,0]=3 3066 B11R0.3 CCCCOCCCNCOC 2230a_200000211371_100000766300 [1,0,0,0,0,0|3,0,0]=4 3067 B11R0.3 CCCCOCCCNCSC 2230a_200000211371_100011218213 [1,0,0,0,0,0|3,0,0]=4 3068 B11R0.3 CCCCOCCCNCSC 34a_200000211371_100011218213 [1,0,0,0,0,0|3,0,0]=4 3069 B11R0.3 CCCCOCCCOCCC 34a_200011215613_100000210303 [1,0,0,0,0,0|2,0,0]=3 3070 B11R0.3 CCCCOCCCOCCC 7a_200011215613_100000210303 [1,0,0,0,0,0|2,0,0]=3 3071 B11R0.3 CCCCOCCCOCCF 34a_200011215613_100011217306 [1,0,0,0,0,0|3,0,0]=4 3072 B11R0.3 CCCCOCCCOCCF 7a_200011215613_100011217306 [1,0,0,0,0,0|3,0,0]=4 3073 B11R0.3 CCCCOCCCOCCO 34a_200011215613_100000211926 [1,0,0,0,0,0|2,0,0]=3 3074 B11R0.3 CCCCOCCCOCCO 7a_200011215613_100000211926 [1,0,0,0,0,0|2,0,0]=3 3075 B11R0.3 CCCCOCCCOCSC 34a_200011215613_100011218213 [1,0,0,0,0,0|3,0,0]=4 3076 B11R0.3 CCCCOCCNCCCF 2230a_100015189416_100000743108 [1,0,0,0,0,0|3,0,0]=4 3077 B11R0.3 CCCCOCCNCCCF 34a_100015189416_100000743108 [1,0,0,0,0,0|3,0,0]=4 3078 B11R0.3 CCCCOCCNCCOC 2230a_100000209980_100000743108 [1,0,0,0,0,0|3,0,0]=4 3079 B11R0.3 CCCCOCCNCCSC 2230a_100020590264_100000743108 [1,0,0,0,0,0|3,0,0]=4 3080 B11R0.3 CCCCOCCOCCCBr 34a_100011217188_100000743108 [1,0,0,0,0,0|3,0,0]=4 3081 B11R0.3 CCCCOCCOCCCC 34a_100000210227_100000743108 [1,0,0,0,0,0|2,0,0]=3 3082 B11R0.3 CCCCOCCOCCCC 34a_100000210238_100000210210 [1,0,0,0,0,0|2,0,0]=3 3083 B11R0.3 CCCCOCCOCCCC 7a_100000210227_100000743108 [1,0,0,0,0,0|2,0,0]=3 3084 B11R0.3 CCCCOCCOCCCC 7a_100000210238_100000210211 [1,0,0,0,0,0|2,0,0]=3 3085 B11R0.3 CCCCOCCOCCCCl 34a_100000230001_100000743108 [1,0,0,0,0,0|3,0,0]=4 3086 B11R0.3 CCCCOCCOCCCF 34a_100000210238_100011934791 [1,0,0,0,0,0|3,0,0]=4 3087 B11R0.3 CCCCOCCOCCCF 34a_100000759539_100000743108 [1,0,0,0,0,0|3,0,0]=4 3088 B11R0.3 CCCCOCCOCCCF 7a_100000210238_100011934791 [1,0,0,0,0,0|3,0,0]=4 3089 B11R0.3 CCCCOCCOCCCN 34a_100000182051_100000743108 [1,0,0,0,0,0|3,0,0]=4 3090 B11R0.3 CCCCOCCOCCCO 34a_100000210238_100000230001 [1,0,0,0,0,0|2,0,0]=3 3091 B11R0.3 CCCCOCCOCCCO 7a_100000210238_100011215043 [1,0,0,0,0,0|2,0,0]=3 3092 B11R0.3 CCCCOCCOCCNC 34a_100000228057_100000210210 [1,0,0,0,0,0|3,0,0]=4 3093 B11R0.3 CCCCOCCOCCOC 34a_100000210227_100000695917 [1,0,0,0,0,0|3,0,0]=4 3094 B11R0.3 CCCCOCCOCCOC 34a_100000210237_100000743108 [1,0,0,0,0,0|3,0,0]=4 3095 B11R0.3 CCCCOCCOCCOC 34a_100000210238_100011201679 [1,0,0,0,0,0|3,0,0]=4 3096 B11R0.3 CCCCOCCOCCOC 34a_100011215163_100000210210 [1,0,0,0,0,0|3,0,0]=4 3097 B11R0.3 CCCCOCCOCCOC 34a_100011215186_200000210301 [1,0,0,0,0,0|3,0,0]=4 3098 B11R0.3 CCCCOCCOCCOC 7a_100000210227_100000695917 [1,0,0,0,0,0|3,0,0]=4 3099 B11R0.3 CCCCOCCOCCOC 7a_100000210238_100000233755 [1,0,0,0,0,0|3,0,0]=4 3100 B11R0.3 CCCCOCCOCCOC 7a_100011215163_100000210211 [1,0,0,0,0,0|3,0,0]=4 3101 B11R0.3 CCCCOCCOCCOC 7a_100011215186_200000210301 [1,0,0,0,0,0|3,0,0]=4 3102 B11R0.3 CCCCOCCOCCO[13CH3] 34a_100011215186_200025704644 [1,0,0,0,0,0|3,0,0]=4 3103 B11R0.3 CCCCOCCOCCO[13CH3] 7a_100011215186_200025704644 [1,0,0,0,0,0|3,0,0]=4 3104 B11R0.3 CCCCOCCOCCSC 34a_100000210238_100000212216 [1,0,0,0,0,0|3,0,0]=4 3105 B11R0.3 CCCCOCCOCCSC 34a_100000230434_100000743108 [1,0,0,0,0,0|3,0,0]=4 3106 B11R0.3 CCCCOCCOCCSC 7a_100000210238_100000212216 [1,0,0,0,0,0|3,0,0]=4 3107 B11R0.3 CCCCOCCOCCSC 7a_100000230434_100000743108 [1,0,0,0,0,0|3,0,0]=4 3108 B11R0.3 CCCCOCCSCCCC 34a_200000230436_100000210210 [1,0,0,0,0,0|2,0,0]=3 3109 B11R0.3 CCCCOCCSCCCC 62a_100000210211_100000743108 [1,0,0,0,0,0|2,0,0]=3 3110 B11R0.3 CCCCOCCSCCCC 62a_100000743108_100000210210 [1,0,0,0,0,0|2,0,0]=3 3111 B11R0.3 CCCCOCCSCCCC 7a_200000230436_100000210211 [1,0,0,0,0,0|2,0,0]=3 3112 B11R0.3 CCCCOCCSCCCF 62a_100000743108_100011934791 [1,0,0,0,0,0|3,0,0]=4 3113 B11R0.3 CCCCOCCSCCCF 62a_100011934791_100000743108 [1,0,0,0,0,0|3,0,0]=4 3114 B11R0.3 CCCCOCCSCCCO 62a_100000743108_100011215043 [1,0,0,0,0,0|2,0,0]=3 3115 B11R0.3 CCCCOCCSCCCO 62a_100011215043_100000743108 [1,0,0,0,0,0|2,0,0]=3 3116 B11R0.3 CCCCOCCSCCOC 62a_100000233755_100000743108 [1,0,0,0,0,0|3,0,0]=4 3117 B11R0.3 CCCCOCCSCCOC 62a_100000743108_100000233755 [1,0,0,0,0,0|3,0,0]=4 3118 B11R0.3 CCCCOCCSCCSC 62a_100000212216_100000743108 [1,0,0,0,0,0|3,0,0]=4 3119 B11R0.3 CCCCOCCSCCSC 62a_100000743108_100000751147 [1,0,0,0,0,0|3,0,0]=4 3120 B11R0.3 CCCCOCCSCOCC 62a_100000739092_100000743108 [1,0,0,0,0,0|3,0,0]=4 3121 B11R0.3 CCCCOCCSCOCC 62a_100000743108_100000739092 [1,0,0,0,0,0|3,0,0]=4 3122 B11R0.3 CCCCOCNCCCCO 2230a_100000750430_100011995733 [1,0,0,0,0,0|2,0,0]=3 3123 B11R0.3 CCCCOCNCCCCO 34a_100000750430_100011995733 [1,0,0,0,0,0|2,0,0]=3 3124 B11R0.3 CCCCOCNCCCOC 34a_100150723488_100011995733 [1,0,0,0,0,0|3,0,0]=4 3125 B11R0.3 CCCCOCNCCCSC 2230a_100000749238_100011995733 [1,0,0,0,0,0|3,0,0]=4 3126 B11R0.3 CCCCOCNCCOCC 2230a_102516460346_100011995733 [1,0,0,0,0,0|3,0,0]=4 3127 B11R0.3 CCCCOCNCCOCC 34a_102516460346_100011995733 [1,0,0,0,0,0|3,0,0]=4 3128 B11R0.3 CCCCOCNCCSCC 2230a_100000106463_100011995733 [1,0,0,0,0,0|3,0,0]=4 3129 B11R0.3 CCCCOCOCCCCBr 34a_100011216708_100011995733 [1,0,0,0,0,0|3,0,0]=4 3130 B11R0.3 CCCCOCOCCCCCl 34a_100000210776_100011995733 [1,0,0,0,0,0|3,0,0]=4 3131 B11R0.3 CCCCOCOCCCCF 34a_100011995726_100011995733 [1,0,0,0,0,0|3,0,0]=4 3132 B11R0.3 CCCCOCOCCCCI 34a_200012148704_100011995733 [1,0,0,0,0,0|3,0,0]=4 3133 B11R0.3 CCCCOCOCCCCN 34a_100000750430_100011995733 [1,0,0,0,0,0|3,0,0]=4 3134 B11R0.3 CCCCOCOCCCNC 34a_100000213112_100011995733 [1,0,0,0,0,0|3,0,0]=4 3135 B11R0.3 CCCCOCOCCCOC 34a_100000740835_100011995733 [1,0,0,0,0,0|3,0,0]=4 3136 B11R0.3 CCCCOCOCCCSC 34a_100000690336_100011995733 [1,0,0,0,0,0|3,0,0]=4 3137 B11R0.3 CCCCOCOCCOCC 34a_100000210136_100011995733 [1,0,0,0,0,0|3,0,0]=4 3138 B11R0.3 CCCCOCOCCSCC 34a_100000212035_100011995733 [1,0,0,0,0,0|3,0,0]=4 3139 B11R0.3 CCCCOCSCCCCF 62a_100000729493_100011995733 [1,0,0,0,0,0|3,0,0]=4 3140 B11R0.3 CCCCOCSCCCCF 62a_100011995733_100000729493 [1,0,0,0,0,0|3,0,0]=4 3141 B11R0.3 CCCCOCSCCCCO 62a_100000210776_100011995733 [1,0,0,0,0,0|2,0,0]=3 3142 B11R0.3 CCCCOCSCCCCO 62a_100011995733_100000210776 [1,0,0,0,0,0|2,0,0]=3 3143 B11R0.3 CCCCOCSCCCOC 62a_100000709357_100011995733 [1,0,0,0,0,0|3,0,0]=4 3144 B11R0.3 CCCCOCSCCCOC 62a_100011995733_100000709357 [1,0,0,0,0,0|3,0,0]=4 3145 B11R0.3 CCCCOCSCCOCC 62a_100000210147_100011995733 [1,0,0,0,0,0|3,0,0]=4 3146 B11R0.3 CCCCOCSCCOCC 62a_100011995733_100011215890 [1,0,0,0,0,0|3,0,0]=4 3147 B11R0.3 CCCCOCSCCSCC 62a_100000757381_100011995733 [1,0,0,0,0,0|3,0,0]=4 3148 B11R0.3 CCCCOCSCCSCC 62a_100011995733_100000757381 [1,0,0,0,0,0|3,0,0]=4 3149 B11R0.3 CCCCSCCCCCC#N 62a_100000210211_100009813376 [1,0,0,0,0,0|2,0,1]=4 3150 B11R0.3 CCCCSCCCCCC#N 62a_100009813376_100000210210 [1,0,0,0,0,0|2,0,1]=4 3151 B11R0.3 CCCCSCCCCCC=O 62a_100000139337_100000210210 [1,0,0,0,0,0|1,0,2]=4 3152 B11R0.3 CCCCSCCCCCC=O 62a_100000210211_100000139337 [1,0,0,0,0,0|1,0,2]=4 3153 B11R0.3 CCCCSCCCCCCF 62a_100000210211_100015922095 [1,0,0,0,0,0|2,0,0]=3 3154 B11R0.3 CCCCSCCCCCCF 62a_100015922095_100000210210 [1,0,0,0,0,0|2,0,0]=3 3155 B11R0.3 CCCCSCCCCCCO 62a_100000210211_100000766143 [1,0,0,0,0,0|1,0,0]=2 3156 B11R0.3 CCCCSCCCCCCO 62a_100000766143_100000210210 [1,0,0,0,0,0|1,0,0]=2 3157 B11R0.3 CCCCSCCNCCCF 2230a_100025743550_100011934791 [1,0,0,0,0,0|3,0,0]=4 3158 B11R0.3 CCCCSCCNCCCO 2230a_100025743550_100000230001 [1,0,0,0,0,0|2,0,0]=3 3159 B11R0.3 CCCCSCCNCCOC 2230a_100025743550_100011201679 [1,0,0,0,0,0|3,0,0]=4 3160 B11R0.3 CCCCSCCNCCSC 2230a_100025743550_100000751147 [1,0,0,0,0,0|3,0,0]=4 3161 B11R0.3 CCCCSCCOCCCF 34a_200000230436_100011934791 [1,0,0,0,0,0|3,0,0]=4 3162 B11R0.3 CCCCSCCOCCCF 7a_200000230436_100011934791 [1,0,0,0,0,0|3,0,0]=4 3163 B11R0.3 CCCCSCCOCCCO 34a_200000230436_100000230001 [1,0,0,0,0,0|2,0,0]=3 3164 B11R0.3 CCCCSCCOCCCO 7a_200000230436_100011215043 [1,0,0,0,0,0|2,0,0]=3 3165 B11R0.3 CCCCSCCOCCOC 34a_200000230436_100011201679 [1,0,0,0,0,0|3,0,0]=4 3166 B11R0.3 CCCCSCCOCCOC 62a_100000210211_100000695917 [1,0,0,0,0,0|3,0,0]=4 3167 B11R0.3 CCCCSCCOCCOC 62a_100000695917_100000210210 [1,0,0,0,0,0|3,0,0]=4 3168 B11R0.3 CCCCSCCOCCOC 7a_200000230436_100000233755 [1,0,0,0,0,0|3,0,0]=4 3169 B11R0.3 CCCCSCCOCCSC 34a_200000230436_100000212216 [1,0,0,0,0,0|3,0,0]=4 3170 B11R0.3 CCCCSCCOCCSC 7a_200000230436_100000212216 [1,0,0,0,0,0|3,0,0]=4 3171 B11R0.3 CCCNCCCCCCCO 2230a_100011996573_100000210303 [1,0,0,0,0,0|1,0,0]=2 3172 B11R0.3 CCCNCCCCCCCO 34a_100011996573_100000210303 [1,0,0,0,0,0|1,0,0]=2 3173 B11R0.3 CCCNCCCOCCCO 2230a_100011310245_100000210303 [1,0,0,0,0,0|2,0,0]=3 3174 B11R0.3 CCCNCCCOCCCO 34a_100011310245_100000210303 [1,0,0,0,0,0|2,0,0]=3 3175 B11R0.3 CCCNCCCOCCOC 2230a_100000206027_100000210303 [1,0,0,0,0,0|3,0,0]=4 3176 B11R0.3 CCCNCCCOCCOC 34a_100000206027_100000210303 [1,0,0,0,0,0|3,0,0]=4 3177 B11R0.3 CCCNCCOCCOCC 2230a_100102712874_100000210303 [1,0,0,0,0,0|3,0,0]=4 3178 B11R0.3 CCCNCCOCCOCC 34a_100102712874_100000210303 [1,0,0,0,0,0|3,0,0]=4 3179 B11R0.3 CCCOCCCCCCCBr 34a_100000760002_100000210303 [1,0,0,0,0,0|2,0,0]=3 3180 B11R0.3 CCCOCCCCCCCBr 7a_100000760002_100000210303 [1,0,0,0,0,0|2,0,0]=3 3181 B11R0.3 CCCOCCCCCCCN 34a_100011996573_100000210303 [1,0,0,0,0,0|2,0,0]=3 3182 B11R0.3 CCCOCCCCCCCO 34a_100000210258_100000760002 [1,0,0,0,0,0|1,0,0]=2 3183 B11R0.3 CCCOCCCCCCOC 34a_100000210258_100011998445 [1,0,0,0,0,0|2,0,0]=3 3184 B11R0.3 CCCOCCCCCCOC 34a_200012092642_100000210303 [1,0,0,0,0,0|2,0,0]=3 3185 B11R0.3 CCCOCCCCCCOC 7a_200012092642_100000210303 [1,0,0,0,0,0|2,0,0]=3 3186 B11R0.3 CCCOCCCNCCCF 2230a_100011217757_100011934791 [1,0,0,0,0,0|3,0,0]=4 3187 B11R0.3 CCCOCCCNCCCF 34a_100011217757_100011934791 [1,0,0,0,0,0|3,0,0]=4 3188 B11R0.3 CCCOCCCNCCCO 2230a_100011217757_100000230001 [1,0,0,0,0,0|2,0,0]=3 3189 B11R0.3 CCCOCCCNCCCO 34a_100011217757_100000230001 [1,0,0,0,0,0|2,0,0]=3 3190 B11R0.3 CCCOCCCNCCOC 2230a_100011217757_100011201679 [1,0,0,0,0,0|3,0,0]=4 3191 B11R0.3 CCCOCCCNCCOC 34a_100011217757_100011201679 [1,0,0,0,0,0|3,0,0]=4 3192 B11R0.3 CCCOCCCNCCSC 2230a_100011217757_100000751147 [1,0,0,0,0,0|3,0,0]=4 3193 B11R0.3 CCCOCCCNCCSC 34a_100011217757_100000212216 [1,0,0,0,0,0|3,0,0]=4 3194 B11R0.3 CCCOCCCOCCCN 34a_100011310245_100000210303 [1,0,0,0,0,0|3,0,0]=4 3195 B11R0.3 CCCOCCCOCCOC 34a_100000210258_100011216529 [1,0,0,0,0,0|3,0,0]=4 3196 B11R0.3 CCCOCCNCCCCF 2230a_100161115042_100000729493 [1,0,0,0,0,0|3,0,0]=4 3197 B11R0.3 CCCOCCNCCCCF 34a_100161115042_100000729493 [1,0,0,0,0,0|3,0,0]=4 3198 B11R0.3 CCCOCCNCCCCO 2230a_100000750430_100011215938 [1,0,0,0,0,0|2,0,0]=3 3199 B11R0.3 CCCOCCNCCCCO 2230a_100161115042_100000210776 [1,0,0,0,0,0|2,0,0]=3 3200 B11R0.3 CCCOCCNCCCCO 34a_100000750430_100011215938 [1,0,0,0,0,0|2,0,0]=3 3201 B11R0.3 CCCOCCNCCCCO 34a_100161115042_100011216708 [1,0,0,0,0,0|2,0,0]=3 3202 B11R0.3 CCCOCCNCCCOC 2230a_100161115042_100000740836 [1,0,0,0,0,0|3,0,0]=4 3203 B11R0.3 CCCOCCNCCCOC 34a_100150723488_100011215938 [1,0,0,0,0,0|3,0,0]=4 3204 B11R0.3 CCCOCCNCCCOC 34a_100161115042_100000740836 [1,0,0,0,0,0|3,0,0]=4 3205 B11R0.3 CCCOCCNCCCSC 2230a_100000749238_100011215938 [1,0,0,0,0,0|3,0,0]=4 3206 B11R0.3 CCCOCCNCCOCC 2230a_100161115042_100011215890 [1,0,0,0,0,0|3,0,0]=4 3207 B11R0.3 CCCOCCNCCOCC 2230a_102516460346_100011215938 [1,0,0,0,0,0|3,0,0]=4 3208 B11R0.3 CCCOCCNCCOCC 34a_100161115042_100000210147 [1,0,0,0,0,0|3,0,0]=4 3209 B11R0.3 CCCOCCNCCOCC 34a_102516460346_100011215938 [1,0,0,0,0,0|3,0,0]=4 3210 B11R0.3 CCCOCCNCCSCC 2230a_100000106463_100011215938 [1,0,0,0,0,0|3,0,0]=4 3211 B11R0.3 CCCOCCNCCSCC 2230a_100161115042_100000757381 [1,0,0,0,0,0|3,0,0]=4 3212 B11R0.3 CCCOCCNCCSCC 34a_100161115042_100000757381 [1,0,0,0,0,0|3,0,0]=4 3213 B11R0.3 CCCOCCOCCCCBr 34a_100011216708_100011215938 [1,0,0,0,0,0|3,0,0]=4 3214 B11R0.3 CCCOCCOCCCCCl 34a_100000210776_100011215938 [1,0,0,0,0,0|3,0,0]=4 3215 B11R0.3 CCCOCCOCCCCCl 7a_100000210776_100011215938 [1,0,0,0,0,0|3,0,0]=4 3216 B11R0.3 CCCOCCOCCCCF 34a_100000752267_100000729493 [1,0,0,0,0,0|3,0,0]=4 3217 B11R0.3 CCCOCCOCCCCF 34a_100011995726_100011215938 [1,0,0,0,0,0|3,0,0]=4 3218 B11R0.3 CCCOCCOCCCCF 7a_100000752267_100000729493 [1,0,0,0,0,0|3,0,0]=4 3219 B11R0.3 CCCOCCOCCCCF 7a_100011995726_100011215938 [1,0,0,0,0,0|3,0,0]=4 3220 B11R0.3 CCCOCCOCCCCI 34a_200012148704_100011215938 [1,0,0,0,0,0|3,0,0]=4 3221 B11R0.3 CCCOCCOCCCCN 34a_100000750430_100011215938 [1,0,0,0,0,0|3,0,0]=4 3222 B11R0.3 CCCOCCOCCCCO 34a_100000752267_100011216708 [1,0,0,0,0,0|2,0,0]=3 3223 B11R0.3 CCCOCCOCCCCO 7a_100000752267_100000210776 [1,0,0,0,0,0|2,0,0]=3 3224 B11R0.3 CCCOCCOCCCNC 34a_100000213112_100011215938 [1,0,0,0,0,0|3,0,0]=4 3225 B11R0.3 CCCOCCOCCCOC 34a_100000740835_100011215938 [1,0,0,0,0,0|3,0,0]=4 3226 B11R0.3 CCCOCCOCCCOC 34a_100000752267_100000740836 [1,0,0,0,0,0|3,0,0]=4 3227 B11R0.3 CCCOCCOCCCOC 7a_100000752267_100000740836 [1,0,0,0,0,0|3,0,0]=4 3228 B11R0.3 CCCOCCOCCCSC 34a_100000690336_100011215938 [1,0,0,0,0,0|3,0,0]=4 3229 B11R0.3 CCCOCCOCCCSC 7a_100000690336_100011215938 [1,0,0,0,0,0|3,0,0]=4 3230 B11R0.3 CCCOCCOCCNCC 2230a_200011904461_100000210202 [1,0,0,0,0,0|3,0,0]=4 3231 B11R0.3 CCCOCCOCCNCC 34a_200011904461_100000210202 [1,0,0,0,0,0|3,0,0]=4 3232 B11R0.3 CCCOCCOCCOCC 34a_100000210136_100011215938 [1,0,0,0,0,0|3,0,0]=4 3233 B11R0.3 CCCOCCOCCOCC 34a_100000210240_100000210303 [1,0,0,0,0,0|3,0,0]=4 3234 B11R0.3 CCCOCCOCCOCC 34a_100000210258_100011211534 [1,0,0,0,0,0|3,0,0]=4 3235 B11R0.3 CCCOCCOCCOCC 34a_100000752267_100000210147 [1,0,0,0,0,0|3,0,0]=4 3236 B11R0.3 CCCOCCOCCOCC 7a_100000210136_100011215938 [1,0,0,0,0,0|3,0,0]=4 3237 B11R0.3 CCCOCCOCCOCC 7a_100000210240_100000210303 [1,0,0,0,0,0|3,0,0]=4 3238 B11R0.3 CCCOCCOCCOCC 7a_100000752267_100011215890 [1,0,0,0,0,0|3,0,0]=4 3239 B11R0.3 CCCOCCOCCSCC 34a_100000212035_100011215938 [1,0,0,0,0,0|3,0,0]=4 3240 B11R0.3 CCCOCCOCCSCC 34a_100000752267_100000757381 [1,0,0,0,0,0|3,0,0]=4 3241 B11R0.3 CCCOCCOCCSCC 7a_100000212035_100011215938 [1,0,0,0,0,0|3,0,0]=4 3242 B11R0.3 CCCOCCOCCSCC 7a_100000752267_100000757381 [1,0,0,0,0,0|3,0,0]=4 3243 B11R0.3 CCCOCCSCCCCF 62a_100000729493_100011215938 [1,0,0,0,0,0|3,0,0]=4 3244 B11R0.3 CCCOCCSCCCCF 62a_100011215938_100000729493 [1,0,0,0,0,0|3,0,0]=4 3245 B11R0.3 CCCOCCSCCCCO 62a_100000210776_100011215938 [1,0,0,0,0,0|2,0,0]=3 3246 B11R0.3 CCCOCCSCCCCO 62a_100011215938_100000210776 [1,0,0,0,0,0|2,0,0]=3 3247 B11R0.3 CCCOCCSCCCOC 62a_100000709357_100011215938 [1,0,0,0,0,0|3,0,0]=4 3248 B11R0.3 CCCOCCSCCCOC 62a_100011215938_100000709357 [1,0,0,0,0,0|3,0,0]=4 3249 B11R0.3 CCCOCCSCCOCC 62a_100000210147_100011215938 [1,0,0,0,0,0|3,0,0]=4 3250 B11R0.3 CCCOCCSCCOCC 62a_100011215938_100011215890 [1,0,0,0,0,0|3,0,0]=4 3251 B11R0.3 CCCOCCSCCSCC 62a_100000757381_100011215938 [1,0,0,0,0,0|3,0,0]=4 3252 B11R0.3 CCCOCCSCCSCC 62a_100011215938_100000757381 [1,0,0,0,0,0|3,0,0]=4 3253 B11R0.3 CCCSCCCCCCC#N 62a_100000210303_100009813337 [1,0,0,0,0,0|2,0,1]=4 3254 B11R0.3 CCCSCCCCCCC#N 62a_100009813337_100000210303 [1,0,0,0,0,0|2,0,1]=4 3255 B11R0.3 CCCSCCCCCCCO 62a_100000210303_100000760002 [1,0,0,0,0,0|1,0,0]=2 3256 B11R0.3 CCCSCCCCCCCO 62a_100000760002_100000210303 [1,0,0,0,0,0|1,0,0]=2 3257 B11R0.3 CCCSCCCCCCOC 62a_100000210303_100011998445 [1,0,0,0,0,0|2,0,0]=3 3258 B11R0.3 CCCSCCCCCCOC 62a_100011998445_100000210303 [1,0,0,0,0,0|2,0,0]=3 3259 B11R0.3 CCCSCCCOCCOC 62a_100000210303_100011216529 [1,0,0,0,0,0|3,0,0]=4 3260 B11R0.3 CCCSCCCOCCOC 62a_100011216529_100000210303 [1,0,0,0,0,0|3,0,0]=4 3261 B11R0.3 CCCSCCNCCCCF 2230a_100020603323_100000729493 [1,0,0,0,0,0|3,0,0]=4 3262 B11R0.3 CCCSCCNCCCCO 2230a_100020603323_100000210776 [1,0,0,0,0,0|2,0,0]=3 3263 B11R0.3 CCCSCCNCCCOC 2230a_100020603323_100000740836 [1,0,0,0,0,0|3,0,0]=4 3264 B11R0.3 CCCSCCNCCOCC 2230a_100020603323_100011215890 [1,0,0,0,0,0|3,0,0]=4 3265 B11R0.3 CCCSCCNCCSCC 2230a_100020603323_100000757381 [1,0,0,0,0,0|3,0,0]=4 3266 B11R0.3 CCCSCCOCCCCF 34a_200000230433_100000729493 [1,0,0,0,0,0|3,0,0]=4 3267 B11R0.3 CCCSCCOCCCCF 7a_200000230433_100000729493 [1,0,0,0,0,0|3,0,0]=4 3268 B11R0.3 CCCSCCOCCCCO 34a_200000230433_100011216708 [1,0,0,0,0,0|2,0,0]=3 3269 B11R0.3 CCCSCCOCCCCO 7a_200000230433_100000210776 [1,0,0,0,0,0|2,0,0]=3 3270 B11R0.3 CCCSCCOCCCOC 34a_200000230433_100000740836 [1,0,0,0,0,0|3,0,0]=4 3271 B11R0.3 CCCSCCOCCCOC 7a_200000230433_100000740836 [1,0,0,0,0,0|3,0,0]=4 3272 B11R0.3 CCCSCCOCCOCC 34a_200000230433_100000210147 [1,0,0,0,0,0|3,0,0]=4 3273 B11R0.3 CCCSCCOCCOCC 62a_100000210303_100011211534 [1,0,0,0,0,0|3,0,0]=4 3274 B11R0.3 CCCSCCOCCOCC 62a_100011211534_100000210303 [1,0,0,0,0,0|3,0,0]=4 3275 B11R0.3 CCCSCCOCCOCC 7a_200000230433_100011215890 [1,0,0,0,0,0|3,0,0]=4 3276 B11R0.3 CCCSCCOCCSCC 34a_200000230433_100000757381 [1,0,0,0,0,0|3,0,0]=4 3277 B11R0.3 CCCSCCOCCSCC 7a_200000230433_100000757381 [1,0,0,0,0,0|3,0,0]=4 3278 B11R0.3 CCNCCCCCCCCO 2230a_100015525214_100000033203 [1,0,0,0,0,0|1,0,0]=2 3279 B11R0.3 CCNCCCCCCCCO 2230a_102515433106_100000210202 [1,0,0,0,0,0|1,0,0]=2 3280 B11R0.3 CCNCCCCCCCCO 34a_102515433106_100000210202 [1,0,0,0,0,0|1,0,0]=2 3281 B11R0.3 CCNCCOCCOCCO 2230a_100011998139_100000210202 [1,0,0,0,0,0|3,0,0]=4 3282 B11R0.3 CCNCCOCCOCCO 2230a_100015525214_100000032323 [1,0,0,0,0,0|3,0,0]=4 3283 B11R0.3 CCNCCOCCOCCO 34a_100011998139_100000210202 [1,0,0,0,0,0|3,0,0]=4 3284 B11R0.3 CCOCCCCCCCCBr 34a_100009813846_100000210202 [1,0,0,0,0,0|2,0,0]=3 3285 B11R0.3 CCOCCCCCCCCBr 7a_100009813846_100000210202 [1,0,0,0,0,0|2,0,0]=3 3286 B11R0.3 CCOCCCCCCCCCl 34a_100000033203_100000210202 [1,0,0,0,0,0|2,0,0]=3 3287 B11R0.3 CCOCCCCCCCCCl 7a_100000033203_100000210202 [1,0,0,0,0,0|2,0,0]=3 3288 B11R0.3 CCOCCCCCCCCN 34a_102515433106_100000210202 [1,0,0,0,0,0|2,0,0]=3 3289 B11R0.3 CCOCCCCCCCCO 34a_100121572206_100000033203 [1,0,0,0,0,0|1,0,0]=2 3290 B11R0.3 CCOCCCCCNCCN 34a_103619048469_100000210202 [1,0,0,0,0,0|3,0,0]=4 3291 B11R0.3 CCOCCCNCCCCF 2230a_100000210961_100000729493 [1,0,0,0,0,0|3,0,0]=4 3292 B11R0.3 CCOCCCNCCCCF 34a_100000210961_100000729493 [1,0,0,0,0,0|3,0,0]=4 3293 B11R0.3 CCOCCCNCCCCO 2230a_100000210961_100000210776 [1,0,0,0,0,0|2,0,0]=3 3294 B11R0.3 CCOCCCNCCCCO 2230a_100000750430_100012232248 [1,0,0,0,0,0|2,0,0]=3 3295 B11R0.3 CCOCCCNCCCCO 34a_100000210961_100011216708 [1,0,0,0,0,0|2,0,0]=3 3296 B11R0.3 CCOCCCNCCCCO 34a_100000750430_100012232248 [1,0,0,0,0,0|2,0,0]=3 3297 B11R0.3 CCOCCCNCCCOC 2230a_100000210961_100000740836 [1,0,0,0,0,0|3,0,0]=4 3298 B11R0.3 CCOCCCNCCCOC 34a_100000210961_100000740836 [1,0,0,0,0,0|3,0,0]=4 3299 B11R0.3 CCOCCCNCCCOC 34a_100150723488_100012232248 [1,0,0,0,0,0|3,0,0]=4 3300 B11R0.3 CCOCCCNCCCSC 2230a_100000749238_100012232248 [1,0,0,0,0,0|3,0,0]=4 3301 B11R0.3 CCOCCCNCCOCC 2230a_100000210961_100011215890 [1,0,0,0,0,0|3,0,0]=4 3302 B11R0.3 CCOCCCNCCOCC 2230a_102516460346_100012232248 [1,0,0,0,0,0|3,0,0]=4 3303 B11R0.3 CCOCCCNCCOCC 34a_100000210961_100000210147 [1,0,0,0,0,0|3,0,0]=4 3304 B11R0.3 CCOCCCNCCOCC 34a_102516460346_100012232248 [1,0,0,0,0,0|3,0,0]=4 3305 B11R0.3 CCOCCCNCCSCC 2230a_100000106463_100012232248 [1,0,0,0,0,0|3,0,0]=4 3306 B11R0.3 CCOCCCNCCSCC 2230a_100000210961_100000757381 [1,0,0,0,0,0|3,0,0]=4 3307 B11R0.3 CCOCCCNCCSCC 34a_100000210961_100000757381 [1,0,0,0,0,0|3,0,0]=4 3308 B11R0.3 CCOCCCOCCCCBr 34a_100011216708_100012232248 [1,0,0,0,0,0|3,0,0]=4 3309 B11R0.3 CCOCCCOCCCCCl 34a_100000210776_100012232248 [1,0,0,0,0,0|3,0,0]=4 3310 B11R0.3 CCOCCCOCCCCCl 7a_100000210776_100012232248 [1,0,0,0,0,0|3,0,0]=4 3311 B11R0.3 CCOCCCOCCCCF 34a_100000757476_100000729493 [1,0,0,0,0,0|3,0,0]=4 3312 B11R0.3 CCOCCCOCCCCF 34a_100011995726_100012232248 [1,0,0,0,0,0|3,0,0]=4 3313 B11R0.3 CCOCCCOCCCCF 7a_100000757476_100000729493 [1,0,0,0,0,0|3,0,0]=4 3314 B11R0.3 CCOCCCOCCCCF 7a_100011995726_100012232248 [1,0,0,0,0,0|3,0,0]=4 3315 B11R0.3 CCOCCCOCCCCI 34a_200012148704_100012232248 [1,0,0,0,0,0|3,0,0]=4 3316 B11R0.3 CCOCCCOCCCCN 34a_100000750430_100012232248 [1,0,0,0,0,0|3,0,0]=4 3317 B11R0.3 CCOCCCOCCCCO 34a_100000757476_100011216708 [1,0,0,0,0,0|2,0,0]=3 3318 B11R0.3 CCOCCCOCCCCO 7a_100000757476_100000210776 [1,0,0,0,0,0|2,0,0]=3 3319 B11R0.3 CCOCCCOCCCNC 34a_100000213112_100012232248 [1,0,0,0,0,0|3,0,0]=4 3320 B11R0.3 CCOCCCOCCCOC 34a_100000740835_100012232248 [1,0,0,0,0,0|3,0,0]=4 3321 B11R0.3 CCOCCCOCCCOC 34a_100000757476_100000740836 [1,0,0,0,0,0|3,0,0]=4 3322 B11R0.3 CCOCCCOCCCOC 34a_200011215475_100000210202 [1,0,0,0,0,0|3,0,0]=4 3323 B11R0.3 CCOCCCOCCCOC 7a_100000757476_100000740836 [1,0,0,0,0,0|3,0,0]=4 3324 B11R0.3 CCOCCCOCCCOC 7a_200011215475_100000210202 [1,0,0,0,0,0|3,0,0]=4 3325 B11R0.3 CCOCCCOCCCSC 34a_100000690336_100012232248 [1,0,0,0,0,0|3,0,0]=4 3326 B11R0.3 CCOCCCOCCCSC 7a_100000690336_100012232248 [1,0,0,0,0,0|3,0,0]=4 3327 B11R0.3 CCOCCCOCCOCC 34a_100000210136_100012232248 [1,0,0,0,0,0|3,0,0]=4 3328 B11R0.3 CCOCCCOCCOCC 34a_100000757476_100000210147 [1,0,0,0,0,0|3,0,0]=4 3329 B11R0.3 CCOCCCOCCOCC 7a_100000210136_100012232248 [1,0,0,0,0,0|3,0,0]=4 3330 B11R0.3 CCOCCCOCCOCC 7a_100000757476_100011215890 [1,0,0,0,0,0|3,0,0]=4 3331 B11R0.3 CCOCCCOCCSCC 34a_100000212035_100012232248 [1,0,0,0,0,0|3,0,0]=4 3332 B11R0.3 CCOCCCOCCSCC 34a_100000757476_100000757381 [1,0,0,0,0,0|3,0,0]=4 3333 B11R0.3 CCOCCCOCCSCC 7a_100000212035_100012232248 [1,0,0,0,0,0|3,0,0]=4 3334 B11R0.3 CCOCCCOCCSCC 7a_100000757476_100000757381 [1,0,0,0,0,0|3,0,0]=4 3335 B11R0.3 CCOCCCSCCCCF 62a_100000729493_100012232248 [1,0,0,0,0,0|3,0,0]=4 3336 B11R0.3 CCOCCCSCCCCF 62a_100012232248_100000729493 [1,0,0,0,0,0|3,0,0]=4 3337 B11R0.3 CCOCCCSCCCCO 62a_100000210776_100012232248 [1,0,0,0,0,0|2,0,0]=3 3338 B11R0.3 CCOCCCSCCCCO 62a_100012232248_100000210776 [1,0,0,0,0,0|2,0,0]=3 3339 B11R0.3 CCOCCCSCCCOC 62a_100000709357_100012232248 [1,0,0,0,0,0|3,0,0]=4 3340 B11R0.3 CCOCCCSCCCOC 62a_100012232248_100000709357 [1,0,0,0,0,0|3,0,0]=4 3341 B11R0.3 CCOCCCSCCOCC 62a_100000210147_100012232248 [1,0,0,0,0,0|3,0,0]=4 3342 B11R0.3 CCOCCCSCCOCC 62a_100012232248_100011215890 [1,0,0,0,0,0|3,0,0]=4 3343 B11R0.3 CCOCCCSCCSCC 62a_100000757381_100012232248 [1,0,0,0,0,0|3,0,0]=4 3344 B11R0.3 CCOCCCSCCSCC 62a_100012232248_100000757381 [1,0,0,0,0,0|3,0,0]=4 3345 B11R0.3 CCOCCNCCCCCF 2230a_102516460346_100000729378 [1,0,0,0,0,0|3,0,0]=4 3346 B11R0.3 CCOCCNCCCCCF 34a_102516460346_100000729378 [1,0,0,0,0,0|3,0,0]=4 3347 B11R0.3 CCOCCNCCCCCO 2230a_100000762737_100011215890 [1,0,0,0,0,0|2,0,0]=3 3348 B11R0.3 CCOCCNCCCCCO 2230a_102516460346_100000746330 [1,0,0,0,0,0|2,0,0]=3 3349 B11R0.3 CCOCCNCCCCCO 34a_100000762737_100000210147 [1,0,0,0,0,0|2,0,0]=3 3350 B11R0.3 CCOCCNCCCCCO 34a_102516460346_100000746330 [1,0,0,0,0,0|2,0,0]=3 3351 B11R0.3 CCOCCNCCCCOC 2230a_102516460346_100000730899 [1,0,0,0,0,0|3,0,0]=4 3352 B11R0.3 CCOCCNCCCCOC 34a_102516460346_100000755781 [1,0,0,0,0,0|3,0,0]=4 3353 B11R0.3 CCOCCNCCOCCO 2230a_100000211614_100011215890 [1,0,0,0,0,0|3,0,0]=4 3354 B11R0.3 CCOCCNCCOCCO 2230a_102516460346_100011215305 [1,0,0,0,0,0|3,0,0]=4 3355 B11R0.3 CCOCCNCCOCCO 34a_100000211614_100000210147 [1,0,0,0,0,0|3,0,0]=4 3356 B11R0.3 CCOCCNCCOCCO 34a_102516460346_100000692535 [1,0,0,0,0,0|3,0,0]=4 3357 B11R0.3 CCOCCNCCSCCO 2230a_100011219999_100011215890 [1,0,0,0,0,0|3,0,0]=4 3358 B11R0.3 CCOCCOCCCCCBr 34a_100000746331_100000210147 [1,0,0,0,0,0|3,0,0]=4 3359 B11R0.3 CCOCCOCCCCCBr 7a_100000746331_100011215890 [1,0,0,0,0,0|3,0,0]=4 3360 B11R0.3 CCOCCOCCCCCCl 34a_100000746330_100000210147 [1,0,0,0,0,0|3,0,0]=4 3361 B11R0.3 CCOCCOCCCCCCl 7a_100000746330_100011215890 [1,0,0,0,0,0|3,0,0]=4 3362 B11R0.3 CCOCCOCCCCCF 34a_100000210136_100000729378 [1,0,0,0,0,0|3,0,0]=4 3363 B11R0.3 CCOCCOCCCCCF 7a_100000210136_100000729378 [1,0,0,0,0,0|3,0,0]=4 3364 B11R0.3 CCOCCOCCCCCI 34a_200012148887_100000210147 [1,0,0,0,0,0|3,0,0]=4 3365 B11R0.3 CCOCCOCCCCCI 7a_200012148887_100011215890 [1,0,0,0,0,0|3,0,0]=4 3366 B11R0.3 CCOCCOCCCCCN 34a_100000762737_100000210147 [1,0,0,0,0,0|3,0,0]=4 3367 B11R0.3 CCOCCOCCCCCO 34a_100000210136_100000746330 [1,0,0,0,0,0|2,0,0]=3 3368 B11R0.3 CCOCCOCCCCCO 7a_100000210136_100000746330 [1,0,0,0,0,0|2,0,0]=3 3369 B11R0.3 CCOCCOCCCCOC 34a_100000210136_100000755781 [1,0,0,0,0,0|3,0,0]=4 3370 B11R0.3 CCOCCOCCCCOC 34a_100000740925_100000210147 [1,0,0,0,0,0|3,0,0]=4 3371 B11R0.3 CCOCCOCCCCOC 7a_100000210136_100000730899 [1,0,0,0,0,0|3,0,0]=4 3372 B11R0.3 CCOCCOCCCCSC 34a_100011217163_100000210147 [1,0,0,0,0,0|3,0,0]=4 3373 B11R0.3 CCOCCOCCCCSC 7a_100011217163_100011215890 [1,0,0,0,0,0|3,0,0]=4 3374 B11R0.3 CCOCCOCCCSCC 34a_100011216438_100000210147 [1,0,0,0,0,0|3,0,0]=4 3375 B11R0.3 CCOCCOCCCSCC 7a_100011216438_100011215890 [1,0,0,0,0,0|3,0,0]=4 3376 B11R0.3 CCOCCOCCNCCO 2230a_100016997473_100011211534 [1,0,0,0,0,0|3,0,0]=4 3377 B11R0.3 CCOCCOCCNCCO 2230a_100102712874_100000211926 [1,0,0,0,0,0|3,0,0]=4 3378 B11R0.3 CCOCCOCCNCCO 34a_100016990907_100011211534 [1,0,0,0,0,0|3,0,0]=4 3379 B11R0.3 CCOCCOCCNCCO 34a_100102712874_100000211926 [1,0,0,0,0,0|3,0,0]=4 3380 B11R0.3 CCOCCOCCOCCO 34a_100000210136_100000692535 [1,0,0,0,0,0|3,0,0]=4 3381 B11R0.3 CCOCCOCCOCCO 34a_100000210240_100000211926 [1,0,0,0,0,0|3,0,0]=4 3382 B11R0.3 CCOCCOCCOCCO 34a_100121572206_100000032323 [1,0,0,0,0,0|3,0,0]=4 3383 B11R0.3 CCOCCOCCOCCO 7a_100000210136_100011215305 [1,0,0,0,0,0|3,0,0]=4 3384 B11R0.3 CCOCCOCCOCCO 7a_100000210240_100000211926 [1,0,0,0,0,0|3,0,0]=4 3385 B11R0.3 CCOCCOCCSCCO 62a_100000211926_100011211534 [1,0,0,0,0,0|3,0,0]=4 3386 B11R0.3 CCOCCOCCSCCO 62a_100011211534_100000211926 [1,0,0,0,0,0|3,0,0]=4 3387 B11R0.3 CCOCCSCCCCCF 62a_100000210147_100000729378 [1,0,0,0,0,0|3,0,0]=4 3388 B11R0.3 CCOCCSCCCCCF 62a_100000729378_100011215890 [1,0,0,0,0,0|3,0,0]=4 3389 B11R0.3 CCOCCSCCCCCO 62a_100000210147_100000746330 [1,0,0,0,0,0|2,0,0]=3 3390 B11R0.3 CCOCCSCCCCCO 62a_100000746330_100011215890 [1,0,0,0,0,0|2,0,0]=3 3391 B11R0.3 CCOCCSCCCCOC 62a_100000210147_100000730899 [1,0,0,0,0,0|3,0,0]=4 3392 B11R0.3 CCOCCSCCCCOC 62a_100000730899_100011215890 [1,0,0,0,0,0|3,0,0]=4 3393 B11R0.3 CCOCCSCCOCCO 62a_100000210147_100011215305 [1,0,0,0,0,0|3,0,0]=4 3394 B11R0.3 CCOCCSCCOCCO 62a_100011215305_100011215890 [1,0,0,0,0,0|3,0,0]=4 3395 B11R0.3 CCOCSCCCCCCF 62a_100000739092_100015922095 [1,0,0,0,0,0|3,0,0]=4 3396 B11R0.3 CCOCSCCCCCCF 62a_100015922095_100000739092 [1,0,0,0,0,0|3,0,0]=4 3397 B11R0.3 CCOCSCCCCCCO 62a_100000739092_100000766143 [1,0,0,0,0,0|2,0,0]=3 3398 B11R0.3 CCOCSCCCCCCO 62a_100000766143_100000739092 [1,0,0,0,0,0|2,0,0]=3 3399 B11R0.3 CCSCCCCCCCCO 62a_100000033203_100000210202 [1,0,0,0,0,0|1,0,0]=2 3400 B11R0.3 CCSCCCCCCCCO 62a_100000210202_100000033203 [1,0,0,0,0,0|1,0,0]=2 3401 B11R0.3 CCSCCCOCCCCF 34a_100011216438_100000729493 [1,0,0,0,0,0|3,0,0]=4 3402 B11R0.3 CCSCCCOCCCCF 7a_100011216438_100000729493 [1,0,0,0,0,0|3,0,0]=4 3403 B11R0.3 CCSCCCOCCCCO 34a_100011216438_100011216708 [1,0,0,0,0,0|2,0,0]=3 3404 B11R0.3 CCSCCCOCCCCO 7a_100011216438_100000210776 [1,0,0,0,0,0|2,0,0]=3 3405 B11R0.3 CCSCCCOCCCOC 34a_100011216438_100000740836 [1,0,0,0,0,0|3,0,0]=4 3406 B11R0.3 CCSCCCOCCCOC 7a_100011216438_100000740836 [1,0,0,0,0,0|3,0,0]=4 3407 B11R0.3 CCSCCCOCCSCC 34a_100011216438_100000757381 [1,0,0,0,0,0|3,0,0]=4 3408 B11R0.3 CCSCCCOCCSCC 7a_100011216438_100000757381 [1,0,0,0,0,0|3,0,0]=4 3409 B11R0.3 CCSCCNCCCCCF 2230a_100000106463_100000729378 [1,0,0,0,0,0|3,0,0]=4 3410 B11R0.3 CCSCCNCCCCCO 2230a_100000106463_100000746330 [1,0,0,0,0,0|2,0,0]=3 3411 B11R0.3 CCSCCNCCCCCO 2230a_100000762737_100000757381 [1,0,0,0,0,0|2,0,0]=3 3412 B11R0.3 CCSCCNCCCCCO 34a_100000762737_100000757381 [1,0,0,0,0,0|2,0,0]=3 3413 B11R0.3 CCSCCNCCCCOC 2230a_100000106463_100000730899 [1,0,0,0,0,0|3,0,0]=4 3414 B11R0.3 CCSCCNCCOCCO 2230a_100000106463_100011215305 [1,0,0,0,0,0|3,0,0]=4 3415 B11R0.3 CCSCCNCCOCCO 2230a_100000211614_100000757381 [1,0,0,0,0,0|3,0,0]=4 3416 B11R0.3 CCSCCNCCOCCO 34a_100000211614_100000757381 [1,0,0,0,0,0|3,0,0]=4 3417 B11R0.3 CCSCCNCCSCCO 2230a_100011219999_100000757381 [1,0,0,0,0,0|3,0,0]=4 3418 B11R0.3 CCSCCOCCCCCBr 34a_100000746331_100000757381 [1,0,0,0,0,0|3,0,0]=4 3419 B11R0.3 CCSCCOCCCCCBr 7a_100000746331_100000757381 [1,0,0,0,0,0|3,0,0]=4 3420 B11R0.3 CCSCCOCCCCCCl 34a_100000746330_100000757381 [1,0,0,0,0,0|3,0,0]=4 3421 B11R0.3 CCSCCOCCCCCCl 7a_100000746330_100000757381 [1,0,0,0,0,0|3,0,0]=4 3422 B11R0.3 CCSCCOCCCCCF 34a_100000212035_100000729378 [1,0,0,0,0,0|3,0,0]=4 3423 B11R0.3 CCSCCOCCCCCF 7a_100000212035_100000729378 [1,0,0,0,0,0|3,0,0]=4 3424 B11R0.3 CCSCCOCCCCCI 34a_200012148887_100000757381 [1,0,0,0,0,0|3,0,0]=4 3425 B11R0.3 CCSCCOCCCCCI 7a_200012148887_100000757381 [1,0,0,0,0,0|3,0,0]=4 3426 B11R0.3 CCSCCOCCCCCN 34a_100000762737_100000757381 [1,0,0,0,0,0|3,0,0]=4 3427 B11R0.3 CCSCCOCCCCCO 34a_100000212035_100000746330 [1,0,0,0,0,0|2,0,0]=3 3428 B11R0.3 CCSCCOCCCCCO 7a_100000212035_100000746330 [1,0,0,0,0,0|2,0,0]=3 3429 B11R0.3 CCSCCOCCCCOC 34a_100000212035_100000755781 [1,0,0,0,0,0|3,0,0]=4 3430 B11R0.3 CCSCCOCCCCOC 34a_100000740925_100000757381 [1,0,0,0,0,0|3,0,0]=4 3431 B11R0.3 CCSCCOCCCCOC 7a_100000212035_100000730899 [1,0,0,0,0,0|3,0,0]=4 3432 B11R0.3 CCSCCOCCCCSC 34a_100011217163_100000757381 [1,0,0,0,0,0|3,0,0]=4 3433 B11R0.3 CCSCCOCCCCSC 7a_100011217163_100000757381 [1,0,0,0,0,0|3,0,0]=4 3434 B11R0.3 CCSCCOCCOCCO 34a_100000212035_100000692535 [1,0,0,0,0,0|3,0,0]=4 3435 B11R0.3 CCSCCOCCOCCO 62a_100000032323_100000210202 [1,0,0,0,0,0|3,0,0]=4 3436 B11R0.3 CCSCCOCCOCCO 62a_100000210202_100000032323 [1,0,0,0,0,0|3,0,0]=4 3437 B11R0.3 CCSCCOCCOCCO 7a_100000212035_100011215305 [1,0,0,0,0,0|3,0,0]=4 3438 B11R0.3 CCSCCSCCCCCF 62a_100000729378_100000757381 [1,0,0,0,0,0|3,0,0]=4 3439 B11R0.3 CCSCCSCCCCCF 62a_100000757381_100000729378 [1,0,0,0,0,0|3,0,0]=4 3440 B11R0.3 CCSCCSCCCCCO 62a_100000746330_100000757381 [1,0,0,0,0,0|2,0,0]=3 3441 B11R0.3 CCSCCSCCCCCO 62a_100000757381_100000746330 [1,0,0,0,0,0|2,0,0]=3 3442 B11R0.3 CCSCCSCCCCOC 62a_100000730899_100000757381 [1,0,0,0,0,0|3,0,0]=4 3443 B11R0.3 CCSCCSCCCCOC 62a_100000757381_100000730899 [1,0,0,0,0,0|3,0,0]=4 3444 B11R0.3 CCSCCSCCOCCO 62a_100000757381_100011215305 [1,0,0,0,0,0|3,0,0]=4 3445 B11R0.3 CCSCCSCCOCCO 62a_100011215305_100000757381 [1,0,0,0,0,0|3,0,0]=4 3446 B11R0.3 CNCCCCCCCCCO 2230a_100000078944_200000210301 [1,0,0,0,0,0|1,0,0]=2 3447 B11R0.3 CNCCCCCCCCCO 2230a_106832991635_100009813782 [1,0,0,0,0,0|1,0,0]=2 3448 B11R0.3 CNCCCCCCCCCO 34a_100000078944_200000210301 [1,0,0,0,0,0|1,0,0]=2 3449 B11R0.3 CNCCCCCCCCCO 34a_100102657272_100009813782 [1,0,0,0,0,0|1,0,0]=2 3450 B11R0.3 CNCCCCCCCCCO 7a_106832991635_100009813782 [1,0,0,0,0,0|1,0,0]=2 3451 B11R0.3 CNCCCCCOCCCF 34a_100000722520_100011934791 [1,0,0,0,0,0|3,0,0]=4 3452 B11R0.3 CNCCCCCOCCCO 34a_100000722520_100000230001 [1,0,0,0,0,0|2,0,0]=3 3453 B11R0.3 CNCCCCCOCCOC 34a_100000722520_100011201679 [1,0,0,0,0,0|3,0,0]=4 3454 B11R0.3 CNCCCCCOCCSC 34a_100000722520_100000212216 [1,0,0,0,0,0|3,0,0]=4 3455 B11R0.3 CNCCCOCCCCCF 34a_100000213112_100000729378 [1,0,0,0,0,0|3,0,0]=4 3456 B11R0.3 CNCCCOCCCCCO 34a_100000213112_100000746330 [1,0,0,0,0,0|2,0,0]=3 3457 B11R0.3 CNCCCOCCCCOC 34a_100000213112_100000755781 [1,0,0,0,0,0|3,0,0]=4 3458 B11R0.3 CNCCCOCCOCCO 2230a_100011996194_200000210301 [1,0,0,0,0,0|3,0,0]=4 3459 B11R0.3 CNCCCOCCOCCO 34a_100000213112_100000692535 [1,0,0,0,0,0|3,0,0]=4 3460 B11R0.3 CNCCCOCCOCCO 34a_100011996194_200000210301 [1,0,0,0,0,0|3,0,0]=4 3461 B11R0.3 CNCCOCCOCCCO 34a_100000228057_100000230001 [1,0,0,0,0,0|3,0,0]=4 3462 B11R0.3 COCCCCCCCCCBr 34a_100009813782_200000210301 [1,0,0,0,0,0|2,0,0]=3 3463 B11R0.3 COCCCCCCCCCBr 7a_100009813782_200000210301 [1,0,0,0,0,0|2,0,0]=3 3464 B11R0.3 COCCCCCCCCCCl 34a_100009868337_200000210301 [1,0,0,0,0,0|2,0,0]=3 3465 B11R0.3 COCCCCCCCCCCl 7a_100009868337_200000210301 [1,0,0,0,0,0|2,0,0]=3 3466 B11R0.3 COCCCCCCCCCN 34a_100000078944_200000210301 [1,0,0,0,0,0|2,0,0]=3 3467 B11R0.3 COCCCCCCCCCO 34a_100138415774_100009813782 [1,0,0,0,0,0|1,0,0]=2 3468 B11R0.3 COCCCCCCNCCF 34a_100000724931_100011998445 [1,0,0,0,0,0|3,0,0]=4 3469 B11R0.3 COCCCCCCNCCO 2230a_100016997473_100011998445 [1,0,0,0,0,0|2,0,0]=3 3470 B11R0.3 COCCCCCCNCCO 34a_100016990907_100011998445 [1,0,0,0,0,0|2,0,0]=3 3471 B11R0.3 COCCCCCCOCCBr 34a_100000211926_100011998445 [1,0,0,0,0,0|3,0,0]=4 3472 B11R0.3 COCCCCCCOCCF 34a_200012092642_100011217306 [1,0,0,0,0,0|3,0,0]=4 3473 B11R0.3 COCCCCCCOCCF 7a_200012092642_100011217306 [1,0,0,0,0,0|3,0,0]=4 3474 B11R0.3 COCCCCCCOCCN 34a_100000210304_100011998445 [1,0,0,0,0,0|3,0,0]=4 3475 B11R0.3 COCCCCCCOCCO 34a_200012092642_100000211926 [1,0,0,0,0,0|2,0,0]=3 3476 B11R0.3 COCCCCCCOCCO 7a_200012092642_100000211926 [1,0,0,0,0,0|2,0,0]=3 3477 B11R0.3 COCCCCCCOCSC 34a_200012092642_100011218213 [1,0,0,0,0,0|3,0,0]=4 3478 B11R0.3 COCCCCCCSCCF 62a_100011217306_100011998445 [1,0,0,0,0,0|3,0,0]=4 3479 B11R0.3 COCCCCCCSCCF 62a_100011998445_100011217306 [1,0,0,0,0,0|3,0,0]=4 3480 B11R0.3 COCCCCCCSCCO 62a_100000211926_100011998445 [1,0,0,0,0,0|2,0,0]=3 3481 B11R0.3 COCCCCCCSCCO 62a_100011998445_100000211926 [1,0,0,0,0,0|2,0,0]=3 3482 B11R0.3 COCCCCCCSCOC 62a_100000766300_100011998445 [1,0,0,0,0,0|3,0,0]=4 3483 B11R0.3 COCCCCCCSCOC 62a_100011998445_100000766300 [1,0,0,0,0,0|3,0,0]=4 3484 B11R0.3 COCCCCCCSCSC 62a_100011218213_100011998445 [1,0,0,0,0,0|3,0,0]=4 3485 B11R0.3 COCCCCCCSCSC 62a_100011998445_100011218213 [1,0,0,0,0,0|3,0,0]=4 3486 B11R0.3 COCCCCCNCCCF 2230a_100000747528_100011934791 [1,0,0,0,0,0|3,0,0]=4 3487 B11R0.3 COCCCCCNCCCF 34a_100000747528_100011934791 [1,0,0,0,0,0|3,0,0]=4 3488 B11R0.3 COCCCCCNCCCO 2230a_100000747528_100000230001 [1,0,0,0,0,0|2,0,0]=3 3489 B11R0.3 COCCCCCNCCCO 34a_100000747528_100000230001 [1,0,0,0,0,0|2,0,0]=3 3490 B11R0.3 COCCCCCNCCOC 2230a_100000747528_100011201679 [1,0,0,0,0,0|3,0,0]=4 3491 B11R0.3 COCCCCCNCCOC 34a_100000747528_100011201679 [1,0,0,0,0,0|3,0,0]=4 3492 B11R0.3 COCCCCCNCCSC 2230a_100000747528_100000751147 [1,0,0,0,0,0|3,0,0]=4 3493 B11R0.3 COCCCCCNCCSC 34a_100000747528_100000212216 [1,0,0,0,0,0|3,0,0]=4 3494 B11R0.3 COCCCCNCCCCO 2230a_100000750430_100000730899 [1,0,0,0,0,0|2,0,0]=3 3495 B11R0.3 COCCCCNCCCCO 34a_100000750430_100000755781 [1,0,0,0,0,0|2,0,0]=3 3496 B11R0.3 COCCCCNCCCOC 34a_100150723488_100000755781 [1,0,0,0,0,0|3,0,0]=4 3497 B11R0.3 COCCCCNCCCSC 2230a_100000749238_100000730899 [1,0,0,0,0,0|3,0,0]=4 3498 B11R0.3 COCCCCOCCCCBr 34a_100011216708_100000755781 [1,0,0,0,0,0|3,0,0]=4 3499 B11R0.3 COCCCCOCCCCCl 34a_100000210776_100000755781 [1,0,0,0,0,0|3,0,0]=4 3500 B11R0.3 COCCCCOCCCCCl 7a_100000210776_100000730899 [1,0,0,0,0,0|3,0,0]=4 3501 B11R0.3 COCCCCOCCCCF 34a_100000740925_100000729493 [1,0,0,0,0,0|3,0,0]=4 3502 B11R0.3 COCCCCOCCCCF 34a_100011995726_100000755781 [1,0,0,0,0,0|3,0,0]=4 3503 B11R0.3 COCCCCOCCCCF 7a_100011995726_100000730899 [1,0,0,0,0,0|3,0,0]=4 3504 B11R0.3 COCCCCOCCCCI 34a_200012148704_100000755781 [1,0,0,0,0,0|3,0,0]=4 3505 B11R0.3 COCCCCOCCCCN 34a_100000750430_100000755781 [1,0,0,0,0,0|3,0,0]=4 3506 B11R0.3 COCCCCOCCCCO 34a_100000740925_100011216708 [1,0,0,0,0,0|2,0,0]=3 3507 B11R0.3 COCCCCOCCCOC 34a_100000740835_100000755781 [1,0,0,0,0,0|3,0,0]=4 3508 B11R0.3 COCCCCOCCCOC 34a_100000740925_100000740836 [1,0,0,0,0,0|3,0,0]=4 3509 B11R0.3 COCCCCOCCCSC 34a_100000690336_100000755781 [1,0,0,0,0,0|3,0,0]=4 3510 B11R0.3 COCCCCOCCCSC 7a_100000690336_100000730899 [1,0,0,0,0,0|3,0,0]=4 3511 B11R0.3 COCCCCSCCCCF 62a_100000729493_100000730899 [1,0,0,0,0,0|3,0,0]=4 3512 B11R0.3 COCCCCSCCCCF 62a_100000730899_100000729493 [1,0,0,0,0,0|3,0,0]=4 3513 B11R0.3 COCCCCSCCCCO 62a_100000210776_100000730899 [1,0,0,0,0,0|2,0,0]=3 3514 B11R0.3 COCCCCSCCCCO 62a_100000730899_100000210776 [1,0,0,0,0,0|2,0,0]=3 3515 B11R0.3 COCCCCSCCCOC 62a_100000709357_100000730899 [1,0,0,0,0,0|3,0,0]=4 3516 B11R0.3 COCCCCSCCCOC 62a_100000730899_100000709357 [1,0,0,0,0,0|3,0,0]=4 3517 B11R0.3 COCCCNCCCCCF 34a_100150723488_100000729378 [1,0,0,0,0,0|3,0,0]=4 3518 B11R0.3 COCCCNCCCCCO 2230a_100000762737_100000740836 [1,0,0,0,0,0|2,0,0]=3 3519 B11R0.3 COCCCNCCCCCO 34a_100000762737_100000740836 [1,0,0,0,0,0|2,0,0]=3 3520 B11R0.3 COCCCNCCCCCO 34a_100150723488_100000746330 [1,0,0,0,0,0|2,0,0]=3 3521 B11R0.3 COCCCNCCOCCO 2230a_100000211614_100000740836 [1,0,0,0,0,0|3,0,0]=4 3522 B11R0.3 COCCCNCCOCCO 34a_100000211614_100000740836 [1,0,0,0,0,0|3,0,0]=4 3523 B11R0.3 COCCCNCCOCCO 34a_100150723488_100000692535 [1,0,0,0,0,0|3,0,0]=4 3524 B11R0.3 COCCCNCCSCCO 2230a_100011219999_100000740836 [1,0,0,0,0,0|3,0,0]=4 3525 B11R0.3 COCCCOCCCCCBr 34a_100000746331_100000740836 [1,0,0,0,0,0|3,0,0]=4 3526 B11R0.3 COCCCOCCCCCBr 7a_100000746331_100000740836 [1,0,0,0,0,0|3,0,0]=4 3527 B11R0.3 COCCCOCCCCCCl 34a_100000746330_100000740836 [1,0,0,0,0,0|3,0,0]=4 3528 B11R0.3 COCCCOCCCCCCl 7a_100000746330_100000740836 [1,0,0,0,0,0|3,0,0]=4 3529 B11R0.3 COCCCOCCCCCF 34a_100000740835_100000729378 [1,0,0,0,0,0|3,0,0]=4 3530 B11R0.3 COCCCOCCCCCI 34a_200012148887_100000740836 [1,0,0,0,0,0|3,0,0]=4 3531 B11R0.3 COCCCOCCCCCI 7a_200012148887_100000740836 [1,0,0,0,0,0|3,0,0]=4 3532 B11R0.3 COCCCOCCCCCN 34a_100000762737_100000740836 [1,0,0,0,0,0|3,0,0]=4 3533 B11R0.3 COCCCOCCCCCO 34a_100000740835_100000746330 [1,0,0,0,0,0|2,0,0]=3 3534 B11R0.3 COCCCOCCCCSC 34a_100011217163_100000740836 [1,0,0,0,0,0|3,0,0]=4 3535 B11R0.3 COCCCOCCCCSC 7a_100011217163_100000740836 [1,0,0,0,0,0|3,0,0]=4 3536 B11R0.3 COCCCOCCOCCO 34a_100000740835_100000692535 [1,0,0,0,0,0|3,0,0]=4 3537 B11R0.3 COCCCSCCCCCF 62a_100000709357_100000729378 [1,0,0,0,0,0|3,0,0]=4 3538 B11R0.3 COCCCSCCCCCF 62a_100000729378_100000709357 [1,0,0,0,0,0|3,0,0]=4 3539 B11R0.3 COCCCSCCCCCO 62a_100000709357_100000746330 [1,0,0,0,0,0|2,0,0]=3 3540 B11R0.3 COCCCSCCCCCO 62a_100000746330_100000709357 [1,0,0,0,0,0|2,0,0]=3 3541 B11R0.3 COCCCSCCOCCO 62a_100000709357_100011215305 [1,0,0,0,0,0|3,0,0]=4 3542 B11R0.3 COCCCSCCOCCO 62a_100011215305_100000709357 [1,0,0,0,0,0|3,0,0]=4 3543 B11R0.3 COCCNCCCCCCF 2230a_100000209980_100015922095 [1,0,0,0,0,0|3,0,0]=4 3544 B11R0.3 COCCNCCCCCCO 2230a_100000209980_100000766143 [1,0,0,0,0,0|2,0,0]=3 3545 B11R0.3 COCCNCCCCCCO 2230a_100000686447_100011201679 [1,0,0,0,0,0|2,0,0]=3 3546 B11R0.3 COCCNCCCCCCO 34a_100000686447_100011201679 [1,0,0,0,0,0|2,0,0]=3 3547 B11R0.3 COCCOCCCCCCBr 34a_100011215345_100011201679 [1,0,0,0,0,0|3,0,0]=4 3548 B11R0.3 COCCOCCCCCCBr 7a_100011215345_100000233755 [1,0,0,0,0,0|3,0,0]=4 3549 B11R0.3 COCCOCCCCCCCl 34a_100000766143_100011201679 [1,0,0,0,0,0|3,0,0]=4 3550 B11R0.3 COCCOCCCCCCCl 7a_100000766143_100000233755 [1,0,0,0,0,0|3,0,0]=4 3551 B11R0.3 COCCOCCCCCCF 34a_100000210237_100015922095 [1,0,0,0,0,0|3,0,0]=4 3552 B11R0.3 COCCOCCCCCCF 34a_100000732779_100011201679 [1,0,0,0,0,0|3,0,0]=4 3553 B11R0.3 COCCOCCCCCCF 7a_100000732779_100000233755 [1,0,0,0,0,0|3,0,0]=4 3554 B11R0.3 COCCOCCCCCCN 34a_100000686447_100011201679 [1,0,0,0,0,0|3,0,0]=4 3555 B11R0.3 COCCOCCCCCCO 34a_100000210237_100000766143 [1,0,0,0,0,0|2,0,0]=3 3556 B11R0.3 COCCOCCCNCCO 2230a_100000206027_100000211926 [1,0,0,0,0,0|3,0,0]=4 3557 B11R0.3 COCCOCCCNCCO 2230a_100016997473_100011216529 [1,0,0,0,0,0|3,0,0]=4 3558 B11R0.3 COCCOCCCNCCO 34a_100000206027_100000211926 [1,0,0,0,0,0|3,0,0]=4 3559 B11R0.3 COCCOCCCNCCO 34a_100016990907_100011216529 [1,0,0,0,0,0|3,0,0]=4 3560 B11R0.3 COCCOCCCSCCO 62a_100000211926_100011216529 [1,0,0,0,0,0|3,0,0]=4 3561 B11R0.3 COCCOCCCSCCO 62a_100011216529_100000211926 [1,0,0,0,0,0|3,0,0]=4 3562 B11R0.3 COCCOCCNCCCO 2230a_100000745349_100000230001 [1,0,0,0,0,0|3,0,0]=4 3563 B11R0.3 COCCOCCNCCCO 34a_100000745349_100000230001 [1,0,0,0,0,0|3,0,0]=4 3564 B11R0.3 COCCOCCOCCCO 34a_100011215163_100000230001 [1,0,0,0,0,0|3,0,0]=4 3565 B11R0.3 COCCOCCOCCCO 7a_100011215163_100011215043 [1,0,0,0,0,0|3,0,0]=4 3566 B11R0.3 COCCOCCSCCCO 62a_100000695917_100011215043 [1,0,0,0,0,0|3,0,0]=4 3567 B11R0.3 COCCOCCSCCCO 62a_100011215043_100000695917 [1,0,0,0,0,0|3,0,0]=4 3568 B11R0.3 COCCOCNCCCCO 2230a_100000750430_100000231047 [1,0,0,0,0,0|3,0,0]=4 3569 B11R0.3 COCCOCSCCCCO 62a_100000210776_100000231047 [1,0,0,0,0,0|3,0,0]=4 3570 B11R0.3 COCCOCSCCCCO 62a_100000231047_100000210776 [1,0,0,0,0,0|3,0,0]=4 3571 B11R0.3 COCCSCCCCCCF 62a_100000233755_100015922095 [1,0,0,0,0,0|3,0,0]=4 3572 B11R0.3 COCCSCCCCCCF 62a_100015922095_100000233755 [1,0,0,0,0,0|3,0,0]=4 3573 B11R0.3 COCCSCCCCCCO 62a_100000233755_100000766143 [1,0,0,0,0,0|2,0,0]=3 3574 B11R0.3 COCCSCCCCCCO 62a_100000766143_100000233755 [1,0,0,0,0,0|2,0,0]=3 3575 B11R0.3 COCNCCCCCCCO 2230a_100011996573_100000766300 [1,0,0,0,0,0|2,0,0]=3 3576 B11R0.3 COCNCCCOCCCO 2230a_100011310245_100000766300 [1,0,0,0,0,0|3,0,0]=4 3577 B11R0.3 COCSCCCCCCCO 62a_100000760002_100000766300 [1,0,0,0,0,0|2,0,0]=3 3578 B11R0.3 COCSCCCCCCCO 62a_100000766300_100000760002 [1,0,0,0,0,0|2,0,0]=3 3579 B11R0.3 CSCCCCCCCCCO 62a_100009813782_200000210301 [1,0,0,0,0,0|1,0,0]=2 3580 B11R0.3 CSCCCCCCCCCO 62a_200000210301_100009813782 [1,0,0,0,0,0|1,0,0]=2 3581 B11R0.3 CSCCCCOCCCCF 34a_100011217163_100000729493 [1,0,0,0,0,0|3,0,0]=4 3582 B11R0.3 CSCCCCOCCCCF 7a_100011217163_100000729493 [1,0,0,0,0,0|3,0,0]=4 3583 B11R0.3 CSCCCCOCCCCO 34a_100011217163_100011216708 [1,0,0,0,0,0|2,0,0]=3 3584 B11R0.3 CSCCCCOCCCCO 7a_100011217163_100000210776 [1,0,0,0,0,0|2,0,0]=3 3585 B11R0.3 CSCCCNCCCCCF 2230a_100000749238_100000729378 [1,0,0,0,0,0|3,0,0]=4 3586 B11R0.3 CSCCCNCCCCCO 2230a_100000749238_100000746330 [1,0,0,0,0,0|2,0,0]=3 3587 B11R0.3 CSCCCNCCOCCO 2230a_100000749238_100011215305 [1,0,0,0,0,0|3,0,0]=4 3588 B11R0.3 CSCCCOCCCCCF 34a_100000690336_100000729378 [1,0,0,0,0,0|3,0,0]=4 3589 B11R0.3 CSCCCOCCCCCF 7a_100000690336_100000729378 [1,0,0,0,0,0|3,0,0]=4 3590 B11R0.3 CSCCCOCCCCCO 34a_100000690336_100000746330 [1,0,0,0,0,0|2,0,0]=3 3591 B11R0.3 CSCCCOCCCCCO 7a_100000690336_100000746330 [1,0,0,0,0,0|2,0,0]=3 3592 B11R0.3 CSCCCOCCOCCO 34a_100000690336_100000692535 [1,0,0,0,0,0|3,0,0]=4 3593 B11R0.3 CSCCCOCCOCCO 7a_100000690336_100011215305 [1,0,0,0,0,0|3,0,0]=4 3594 B11R0.3 CSCCNCCCCCCF 2230a_100020590264_100015922095 [1,0,0,0,0,0|3,0,0]=4 3595 B11R0.3 CSCCNCCCCCCO 2230a_100000686447_100000751147 [1,0,0,0,0,0|2,0,0]=3 3596 B11R0.3 CSCCNCCCCCCO 2230a_100020590264_100000766143 [1,0,0,0,0,0|2,0,0]=3 3597 B11R0.3 CSCCNCCCCCCO 34a_100000686447_100000212216 [1,0,0,0,0,0|2,0,0]=3 3598 B11R0.3 CSCCOCCCCCCBr 34a_100011215345_100000212216 [1,0,0,0,0,0|3,0,0]=4 3599 B11R0.3 CSCCOCCCCCCBr 7a_100011215345_100000212216 [1,0,0,0,0,0|3,0,0]=4 3600 B11R0.3 CSCCOCCCCCCCl 34a_100000766143_100000212216 [1,0,0,0,0,0|3,0,0]=4 3601 B11R0.3 CSCCOCCCCCCCl 7a_100000766143_100000212216 [1,0,0,0,0,0|3,0,0]=4 3602 B11R0.3 CSCCOCCCCCCF 34a_100000230434_100015922095 [1,0,0,0,0,0|3,0,0]=4 3603 B11R0.3 CSCCOCCCCCCF 34a_100000732779_100000212216 [1,0,0,0,0,0|3,0,0]=4 3604 B11R0.3 CSCCOCCCCCCF 7a_100000230434_100015922095 [1,0,0,0,0,0|3,0,0]=4 3605 B11R0.3 CSCCOCCCCCCF 7a_100000732779_100000212216 [1,0,0,0,0,0|3,0,0]=4 3606 B11R0.3 CSCCOCCCCCCN 34a_100000686447_100000212216 [1,0,0,0,0,0|3,0,0]=4 3607 B11R0.3 CSCCOCCCCCCO 34a_100000230434_100000766143 [1,0,0,0,0,0|2,0,0]=3 3608 B11R0.3 CSCCOCCCCCCO 7a_100000230434_100000766143 [1,0,0,0,0,0|2,0,0]=3 3609 B11R0.3 CSCCSCCCCCCF 62a_100000212216_100015922095 [1,0,0,0,0,0|3,0,0]=4 3610 B11R0.3 CSCCSCCCCCCF 62a_100015922095_100000751147 [1,0,0,0,0,0|3,0,0]=4 3611 B11R0.3 CSCCSCCCCCCO 62a_100000212216_100000766143 [1,0,0,0,0,0|2,0,0]=3 3612 B11R0.3 CSCCSCCCCCCO 62a_100000766143_100000751147 [1,0,0,0,0,0|2,0,0]=3 3613 B11R0.3 CSCNCCCCCCCO 2230a_100011996573_100011218213 [1,0,0,0,0,0|2,0,0]=3 3614 B11R0.3 CSCNCCCCCCCO 34a_100011996573_100011218213 [1,0,0,0,0,0|2,0,0]=3 3615 B11R0.3 CSCNCCCOCCCO 2230a_100011310245_100011218213 [1,0,0,0,0,0|3,0,0]=4 3616 B11R0.3 CSCNCCCOCCCO 34a_100011310245_100011218213 [1,0,0,0,0,0|3,0,0]=4 3617 B11R0.3 CSCOCCCCCCCBr 34a_100000760002_100011218213 [1,0,0,0,0,0|3,0,0]=4 3618 B11R0.3 CSCOCCCCCCCN 34a_100011996573_100011218213 [1,0,0,0,0,0|3,0,0]=4 3619 B11R0.3 CSCSCCCCCCCO 62a_100000760002_100011218213 [1,0,0,0,0,0|2,0,0]=3 3620 B11R0.3 CSCSCCCCCCCO 62a_100011218213_100000760002 [1,0,0,0,0,0|2,0,0]=3 3621 B11R0.3 FCCCCCCNCCCF 2230a_100015189416_100015922095 [1,0,0,0,0,0|3,0,0]=4 3622 B11R0.3 FCCCCCCNCCCF 34a_100015189416_100015922095 [1,0,0,0,0,0|3,0,0]=4 3623 B11R0.3 FCCCCCCOCCCBr 34a_100011217188_100015922095 [1,0,0,0,0,0|3,0,0]=4 3624 B11R0.3 FCCCCCCOCCCCl 34a_100000230001_100015922095 [1,0,0,0,0,0|3,0,0]=4 3625 B11R0.3 FCCCCCCOCCCF 34a_100000732779_100011934791 [1,0,0,0,0,0|3,0,0]=4 3626 B11R0.3 FCCCCCCOCCCF 34a_100000759539_100015922095 [1,0,0,0,0,0|3,0,0]=4 3627 B11R0.3 FCCCCCCOCCCF 7a_100000732779_100011934791 [1,0,0,0,0,0|3,0,0]=4 3628 B11R0.3 FCCCCCCSCCCF 62a_100011934791_100015922095 [1,0,0,0,0,0|3,0,0]=4 3629 B11R0.3 FCCCCCCSCCCF 62a_100015922095_100011934791 [1,0,0,0,0,0|3,0,0]=4 3630 B11R0.3 FCCCCCOCCCCBr 34a_100011216708_100000729378 [1,0,0,0,0,0|3,0,0]=4 3631 B11R0.3 FCCCCCOCCCCCl 34a_100000210776_100000729378 [1,0,0,0,0,0|3,0,0]=4 3632 B11R0.3 FCCCCCOCCCCCl 7a_100000210776_100000729378 [1,0,0,0,0,0|3,0,0]=4 3633 B11R0.3 FCCCCCOCCCCF 34a_100011995726_100000729378 [1,0,0,0,0,0|3,0,0]=4 3634 B11R0.3 FCCCCCOCCCCF 7a_100011995726_100000729378 [1,0,0,0,0,0|3,0,0]=4 3635 B11R0.3 FCCCCCOCCCCI 34a_200012148704_100000729378 [1,0,0,0,0,0|3,0,0]=4 3636 B11R0.3 FCCCCCSCCCCF 62a_100000729378_100000729493 [1,0,0,0,0,0|3,0,0]=4 3637 B11R0.3 FCCCCCSCCCCF 62a_100000729493_100000729378 [1,0,0,0,0,0|3,0,0]=4 3638 B11R0.3 FCCCCOCCCCCBr 34a_100000746331_100000729493 [1,0,0,0,0,0|3,0,0]=4 3639 B11R0.3 FCCCCOCCCCCBr 7a_100000746331_100000729493 [1,0,0,0,0,0|3,0,0]=4 3640 B11R0.3 FCCCCOCCCCCCl 34a_100000746330_100000729493 [1,0,0,0,0,0|3,0,0]=4 3641 B11R0.3 FCCCCOCCCCCCl 7a_100000746330_100000729493 [1,0,0,0,0,0|3,0,0]=4 3642 B11R0.3 FCCCCOCCCCCI 34a_200012148887_100000729493 [1,0,0,0,0,0|3,0,0]=4 3643 B11R0.3 FCCCCOCCCCCI 7a_200012148887_100000729493 [1,0,0,0,0,0|3,0,0]=4 3644 B11R0.3 FCCCOCCCCCCBr 34a_100011215345_100011934791 [1,0,0,0,0,0|3,0,0]=4 3645 B11R0.3 FCCCOCCCCCCBr 7a_100011215345_100011934791 [1,0,0,0,0,0|3,0,0]=4 3646 B11R0.3 FCCCOCCCCCCCl 34a_100000766143_100011934791 [1,0,0,0,0,0|3,0,0]=4 3647 B11R0.3 FCCCOCCCCCCCl 7a_100000766143_100011934791 [1,0,0,0,0,0|3,0,0]=4 3648 B11R0.3 FCCOCCCCCCCBr 34a_100000760002_100011217306 [1,0,0,0,0,0|3,0,0]=4 3649 B11R0.3 FCCOCCCCCCCBr 7a_100000760002_100011217306 [1,0,0,0,0,0|3,0,0]=4 3650 B11R0.3 FCOCCCCCCCCBr 34a_100009813846_100015361967 [1,0,0,0,0,0|3,0,0]=4 3651 B11R0.3 FCOCCCCCCCCBr 7a_100009813846_100015361967 [1,0,0,0,0,0|3,0,0]=4 3652 B11R0.3 FCOCCCCCCCCCl 34a_100000033203_100015361967 [1,0,0,0,0,0|3,0,0]=4 3653 B11R0.3 FCOCCCCCCCCCl 7a_100000033203_100015361967 [1,0,0,0,0,0|3,0,0]=4 3654 B11R0.3 N#CCCCCCCNCCO 2230a_100016997473_100009813337 [1,0,0,0,0,0|2,0,1]=4 3655 B11R0.3 N#CCCCCCCSCCO 62a_100000211926_100009813337 [1,0,0,0,0,0|2,0,1]=4 3656 B11R0.3 N#CCCCCCCSCCO 62a_100009813337_100000211926 [1,0,0,0,0,0|2,0,1]=4 3657 B11R0.3 N#CCCCCCSCCCO 62a_100009813376_100011215043 [1,0,0,0,0,0|2,0,1]=4 3658 B11R0.3 N#CCCCCCSCCCO 62a_100011215043_100009813376 [1,0,0,0,0,0|2,0,1]=4 3659 B11R0.3 N#CCCCCNCCCCO 2230a_100000750430_100000211819 [1,0,0,0,0,0|2,0,1]=4 3660 B11R0.3 N#CCCCCSCCCCO 62a_100000210776_100000211819 [1,0,0,0,0,0|2,0,1]=4 3661 B11R0.3 N#CCCCCSCCCCO 62a_100011219923_100000210776 [1,0,0,0,0,0|2,0,1]=4 3662 B11R0.3 N#CCCCNCCCCCO 2230a_100000762737_100000687738 [1,0,0,0,0,0|2,0,1]=4 3663 B11R0.3 N#CCCCSCCCCCO 62a_100000687738_100000746330 [1,0,0,0,0,0|2,0,1]=4 3664 B11R0.3 N#CCCCSCCCCCO 62a_100000746330_100000687738 [1,0,0,0,0,0|2,0,1]=4 3665 B11R0.3 N#CCCNCCCCCCO 2230a_100000686447_100011215226 [1,0,0,0,0,0|2,0,1]=4 3666 B11R0.3 N#CCCSCCCCCCO 62a_100000766143_100011215226 [1,0,0,0,0,0|2,0,1]=4 3667 B11R0.3 N#CCCSCCCCCCO 62a_100011215226_100000766143 [1,0,0,0,0,0|2,0,1]=4 3668 B11R0.3 N#CCNCCCCCCCO 2230a_100011996573_100011215382 [1,0,0,0,0,0|2,0,1]=4 3669 B11R0.3 N#CCSCCCCCCCO 62a_100000760002_100011215382 [1,0,0,0,0,0|2,0,1]=4 3670 B11R0.3 N#CCSCCCCCCCO 62a_100011215382_100000760002 [1,0,0,0,0,0|2,0,1]=4 3671 B11R0.3 NCCCCCCCCOCF 34a_102515433106_100015361967 [1,0,0,0,0,0|3,0,0]=4 3672 B11R0.3 NCCCCCCCOCCF 34a_100011996573_100011217306 [1,0,0,0,0,0|3,0,0]=4 3673 B11R0.3 NCCCCCCCOCCO 34a_100011996573_100000211926 [1,0,0,0,0,0|2,0,0]=3 3674 B11R0.3 NCCCCCCOCCCF 34a_100000686447_100011934791 [1,0,0,0,0,0|3,0,0]=4 3675 B11R0.3 NCCCCCCOCCCO 34a_100000686447_100000230001 [1,0,0,0,0,0|2,0,0]=3 3676 B11R0.3 NCCCCCOCCCCF 34a_100000762737_100000729493 [1,0,0,0,0,0|3,0,0]=4 3677 B11R0.3 NCCCCCOCCCCO 34a_100000762737_100011216708 [1,0,0,0,0,0|2,0,0]=3 3678 B11R0.3 NCCCCOCCCCCF 34a_100000750430_100000729378 [1,0,0,0,0,0|3,0,0]=4 3679 B11R0.3 NCCCCOCCCCCO 34a_100000750430_100000746330 [1,0,0,0,0,0|2,0,0]=3 3680 B11R0.3 NCCCCOCCOCCO 34a_100000750430_100000692535 [1,0,0,0,0,0|3,0,0]=4 3681 B11R0.3 NCCCOCCCCCCF 34a_100000182051_100015922095 [1,0,0,0,0,0|3,0,0]=4 3682 B11R0.3 NCCCOCCCCCCO 34a_100000182051_100000766143 [1,0,0,0,0,0|2,0,0]=3 3683 B11R0.3 NCCCOCCCOCCO 34a_100011310245_100000211926 [1,0,0,0,0,0|3,0,0]=4 3684 B11R0.3 NCCOCCCCCCCO 34a_100000210304_100000760002 [1,0,0,0,0,0|2,0,0]=3 3685 B11R0.3 NCCOCCOCCCCO 34a_100000211614_100011216708 [1,0,0,0,0,0|3,0,0]=4 3686 B11R0.3 NOCCOCCCCCCO 34a_100000700252_100000766143 [1,0,0,0,0,0|3,0,0]=4 3687 B11R0.3 O=CCCCCCSCCCO 62a_100000139337_100011215043 [1,0,0,0,0,0|2,0,1]=4 3688 B11R0.3 O=CCCCCCSCCCO 62a_100011215043_100000139337 [1,0,0,0,0,0|2,0,1]=4 3689 B11R0.3 O=CCCCCNCCCCO 2230a_100000750430_100000139335 [1,0,0,0,0,0|2,0,1]=4 3690 B11R0.3 O=CCCCCSCCCCO 62a_100000139335_100000210776 [1,0,0,0,0,0|2,0,1]=4 3691 B11R0.3 O=CCCCCSCCCCO 62a_100000210776_100000139335 [1,0,0,0,0,0|2,0,1]=4 3692 B11R0.3 O=CCCCNCCCCCO 2230a_100000762737_200011292268 [1,0,0,0,0,0|2,0,1]=4 3693 B11R0.3 O=CCCCSCCCCCO 62a_100000746330_200011292268 [1,0,0,0,0,0|2,0,1]=4 3694 B11R0.3 O=CCCCSCCCCCO 62a_200011292268_100000746330 [1,0,0,0,0,0|2,0,1]=4 3695 B11R0.3 O=CCNCCCCCCCO 2230a_100011996573_200015260668 [1,0,0,0,0,0|2,0,1]=4 3696 B11R0.3 O=CCNCCCCCCCO 34a_100011996573_200009817547 [1,0,0,0,0,0|2,0,1]=4 3697 B11R0.3 O=CCSCCCCCCCO 62a_100000760002_200015260668 [1,0,0,0,0,0|2,0,1]=4 3698 B11R0.3 O=CCSCCCCCCCO 62a_200015260668_100000760002 [1,0,0,0,0,0|2,0,1]=4 3699 B11R0.3 OCCCCCCCCNCF 34a_102515433106_100015361967 [1,0,0,0,0,0|2,0,0]=3 3700 B11R0.3 OCCCCCCCCSCF 62a_100000033203_100015361967 [1,0,0,0,0,0|2,0,0]=3 3701 B11R0.3 OCCCCCCCCSCF 62a_100015361967_100000033203 [1,0,0,0,0,0|2,0,0]=3 3702 B11R0.3 OCCCCCCCNCCF 2230a_100011996573_100011217306 [1,0,0,0,0,0|2,0,0]=3 3703 B11R0.3 OCCCCCCCNCCF 34a_100000724931_100000760002 [1,0,0,0,0,0|2,0,0]=3 3704 B11R0.3 OCCCCCCCNCCF 34a_100011996573_100011217306 [1,0,0,0,0,0|2,0,0]=3 3705 B11R0.3 OCCCCCCCNCCO 2230a_100011996573_100000211926 [1,0,0,0,0,0|2,0,0]=3 3706 B11R0.3 OCCCCCCCNCCO 2230a_100016997473_100000760002 [1,0,0,0,0,0|2,0,0]=3 3707 B11R0.3 OCCCCCCCNCCO 34a_100011996573_100000211926 [1,0,0,0,0,0|2,0,0]=3 3708 B11R0.3 OCCCCCCCNCCO 34a_100016990907_100000760002 [1,0,0,0,0,0|2,0,0]=3 3709 B11R0.3 OCCCCCCCOCCBr 34a_100000211926_100000760002 [1,0,0,0,0,0|2,0,0]=3 3710 B11R0.3 OCCCCCCCSCCF 62a_100000760002_100011217306 [1,0,0,0,0,0|2,0,0]=3 3711 B11R0.3 OCCCCCCCSCCF 62a_100011217306_100000760002 [1,0,0,0,0,0|2,0,0]=3 3712 B11R0.3 OCCCCCCCSCCO 62a_100000211926_100000760002 [1,0,0,0,0,0|2,0,0]=3 3713 B11R0.3 OCCCCCCCSCCO 62a_100000760002_100000211926 [1,0,0,0,0,0|2,0,0]=3 3714 B11R0.3 OCCCCCCNCCCF 2230a_100000686447_100011934791 [1,0,0,0,0,0|2,0,0]=3 3715 B11R0.3 OCCCCCCNCCCF 2230a_100015189416_100000766143 [1,0,0,0,0,0|2,0,0]=3 3716 B11R0.3 OCCCCCCNCCCF 34a_100000686447_100011934791 [1,0,0,0,0,0|2,0,0]=3 3717 B11R0.3 OCCCCCCNCCCF 34a_100015189416_100000766143 [1,0,0,0,0,0|2,0,0]=3 3718 B11R0.3 OCCCCCCNCCCO 2230a_100000686447_100000230001 [1,0,0,0,0,0|2,0,0]=3 3719 B11R0.3 OCCCCCCNCCCO 34a_100000686447_100000230001 [1,0,0,0,0,0|2,0,0]=3 3720 B11R0.3 OCCCCCCOCCCBr 34a_100011217188_100000766143 [1,0,0,0,0,0|2,0,0]=3 3721 B11R0.3 OCCCCCCOCCCCl 34a_100000230001_100000766143 [1,0,0,0,0,0|2,0,0]=3 3722 B11R0.3 OCCCCCCOCCCF 34a_100000759539_100000766143 [1,0,0,0,0,0|2,0,0]=3 3723 B11R0.3 OCCCCCCSCCCF 62a_100000766143_100011934791 [1,0,0,0,0,0|2,0,0]=3 3724 B11R0.3 OCCCCCCSCCCF 62a_100011934791_100000766143 [1,0,0,0,0,0|2,0,0]=3 3725 B11R0.3 OCCCCCCSCCCO 62a_100000766143_100011215043 [1,0,0,0,0,0|2,0,0]=3 3726 B11R0.3 OCCCCCCSCCCO 62a_100011215043_100000766143 [1,0,0,0,0,0|2,0,0]=3 3727 B11R0.3 OCCCCCNCCCCF 2230a_100000762737_100000729493 [1,0,0,0,0,0|2,0,0]=3 3728 B11R0.3 OCCCCCNCCCCF 34a_100000762737_100000729493 [1,0,0,0,0,0|2,0,0]=3 3729 B11R0.3 OCCCCCNCCCCO 2230a_100000750430_100000746330 [1,0,0,0,0,0|2,0,0]=3 3730 B11R0.3 OCCCCCNCCCCO 2230a_100000762737_100000210776 [1,0,0,0,0,0|2,0,0]=3 3731 B11R0.3 OCCCCCNCCCCO 34a_100000750430_100000746330 [1,0,0,0,0,0|2,0,0]=3 3732 B11R0.3 OCCCCCNCCCCO 34a_100000762737_100011216708 [1,0,0,0,0,0|2,0,0]=3 3733 B11R0.3 OCCCCCOCCCCBr 34a_100011216708_100000746330 [1,0,0,0,0,0|2,0,0]=3 3734 B11R0.3 OCCCCCOCCCCCl 34a_100000210776_100000746330 [1,0,0,0,0,0|2,0,0]=3 3735 B11R0.3 OCCCCCOCCCCCl 7a_100000210776_100000746330 [1,0,0,0,0,0|2,0,0]=3 3736 B11R0.3 OCCCCCOCCCCF 34a_100011995726_100000746330 [1,0,0,0,0,0|2,0,0]=3 3737 B11R0.3 OCCCCCOCCCCF 7a_100011995726_100000746330 [1,0,0,0,0,0|2,0,0]=3 3738 B11R0.3 OCCCCCOCCCCI 34a_200012148704_100000746330 [1,0,0,0,0,0|2,0,0]=3 3739 B11R0.3 OCCCCCSCCCCF 62a_100000729493_100000746330 [1,0,0,0,0,0|2,0,0]=3 3740 B11R0.3 OCCCCCSCCCCF 62a_100000746330_100000729493 [1,0,0,0,0,0|2,0,0]=3 3741 B11R0.3 OCCCCCSCCCCO 62a_100000210776_100000746330 [1,0,0,0,0,0|2,0,0]=3 3742 B11R0.3 OCCCCCSCCCCO 62a_100000746330_100000210776 [1,0,0,0,0,0|2,0,0]=3 3743 B11R0.3 OCCCCNCCCCCF 2230a_100000750430_100000729378 [1,0,0,0,0,0|2,0,0]=3 3744 B11R0.3 OCCCCNCCCCCF 34a_100000750430_100000729378 [1,0,0,0,0,0|2,0,0]=3 3745 B11R0.3 OCCCCNCCOCCO 2230a_100000211614_100000210776 [1,0,0,0,0,0|3,0,0]=4 3746 B11R0.3 OCCCCNCCOCCO 2230a_100000750430_100011215305 [1,0,0,0,0,0|3,0,0]=4 3747 B11R0.3 OCCCCNCCOCCO 34a_100000211614_100011216708 [1,0,0,0,0,0|3,0,0]=4 3748 B11R0.3 OCCCCNCCOCCO 34a_100000750430_100000692535 [1,0,0,0,0,0|3,0,0]=4 3749 B11R0.3 OCCCCNCCSCCO 2230a_100011219999_100000210776 [1,0,0,0,0,0|3,0,0]=4 3750 B11R0.3 OCCCCOCCCCCBr 34a_100000746331_100011216708 [1,0,0,0,0,0|2,0,0]=3 3751 B11R0.3 OCCCCOCCCCCBr 7a_100000746331_100000210776 [1,0,0,0,0,0|2,0,0]=3 3752 B11R0.3 OCCCCOCCCCCCl 34a_100000746330_100011216708 [1,0,0,0,0,0|2,0,0]=3 3753 B11R0.3 OCCCCOCCCCCCl 7a_100000746330_100000210776 [1,0,0,0,0,0|2,0,0]=3 3754 B11R0.3 OCCCCOCCCCCI 34a_200012148887_100011216708 [1,0,0,0,0,0|2,0,0]=3 3755 B11R0.3 OCCCCOCCCCCI 7a_200012148887_100000210776 [1,0,0,0,0,0|2,0,0]=3 3756 B11R0.3 OCCCCOCCOCCBr 34a_100000692535_100011216708 [1,0,0,0,0,0|3,0,0]=4 3757 B11R0.3 OCCCCOCCOCCBr 7a_100000692535_100000210776 [1,0,0,0,0,0|3,0,0]=4 3758 B11R0.3 OCCCCOCCOCCCl 34a_100011215305_100011216708 [1,0,0,0,0,0|3,0,0]=4 3759 B11R0.3 OCCCCOCCOCCCl 7a_100011215305_100000210776 [1,0,0,0,0,0|3,0,0]=4 3760 B11R0.3 OCCCCOCCOCCF 34a_200015357709_100011216708 [1,0,0,0,0,0|3,0,0]=4 3761 B11R0.3 OCCCCOCCOCCF 7a_200015357709_100000210776 [1,0,0,0,0,0|3,0,0]=4 3762 B11R0.3 OCCCCOCCOCCI 34a_100012149058_100011216708 [1,0,0,0,0,0|3,0,0]=4 3763 B11R0.3 OCCCCOCCOCCI 7a_100012149058_100000210776 [1,0,0,0,0,0|3,0,0]=4 3764 B11R0.3 OCCCCSCCCCCF 62a_100000210776_100000729378 [1,0,0,0,0,0|2,0,0]=3 3765 B11R0.3 OCCCCSCCCCCF 62a_100000729378_100000210776 [1,0,0,0,0,0|2,0,0]=3 3766 B11R0.3 OCCCCSCCOCCO 62a_100000210776_100011215305 [1,0,0,0,0,0|3,0,0]=4 3767 B11R0.3 OCCCCSCCOCCO 62a_100011215305_100000210776 [1,0,0,0,0,0|3,0,0]=4 3768 B11R0.3 OCCCOCCCCCCBr 34a_100011215345_100000230001 [1,0,0,0,0,0|2,0,0]=3 3769 B11R0.3 OCCCOCCCCCCBr 7a_100011215345_100011215043 [1,0,0,0,0,0|2,0,0]=3 3770 B11R0.3 OCCCOCCCCCCCl 34a_100000766143_100000230001 [1,0,0,0,0,0|2,0,0]=3 3771 B11R0.3 OCCCOCCCCCCCl 7a_100000766143_100011215043 [1,0,0,0,0,0|2,0,0]=3 3772 B11R0.3 OCCCOCCCCCCF 34a_100000732779_100000230001 [1,0,0,0,0,0|2,0,0]=3 3773 B11R0.3 OCCCOCCCCCCF 7a_100000732779_100011215043 [1,0,0,0,0,0|2,0,0]=3 3774 B11R0.3 OCCCOCCCNCCF 2230a_100011310245_100011217306 [1,0,0,0,0,0|3,0,0]=4 3775 B11R0.3 OCCCOCCCNCCF 34a_100011310245_100011217306 [1,0,0,0,0,0|3,0,0]=4 3776 B11R0.3 OCCCOCCCNCCO 2230a_100011310245_100000211926 [1,0,0,0,0,0|3,0,0]=4 3777 B11R0.3 OCCCOCCCNCCO 34a_100011310245_100000211926 [1,0,0,0,0,0|3,0,0]=4 3778 B11R0.3 OCCCSCCCCCCF 62a_100011215043_100015922095 [1,0,0,0,0,0|2,0,0]=3 3779 B11R0.3 OCCCSCCCCCCF 62a_100015922095_100011215043 [1,0,0,0,0,0|2,0,0]=3 3780 B11R0.3 OCCOCCCCCCCBr 34a_100000760002_100000211926 [1,0,0,0,0,0|2,0,0]=3 3781 B11R0.3 OCCOCCCCCCCBr 7a_100000760002_100000211926 [1,0,0,0,0,0|2,0,0]=3 3782 B11R0.3 OCCOCCNCCCCF 2230a_100000211614_100000729493 [1,0,0,0,0,0|3,0,0]=4 3783 B11R0.3 OCCOCCNCCCCF 34a_100000211614_100000729493 [1,0,0,0,0,0|3,0,0]=4 3784 B11R0.3 OCCOCCOCCCCBr 34a_100011216708_100000692535 [1,0,0,0,0,0|3,0,0]=4 3785 B11R0.3 OCCOCCOCCCCCl 34a_100000210776_100000692535 [1,0,0,0,0,0|3,0,0]=4 3786 B11R0.3 OCCOCCOCCCCCl 7a_100000210776_100011215305 [1,0,0,0,0,0|3,0,0]=4 3787 B11R0.3 OCCOCCOCCCCF 34a_100011995726_100000692535 [1,0,0,0,0,0|3,0,0]=4 3788 B11R0.3 OCCOCCOCCCCF 7a_100011995726_100011215305 [1,0,0,0,0,0|3,0,0]=4 3789 B11R0.3 OCCOCCOCCCCI 34a_200012148704_100000692535 [1,0,0,0,0,0|3,0,0]=4 3790 B11R0.3 OCCOCCSCCCCF 62a_100000729493_100011215305 [1,0,0,0,0,0|3,0,0]=4 3791 B11R0.3 OCCOCCSCCCCF 62a_100011215305_100000729493 [1,0,0,0,0,0|3,0,0]=4 3792 B11R0.3 OCCSCCNCCCCF 2230a_100011219999_100000729493 [1,0,0,0,0,0|3,0,0]=4 3793 B11R0.3 [13CH3]NCCCCCCCCCO 2230a_100000078944_200025704644 [1,0,0,0,0,0|1,0,0]=2 3794 B11R0.3 [13CH3]NCCCCCCCCCO 34a_100000078944_200025704644 [1,0,0,0,0,0|1,0,0]=2 3795 B11R0.3 [13CH3]NCCCOCCOCCO 2230a_100011996194_200025704644 [1,0,0,0,0,0|3,0,0]=4 3796 B11R0.3 [13CH3]NCCCOCCOCCO 34a_100011996194_200025704644 [1,0,0,0,0,0|3,0,0]=4 3797 B11R0.3 [13CH3]OCCCCCCCCCBr 34a_100009813782_200025704644 [1,0,0,0,0,0|2,0,0]=3 3798 B11R0.3 [13CH3]OCCCCCCCCCBr 7a_100009813782_200025704644 [1,0,0,0,0,0|2,0,0]=3 3799 B11R0.3 [13CH3]OCCCCCCCCCCl 34a_100009868337_200025704644 [1,0,0,0,0,0|2,0,0]=3 3800 B11R0.3 [13CH3]OCCCCCCCCCCl 7a_100009868337_200025704644 [1,0,0,0,0,0|2,0,0]=3 3801 B11R0.3 [13CH3]OCCCCCCCCCN 34a_100000078944_200025704644 [1,0,0,0,0,0|2,0,0]=3 3802 B11R0.3 [13CH3]SCCCCCCCCCO 62a_100009813782_200025704644 [1,0,0,0,0,0|1,0,0]=2 3803 B11R0.3 [13CH3]SCCCCCCCCCO 62a_200025704644_100009813782 [1,0,0,0,0,0|1,0,0]=2 3804 B13R0.2 C#CCC(=O)CCCCCCCCC 1458a_100000210558_100000184674 [0,1,0,0,0,0|1,0,2]=4 3805 B13R0.2 C#CCC(=O)CCCCCCCCC 1458a_100011220946_100000210670 [0,1,0,0,0,0|1,0,2]=4 3806 B13R0.2 C#CCC(=O)CCCCCCCCO 1458a_100011220946_100000033203 [0,1,0,0,0,0|0,0,3]=4 3807 B13R0.2 C#CCC(C)OCCCCCCCC 34a_100000685586_100000210759 [0,1,0,0,0,0|2,0,1]=4 3808 B13R0.2 C#CCC(C)OCCCCCCCC 7a_100000685586_100000210759 [0,1,0,0,0,0|2,0,1]=4 3809 B13R0.2 C#CCC(C)OCCCCCCCO 34a_100000685586_100000760002 [0,1,0,0,0,0|1,0,2]=4 3810 B13R0.2 C#CCC(C)OCCCCCCCO 7a_100000685586_100000760002 [0,1,0,0,0,0|1,0,2]=4 3811 B13R0.2 C#CCCCCCCCC(=O)CCC 1458a_100000087357_100000210303 [0,1,0,0,0,0|1,0,2]=4 3812 B13R0.2 C#CCCCCCCCC(=O)CCC 1458a_100000211992_100153394163 [0,1,0,0,0,0|1,0,2]=4 3813 B13R0.2 C#CCCCCCCCC(=O)CCO 1458a_100000087357_100000211926 [0,1,0,0,0,0|0,0,3]=4 3814 B13R0.2 C#CCCCCCCCC(=O)CCO 1458a_100011216618_100153394163 [0,1,0,0,0,0|0,0,3]=4 3815 B13R0.2 C#CCCCCCCCN(C)CCC 2230a_100000747261_100153394163 [0,1,0,0,0,0|2,0,1]=4 3816 B13R0.2 C#CCCCCCCCN(C)CCC 269982a_100000747261_100153394163 [0,1,0,0,0,0|2,0,1]=4 3817 B13R0.2 C#CCCCCCCCN(C)CCO 2230a_100000210263_100153394163 [0,1,0,0,0,0|1,0,2]=4 3818 B13R0.2 C#CCCCCCCCN(C)CCO 269982a_100000210263_100153394163 [0,1,0,0,0,0|1,0,2]=4 3819 B13R0.2 C#CCCCCCCNC(C)CCC 2230a_100000741246_100012276617 [0,1,0,0,0,0|2,0,1]=4 3820 B13R0.2 C#CCCCCCCN[C@H](C)CCO 2230a_100000706166_100012276617 [0,1,0,0,0,0|1,0,2]=4 3821 B13R0.2 C#CCCCCCCN[C@H](C)CCO 34a_100000706166_100012276617 [0,1,0,0,0,0|1,0,2]=4 3822 B13R0.2 C#CCCCCCCOC(C)CCC 34a_100000764384_100012276617 [0,1,0,0,0,0|2,0,1]=4 3823 B13R0.2 C#CCCCCCCOC(C)CCC 34a_100011217361_100000766640 [0,1,0,0,0,0|2,0,1]=4 3824 B13R0.2 C#CCCCCCCOC(C)CCC 7a_100000764384_100012276617 [0,1,0,0,0,0|2,0,1]=4 3825 B13R0.2 C#CCCCCCCOC(C)CCC 7a_100011217361_100000766640 [0,1,0,0,0,0|2,0,1]=4 3826 B13R0.2 C#CCCCCCCOC(C)CCO 34a_100011217361_100009893172 [0,1,0,0,0,0|1,0,2]=4 3827 B13R0.2 C#CCCCCCCOC(C)CCO 7a_100011217361_100009893172 [0,1,0,0,0,0|1,0,2]=4 3828 B13R0.2 C#CCCCCCCSC(C)CCC 62a_100000766640_100012276617 [0,1,0,0,0,0|2,0,1]=4 3829 B13R0.2 C#CCCCCCCSC(C)CCC 62a_100012276617_100000766640 [0,1,0,0,0,0|2,0,1]=4 3830 B13R0.2 C#CCCCCCCSC(C)CCO 62a_100009893172_100012276617 [0,1,0,0,0,0|1,0,2]=4 3831 B13R0.2 C#CCCCCCCSC(C)CCO 62a_100012276617_100009893172 [0,1,0,0,0,0|1,0,2]=4 3832 B13R0.2 C#CCCCCCOCC(C)CCC 34a_100000688023_100012094781 [0,1,0,0,0,0|2,0,1]=4 3833 B13R0.2 C#CCCCCCOCC(C)CCC 34a_100000766912_100011216630 [0,1,0,0,0,0|2,0,1]=4 3834 B13R0.2 C#CCCCCCOCC(C)CCC 7a_100000688023_100012094781 [0,1,0,0,0,0|2,0,1]=4 3835 B13R0.2 C#CCCCCCOCC(C)CCC 7a_100000766912_100011216630 [0,1,0,0,0,0|2,0,1]=4 3836 B13R0.2 C#CCCCCCOC[C@@H](N)CCC 34a_100000732646_100012094781 [0,1,0,0,0,0|2,0,1]=4 3837 B13R0.2 C#CCCCCCSCC(C)CCC 62a_100011216630_100012094781 [0,1,0,0,0,0|2,0,1]=4 3838 B13R0.2 C#CCCCCCSCC(C)CCC 62a_100012094781_100011216630 [0,1,0,0,0,0|2,0,1]=4 3839 B13R0.2 C#CCCCCOCCC(C)CCC 34a_100011217855_100010269958 [0,1,0,0,0,0|2,0,1]=4 3840 B13R0.2 C#CCCCCOCCC(C)CCC 7a_100011217855_100010269958 [0,1,0,0,0,0|2,0,1]=4 3841 B13R0.2 C#CCCCCOCC[C@@H](N)CCC 34a_100015193777_100010269958 [0,1,0,0,0,0|2,0,1]=4 3842 B13R0.2 C#CCCCOCCCC(C)CCC 34a_100011713154_100000695029 [0,1,0,0,0,0|2,0,1]=4 3843 B13R0.2 C#CCCCOCCCC(C)CCC 7a_100011713154_100011215417 [0,1,0,0,0,0|2,0,1]=4 3844 B13R0.2 C#CCN(C)CCCCCCCCC 2230a_100000225692_100011214924 [0,1,0,0,0,0|2,0,1]=4 3845 B13R0.2 C#CCN(C)CCCCCCCCC 2230a_100000232482_100000038162 [0,1,0,0,0,0|2,0,1]=4 3846 B13R0.2 C#CCN(C)CCCCCCCCC 34a_100000225692_100011214924 [0,1,0,0,0,0|2,0,1]=4 3847 B13R0.2 C#CCN(C)CCCCCCCCO 2230a_100000225692_100000033203 [0,1,0,0,0,0|1,0,2]=4 3848 B13R0.2 C#CCN(C)CCCCCCCCO 34a_100000225692_100000033203 [0,1,0,0,0,0|1,0,2]=4 3849 B13R0.2 C/C=C/C(C)OCCCCCCCO 34a_200102604097_100000760002 [0,1,0,0,0,0|1,0,2]=4 3850 B13R0.2 C=CCC(=O)CCCCCCCCC 1458a_100000210193_100000210670 [0,1,0,0,0,0|1,0,2]=4 3851 B13R0.2 C=CCC(=O)CCCCCCCCC 1458a_100000210558_100000210623 [0,1,0,0,0,0|1,0,2]=4 3852 B13R0.2 C=CCC(=O)CCCCCCCCO 1458a_100000210193_100000033203 [0,1,0,0,0,0|0,0,3]=4 3853 B13R0.2 C=CCC(C)COCCCCCCC 34a_100009832082_100000210614 [0,1,0,0,0,0|2,0,1]=4 3854 B13R0.2 C=CCC(C)COCCCCCCC 7a_100009832082_100000210614 [0,1,0,0,0,0|2,0,1]=4 3855 B13R0.2 C=CCC(C)COCCCCCCO 34a_100009832082_100000766143 [0,1,0,0,0,0|1,0,2]=4 3856 B13R0.2 C=CCC(C)COCCCCCCO 7a_100009832082_100000766143 [0,1,0,0,0,0|1,0,2]=4 3857 B13R0.2 C=CCCCCCCCC(=O)CCC 1458a_100000211992_100012355270 [0,1,0,0,0,0|1,0,2]=4 3858 B13R0.2 C=CCCCCCCCC(=O)CCC 1458a_100011216160_100000210303 [0,1,0,0,0,0|1,0,2]=4 3859 B13R0.2 C=CCCCCCCCC(=O)CCO 1458a_100011216160_100000211926 [0,1,0,0,0,0|0,0,3]=4 3860 B13R0.2 C=CCCCCCCCC(=O)CCO 1458a_100011216618_100012355270 [0,1,0,0,0,0|0,0,3]=4 3861 B13R0.2 C=CCCCCCCCN(C)CCC 2230a_100000747261_100012355270 [0,1,0,0,0,0|2,0,1]=4 3862 B13R0.2 C=CCCCCCCCN(C)CCC 269982a_100000747261_100012355270 [0,1,0,0,0,0|2,0,1]=4 3863 B13R0.2 C=CCCCCCCCN(C)CCO 2230a_100000210263_100012355270 [0,1,0,0,0,0|1,0,2]=4 3864 B13R0.2 C=CCCCCCCCN(C)CCO 269982a_100000210263_100012355270 [0,1,0,0,0,0|1,0,2]=4 3865 B13R0.2 C=CCCCCCCNC(C)CCC 2230a_100000741246_100011215473 [0,1,0,0,0,0|2,0,1]=4 3866 B13R0.2 C=CCCCCCCN[C@H](C)CCO 2230a_100000706166_100011215473 [0,1,0,0,0,0|1,0,2]=4 3867 B13R0.2 C=CCCCCCCN[C@H](C)CCO 34a_100000706166_100011215473 [0,1,0,0,0,0|1,0,2]=4 3868 B13R0.2 C=CCCCCCCOC(C)CCC 34a_100000764384_100011215473 [0,1,0,0,0,0|2,0,1]=4 3869 B13R0.2 C=CCCCCCCOC(C)CCC 34a_200011216477_100000766640 [0,1,0,0,0,0|2,0,1]=4 3870 B13R0.2 C=CCCCCCCOC(C)CCC 7a_100000764384_100011215473 [0,1,0,0,0,0|2,0,1]=4 3871 B13R0.2 C=CCCCCCCOC(C)CCC 7a_200011216477_100000766640 [0,1,0,0,0,0|2,0,1]=4 3872 B13R0.2 C=CCCCCCCOC(C)CCO 34a_200011216477_100009893172 [0,1,0,0,0,0|1,0,2]=4 3873 B13R0.2 C=CCCCCCCOC(C)CCO 7a_200011216477_100009893172 [0,1,0,0,0,0|1,0,2]=4 3874 B13R0.2 C=CCCCCCCSC(C)CCC 62a_100000766640_100011215473 [0,1,0,0,0,0|2,0,1]=4 3875 B13R0.2 C=CCCCCCCSC(C)CCC 62a_100011215473_100000766640 [0,1,0,0,0,0|2,0,1]=4 3876 B13R0.2 C=CCCCCCCSC(C)CCO 62a_100009893172_100011215473 [0,1,0,0,0,0|1,0,2]=4 3877 B13R0.2 C=CCCCCCCSC(C)CCO 62a_100011215473_100009893172 [0,1,0,0,0,0|1,0,2]=4 3878 B13R0.2 C=CCCCCCOCC(C)CCC 34a_100000688023_100000700193 [0,1,0,0,0,0|2,0,1]=4 3879 B13R0.2 C=CCCCCCOCC(C)CCC 34a_100011216702_100011216630 [0,1,0,0,0,0|2,0,1]=4 3880 B13R0.2 C=CCCCCCOCC(C)CCC 7a_100000688023_100000700193 [0,1,0,0,0,0|2,0,1]=4 3881 B13R0.2 C=CCCCCCOCC(C)CCC 7a_100011216702_100011216630 [0,1,0,0,0,0|2,0,1]=4 3882 B13R0.2 C=CCCCCCOC[C@@H](N)CCC 34a_100000732646_100000700193 [0,1,0,0,0,0|2,0,1]=4 3883 B13R0.2 C=CCCCCCSCC(C)CCC 62a_100000700193_100011216630 [0,1,0,0,0,0|2,0,1]=4 3884 B13R0.2 C=CCCCCCSCC(C)CCC 62a_100011216630_100000700193 [0,1,0,0,0,0|2,0,1]=4 3885 B13R0.2 C=CCCCCOCCC(C)CCC 34a_100011217855_100011215482 [0,1,0,0,0,0|2,0,1]=4 3886 B13R0.2 C=CCCCCOCCC(C)CCC 7a_100011217855_100011215482 [0,1,0,0,0,0|2,0,1]=4 3887 B13R0.2 C=CCCCCOCC[C@@H](N)CCC 34a_100015193777_100011215482 [0,1,0,0,0,0|2,0,1]=4 3888 B13R0.2 C=CCCCOCCCC(C)CCC 34a_100011713154_100000757094 [0,1,0,0,0,0|2,0,1]=4 3889 B13R0.2 C=CCCCOCCCC(C)CCC 7a_100011713154_100000757094 [0,1,0,0,0,0|2,0,1]=4 3890 B13R0.2 C=CCN(C)CCCCCCCCC 2230a_100000225617_100011214924 [0,1,0,0,0,0|2,0,1]=4 3891 B13R0.2 C=CCN(C)CCCCCCCCC 2230a_100000232482_100000210623 [0,1,0,0,0,0|2,0,1]=4 3892 B13R0.2 C=CCN(C)CCCCCCCCC 269982a_100000225617_100000210670 [0,1,0,0,0,0|2,0,1]=4 3893 B13R0.2 C=CCN(C)CCCCCCCCC 269982a_100000232482_100000210623 [0,1,0,0,0,0|2,0,1]=4 3894 B13R0.2 C=CCN(C)CCCCCCCCO 2230a_100000225617_100000033203 [0,1,0,0,0,0|1,0,2]=4 3895 B13R0.2 C=CCN(C)CCCCCCCCO 269982a_100000225617_100000033203 [0,1,0,0,0,0|1,0,2]=4 3896 B13R0.2 C=CC[C@@H](C)OCCCCCCCC 34a_100000731007_100000210759 [0,1,0,0,0,0|2,0,1]=4 3897 B13R0.2 C=CC[C@@H](C)OCCCCCCCC 7a_100000731007_100000210759 [0,1,0,0,0,0|2,0,1]=4 3898 B13R0.2 C=CC[C@@H](C)OCCCCCCCO 34a_100000731007_100000760002 [0,1,0,0,0,0|1,0,2]=4 3899 B13R0.2 C=CC[C@@H](C)OCCCCCCCO 7a_100000731007_100000760002 [0,1,0,0,0,0|1,0,2]=4 3900 B13R0.2 C=CC[C@@H](N)COCCCCCCC 34a_100020615467_100000210614 [0,1,0,0,0,0|2,0,1]=4 3901 B13R0.2 C=CC[C@@H](N)COCCCCCCO 34a_100020615467_100000766143 [0,1,0,0,0,0|1,0,2]=4 3902 B13R0.2 CC#CC(=O)CCCCCCCCO 1458a_100000763181_100000033203 [0,1,0,0,0,0|0,0,3]=4 3903 B13R0.2 CC#CC(C)OCCCCCCCO 34a_100011216543_100000760002 [0,1,0,0,0,0|1,0,2]=4 3904 B13R0.2 CC(CC#N)NCCCCCCCO 2230a_100011996573_100009813641 [0,1,0,0,0,0|2,0,1]=4 3905 B13R0.2 CC(CC#N)SCCCCCCCO 62a_100000760002_100009813641 [0,1,0,0,0,0|2,0,1]=4 3906 B13R0.2 CC(CC#N)SCCCCCCCO 62a_100009813641_100000760002 [0,1,0,0,0,0|2,0,1]=4 3907 B13R0.2 CC(CCBr)OCCCCCCCO 34a_100012276601_100000760002 [0,1,0,0,0,0|2,0,0]=3 3908 B13R0.2 CC(CCN)COCCCCCCF 34a_106354213184_100015922095 [0,1,0,0,0,0|3,0,0]=4 3909 B13R0.2 CC(CCN)COCCCCCCO 34a_106354213184_100000766143 [0,1,0,0,0,0|2,0,0]=3 3910 B13R0.2 CC(CCO)NCCCCCCCO 2230a_100011996573_100009893172 [0,1,0,0,0,0|2,0,0]=3 3911 B13R0.2 CC(CCO)NCCCCCCCO 34a_100011996573_100009893172 [0,1,0,0,0,0|2,0,0]=3 3912 B13R0.2 CC(CCO)NCCCOCCCO 2230a_100011310245_100009893172 [0,1,0,0,0,0|3,0,0]=4 3913 B13R0.2 CC(CCO)NCCCOCCCO 34a_100011310245_100009893172 [0,1,0,0,0,0|3,0,0]=4 3914 B13R0.2 CC(CCO)OCCCCCCCBr 34a_100000760002_100009893172 [0,1,0,0,0,0|2,0,0]=3 3915 B13R0.2 CC(CCO)OCCCCCCCBr 7a_100000760002_100009893172 [0,1,0,0,0,0|2,0,0]=3 3916 B13R0.2 CC(CCO)OCCCCCCCN 34a_100011996573_100009893172 [0,1,0,0,0,0|2,0,0]=3 3917 B13R0.2 CC(CCO)OCCCOCCCN 34a_100011310245_100009893172 [0,1,0,0,0,0|3,0,0]=4 3918 B13R0.2 CC(CCO)SCCCCCCC#N 62a_100009813337_100009893172 [0,1,0,0,0,0|2,0,1]=4 3919 B13R0.2 CC(CCO)SCCCCCCC#N 62a_100009893172_100009813337 [0,1,0,0,0,0|2,0,1]=4 3920 B13R0.2 CC(CCO)SCCCCCCCO 62a_100000760002_100009893172 [0,1,0,0,0,0|2,0,0]=3 3921 B13R0.2 CC(CCO)SCCCCCCCO 62a_100009893172_100000760002 [0,1,0,0,0,0|2,0,0]=3 3922 B13R0.2 CC/C=C\CCCCOC(C)CCO 34a_100016287862_100009893172 [0,1,0,0,0,0|1,0,2]=4 3923 B13R0.2 CC/C=C\CCCCOC(C)CCO 7a_100016287862_100009893172 [0,1,0,0,0,0|1,0,2]=4 3924 B13R0.2 CC=CC(=O)CCCCCCCCO 1458a_100000210699_100000033203 [0,1,0,0,0,0|0,0,3]=4 3925 B13R0.2 CCCC(=O)CCCCCCCCO 1458a_100000211992_100000033203 [0,1,0,0,0,0|0,0,1]=2 3926 B13R0.2 CCCC(=O)CCOCCOCCO 1458a_100000211992_100000032323 [0,1,0,0,0,0|2,0,1]=4 3927 B13R0.2 CCCC(=O)CCOCCOCCO 1458a_100009915118_100000210303 [0,1,0,0,0,0|2,0,1]=4 3928 B13R0.2 CCCC(=O)CNCCCCCCO 2230a_100000686447_100000747444 [0,1,0,0,0,0|1,0,1]=3 3929 B13R0.2 CCCC(=O)COCCCCCCBr 7a_100011215345_100000747444 [0,1,0,0,0,0|2,0,1]=4 3930 B13R0.2 CCCC(=O)COCCCCCCCl 7a_100000766143_100000747444 [0,1,0,0,0,0|2,0,1]=4 3931 B13R0.2 CCCC(=O)COCCCCCCF 7a_100000732779_100000747444 [0,1,0,0,0,0|2,0,1]=4 3932 B13R0.2 CCCC(=O)CSCCCCCCF 62a_100000747444_100015922095 [0,1,0,0,0,0|2,0,1]=4 3933 B13R0.2 CCCC(=O)CSCCCCCCF 62a_100015922095_100000747444 [0,1,0,0,0,0|2,0,1]=4 3934 B13R0.2 CCCC(=O)CSCCCCCCO 62a_100000747444_100000766143 [0,1,0,0,0,0|1,0,1]=3 3935 B13R0.2 CCCC(=O)CSCCCCCCO 62a_100000766143_100000747444 [0,1,0,0,0,0|1,0,1]=3 3936 B13R0.2 CCCC(=O)NCCCCCCCO 240690a_100011996573_100000211992 [0,1,0,0,0,0|1,0,1]=3 3937 B13R0.2 CCCC(=O)NCCCOCCCO 240690a_100011310245_100000211992 [0,1,0,0,0,0|2,0,1]=4 3938 B13R0.2 CCCC(=O)OCNCCCCCO 2230a_100000762737_100000034017 [0,1,0,0,0,0|2,0,1]=4 3939 B13R0.2 CCCC(=O)OCNCCCCCO 34a_100000762737_100000034017 [0,1,0,0,0,0|2,0,1]=4 3940 B13R0.2 CCCC(=O)OCSCCCCCO 62a_100000746330_100000034017 [0,1,0,0,0,0|2,0,1]=4 3941 B13R0.2 CCCC(C)CCCOCC#CCO 34a_100011713154_200000047223 [0,1,0,0,0,0|1,0,2]=4 3942 B13R0.2 CCCC(C)CCCOCC#CCO 7a_100011713154_200000047223 [0,1,0,0,0,0|1,0,2]=4 3943 B13R0.2 CCCC(C)CCCOCCCC#N 7a_100011713154_100000687738 [0,1,0,0,0,0|2,0,1]=4 3944 B13R0.2 CCCC(C)CCCOCCCC=O 7a_100011713154_200011292268 [0,1,0,0,0,0|1,0,2]=4 3945 B13R0.2 CCCC(C)CCCOCCCCF 34a_100011713154_100000729493 [0,1,0,0,0,0|2,0,0]=3 3946 B13R0.2 CCCC(C)CCCOCCCCF 7a_100011713154_100000729493 [0,1,0,0,0,0|2,0,0]=3 3947 B13R0.2 CCCC(C)CCCOCCCCO 34a_100011713154_100011216708 [0,1,0,0,0,0|1,0,0]=2 3948 B13R0.2 CCCC(C)CCCOCCCCO 7a_100011713154_100000210776 [0,1,0,0,0,0|1,0,0]=2 3949 B13R0.2 CCCC(C)CCCOCCCOC 34a_100011713154_100000740836 [0,1,0,0,0,0|3,0,0]=4 3950 B13R0.2 CCCC(C)CCCOCCCOC 7a_100011713154_100000740836 [0,1,0,0,0,0|3,0,0]=4 3951 B13R0.2 CCCC(C)CCCOCCOCC 34a_100011713154_100000210147 [0,1,0,0,0,0|3,0,0]=4 3952 B13R0.2 CCCC(C)CCCOCCOCC 7a_100011713154_100011215890 [0,1,0,0,0,0|3,0,0]=4 3953 B13R0.2 CCCC(C)CCCOCCSCC 34a_100011713154_100000757381 [0,1,0,0,0,0|3,0,0]=4 3954 B13R0.2 CCCC(C)CCCOCCSCC 7a_100011713154_100000757381 [0,1,0,0,0,0|3,0,0]=4 3955 B13R0.2 CCCC(C)CCOCCCCC#N 7a_100011217855_100000211819 [0,1,0,0,0,0|2,0,1]=4 3956 B13R0.2 CCCC(C)CCOCCCCC=O 7a_100011217855_100000139335 [0,1,0,0,0,0|1,0,2]=4 3957 B13R0.2 CCCC(C)CCOCCCCCF 34a_100011217855_100000729378 [0,1,0,0,0,0|2,0,0]=3 3958 B13R0.2 CCCC(C)CCOCCCCCF 7a_100011217855_100000729378 [0,1,0,0,0,0|2,0,0]=3 3959 B13R0.2 CCCC(C)CCOCCCCCO 34a_100011217855_100000746330 [0,1,0,0,0,0|1,0,0]=2 3960 B13R0.2 CCCC(C)CCOCCCCCO 7a_100011217855_100000746330 [0,1,0,0,0,0|1,0,0]=2 3961 B13R0.2 CCCC(C)CCOCCCCOC 34a_100011217855_100000755781 [0,1,0,0,0,0|3,0,0]=4 3962 B13R0.2 CCCC(C)CCOCCCCOC 7a_100011217855_100000730899 [0,1,0,0,0,0|3,0,0]=4 3963 B13R0.2 CCCC(C)CCOCCCOCC 34a_100011217855_100012232248 [0,1,0,0,0,0|3,0,0]=4 3964 B13R0.2 CCCC(C)CCOCCCOCC 7a_100011217855_100012232248 [0,1,0,0,0,0|3,0,0]=4 3965 B13R0.2 CCCC(C)CCOCCOCCO 34a_100011217855_100000692535 [0,1,0,0,0,0|2,0,0]=3 3966 B13R0.2 CCCC(C)CCOCCOCCO 7a_100011217855_100011215305 [0,1,0,0,0,0|2,0,0]=3 3967 B13R0.2 CCCC(C)CNCCCCCC#N 270004a_100000061152_100000243154 [0,1,0,0,0,0|2,0,1]=4 3968 B13R0.2 CCCC(C)CNCCCCCCO 2230a_100000686447_100011216630 [0,1,0,0,0,0|1,0,0]=2 3969 B13R0.2 CCCC(C)CNCCCCCCO 270004a_100000686447_100000243154 [0,1,0,0,0,0|1,0,0]=2 3970 B13R0.2 CCCC(C)CNCCCCCCO 34a_100000686447_100011216630 [0,1,0,0,0,0|1,0,0]=2 3971 B13R0.2 CCCC(C)CNCCCCCOC 2230a_100000747528_100011216630 [0,1,0,0,0,0|3,0,0]=4 3972 B13R0.2 CCCC(C)CNCCCCCOC 270004a_100000747528_100000243154 [0,1,0,0,0,0|3,0,0]=4 3973 B13R0.2 CCCC(C)CNCCCCCOC 34a_100000747528_100011216630 [0,1,0,0,0,0|3,0,0]=4 3974 B13R0.2 CCCC(C)COCCCCCC#N 7a_100000688023_100009813376 [0,1,0,0,0,0|2,0,1]=4 3975 B13R0.2 CCCC(C)COCCCCCC=O 7a_100000688023_100000139337 [0,1,0,0,0,0|1,0,2]=4 3976 B13R0.2 CCCC(C)COCCCCCCBr 34a_100011215345_100011216630 [0,1,0,0,0,0|2,0,0]=3 3977 B13R0.2 CCCC(C)COCCCCCCBr 7a_100011215345_100011216630 [0,1,0,0,0,0|2,0,0]=3 3978 B13R0.2 CCCC(C)COCCCCCCCl 34a_100000766143_100011216630 [0,1,0,0,0,0|2,0,0]=3 3979 B13R0.2 CCCC(C)COCCCCCCCl 7a_100000766143_100011216630 [0,1,0,0,0,0|2,0,0]=3 3980 B13R0.2 CCCC(C)COCCCCCCF 34a_100000688023_100015922095 [0,1,0,0,0,0|2,0,0]=3 3981 B13R0.2 CCCC(C)COCCCCCCF 34a_100000732779_100011216630 [0,1,0,0,0,0|2,0,0]=3 3982 B13R0.2 CCCC(C)COCCCCCCF 7a_100000688023_100015922095 [0,1,0,0,0,0|2,0,0]=3 3983 B13R0.2 CCCC(C)COCCCCCCF 7a_100000732779_100011216630 [0,1,0,0,0,0|2,0,0]=3 3984 B13R0.2 CCCC(C)COCCCCCCN 34a_100000686447_100011216630 [0,1,0,0,0,0|2,0,0]=3 3985 B13R0.2 CCCC(C)COCCCCCCO 34a_100000688023_100000766143 [0,1,0,0,0,0|1,0,0]=2 3986 B13R0.2 CCCC(C)COCCCCCCO 7a_100000688023_100000766143 [0,1,0,0,0,0|1,0,0]=2 3987 B13R0.2 CCCC(C)COCCCCCNC 34a_100000722520_100011216630 [0,1,0,0,0,0|3,0,0]=4 3988 B13R0.2 CCCC(C)CSCCCCCC#N 62a_100009813376_100011216630 [0,1,0,0,0,0|2,0,1]=4 3989 B13R0.2 CCCC(C)CSCCCCCC#N 62a_100011216630_100009813376 [0,1,0,0,0,0|2,0,1]=4 3990 B13R0.2 CCCC(C)CSCCCCCC=O 62a_100000139337_100011216630 [0,1,0,0,0,0|1,0,2]=4 3991 B13R0.2 CCCC(C)CSCCCCCC=O 62a_100011216630_100000139337 [0,1,0,0,0,0|1,0,2]=4 3992 B13R0.2 CCCC(C)CSCCCCCCF 62a_100011216630_100015922095 [0,1,0,0,0,0|2,0,0]=3 3993 B13R0.2 CCCC(C)CSCCCCCCF 62a_100015922095_100011216630 [0,1,0,0,0,0|2,0,0]=3 3994 B13R0.2 CCCC(C)CSCCCCCCO 62a_100000766143_100011216630 [0,1,0,0,0,0|1,0,0]=2 3995 B13R0.2 CCCC(C)CSCCCCCCO 62a_100011216630_100000766143 [0,1,0,0,0,0|1,0,0]=2 3996 B13R0.2 CCCC(C)NCCCCCCC#N 2230a_100000741246_100009813337 [0,1,0,0,0,0|2,0,1]=4 3997 B13R0.2 CCCC(C)NCCCCCCCO 2230a_100000741246_100000760002 [0,1,0,0,0,0|1,0,0]=2 3998 B13R0.2 CCCC(C)NCCCCCCCO 2230a_100011996573_100000766640 [0,1,0,0,0,0|1,0,0]=2 3999 B13R0.2 CCCC(C)NCCCCCCCO 270004a_100011996573_100000211909 [0,1,0,0,0,0|1,0,0]=2 4000 B13R0.2 CCCC(C)NCCCCCCCO 34a_100011996573_100000766640 [0,1,0,0,0,0|1,0,0]=2 4001 B13R0.2 CCCC(C)NCCCCCCOC 2230a_100000741246_100011998445 [0,1,0,0,0,0|3,0,0]=4 4002 B13R0.2 CCCC(C)NCCCOCCCO 2230a_100011310245_100000766640 [0,1,0,0,0,0|2,0,0]=3 4003 B13R0.2 CCCC(C)NCCCOCCCO 270004a_100011310245_100000211909 [0,1,0,0,0,0|2,0,0]=3 4004 B13R0.2 CCCC(C)NCCCOCCCO 34a_100011310245_100000766640 [0,1,0,0,0,0|2,0,0]=3 4005 B13R0.2 CCCC(C)OCCCCCCC#N 7a_100000764384_100009813337 [0,1,0,0,0,0|2,0,1]=4 4006 B13R0.2 CCCC(C)OCCCCCCCBr 34a_100000760002_100000766640 [0,1,0,0,0,0|2,0,0]=3 4007 B13R0.2 CCCC(C)OCCCCCCCBr 7a_100000760002_100000766640 [0,1,0,0,0,0|2,0,0]=3 4008 B13R0.2 CCCC(C)OCCCCCCCN 34a_100011996573_100000766640 [0,1,0,0,0,0|2,0,0]=3 4009 B13R0.2 CCCC(C)OCCCCCCCO 34a_100000764384_100000760002 [0,1,0,0,0,0|1,0,0]=2 4010 B13R0.2 CCCC(C)OCCCCCCCO 7a_100000764384_100000760002 [0,1,0,0,0,0|1,0,0]=2 4011 B13R0.2 CCCC(C)OCCCCCCOC 34a_100000764384_100011998445 [0,1,0,0,0,0|3,0,0]=4 4012 B13R0.2 CCCC(C)OCCCCCCOC 34a_200012092642_100000766640 [0,1,0,0,0,0|3,0,0]=4 4013 B13R0.2 CCCC(C)OCCCCCCOC 7a_100000764384_100011998445 [0,1,0,0,0,0|3,0,0]=4 4014 B13R0.2 CCCC(C)OCCCCCCOC 7a_200012092642_100000766640 [0,1,0,0,0,0|3,0,0]=4 4015 B13R0.2 CCCC(C)OCCCOCCCN 34a_100011310245_100000766640 [0,1,0,0,0,0|3,0,0]=4 4016 B13R0.2 CCCC(C)SCCCCCCC#N 62a_100000766640_100009813337 [0,1,0,0,0,0|2,0,1]=4 4017 B13R0.2 CCCC(C)SCCCCCCC#N 62a_100009813337_100000766640 [0,1,0,0,0,0|2,0,1]=4 4018 B13R0.2 CCCC(C)SCCCCCCCO 62a_100000760002_100000766640 [0,1,0,0,0,0|1,0,0]=2 4019 B13R0.2 CCCC(C)SCCCCCCCO 62a_100000766640_100000760002 [0,1,0,0,0,0|1,0,0]=2 4020 B13R0.2 CCCC(C)SCCCCCCOC 62a_100000766640_100011998445 [0,1,0,0,0,0|3,0,0]=4 4021 B13R0.2 CCCC(C)SCCCCCCOC 62a_100011998445_100000766640 [0,1,0,0,0,0|3,0,0]=4 4022 B13R0.2 CCCC/C=C\CCOC(C)CCO 34a_200016286491_100009893172 [0,1,0,0,0,0|1,0,2]=4 4023 B13R0.2 CCCC/C=C\CCOC(C)CCO 7a_200016286491_100009893172 [0,1,0,0,0,0|1,0,2]=4 4024 B13R0.2 CCCCC#CCCCC(=O)CCO 1458a_100011216618_200000047210 [0,1,0,0,0,0|0,0,3]=4 4025 B13R0.2 CCCCC#CCCCN(C)CCO 2230a_100000210263_200000047210 [0,1,0,0,0,0|1,0,2]=4 4026 B13R0.2 CCCCC#CCCCN(C)CCO 269982a_100000210263_200000047210 [0,1,0,0,0,0|1,0,2]=4 4027 B13R0.2 CCCCC#CCCOC(C)CCO 34a_100000037610_100009893172 [0,1,0,0,0,0|1,0,2]=4 4028 B13R0.2 CCCCC#CCCOC(C)CCO 7a_100000037610_100009893172 [0,1,0,0,0,0|1,0,2]=4 4029 B13R0.2 CCCCC/C=C/CCC(=O)CCO 1458a_200015255902_100000211926 [0,1,0,0,0,0|0,0,3]=4 4030 B13R0.2 CCCCC/C=C/COC(C)CCO 34a_100016258190_100009893172 [0,1,0,0,0,0|1,0,2]=4 4031 B13R0.2 CCCCC/C=C/COC(C)CCO 7a_100016258190_100009893172 [0,1,0,0,0,0|1,0,2]=4 4032 B13R0.2 CCCCCC#CCN[C@H](C)CCO 2230a_100000706166_100009816472 [0,1,0,0,0,0|1,0,2]=4 4033 B13R0.2 CCCCCC#CCN[C@H](C)CCO 34a_100000706166_100009816472 [0,1,0,0,0,0|1,0,2]=4 4034 B13R0.2 CCCCCC#CCOC(C)CCO 34a_200000033628_100009893172 [0,1,0,0,0,0|1,0,2]=4 4035 B13R0.2 CCCCCC#CCOC(C)CCO 7a_200000033628_100009893172 [0,1,0,0,0,0|1,0,2]=4 4036 B13R0.2 CCCCCC#CCSC(C)CCO 62a_100009816472_100009893172 [0,1,0,0,0,0|1,0,2]=4 4037 B13R0.2 CCCCCC#CCSC(C)CCO 62a_100009893172_100009816472 [0,1,0,0,0,0|1,0,2]=4 4038 B13R0.2 CCCCCC/C=C/CC(=O)CCO 1458a_100020681715_100000211926 [0,1,0,0,0,0|0,0,3]=4 4039 B13R0.2 CCCCCCCC=CC(=O)CCO 1458a_200015332781_100000211926 [0,1,0,0,0,0|0,0,3]=4 4040 B13R0.2 CCCCCCCCCC(=O)CC#N 1458a_100000210558_100011214920 [0,1,0,0,0,0|1,0,2]=4 4041 B13R0.2 CCCCCCCCCC(=O)CC#N 1458a_100051588842_100000210670 [0,1,0,0,0,0|1,0,2]=4 4042 B13R0.2 CCCCCCCCCC(=O)CCC 1458a_100000210558_100000210303 [0,1,0,0,0,0|1,0,1]=3 4043 B13R0.2 CCCCCCCCCC(=O)CCC 1458a_100000211992_100000210670 [0,1,0,0,0,0|1,0,1]=3 4044 B13R0.2 CCCCCCCCCC(=O)CCF 1458a_100000210558_100011217306 [0,1,0,0,0,0|1,0,1]=3 4045 B13R0.2 CCCCCCCCCC(=O)CCO 1458a_100000210558_100000211926 [0,1,0,0,0,0|0,0,1]=2 4046 B13R0.2 CCCCCCCCCC(=O)CCO 1458a_100011216618_100000210670 [0,1,0,0,0,0|0,0,1]=2 4047 B13R0.2 CCCCCCCCCC(=O)COC 1458a_100000210968_100000210670 [0,1,0,0,0,0|2,0,1]=4 4048 B13R0.2 CCCCCCCCCC(=O)CSC 1458a_100000184570_100000210670 [0,1,0,0,0,0|2,0,1]=4 4049 B13R0.2 CCCCCCCCCC(=O)NCC 11a_100015525214_100000210558 [0,1,0,0,0,0|2,0,1]=4 4050 B13R0.2 CCCCCCCCCC(=O)NCC 240690a_100015525214_100000210558 [0,1,0,0,0,0|2,0,1]=4 4051 B13R0.2 CCCCCCCCCC(=O)NCC 527a_100015525214_100000210558 [0,1,0,0,0,0|2,0,1]=4 4052 B13R0.2 CCCCCCCCCC(C)CNC 270004a_106832991635_200011218516 [0,1,0,0,0,0|2,0,0]=3 4053 B13R0.2 CCCCCCCCCC(C)NCC 270004a_100015525214_100011215753 [0,1,0,0,0,0|2,0,0]=3 4054 B13R0.2 CCCCCCCCCC(C)OCC 34a_100011218016_100000210202 [0,1,0,0,0,0|2,0,0]=3 4055 B13R0.2 CCCCCCCCCC(C)OCC 7a_100011218016_100000210202 [0,1,0,0,0,0|2,0,0]=3 4056 B13R0.2 CCCCCCCCCC(C)OCF 34a_100011218016_100015361967 [0,1,0,0,0,0|2,0,0]=3 4057 B13R0.2 CCCCCCCCCC(C)OCF 7a_100011218016_100015361967 [0,1,0,0,0,0|2,0,0]=3 4058 B13R0.2 CCCCCCCCCN(C)CC#N 2230a_100000232482_100011215382 [0,1,0,0,0,0|2,0,1]=4 4059 B13R0.2 CCCCCCCCCN(C)CC#N 2230a_100000748184_100011214924 [0,1,0,0,0,0|2,0,1]=4 4060 B13R0.2 CCCCCCCCCN(C)CC#N 269982a_100000232482_100011214920 [0,1,0,0,0,0|2,0,1]=4 4061 B13R0.2 CCCCCCCCCN(C)CC=O 2230a_100000232482_200015260668 [0,1,0,0,0,0|1,0,2]=4 4062 B13R0.2 CCCCCCCCCN(C)CC=O 269982a_100000232482_200015260668 [0,1,0,0,0,0|1,0,2]=4 4063 B13R0.2 CCCCCCCCCN(C)CCC 2230a_100000232482_100000210303 [0,1,0,0,0,0|2,0,0]=3 4064 B13R0.2 CCCCCCCCCN(C)CCC 2230a_100000747261_100011214924 [0,1,0,0,0,0|2,0,0]=3 4065 B13R0.2 CCCCCCCCCN(C)CCC 269982a_100000232482_100000210303 [0,1,0,0,0,0|2,0,0]=3 4066 B13R0.2 CCCCCCCCCN(C)CCC 269982a_100000747261_100000210670 [0,1,0,0,0,0|2,0,0]=3 4067 B13R0.2 CCCCCCCCCN(C)CCF 2230a_100000232482_100011217306 [0,1,0,0,0,0|2,0,0]=3 4068 B13R0.2 CCCCCCCCCN(C)CCF 269982a_100000232482_100011217306 [0,1,0,0,0,0|2,0,0]=3 4069 B13R0.2 CCCCCCCCCN(C)CCO 2230a_100000210263_100011214924 [0,1,0,0,0,0|1,0,0]=2 4070 B13R0.2 CCCCCCCCCN(C)CCO 2230a_100000232482_100000211926 [0,1,0,0,0,0|1,0,0]=2 4071 B13R0.2 CCCCCCCCCN(C)CCO 269982a_100000210263_100000210670 [0,1,0,0,0,0|1,0,0]=2 4072 B13R0.2 CCCCCCCCCN(C)CCO 269982a_100000232482_100000211926 [0,1,0,0,0,0|1,0,0]=2 4073 B13R0.2 CCCCCCCCCN(C)COC 2230a_100000232482_100000766300 [0,1,0,0,0,0|3,0,0]=4 4074 B13R0.2 CCCCCCCCCN(C)COC 269982a_100000232482_100000766300 [0,1,0,0,0,0|3,0,0]=4 4075 B13R0.2 CCCCCCCCCN(C)CSC 2230a_100000232482_100011218213 [0,1,0,0,0,0|3,0,0]=4 4076 B13R0.2 CCCCCCCCCN(C)CSC 269982a_100000232482_100011218213 [0,1,0,0,0,0|3,0,0]=4 4077 B13R0.2 CCCCCCCCNC(=O)CCC 11a_100000229939_100000211992 [0,1,0,0,0,0|2,0,1]=4 4078 B13R0.2 CCCCCCCCNC(=O)CCC 1626a_100000229939_100000211992 [0,1,0,0,0,0|2,0,1]=4 4079 B13R0.2 CCCCCCCCNC(=O)CCC 240690a_100000229939_100000211992 [0,1,0,0,0,0|2,0,1]=4 4080 B13R0.2 CCCCCCCCNC(=O)CCC 527a_100000229939_100000211992 [0,1,0,0,0,0|2,0,1]=4 4081 B13R0.2 CCCCCCCCNC(=O)CCO 240690a_100000229939_100011216618 [0,1,0,0,0,0|1,0,1]=3 4082 B13R0.2 CCCCCCCCNC(C)CC#N 2230a_100000229939_100009813641 [0,1,0,0,0,0|2,0,1]=4 4083 B13R0.2 CCCCCCCCNC(C)CCC 2230a_100000229939_100000766640 [0,1,0,0,0,0|2,0,0]=3 4084 B13R0.2 CCCCCCCCNC(C)CCC 2230a_100000741246_100000210759 [0,1,0,0,0,0|2,0,0]=3 4085 B13R0.2 CCCCCCCCNC(C)CCC 270004a_100000229939_100000211909 [0,1,0,0,0,0|2,0,0]=3 4086 B13R0.2 CCCCCCCCNC(C)CCC 34a_100000229939_100000766640 [0,1,0,0,0,0|2,0,0]=3 4087 B13R0.2 CCCCCCCCNC(C)CCO 2230a_100000229939_100009893172 [0,1,0,0,0,0|1,0,0]=2 4088 B13R0.2 CCCCCCCCNC(C)CCO 34a_100000229939_100009893172 [0,1,0,0,0,0|1,0,0]=2 4089 B13R0.2 CCCCCCCCNC(C)COC 2230a_100000229939_100000765312 [0,1,0,0,0,0|3,0,0]=4 4090 B13R0.2 CCCCCCCCNC(C)COC 270004a_100000229939_100000749346 [0,1,0,0,0,0|3,0,0]=4 4091 B13R0.2 CCCCCCCCNC(C)COC 34a_100000229939_100000765312 [0,1,0,0,0,0|3,0,0]=4 4092 B13R0.2 CCCCCCCCNC(C)CSC 270004a_100000229939_100011216314 [0,1,0,0,0,0|3,0,0]=4 4093 B13R0.2 CCCCCCCCN[C@@H](C)CC#N 2230a_100016994482_100000210759 [0,1,0,0,0,0|2,0,1]=4 4094 B13R0.2 CCCCCCCCN[C@H](C)CCO 2230a_100000706166_100000210759 [0,1,0,0,0,0|1,0,0]=2 4095 B13R0.2 CCCCCCCCN[C@H](C)CCO 34a_100000706166_100000210759 [0,1,0,0,0,0|1,0,0]=2 4096 B13R0.2 CCCCCCCCN[C@H](C)COC 2230a_100000764878_100000210759 [0,1,0,0,0,0|3,0,0]=4 4097 B13R0.2 CCCCCCCCOC(C)CC#N 7a_100000210232_100009813641 [0,1,0,0,0,0|2,0,1]=4 4098 B13R0.2 CCCCCCCCOC(C)CCBr 34a_100012276601_100000210759 [0,1,0,0,0,0|2,0,0]=3 4099 B13R0.2 CCCCCCCCOC(C)CCC 34a_100000210232_100000766640 [0,1,0,0,0,0|2,0,0]=3 4100 B13R0.2 CCCCCCCCOC(C)CCC 34a_100000764384_100000210759 [0,1,0,0,0,0|2,0,0]=3 4101 B13R0.2 CCCCCCCCOC(C)CCC 7a_100000210232_100000766640 [0,1,0,0,0,0|2,0,0]=3 4102 B13R0.2 CCCCCCCCOC(C)CCC 7a_100000764384_100000210759 [0,1,0,0,0,0|2,0,0]=3 4103 B13R0.2 CCCCCCCCOC(C)CCO 34a_100000210232_100009893172 [0,1,0,0,0,0|1,0,0]=2 4104 B13R0.2 CCCCCCCCOC(C)CCO 7a_100000210232_100009893172 [0,1,0,0,0,0|1,0,0]=2 4105 B13R0.2 CCCCCCCCOC(C)COC 34a_100000210232_100000765312 [0,1,0,0,0,0|3,0,0]=4 4106 B13R0.2 CCCCCCCCOC(C)COC 7a_100000210232_100000765312 [0,1,0,0,0,0|3,0,0]=4 4107 B13R0.2 CCCCCCCCO[C@H](C)COC 34a_100011934205_100000210759 [0,1,0,0,0,0|3,0,0]=4 4108 B13R0.2 CCCCCCCCSC(C)CC#N 62a_100000210759_100009813641 [0,1,0,0,0,0|2,0,1]=4 4109 B13R0.2 CCCCCCCCSC(C)CC#N 62a_100009813641_100000210317 [0,1,0,0,0,0|2,0,1]=4 4110 B13R0.2 CCCCCCCCSC(C)CCC 62a_100000210759_100000766640 [0,1,0,0,0,0|2,0,0]=3 4111 B13R0.2 CCCCCCCCSC(C)CCC 62a_100000766640_100000210317 [0,1,0,0,0,0|2,0,0]=3 4112 B13R0.2 CCCCCCCCSC(C)CCO 62a_100000210759_100009893172 [0,1,0,0,0,0|1,0,0]=2 4113 B13R0.2 CCCCCCCCSC(C)CCO 62a_100009893172_100000210317 [0,1,0,0,0,0|1,0,0]=2 4114 B13R0.2 CCCCCCCCSC(C)COC 62a_100000210759_100000765312 [0,1,0,0,0,0|3,0,0]=4 4115 B13R0.2 CCCCCCCCSC(C)COC 62a_100000765312_100000210317 [0,1,0,0,0,0|3,0,0]=4 4116 B13R0.2 CCCCCCCNCC(=O)CCC 2230a_100000229938_100000747444 [0,1,0,0,0,0|2,0,1]=4 4117 B13R0.2 CCCCCCCNCC(=O)NCO 2230a_100000229938_100000185155 [0,1,0,0,0,0|2,0,1]=4 4118 B13R0.2 CCCCCCCNCC(C)CCC 2230a_100000229938_100011216630 [0,1,0,0,0,0|2,0,0]=3 4119 B13R0.2 CCCCCCCNCC(C)CCC 270004a_100000229938_100000243154 [0,1,0,0,0,0|2,0,0]=3 4120 B13R0.2 CCCCCCCNCC(O)COC 2230a_100000756049_100000210681 [0,1,0,0,0,0|3,0,0]=4 4121 B13R0.2 CCCCCCCNCC(O)COC 34a_100000756049_100000210614 [0,1,0,0,0,0|3,0,0]=4 4122 B13R0.2 CCCCCCCNC[C@@H](O)CC#N 2230a_100000229938_100000001066 [0,1,0,0,0,0|2,0,1]=4 4123 B13R0.2 CCCCCCCOCC(=O)CCC 7a_100000210272_100000747444 [0,1,0,0,0,0|2,0,1]=4 4124 B13R0.2 CCCCCCCOCC(=O)NCO 34a_100000210272_100000185155 [0,1,0,0,0,0|2,0,1]=4 4125 B13R0.2 CCCCCCCOCC(=O)NCO 7a_100000210272_100000185155 [0,1,0,0,0,0|2,0,1]=4 4126 B13R0.2 CCCCCCCOCC(C)CCC 34a_100000210272_100011216630 [0,1,0,0,0,0|2,0,0]=3 4127 B13R0.2 CCCCCCCOCC(C)CCC 34a_100000688023_100000210614 [0,1,0,0,0,0|2,0,0]=3 4128 B13R0.2 CCCCCCCOCC(C)CCC 7a_100000210272_100011216630 [0,1,0,0,0,0|2,0,0]=3 4129 B13R0.2 CCCCCCCOCC(C)CCC 7a_100000688023_100000210614 [0,1,0,0,0,0|2,0,0]=3 4130 B13R0.2 CCCCCCCOCC(C)CCN 34a_106354213184_100000210614 [0,1,0,0,0,0|2,0,0]=3 4131 B13R0.2 CCCCCCCOCC(N)COC 34a_100000724102_100000210614 [0,1,0,0,0,0|3,0,0]=4 4132 B13R0.2 CCCCCCCOCC(O)COC 34a_100000210272_100011215053 [0,1,0,0,0,0|3,0,0]=4 4133 B13R0.2 CCCCCCCOCC(O)COC 7a_100000210272_100011215053 [0,1,0,0,0,0|3,0,0]=4 4134 B13R0.2 CCCCCCCOC[C@@H](N)CCC 34a_100000732646_100000210614 [0,1,0,0,0,0|2,0,0]=3 4135 B13R0.2 CCCCCCCOC[C@@H](O)CC#N 7a_100000210272_100000001066 [0,1,0,0,0,0|2,0,1]=4 4136 B13R0.2 CCCCCCCSCC(=O)CCC 62a_100000210614_100000747444 [0,1,0,0,0,0|2,0,1]=4 4137 B13R0.2 CCCCCCCSCC(=O)CCC 62a_100000747444_100000210316 [0,1,0,0,0,0|2,0,1]=4 4138 B13R0.2 CCCCCCCSCC(=O)NCO 62a_100000185155_100000210316 [0,1,0,0,0,0|2,0,1]=4 4139 B13R0.2 CCCCCCCSCC(=O)NCO 62a_100000210614_100000185155 [0,1,0,0,0,0|2,0,1]=4 4140 B13R0.2 CCCCCCCSCC(C)CCC 62a_100000210614_100011216630 [0,1,0,0,0,0|2,0,0]=3 4141 B13R0.2 CCCCCCCSCC(C)CCC 62a_100011216630_100000210316 [0,1,0,0,0,0|2,0,0]=3 4142 B13R0.2 CCCCCCCSCC(O)COC 62a_100000210614_100011215053 [0,1,0,0,0,0|3,0,0]=4 4143 B13R0.2 CCCCCCCSCC(O)COC 62a_100011215053_100000210316 [0,1,0,0,0,0|3,0,0]=4 4144 B13R0.2 CCCCCCCSC[C@@H](O)CC#N 62a_100000001066_100000210316 [0,1,0,0,0,0|2,0,1]=4 4145 B13R0.2 CCCCCCCSC[C@@H](O)CC#N 62a_100000210614_100000001066 [0,1,0,0,0,0|2,0,1]=4 4146 B13R0.2 CCCCCCOCCC(C)CCC 34a_100011217855_100000210314 [0,1,0,0,0,0|2,0,0]=3 4147 B13R0.2 CCCCCCOCCC(C)CCC 7a_100011217855_100000210314 [0,1,0,0,0,0|2,0,0]=3 4148 B13R0.2 CCCCCCOCC[C@@H](N)CCC 34a_100015193777_100000210314 [0,1,0,0,0,0|2,0,0]=3 4149 B13R0.2 CCCCCNCCOC(C)CCC 34a_100000224656_100000766640 [0,1,0,0,0,0|3,0,0]=4 4150 B13R0.2 CCCCCNCCOC(C)CCO 34a_100000224656_100009893172 [0,1,0,0,0,0|2,0,0]=3 4151 B13R0.2 CCCCCOCCCC(C)CCC 34a_100011713154_100000718602 [0,1,0,0,0,0|2,0,0]=3 4152 B13R0.2 CCCCCOCCCC(C)CCC 7a_100011713154_100000210326 [0,1,0,0,0,0|2,0,0]=3 4153 B13R0.2 CCCCCOCCOC(C)CCC 34a_100011215259_100000766640 [0,1,0,0,0,0|3,0,0]=4 4154 B13R0.2 CCCCCOCCOC(C)CCC 7a_100011215259_100000766640 [0,1,0,0,0,0|3,0,0]=4 4155 B13R0.2 CCCCCOCCOC(C)CCO 34a_100011215259_100009893172 [0,1,0,0,0,0|2,0,0]=3 4156 B13R0.2 CCCCCOCCOC(C)CCO 7a_100011215259_100009893172 [0,1,0,0,0,0|2,0,0]=3 4157 B13R0.2 CCCCOCCCNC(=O)CCO 240690a_200000211371_100011216618 [0,1,0,0,0,0|2,0,1]=4 4158 B13R0.2 CCCCOCCCNC(C)CCC 2230a_200000211371_100000766640 [0,1,0,0,0,0|3,0,0]=4 4159 B13R0.2 CCCCOCCCNC(C)CCC 270004a_200000211371_100000211909 [0,1,0,0,0,0|3,0,0]=4 4160 B13R0.2 CCCCOCCCNC(C)CCC 34a_200000211371_100000766640 [0,1,0,0,0,0|3,0,0]=4 4161 B13R0.2 CCCCOCCCNC(C)CCO 2230a_200000211371_100009893172 [0,1,0,0,0,0|2,0,0]=3 4162 B13R0.2 CCCCOCCCNC(C)CCO 34a_200000211371_100009893172 [0,1,0,0,0,0|2,0,0]=3 4163 B13R0.2 CCCCOCCCOC(C)CCC 34a_200011215613_100000766640 [0,1,0,0,0,0|3,0,0]=4 4164 B13R0.2 CCCCOCCCOC(C)CCC 7a_200011215613_100000766640 [0,1,0,0,0,0|3,0,0]=4 4165 B13R0.2 CCCCOCCCOC(C)CCO 34a_200011215613_100009893172 [0,1,0,0,0,0|2,0,0]=3 4166 B13R0.2 CCCCOCCCOC(C)CCO 7a_200011215613_100009893172 [0,1,0,0,0,0|2,0,0]=3 4167 B13R0.2 CCCCOCCOCC(=O)CCO 1458a_100011216887_100000211926 [0,1,0,0,0,0|2,0,1]=4 4168 B13R0.2 CCCCOCCOCC(C)CCC 34a_100000210238_100011216630 [0,1,0,0,0,0|3,0,0]=4 4169 B13R0.2 CCCCOCCOCC(C)CCC 34a_100000688023_100000743108 [0,1,0,0,0,0|3,0,0]=4 4170 B13R0.2 CCCCOCCOCC(C)CCC 7a_100000210238_100011216630 [0,1,0,0,0,0|3,0,0]=4 4171 B13R0.2 CCCCOCCOCC(C)CCC 7a_100000688023_100000743108 [0,1,0,0,0,0|3,0,0]=4 4172 B13R0.2 CCCCOCCOCC(C)CCN 34a_106354213184_100000743108 [0,1,0,0,0,0|3,0,0]=4 4173 B13R0.2 CCCCOCCOC[C@@H](N)CCC 34a_100000732646_100000743108 [0,1,0,0,0,0|3,0,0]=4 4174 B13R0.2 CCCCOCCSCC(C)CCC 62a_100000743108_100011216630 [0,1,0,0,0,0|3,0,0]=4 4175 B13R0.2 CCCCOCCSCC(C)CCC 62a_100011216630_100000743108 [0,1,0,0,0,0|3,0,0]=4 4176 B13R0.2 CCCCOCOCCC(C)CCC 34a_100011217855_100011995733 [0,1,0,0,0,0|3,0,0]=4 4177 B13R0.2 CCCCOCOCC[C@@H](N)CCC 34a_100015193777_100011995733 [0,1,0,0,0,0|3,0,0]=4 4178 B13R0.2 CCCCSCCNCC(C)CCC 2230a_100025743550_100011216630 [0,1,0,0,0,0|3,0,0]=4 4179 B13R0.2 CCCCSCCNCC(C)CCC 270004a_100025743550_100000243154 [0,1,0,0,0,0|3,0,0]=4 4180 B13R0.2 CCCCSCCOCC(C)CCC 34a_200000230436_100011216630 [0,1,0,0,0,0|3,0,0]=4 4181 B13R0.2 CCCCSCCOCC(C)CCC 7a_200000230436_100011216630 [0,1,0,0,0,0|3,0,0]=4 4182 B13R0.2 CCCN(C)CCCCCCCCO 2230a_100000747261_100000033203 [0,1,0,0,0,0|1,0,0]=2 4183 B13R0.2 CCCN(C)CCCCCCCCO 269982a_100000747261_100000033203 [0,1,0,0,0,0|1,0,0]=2 4184 B13R0.2 CCCN(C)CCOCCOCCO 2230a_100000747261_100000032323 [0,1,0,0,0,0|3,0,0]=4 4185 B13R0.2 CCCN(C)CCOCCOCCO 2230a_200014138305_100000210303 [0,1,0,0,0,0|3,0,0]=4 4186 B13R0.2 CCCN(C)CCOCCOCCO 269982a_100000747261_100000032323 [0,1,0,0,0,0|3,0,0]=4 4187 B13R0.2 CCCN(C)CCOCCOCCO 269982a_200014138305_100000210303 [0,1,0,0,0,0|3,0,0]=4 4188 B13R0.2 CCCN(C)CCOCCOCCO 34a_200014138305_100000210303 [0,1,0,0,0,0|3,0,0]=4 4189 B13R0.2 CCCOCCCNCC(C)CCC 2230a_100011217757_100011216630 [0,1,0,0,0,0|3,0,0]=4 4190 B13R0.2 CCCOCCCNCC(C)CCC 270004a_100011217757_100000243154 [0,1,0,0,0,0|3,0,0]=4 4191 B13R0.2 CCCOCCCNCC(C)CCC 34a_100011217757_100011216630 [0,1,0,0,0,0|3,0,0]=4 4192 B13R0.2 CCCOCCOCCC(C)CCC 34a_100011217855_100011215938 [0,1,0,0,0,0|3,0,0]=4 4193 B13R0.2 CCCOCCOCCC(C)CCC 7a_100011217855_100011215938 [0,1,0,0,0,0|3,0,0]=4 4194 B13R0.2 CCCOCCOCC[C@@H](N)CCC 34a_100015193777_100011215938 [0,1,0,0,0,0|3,0,0]=4 4195 B13R0.2 CCC[C@H](N)CCOCCCCCF 34a_100015193777_100000729378 [0,1,0,0,0,0|2,0,0]=3 4196 B13R0.2 CCC[C@H](N)CCOCCCCCO 34a_100015193777_100000746330 [0,1,0,0,0,0|1,0,0]=2 4197 B13R0.2 CCC[C@H](N)CCOCCCCOC 34a_100015193777_100000755781 [0,1,0,0,0,0|3,0,0]=4 4198 B13R0.2 CCC[C@H](N)CCOCCCOCC 34a_100015193777_100012232248 [0,1,0,0,0,0|3,0,0]=4 4199 B13R0.2 CCC[C@H](N)CCOCCOCCO 34a_100015193777_100000692535 [0,1,0,0,0,0|2,0,0]=3 4200 B13R0.2 CCC[C@H](N)COCCCCCCF 34a_100000732646_100015922095 [0,1,0,0,0,0|2,0,0]=3 4201 B13R0.2 CCC[C@H](N)COCCCCCCO 34a_100000732646_100000766143 [0,1,0,0,0,0|1,0,0]=2 4202 B13R0.2 CCNC(=O)CCCCCCCCO 240690a_100015525214_100000015970 [0,1,0,0,0,0|1,0,1]=3 4203 B13R0.2 CCNC(=O)CCNCCCCCO 2230a_100000762737_100000737597 [0,1,0,0,0,0|2,0,1]=4 4204 B13R0.2 CCNC(=O)CCNCCCCCO 34a_100025743525_100000746330 [0,1,0,0,0,0|2,0,1]=4 4205 B13R0.2 CCNC(=O)CCSCCCCCO 62a_100000737597_100000746330 [0,1,0,0,0,0|2,0,1]=4 4206 B13R0.2 CCNC(=O)CCSCCCCCO 62a_100000746330_100000737597 [0,1,0,0,0,0|2,0,1]=4 4207 B13R0.2 CCNC(=O)CNCCCCCCO 2230a_100000686447_100000183381 [0,1,0,0,0,0|2,0,1]=4 4208 B13R0.2 CCNC(=O)CNCCCCCCO 2230a_100016988866_100000766143 [0,1,0,0,0,0|2,0,1]=4 4209 B13R0.2 CCNC(=O)CNCCCCCCO 34a_100000686447_100000183381 [0,1,0,0,0,0|2,0,1]=4 4210 B13R0.2 CCNC(=O)CSCCCCCCO 62a_100000183381_100000766143 [0,1,0,0,0,0|2,0,1]=4 4211 B13R0.2 CCNC(=O)CSCCCCCCO 62a_100000766143_100000183381 [0,1,0,0,0,0|2,0,1]=4 4212 B13R0.2 CCNC(=O)NCCCCCCCO 2708a_100011996573_100015525214 [0,1,0,0,0,0|2,0,1]=4 4213 B13R0.2 CCNC(=O)NCCCCCCCO 2708a_100015525214_100011996573 [0,1,0,0,0,0|2,0,1]=4 4214 B13R0.2 CCNC(=O)NCCCCCCCO 273464a_100011996573_100015525214 [0,1,0,0,0,0|2,0,1]=4 4215 B13R0.2 CCNC(=O)NCCCCCCCO 273464a_100015525214_100011996573 [0,1,0,0,0,0|2,0,1]=4 4216 B13R0.2 CCNC(=O)NCCCCCCCO 512a_100011996573_100015525214 [0,1,0,0,0,0|2,0,1]=4 4217 B13R0.2 CCNC(=O)NCCCCCCCO 512a_100015525214_100011996573 [0,1,0,0,0,0|2,0,1]=4 4218 B13R0.2 CCOC(=O)CCCCCNCCO 2230a_100016997473_100000755133 [0,1,0,0,0,0|2,0,1]=4 4219 B13R0.2 CCOC(=O)CCCCCNCCO 34a_100016990907_100000755133 [0,1,0,0,0,0|2,0,1]=4 4220 B13R0.2 CCOC(=O)CCCCCOCCO 7a_100011214988_100000211926 [0,1,0,0,0,0|2,0,1]=4 4221 B13R0.2 CCOC(=O)CCCCCSCCO 62a_100000211926_100000755133 [0,1,0,0,0,0|2,0,1]=4 4222 B13R0.2 CCOC(=O)CCCCCSCCO 62a_100000755133_100000211926 [0,1,0,0,0,0|2,0,1]=4 4223 B13R0.2 CCOC(=O)CCCCSCCCO 62a_100000750268_100011215043 [0,1,0,0,0,0|2,0,1]=4 4224 B13R0.2 CCOC(=O)CCCCSCCCO 62a_100011215043_100000750268 [0,1,0,0,0,0|2,0,1]=4 4225 B13R0.2 CCOC(=O)CCCNCCCCO 2230a_100000750430_100009991533 [0,1,0,0,0,0|2,0,1]=4 4226 B13R0.2 CCOC(=O)CCCNCCCCO 34a_100000750430_100009991533 [0,1,0,0,0,0|2,0,1]=4 4227 B13R0.2 CCOC(=O)CCCOCCCCO 7a_100012001163_100000210776 [0,1,0,0,0,0|2,0,1]=4 4228 B13R0.2 CCOC(=O)CCCSCCCCO 62a_100000210776_100009991533 [0,1,0,0,0,0|2,0,1]=4 4229 B13R0.2 CCOC(=O)CCCSCCCCO 62a_100009991533_100000210776 [0,1,0,0,0,0|2,0,1]=4 4230 B13R0.2 CCOC(=O)CCNCCCCCO 2230a_100000762737_100011206558 [0,1,0,0,0,0|2,0,1]=4 4231 B13R0.2 CCOC(=O)CCNCCCCCO 34a_100000762737_100000765890 [0,1,0,0,0,0|2,0,1]=4 4232 B13R0.2 CCOC(=O)CCSCCCCCO 62a_100000746330_100000765890 [0,1,0,0,0,0|2,0,1]=4 4233 B13R0.2 CCOC(=O)CCSCCCCCO 62a_100000765890_100000746330 [0,1,0,0,0,0|2,0,1]=4 4234 B13R0.2 CCOC(=O)CNCCCCCCO 2230a_100000686447_100000188475 [0,1,0,0,0,0|2,0,1]=4 4235 B13R0.2 CCOC(=O)CNCCCCCCO 34a_100000686447_100000188475 [0,1,0,0,0,0|2,0,1]=4 4236 B13R0.2 CCOC(=O)CSCCCCCCO 62a_100000188475_100000766143 [0,1,0,0,0,0|2,0,1]=4 4237 B13R0.2 CCOC(=O)CSCCCCCCO 62a_100000766143_100000188475 [0,1,0,0,0,0|2,0,1]=4 4238 B13R0.2 CCOCCOCCNC(C)CCO 2230a_100102712874_100009893172 [0,1,0,0,0,0|3,0,0]=4 4239 B13R0.2 CCOCCOCCNC(C)CCO 34a_100102712874_100009893172 [0,1,0,0,0,0|3,0,0]=4 4240 B13R0.2 CCOCCOCCN[C@H](C)CCO 2230a_100000706166_100011211534 [0,1,0,0,0,0|3,0,0]=4 4241 B13R0.2 CCOCCOCCN[C@H](C)CCO 34a_100000706166_100011211534 [0,1,0,0,0,0|3,0,0]=4 4242 B13R0.2 CCOCCOCCOC(C)CCO 34a_100000210240_100009893172 [0,1,0,0,0,0|3,0,0]=4 4243 B13R0.2 CCOCCOCCOC(C)CCO 7a_100000210240_100009893172 [0,1,0,0,0,0|3,0,0]=4 4244 B13R0.2 CCOCCOCCSC(C)CCO 62a_100009893172_100011211534 [0,1,0,0,0,0|3,0,0]=4 4245 B13R0.2 CCOCCOCCSC(C)CCO 62a_100011211534_100009893172 [0,1,0,0,0,0|3,0,0]=4 4246 B13R0.2 CN(CC#N)CCCCCCCCO 2230a_100000748184_100000033203 [0,1,0,0,0,0|2,0,1]=4 4247 B13R0.2 CN(CCO)CCCCCCCCO 2230a_100000210263_100000033203 [0,1,0,0,0,0|2,0,0]=3 4248 B13R0.2 CN(CCO)CCCCCCCCO 269982a_100000210263_100000033203 [0,1,0,0,0,0|2,0,0]=3 4249 B13R0.2 CNNC(=O)CCCCCCCCO 22a_100016993582_100000015970 [0,1,0,0,0,0|2,0,1]=4 4250 B13R0.2 COCC(=O)CCCCCCCCO 1458a_100000210968_100000033203 [0,1,0,0,0,0|1,0,1]=3 4251 B13R0.2 COCC(=O)NCCCCCCCO 240690a_100011996573_100000210968 [0,1,0,0,0,0|2,0,1]=4 4252 B13R0.2 COCC(C)NCCCCCCCO 2230a_100011996573_100000765312 [0,1,0,0,0,0|2,0,0]=3 4253 B13R0.2 COCC(C)NCCCCCCCO 270004a_100011996573_100000749346 [0,1,0,0,0,0|2,0,0]=3 4254 B13R0.2 COCC(C)NCCCCCCCO 34a_100011996573_100000765312 [0,1,0,0,0,0|2,0,0]=3 4255 B13R0.2 COCC(C)NCCCOCCCO 2230a_100011310245_100000765312 [0,1,0,0,0,0|3,0,0]=4 4256 B13R0.2 COCC(C)NCCCOCCCO 270004a_100011310245_100000749346 [0,1,0,0,0,0|3,0,0]=4 4257 B13R0.2 COCC(C)NCCCOCCCO 34a_100011310245_100000765312 [0,1,0,0,0,0|3,0,0]=4 4258 B13R0.2 COCC(C)OCCCCCCCBr 34a_100000760002_100000765312 [0,1,0,0,0,0|3,0,0]=4 4259 B13R0.2 COCC(C)OCCCCCCCBr 7a_100000760002_100000765312 [0,1,0,0,0,0|3,0,0]=4 4260 B13R0.2 COCC(C)OCCCCCCCN 34a_100011996573_100000765312 [0,1,0,0,0,0|3,0,0]=4 4261 B13R0.2 COCC(C)SCCCCCCCO 62a_100000760002_100000765312 [0,1,0,0,0,0|2,0,0]=3 4262 B13R0.2 COCC(C)SCCCCCCCO 62a_100000765312_100000760002 [0,1,0,0,0,0|2,0,0]=3 4263 B13R0.2 COCC(N)COCCCCCCF 34a_100000724102_100015922095 [0,1,0,0,0,0|3,0,0]=4 4264 B13R0.2 COCC(N)COCCCCCCO 34a_100000724102_100000766143 [0,1,0,0,0,0|2,0,0]=3 4265 B13R0.2 COCC(O)CNCCCCCCF 2230a_100000756049_100015922095 [0,1,0,0,0,0|3,0,0]=4 4266 B13R0.2 COCC(O)CNCCCCCCF 34a_100000756049_100015922095 [0,1,0,0,0,0|3,0,0]=4 4267 B13R0.2 COCC(O)CNCCCCCCO 2230a_100000756049_100000766143 [0,1,0,0,0,0|2,0,0]=3 4268 B13R0.2 COCC(O)CNCCCCCCO 34a_100000686447_100011215053 [0,1,0,0,0,0|2,0,0]=3 4269 B13R0.2 COCC(O)CNCCCCCCO 34a_100000756049_100000766143 [0,1,0,0,0,0|2,0,0]=3 4270 B13R0.2 COCC(O)COCCCCCCBr 34a_100011215345_100011215053 [0,1,0,0,0,0|3,0,0]=4 4271 B13R0.2 COCC(O)COCCCCCCBr 7a_100011215345_100011215053 [0,1,0,0,0,0|3,0,0]=4 4272 B13R0.2 COCC(O)COCCCCCCCl 34a_100000766143_100011215053 [0,1,0,0,0,0|3,0,0]=4 4273 B13R0.2 COCC(O)COCCCCCCCl 7a_100000766143_100011215053 [0,1,0,0,0,0|3,0,0]=4 4274 B13R0.2 COCC(O)COCCCCCCF 34a_100000732779_100011215053 [0,1,0,0,0,0|3,0,0]=4 4275 B13R0.2 COCC(O)COCCCCCCF 7a_100000732779_100011215053 [0,1,0,0,0,0|3,0,0]=4 4276 B13R0.2 COCC(O)COCCCCCCN 34a_100000686447_100011215053 [0,1,0,0,0,0|3,0,0]=4 4277 B13R0.2 COCC(O)CSCCCCCCF 62a_100011215053_100015922095 [0,1,0,0,0,0|3,0,0]=4 4278 B13R0.2 COCC(O)CSCCCCCCF 62a_100015922095_100011215053 [0,1,0,0,0,0|3,0,0]=4 4279 B13R0.2 COCC(O)CSCCCCCCO 62a_100000766143_100011215053 [0,1,0,0,0,0|2,0,0]=3 4280 B13R0.2 COCC(O)CSCCCCCCO 62a_100011215053_100000766143 [0,1,0,0,0,0|2,0,0]=3 4281 B13R0.2 COCCCCCCN[C@H](C)CCO 2230a_100000706166_100011998445 [0,1,0,0,0,0|2,0,0]=3 4282 B13R0.2 COCCCCCCN[C@H](C)CCO 34a_100000706166_100011998445 [0,1,0,0,0,0|2,0,0]=3 4283 B13R0.2 COCCCCCCOC(C)CCBr 34a_100012276601_100011998445 [0,1,0,0,0,0|3,0,0]=4 4284 B13R0.2 COCCCCCCOC(C)CCO 34a_200012092642_100009893172 [0,1,0,0,0,0|2,0,0]=3 4285 B13R0.2 COCCCCCCOC(C)CCO 7a_200012092642_100009893172 [0,1,0,0,0,0|2,0,0]=3 4286 B13R0.2 COCCCCCCSC(C)CCO 62a_100009893172_100011998445 [0,1,0,0,0,0|2,0,0]=3 4287 B13R0.2 COCCCCCCSC(C)CCO 62a_100011998445_100009893172 [0,1,0,0,0,0|2,0,0]=3 4288 B13R0.2 COCCOCCCNC(C)CCO 2230a_100000206027_100009893172 [0,1,0,0,0,0|3,0,0]=4 4289 B13R0.2 COCCOCCCNC(C)CCO 34a_100000206027_100009893172 [0,1,0,0,0,0|3,0,0]=4 4290 B13R0.2 COCCOCCCN[C@H](C)CCO 2230a_100000706166_100011216529 [0,1,0,0,0,0|3,0,0]=4 4291 B13R0.2 COCCOCCCN[C@H](C)CCO 34a_100000706166_100011216529 [0,1,0,0,0,0|3,0,0]=4 4292 B13R0.2 COCCOCCCSC(C)CCO 62a_100009893172_100011216529 [0,1,0,0,0,0|3,0,0]=4 4293 B13R0.2 COCCOCCCSC(C)CCO 62a_100011216529_100009893172 [0,1,0,0,0,0|3,0,0]=4 4294 B13R0.2 COC[C@@H](C)NCCCCCCCO 2230a_100000764878_100000760002 [0,1,0,0,0,0|2,0,0]=3 4295 B13R0.2 COC[C@@H](C)OCCCCCCCO 34a_100011934205_100000760002 [0,1,0,0,0,0|2,0,0]=3 4296 B13R0.2 CSCC(=O)CCCCCCCCO 1458a_100000184570_100000033203 [0,1,0,0,0,0|1,0,1]=3 4297 B13R0.2 CSCC(=O)NCCCCCCCO 240690a_100011996573_100000184570 [0,1,0,0,0,0|2,0,1]=4 4298 B13R0.2 CSCC(C)NCCCCCCCO 270004a_100011996573_100011216314 [0,1,0,0,0,0|2,0,0]=3 4299 B13R0.2 CSCC(C)NCCCOCCCO 270004a_100011310245_100011216314 [0,1,0,0,0,0|3,0,0]=4 4300 B13R0.2 C[C@@H](CC#N)NCCCCCCCO 2230a_100016994482_100000760002 [0,1,0,0,0,0|2,0,1]=4 4301 B13R0.2 C[C@H](CCO)NCCCCCCC#N 2230a_100000706166_100009813337 [0,1,0,0,0,0|2,0,1]=4 4302 B13R0.2 C[C@H](CCO)NCCCCCCCO 2230a_100000706166_100000760002 [0,1,0,0,0,0|2,0,0]=3 4303 B13R0.2 C[C@H](CCO)NCCCCCCCO 34a_100000706166_100000760002 [0,1,0,0,0,0|2,0,0]=3 4304 B13R0.2 N#CCC(=O)CCCCCCCCO 1458a_100051588842_100000033203 [0,1,0,0,0,0|1,0,2]=4 4305 B13R0.2 N#CC[C@H](O)CNCCCCCCO 2230a_100000686447_100000001066 [0,1,0,0,0,0|2,0,1]=4 4306 B13R0.2 N#CC[C@H](O)CSCCCCCCO 62a_100000001066_100000766143 [0,1,0,0,0,0|2,0,1]=4 4307 B13R0.2 N#CC[C@H](O)CSCCCCCCO 62a_100000766143_100000001066 [0,1,0,0,0,0|2,0,1]=4 4308 B13R0.2 O=C(CCO)CCCCCCCCO 1458a_100011216618_100000033203 [0,1,0,0,0,0|1,0,1]=3 4309 B13R0.2 O=C(CCO)NCCCCCCCO 240690a_100011996573_100011216618 [0,1,0,0,0,0|2,0,1]=4 4310 B13R0.54 C#CCCCCCCCCOC(C)C 34a_100000065265_100000210206 [0,1,0,0,0,0|2,0,1]=4 4311 B13R0.54 C#CCCCCCCCCOC(C)C 7a_100000065265_100000210206 [0,1,0,0,0,0|2,0,1]=4 4312 B13R0.54 C#CCCCCCCCNCC(C)C 2230a_100000210953_100153394163 [0,1,0,0,0,0|2,0,1]=4 4313 B13R0.54 C#CCCCCCCCNCC(C)C 34a_100000210953_100153394163 [0,1,0,0,0,0|2,0,1]=4 4314 B13R0.54 C#CCCCCCCCNCC(C)O 2230a_100000210904_100153394163 [0,1,0,0,0,0|1,0,2]=4 4315 B13R0.54 C#CCCCCCCCNCC(C)O 34a_100000210904_100153394163 [0,1,0,0,0,0|1,0,2]=4 4316 B13R0.54 C#CCCCCCCCOCC(C)Br 34a_100012180447_100153394163 [0,1,0,0,0,0|2,0,1]=4 4317 B13R0.54 C#CCCCCCCCOCC(C)C 34a_100000054614_100000210624 [0,1,0,0,0,0|2,0,1]=4 4318 B13R0.54 C#CCCCCCCCOCC(C)C 34a_100000210257_100153394163 [0,1,0,0,0,0|2,0,1]=4 4319 B13R0.54 C#CCCCCCCCOCC(C)C 7a_100000054614_100000210760 [0,1,0,0,0,0|2,0,1]=4 4320 B13R0.54 C#CCCCCCCCOCC(C)F 34a_100015925927_100153394163 [0,1,0,0,0,0|2,0,1]=4 4321 B13R0.54 C#CCCCCCCCOCC(C)O 34a_100000054614_100011218427 [0,1,0,0,0,0|1,0,2]=4 4322 B13R0.54 C#CCCCCCCCOCC(C)O 7a_100000054614_100011218427 [0,1,0,0,0,0|1,0,2]=4 4323 B13R0.54 C#CCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100153394163 [0,1,0,0,0,0|2,0,1]=4 4324 B13R0.54 C#CCCCCCCCOC[C@@H](C)N 34a_100000737577_100153394163 [0,1,0,0,0,0|2,0,1]=4 4325 B13R0.54 C#CCCCCCCCOC[C@@H](C)O 34a_100000054614_100009817552 [0,1,0,0,0,0|1,0,2]=4 4326 B13R0.54 C#CCCCCCCCOC[C@@H](C)O 7a_100000054614_100009817552 [0,1,0,0,0,0|1,0,2]=4 4327 B13R0.54 C#CCCCCCCCSCC(C)C 62a_100000210624_100153394163 [0,1,0,0,0,0|2,0,1]=4 4328 B13R0.54 C#CCCCCCCCSCC(C)C 62a_100153394163_100000210760 [0,1,0,0,0,0|2,0,1]=4 4329 B13R0.54 C#CCCCCCCCSCC(C)O 62a_100011218427_100153394163 [0,1,0,0,0,0|1,0,2]=4 4330 B13R0.54 C#CCCCCCCCSCC(C)O 62a_100153394163_100011218427 [0,1,0,0,0,0|1,0,2]=4 4331 B13R0.54 C#CCCCCCCCSC[C@@H](C)O 62a_100009817552_100153394163 [0,1,0,0,0,0|1,0,2]=4 4332 B13R0.54 C#CCCCCCCCSC[C@@H](C)O 62a_100153394163_100009817552 [0,1,0,0,0,0|1,0,2]=4 4333 B13R0.54 C#CCCCCCCNCCC(C)O 2230a_200000755665_100012276617 [0,1,0,0,0,0|1,0,2]=4 4334 B13R0.54 C#CCCCCCCOCCC(C)Br 34a_100009893172_100012276617 [0,1,0,0,0,0|2,0,1]=4 4335 B13R0.54 C#CCCCCCCOCCC(C)C 34a_100000210254_100012276617 [0,1,0,0,0,0|2,0,1]=4 4336 B13R0.54 C#CCCCCCCOCCC(C)C 34a_100011217361_100000210312 [0,1,0,0,0,0|2,0,1]=4 4337 B13R0.54 C#CCCCCCCOCCC(C)C 7a_100000210254_100012276617 [0,1,0,0,0,0|2,0,1]=4 4338 B13R0.54 C#CCCCCCCOCCC(C)C 7a_100011217361_100000210626 [0,1,0,0,0,0|2,0,1]=4 4339 B13R0.54 C#CCCCCCCOCCC(C)O 34a_100011217361_100012276601 [0,1,0,0,0,0|1,0,2]=4 4340 B13R0.54 C#CCCCCCCOCCC(C)O 7a_100011217361_100012276601 [0,1,0,0,0,0|1,0,2]=4 4341 B13R0.54 C#CCCCCCCOCC[C@@H](C)N 34a_100000706166_100012276617 [0,1,0,0,0,0|2,0,1]=4 4342 B13R0.54 C#CCCCCCCSCCC(C)C 62a_100000210312_100012276617 [0,1,0,0,0,0|2,0,1]=4 4343 B13R0.54 C#CCCCCCCSCCC(C)C 62a_100012276617_100000210312 [0,1,0,0,0,0|2,0,1]=4 4344 B13R0.54 C#CCCCCCCSCCC(C)O 62a_100012276601_100012276617 [0,1,0,0,0,0|1,0,2]=4 4345 B13R0.54 C#CCCCCCCSCCC(C)O 62a_100012276617_100012276601 [0,1,0,0,0,0|1,0,2]=4 4346 B13R0.54 C#CCCCCCNCCCC(C)C 2230a_200000737386_100012094781 [0,1,0,0,0,0|2,0,1]=4 4347 B13R0.54 C#CCCCCCNCCCC(C)C 34a_200000737386_100012094781 [0,1,0,0,0,0|2,0,1]=4 4348 B13R0.54 C#CCCCCCOCCCC(C)C 34a_100000210774_100012094781 [0,1,0,0,0,0|2,0,1]=4 4349 B13R0.54 C#CCCCCCOCCCC(C)C 34a_100000766912_100011214892 [0,1,0,0,0,0|2,0,1]=4 4350 B13R0.54 C#CCCCCCOCCCC(C)C 7a_100000210774_100012094781 [0,1,0,0,0,0|2,0,1]=4 4351 B13R0.54 C#CCCCCCOCCCC(C)C 7a_100000766912_100011214892 [0,1,0,0,0,0|2,0,1]=4 4352 B13R0.54 C#CCCCCCOCCCC(C)O 34a_100000766912_200000718107 [0,1,0,0,0,0|1,0,2]=4 4353 B13R0.54 C#CCCCCCOCCCC(C)O 7a_100000766912_200000718107 [0,1,0,0,0,0|1,0,2]=4 4354 B13R0.54 C#CCCCCCSCCCC(C)C 62a_100011214892_100012094781 [0,1,0,0,0,0|2,0,1]=4 4355 B13R0.54 C#CCCCCCSCCCC(C)C 62a_100012094781_100011214892 [0,1,0,0,0,0|2,0,1]=4 4356 B13R0.54 C#CCCCCCSCCCC(C)O 62a_100012094781_200000718107 [0,1,0,0,0,0|1,0,2]=4 4357 B13R0.54 C#CCCCCCSCCCC(C)O 62a_200000718107_100012094781 [0,1,0,0,0,0|1,0,2]=4 4358 B13R0.54 C#CCCCCNCCCCC(C)C 2230a_100000706060_100011216152 [0,1,0,0,0,0|2,0,1]=4 4359 B13R0.54 C#CCCCCNCCCCC(C)C 34a_100000706060_100011216152 [0,1,0,0,0,0|2,0,1]=4 4360 B13R0.54 C#CCCCCOCCCCC(C)C 34a_100000766709_100011216152 [0,1,0,0,0,0|2,0,1]=4 4361 B13R0.54 C#CCCCCOCCCCC(C)C 34a_100011214890_100010269958 [0,1,0,0,0,0|2,0,1]=4 4362 B13R0.54 C#CCCCCOCCCCC(C)C 7a_100000766709_100011216152 [0,1,0,0,0,0|2,0,1]=4 4363 B13R0.54 C#CCCCCOCCCCC(C)C 7a_100011214890_100010269958 [0,1,0,0,0,0|2,0,1]=4 4364 B13R0.54 C#CCCCCSCCCCC(C)C 62a_100010269958_100011216152 [0,1,0,0,0,0|2,0,1]=4 4365 B13R0.54 C#CCCCCSCCCCC(C)C 62a_100011216152_100010269958 [0,1,0,0,0,0|2,0,1]=4 4366 B13R0.54 C#CCCCNCCCCCC(C)C 2230a_100011290863_100000731252 [0,1,0,0,0,0|2,0,1]=4 4367 B13R0.54 C#CCCCNCCCCCC(C)C 34a_100000718082_100000210682 [0,1,0,0,0,0|2,0,1]=4 4368 B13R0.54 C#CCCCNCCCCCC(C)C 34a_100011290863_100000695029 [0,1,0,0,0,0|2,0,1]=4 4369 B13R0.54 C#CCCCOCCCCCC(C)C 34a_100000215630_100000210682 [0,1,0,0,0,0|2,0,1]=4 4370 B13R0.54 C#CCCCOCCCCCC(C)C 34a_100011995859_100000695029 [0,1,0,0,0,0|2,0,1]=4 4371 B13R0.54 C#CCCCOCCCCCC(C)C 7a_100000215630_100000210682 [0,1,0,0,0,0|2,0,1]=4 4372 B13R0.54 C#CCCCOCCCCCC(C)C 7a_100011995859_100011215417 [0,1,0,0,0,0|2,0,1]=4 4373 B13R0.54 C#CCCCSCCCCCC(C)C 62a_100000210682_100011215417 [0,1,0,0,0,0|2,0,1]=4 4374 B13R0.54 C#CCCCSCCCCCC(C)C 62a_100011215417_100000210682 [0,1,0,0,0,0|2,0,1]=4 4375 B13R0.54 C#CCCNCCCCCCC(C)C 2230a_100000211014_100000688953 [0,1,0,0,0,0|2,0,1]=4 4376 B13R0.54 C#CCCNCCCCCCC(C)C 34a_100000211014_100000688953 [0,1,0,0,0,0|2,0,1]=4 4377 B13R0.54 C#CCOCCCCCCCC(C)C 34a_200000210741_100000184674 [0,1,0,0,0,0|2,0,1]=4 4378 B13R0.54 C#CCOCCCCCCCC(C)C 7a_200000210741_100000038162 [0,1,0,0,0,0|2,0,1]=4 4379 B13R0.54 C=C(Br)CCOCCCCCCCC 34a_100009813270_100000210759 [0,1,0,0,0,0|2,0,1]=4 4380 B13R0.54 C=C(Br)CCOCCCCCCCO 34a_100009813270_100000760002 [0,1,0,0,0,0|1,0,2]=4 4381 B13R0.54 C=C(C)CCNCCCCCCCC 2230a_100000229939_100000730704 [0,1,0,0,0,0|2,0,1]=4 4382 B13R0.54 C=C(C)CCNCCCCCCCC 34a_100000229939_100000730704 [0,1,0,0,0,0|2,0,1]=4 4383 B13R0.54 C=C(C)CCNCCCCCCCO 2230a_100011996573_100000730704 [0,1,0,0,0,0|1,0,1]=3 4384 B13R0.54 C=C(C)CCNCCCCCCCO 34a_100011996573_100000730704 [0,1,0,0,0,0|1,0,1]=3 4385 B13R0.54 C=C(C)CCNCCCOCCCO 2230a_100011310245_100000730704 [0,1,0,0,0,0|2,0,1]=4 4386 B13R0.54 C=C(C)CCNCCCOCCCO 34a_100011310245_100000730704 [0,1,0,0,0,0|2,0,1]=4 4387 B13R0.54 C=C(C)CCOCCCCCCCBr 34a_100000760002_100000730704 [0,1,0,0,0,0|2,0,1]=4 4388 B13R0.54 C=C(C)CCOCCCCCCCBr 7a_100000760002_100000730704 [0,1,0,0,0,0|2,0,1]=4 4389 B13R0.54 C=C(C)CCOCCCCCCCC 34a_100000210232_100000730704 [0,1,0,0,0,0|2,0,1]=4 4390 B13R0.54 C=C(C)CCOCCCCCCCC 34a_100000764851_100000210759 [0,1,0,0,0,0|2,0,1]=4 4391 B13R0.54 C=C(C)CCOCCCCCCCC 7a_100000210232_100000730704 [0,1,0,0,0,0|2,0,1]=4 4392 B13R0.54 C=C(C)CCOCCCCCCCN 34a_100011996573_100000730704 [0,1,0,0,0,0|2,0,1]=4 4393 B13R0.54 C=C(C)CCOCCCCCCCO 34a_100000764851_100000760002 [0,1,0,0,0,0|1,0,1]=3 4394 B13R0.54 C=C(C)CCSCCCCCCCC 62a_100000210759_100000730704 [0,1,0,0,0,0|2,0,1]=4 4395 B13R0.54 C=C(C)CCSCCCCCCCC 62a_100000730704_100000210317 [0,1,0,0,0,0|2,0,1]=4 4396 B13R0.54 C=C(C)CCSCCCCCCCO 62a_100000730704_100000760002 [0,1,0,0,0,0|1,0,1]=3 4397 B13R0.54 C=C(C)CCSCCCCCCCO 62a_100000760002_100000730704 [0,1,0,0,0,0|1,0,1]=3 4398 B13R0.54 C=C(C)CNCCCCCCCCC 2230a_100000212291_100000748629 [0,1,0,0,0,0|2,0,1]=4 4399 B13R0.54 C=C(C)CNCCCCCCCCC 34a_100000212291_100000748629 [0,1,0,0,0,0|2,0,1]=4 4400 B13R0.54 C=C(C)CNCCCCCCCCO 2230a_102515433106_100000748629 [0,1,0,0,0,0|1,0,1]=3 4401 B13R0.54 C=C(C)CNCCCCCCCCO 34a_102515433106_100000748629 [0,1,0,0,0,0|1,0,1]=3 4402 B13R0.54 C=C(C)COCCCCCCCCBr 34a_100009813846_100000748629 [0,1,0,0,0,0|2,0,1]=4 4403 B13R0.54 C=C(C)COCCCCCCCCBr 7a_100009813846_100000748629 [0,1,0,0,0,0|2,0,1]=4 4404 B13R0.54 C=C(C)COCCCCCCCCC 34a_100000210245_100011214924 [0,1,0,0,0,0|2,0,1]=4 4405 B13R0.54 C=C(C)COCCCCCCCCC 34a_100000210712_100000748629 [0,1,0,0,0,0|2,0,1]=4 4406 B13R0.54 C=C(C)COCCCCCCCCC 7a_100000210712_100000748629 [0,1,0,0,0,0|2,0,1]=4 4407 B13R0.54 C=C(C)COCCCCCCCCCl 34a_100000033203_100000748629 [0,1,0,0,0,0|2,0,1]=4 4408 B13R0.54 C=C(C)COCCCCCCCCCl 7a_100000033203_100000748629 [0,1,0,0,0,0|2,0,1]=4 4409 B13R0.54 C=C(C)COCCCCCCCCN 34a_102515433106_100000748629 [0,1,0,0,0,0|2,0,1]=4 4410 B13R0.54 C=C(C)COCCCCCCCCO 34a_100000210245_100000033203 [0,1,0,0,0,0|1,0,1]=3 4411 B13R0.54 C=C(C)CSCCCCCCCCC 62a_100000748629_100000210670 [0,1,0,0,0,0|2,0,1]=4 4412 B13R0.54 C=C(C)CSCCCCCCCCO 62a_100000033203_100000211660 [0,1,0,0,0,0|1,0,1]=3 4413 B13R0.54 C=C(C)CSCCCCCCCCO 62a_100000748629_100000033203 [0,1,0,0,0,0|1,0,1]=3 4414 B13R0.54 C=C(F)CNCCCCCCCCC 2230a_100000212291_100009893438 [0,1,0,0,0,0|2,0,1]=4 4415 B13R0.54 C=C(F)CNCCCCCCCCC 34a_100000212291_100009893438 [0,1,0,0,0,0|2,0,1]=4 4416 B13R0.54 C=C(F)CNCCCCCCCCO 2230a_102515433106_100009893438 [0,1,0,0,0,0|1,0,2]=4 4417 B13R0.54 C=C(F)CNCCCCCCCCO 34a_102515433106_100009893438 [0,1,0,0,0,0|1,0,2]=4 4418 B13R0.54 C=C(F)COCCCCCCCCC 34a_100000210712_100009893438 [0,1,0,0,0,0|2,0,1]=4 4419 B13R0.54 C=C(F)COCCCCCCCCC 34a_200010262243_100011214924 [0,1,0,0,0,0|2,0,1]=4 4420 B13R0.54 C=C(F)COCCCCCCCCC 7a_100000210712_100000042424 [0,1,0,0,0,0|2,0,1]=4 4421 B13R0.54 C=C(F)COCCCCCCCCO 34a_200010262243_100000033203 [0,1,0,0,0,0|1,0,2]=4 4422 B13R0.54 C=C(F)CSCCCCCCCCC 62a_100000042424_100000210670 [0,1,0,0,0,0|2,0,1]=4 4423 B13R0.54 C=C(F)CSCCCCCCCCO 62a_100000033203_100000042424 [0,1,0,0,0,0|1,0,2]=4 4424 B13R0.54 C=C(F)CSCCCCCCCCO 62a_100000042424_100000033203 [0,1,0,0,0,0|1,0,2]=4 4425 B13R0.54 C=CCCCCCCCCCC(=O)C 1458a_100000070787_100009814027 [0,1,0,0,0,0|1,0,2]=4 4426 B13R0.54 C=CCCCCCCCCCN(C)C 2230a_100102631434_100009814027 [0,1,0,0,0,0|2,0,1]=4 4427 B13R0.54 C=CCCCCCCCCCN(C)C 269982a_100102631434_100009814027 [0,1,0,0,0,0|2,0,1]=4 4428 B13R0.54 C=CCCCCCCCCNC(C)C 2230a_100138425928_100011933949 [0,1,0,0,0,0|2,0,1]=4 4429 B13R0.54 C=CCCCCCCCCNC(C)C 34a_100138425928_100011933949 [0,1,0,0,0,0|2,0,1]=4 4430 B13R0.54 C=CCCCCCCCCOC(C)C 34a_100000212225_100011933949 [0,1,0,0,0,0|2,0,1]=4 4431 B13R0.54 C=CCCCCCCCCOC(C)C 34a_100011215194_100000210206 [0,1,0,0,0,0|2,0,1]=4 4432 B13R0.54 C=CCCCCCCCCOC(C)C 7a_100011215194_100000210206 [0,1,0,0,0,0|2,0,1]=4 4433 B13R0.54 C=CCCCCCCCCSC(C)C 62a_100000210206_100011933949 [0,1,0,0,0,0|2,0,1]=4 4434 B13R0.54 C=CCCCCCCCCSC(C)C 62a_100011933949_100000210206 [0,1,0,0,0,0|2,0,1]=4 4435 B13R0.54 C=CCCCCCCCNCC(C)C 2230a_100000210953_100012355270 [0,1,0,0,0,0|2,0,1]=4 4436 B13R0.54 C=CCCCCCCCNCC(C)C 34a_100000210953_100012355270 [0,1,0,0,0,0|2,0,1]=4 4437 B13R0.54 C=CCCCCCCCNCC(C)O 2230a_100000210904_100012355270 [0,1,0,0,0,0|1,0,2]=4 4438 B13R0.54 C=CCCCCCCCNCC(C)O 34a_100000210904_100012355270 [0,1,0,0,0,0|1,0,2]=4 4439 B13R0.54 C=CCCCCCCCOCC(C)Br 34a_100012180447_100012355270 [0,1,0,0,0,0|2,0,1]=4 4440 B13R0.54 C=CCCCCCCCOCC(C)C 34a_100000210257_100012355270 [0,1,0,0,0,0|2,0,1]=4 4441 B13R0.54 C=CCCCCCCCOCC(C)C 34a_100000730831_100000210624 [0,1,0,0,0,0|2,0,1]=4 4442 B13R0.54 C=CCCCCCCCOCC(C)C 7a_100000730831_100000210760 [0,1,0,0,0,0|2,0,1]=4 4443 B13R0.54 C=CCCCCCCCOCC(C)F 34a_100015925927_100012355270 [0,1,0,0,0,0|2,0,1]=4 4444 B13R0.54 C=CCCCCCCCOCC(C)O 34a_100000730831_100011218427 [0,1,0,0,0,0|1,0,2]=4 4445 B13R0.54 C=CCCCCCCCOCC(C)O 7a_100000730831_100011218427 [0,1,0,0,0,0|1,0,2]=4 4446 B13R0.54 C=CCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100012355270 [0,1,0,0,0,0|2,0,1]=4 4447 B13R0.54 C=CCCCCCCCOC[C@@H](C)N 34a_100000737577_100012355270 [0,1,0,0,0,0|2,0,1]=4 4448 B13R0.54 C=CCCCCCCCOC[C@@H](C)O 34a_100000730831_100009817552 [0,1,0,0,0,0|1,0,2]=4 4449 B13R0.54 C=CCCCCCCCOC[C@@H](C)O 7a_100000730831_100009817552 [0,1,0,0,0,0|1,0,2]=4 4450 B13R0.54 C=CCCCCCCCSCC(C)C 62a_100000210624_100012355270 [0,1,0,0,0,0|2,0,1]=4 4451 B13R0.54 C=CCCCCCCCSCC(C)C 62a_100012355270_100000210760 [0,1,0,0,0,0|2,0,1]=4 4452 B13R0.54 C=CCCCCCCCSCC(C)O 62a_100011218427_100012355270 [0,1,0,0,0,0|1,0,2]=4 4453 B13R0.54 C=CCCCCCCCSCC(C)O 62a_100012355270_100011218427 [0,1,0,0,0,0|1,0,2]=4 4454 B13R0.54 C=CCCCCCCCSC[C@@H](C)O 62a_100009817552_100012355270 [0,1,0,0,0,0|1,0,2]=4 4455 B13R0.54 C=CCCCCCCCSC[C@@H](C)O 62a_100012355270_100009817552 [0,1,0,0,0,0|1,0,2]=4 4456 B13R0.54 C=CCCCCCCNCCC(C)O 2230a_200000755665_100011215473 [0,1,0,0,0,0|1,0,2]=4 4457 B13R0.54 C=CCCCCCCOCCC(C)Br 34a_100009893172_100011215473 [0,1,0,0,0,0|2,0,1]=4 4458 B13R0.54 C=CCCCCCCOCCC(C)C 34a_100000210254_100011215473 [0,1,0,0,0,0|2,0,1]=4 4459 B13R0.54 C=CCCCCCCOCCC(C)C 34a_200011216477_100000210312 [0,1,0,0,0,0|2,0,1]=4 4460 B13R0.54 C=CCCCCCCOCCC(C)C 7a_100000210254_100011215473 [0,1,0,0,0,0|2,0,1]=4 4461 B13R0.54 C=CCCCCCCOCCC(C)C 7a_200011216477_100000210626 [0,1,0,0,0,0|2,0,1]=4 4462 B13R0.54 C=CCCCCCCOCCC(C)O 34a_200011216477_100012276601 [0,1,0,0,0,0|1,0,2]=4 4463 B13R0.54 C=CCCCCCCOCCC(C)O 7a_200011216477_100012276601 [0,1,0,0,0,0|1,0,2]=4 4464 B13R0.54 C=CCCCCCCOCC[C@@H](C)N 34a_100000706166_100011215473 [0,1,0,0,0,0|2,0,1]=4 4465 B13R0.54 C=CCCCCCCSCCC(C)C 62a_100000210312_100011215473 [0,1,0,0,0,0|2,0,1]=4 4466 B13R0.54 C=CCCCCCCSCCC(C)C 62a_100011215473_100000210312 [0,1,0,0,0,0|2,0,1]=4 4467 B13R0.54 C=CCCCCCCSCCC(C)O 62a_100011215473_100012276601 [0,1,0,0,0,0|1,0,2]=4 4468 B13R0.54 C=CCCCCCCSCCC(C)O 62a_100012276601_100011215473 [0,1,0,0,0,0|1,0,2]=4 4469 B13R0.54 C=CCCCCCNCCCC(C)C 2230a_200000737386_100000700193 [0,1,0,0,0,0|2,0,1]=4 4470 B13R0.54 C=CCCCCCNCCCC(C)C 34a_200000737386_100000700193 [0,1,0,0,0,0|2,0,1]=4 4471 B13R0.54 C=CCCCCCOCCCC(C)C 34a_100000210774_100000700193 [0,1,0,0,0,0|2,0,1]=4 4472 B13R0.54 C=CCCCCCOCCCC(C)C 34a_100011216702_100011214892 [0,1,0,0,0,0|2,0,1]=4 4473 B13R0.54 C=CCCCCCOCCCC(C)C 7a_100000210774_100000700193 [0,1,0,0,0,0|2,0,1]=4 4474 B13R0.54 C=CCCCCCOCCCC(C)C 7a_100011216702_100011214892 [0,1,0,0,0,0|2,0,1]=4 4475 B13R0.54 C=CCCCCCOCCCC(C)O 34a_100011216702_200000718107 [0,1,0,0,0,0|1,0,2]=4 4476 B13R0.54 C=CCCCCCOCCCC(C)O 7a_100011216702_200000718107 [0,1,0,0,0,0|1,0,2]=4 4477 B13R0.54 C=CCCCCCSCCCC(C)C 62a_100000700193_100011214892 [0,1,0,0,0,0|2,0,1]=4 4478 B13R0.54 C=CCCCCCSCCCC(C)C 62a_100011214892_100000700193 [0,1,0,0,0,0|2,0,1]=4 4479 B13R0.54 C=CCCCCCSCCCC(C)O 62a_100000700193_200000718107 [0,1,0,0,0,0|1,0,2]=4 4480 B13R0.54 C=CCCCCCSCCCC(C)O 62a_200000718107_100000700193 [0,1,0,0,0,0|1,0,2]=4 4481 B13R0.54 C=CCCCCNCCCCC(C)C 2230a_100000703577_100011216152 [0,1,0,0,0,0|2,0,1]=4 4482 B13R0.54 C=CCCCCNCCCCC(C)C 34a_100000703577_100011216152 [0,1,0,0,0,0|2,0,1]=4 4483 B13R0.54 C=CCCCCOCCCCC(C)C 34a_100000766645_100011216152 [0,1,0,0,0,0|2,0,1]=4 4484 B13R0.54 C=CCCCCOCCCCC(C)C 34a_100011214890_100011215482 [0,1,0,0,0,0|2,0,1]=4 4485 B13R0.54 C=CCCCCOCCCCC(C)C 7a_100000766645_100011216152 [0,1,0,0,0,0|2,0,1]=4 4486 B13R0.54 C=CCCCCOCCCCC(C)C 7a_100011214890_100011215482 [0,1,0,0,0,0|2,0,1]=4 4487 B13R0.54 C=CCCCCSCCCCC(C)C 62a_100011215482_100011216152 [0,1,0,0,0,0|2,0,1]=4 4488 B13R0.54 C=CCCCCSCCCCC(C)C 62a_100011216152_100011215482 [0,1,0,0,0,0|2,0,1]=4 4489 B13R0.54 C=CCCCNCCCCCC(C)C 2230a_100000700776_100000210682 [0,1,0,0,0,0|2,0,1]=4 4490 B13R0.54 C=CCCCNCCCCCC(C)C 2230a_100011290863_100011713584 [0,1,0,0,0,0|2,0,1]=4 4491 B13R0.54 C=CCCCNCCCCCC(C)C 34a_100000700776_100000210682 [0,1,0,0,0,0|2,0,1]=4 4492 B13R0.54 C=CCCCNCCCCCC(C)C 34a_100011290863_100000757094 [0,1,0,0,0,0|2,0,1]=4 4493 B13R0.54 C=CCCCOCCCCCC(C)C 34a_100000758997_100000210682 [0,1,0,0,0,0|2,0,1]=4 4494 B13R0.54 C=CCCCOCCCCCC(C)C 34a_100011995859_100000757094 [0,1,0,0,0,0|2,0,1]=4 4495 B13R0.54 C=CCCCOCCCCCC(C)C 7a_100000758997_100000210682 [0,1,0,0,0,0|2,0,1]=4 4496 B13R0.54 C=CCCCOCCCCCC(C)C 7a_100011995859_100000757094 [0,1,0,0,0,0|2,0,1]=4 4497 B13R0.54 C=CCCCSCCCCCC(C)C 62a_100000210682_100000757094 [0,1,0,0,0,0|2,0,1]=4 4498 B13R0.54 C=CCCCSCCCCCC(C)C 62a_100011713584_100000210682 [0,1,0,0,0,0|2,0,1]=4 4499 B13R0.54 C=CCCNCCCCCCC(C)C 2230a_100000211014_100000754431 [0,1,0,0,0,0|2,0,1]=4 4500 B13R0.54 C=CCCNCCCCCCC(C)C 34a_100000211014_100000754431 [0,1,0,0,0,0|2,0,1]=4 4501 B13R0.54 C=CCOCCCCCCCC(C)C 34a_200000210741_100015514636 [0,1,0,0,0,0|2,0,1]=4 4502 B13R0.54 C=CCOCCCCCCCC(C)C 7a_200000210741_100015514636 [0,1,0,0,0,0|2,0,1]=4 4503 B13R0.54 CC(=CCCNCCCCCCO)C 2230a_100000686447_100011217483 [0,1,0,0,0,0|1,0,2]=4 4504 B13R0.54 CC(=CCCNCCCCCCO)C 34a_100000686447_100011217483 [0,1,0,0,0,0|1,0,2]=4 4505 B13R0.54 CC(=CCCSCCCCCCO)C 62a_100000766143_100011217483 [0,1,0,0,0,0|1,0,2]=4 4506 B13R0.54 CC(=CCCSCCCCCCO)C 62a_100011217483_100000766143 [0,1,0,0,0,0|1,0,2]=4 4507 B13R0.54 CC(=CCNCCCCCCCO)C 2230a_100011996573_100000761012 [0,1,0,0,0,0|1,0,2]=4 4508 B13R0.54 CC(=CCNCCCCCCCO)C 34a_100000718196_100000760002 [0,1,0,0,0,0|1,0,2]=4 4509 B13R0.54 CC(=CCNCCCCCCCO)C 34a_100011996573_100000761012 [0,1,0,0,0,0|1,0,2]=4 4510 B13R0.54 CC(=CCOCCCCCCCO)C 34a_100000753907_100000760002 [0,1,0,0,0,0|1,0,2]=4 4511 B13R0.54 CC(=CCSCCCCCCCO)C 62a_100000760002_100000761012 [0,1,0,0,0,0|1,0,2]=4 4512 B13R0.54 CC(=CCSCCCCCCCO)C 62a_100000761012_100000760002 [0,1,0,0,0,0|1,0,2]=4 4513 B13R0.54 CC(=O)CCCCCCCCCCO 1458a_100000070787_100009813290 [0,1,0,0,0,0|0,0,1]=2 4514 B13R0.54 CC(=O)CCCCNCCCCCO 34a_100000762737_100009817362 [0,1,0,0,0,0|1,0,1]=3 4515 B13R0.54 CC(=O)CCCCNCCOCCO 34a_100000211614_100009817362 [0,1,0,0,0,0|2,0,1]=4 4516 B13R0.54 CC(=O)CCCCOCCCCCBr 34a_100000746331_100009817362 [0,1,0,0,0,0|2,0,1]=4 4517 B13R0.54 CC(=O)CCCCOCCCCCBr 7a_100000746331_100000735457 [0,1,0,0,0,0|2,0,1]=4 4518 B13R0.54 CC(=O)CCCCOCCCCCCl 34a_100000746330_100009817362 [0,1,0,0,0,0|2,0,1]=4 4519 B13R0.54 CC(=O)CCCCOCCCCCCl 7a_100000746330_100000735457 [0,1,0,0,0,0|2,0,1]=4 4520 B13R0.54 CC(=O)CCCCOCCCCCI 34a_200012148887_100009817362 [0,1,0,0,0,0|2,0,1]=4 4521 B13R0.54 CC(=O)CCCCOCCCCCI 7a_200012148887_100000735457 [0,1,0,0,0,0|2,0,1]=4 4522 B13R0.54 CC(=O)CCCCOCCCCCN 34a_100000762737_100009817362 [0,1,0,0,0,0|2,0,1]=4 4523 B13R0.54 CC(=O)CCCCSCCCCCF 62a_100000729378_100000735457 [0,1,0,0,0,0|2,0,1]=4 4524 B13R0.54 CC(=O)CCCCSCCCCCF 62a_100000735457_100000729378 [0,1,0,0,0,0|2,0,1]=4 4525 B13R0.54 CC(=O)CCCCSCCCCCO 62a_100000735457_100000746330 [0,1,0,0,0,0|1,0,1]=3 4526 B13R0.54 CC(=O)CCCCSCCCCCO 62a_100000746330_100000735457 [0,1,0,0,0,0|1,0,1]=3 4527 B13R0.54 CC(=O)CCCCSCCOCCO 62a_100000735457_100011215305 [0,1,0,0,0,0|2,0,1]=4 4528 B13R0.54 CC(=O)CCCCSCCOCCO 62a_100011215305_100000735457 [0,1,0,0,0,0|2,0,1]=4 4529 B13R0.54 CC(=O)CCCNCCCCCCO 34a_100000686447_100000685027 [0,1,0,0,0,0|1,0,1]=3 4530 B13R0.54 CC(=O)CCCOCCCCCCBr 34a_100011215345_100000685027 [0,1,0,0,0,0|2,0,1]=4 4531 B13R0.54 CC(=O)CCCOCCCCCCBr 7a_100011215345_100011215641 [0,1,0,0,0,0|2,0,1]=4 4532 B13R0.54 CC(=O)CCCOCCCCCCCl 34a_100000766143_100000685027 [0,1,0,0,0,0|2,0,1]=4 4533 B13R0.54 CC(=O)CCCOCCCCCCCl 7a_100000766143_100011215641 [0,1,0,0,0,0|2,0,1]=4 4534 B13R0.54 CC(=O)CCCOCCCCCCF 34a_100000732779_100000685027 [0,1,0,0,0,0|2,0,1]=4 4535 B13R0.54 CC(=O)CCCOCCCCCCF 34a_100000759063_100015922095 [0,1,0,0,0,0|2,0,1]=4 4536 B13R0.54 CC(=O)CCCOCCCCCCF 7a_100000732779_100011215641 [0,1,0,0,0,0|2,0,1]=4 4537 B13R0.54 CC(=O)CCCOCCCCCCF 7a_100000759063_100015922095 [0,1,0,0,0,0|2,0,1]=4 4538 B13R0.54 CC(=O)CCCOCCCCCCN 34a_100000686447_100000685027 [0,1,0,0,0,0|2,0,1]=4 4539 B13R0.54 CC(=O)CCCOCCCCCCO 34a_100000759063_100000766143 [0,1,0,0,0,0|1,0,1]=3 4540 B13R0.54 CC(=O)CCCOCCCCCCO 7a_100000759063_100000766143 [0,1,0,0,0,0|1,0,1]=3 4541 B13R0.54 CC(=O)CCCSCCCCCCF 62a_100011215641_100015922095 [0,1,0,0,0,0|2,0,1]=4 4542 B13R0.54 CC(=O)CCCSCCCCCCF 62a_100015922095_100011215641 [0,1,0,0,0,0|2,0,1]=4 4543 B13R0.54 CC(=O)CCCSCCCCCCO 62a_100000766143_100011215641 [0,1,0,0,0,0|1,0,1]=3 4544 B13R0.54 CC(=O)CCCSCCCCCCO 62a_100011215641_100000766143 [0,1,0,0,0,0|1,0,1]=3 4545 B13R0.54 CC(=O)CCOCCCCCCCBr 7a_100000760002_100000053229 [0,1,0,0,0,0|2,0,1]=4 4546 B13R0.54 CC(=O)CCOCCCCCCCO 34a_100000759926_100000760002 [0,1,0,0,0,0|1,0,1]=3 4547 B13R0.54 CC(=O)CCOCCCCCCCO 7a_100000759926_100000760002 [0,1,0,0,0,0|1,0,1]=3 4548 B13R0.54 CC(=O)CCSCCCCCCCO 62a_100000053229_100000760002 [0,1,0,0,0,0|1,0,1]=3 4549 B13R0.54 CC(=O)CCSCCCCCCCO 62a_100000760002_100000053229 [0,1,0,0,0,0|1,0,1]=3 4550 B13R0.54 CC(=O)COCCCCCCCCO 34a_100000211253_100000033203 [0,1,0,0,0,0|1,0,1]=3 4551 B13R0.54 CC(=O)NCCCCCCCCCO 240690a_100000078944_100015343762 [0,1,0,0,0,0|1,0,1]=3 4552 B13R0.54 CC(=O)NCCCCCCNCCO 2230a_200011996284_100000211926 [0,1,0,0,0,0|2,0,1]=4 4553 B13R0.54 CC(=O)NCCCCCCNCCO 34a_200011996284_100000211926 [0,1,0,0,0,0|2,0,1]=4 4554 B13R0.54 CC(=O)NCCCCCNCCCO 2230a_200012022750_100000230001 [0,1,0,0,0,0|2,0,1]=4 4555 B13R0.54 CC(=O)NCCCCCNCCCO 34a_200012022750_100000230001 [0,1,0,0,0,0|2,0,1]=4 4556 B13R0.54 CC(=O)NCCCCNCCCCO 2230a_200011368371_100000210776 [0,1,0,0,0,0|2,0,1]=4 4557 B13R0.54 CC(=O)NCCCCNCCCCO 34a_200011368371_100011216708 [0,1,0,0,0,0|2,0,1]=4 4558 B13R0.54 CC(=O)NCCCNCCCCCO 34a_100000736810_100000746330 [0,1,0,0,0,0|2,0,1]=4 4559 B13R0.54 CC(=O)NCCCOCCCCCO 34a_100000752032_100000746330 [0,1,0,0,0,0|2,0,1]=4 4560 B13R0.54 CC(=O)NCCNCCCCCCO 2230a_100000209853_100000766143 [0,1,0,0,0,0|2,0,1]=4 4561 B13R0.54 CC(=O)NCCNCCCCCCO 2230a_100000686447_100000189650 [0,1,0,0,0,0|2,0,1]=4 4562 B13R0.54 CC(=O)NCCOCCCCCCO 34a_100000158858_100000766143 [0,1,0,0,0,0|2,0,1]=4 4563 B13R0.54 CC(=O)NCCSCCCCCCO 62a_100000189650_100000766143 [0,1,0,0,0,0|2,0,1]=4 4564 B13R0.54 CC(=O)NCCSCCCCCCO 62a_100000766143_100000189650 [0,1,0,0,0,0|2,0,1]=4 4565 B13R0.54 CC(=O)OCCCCCSCCCO 62a_100000033007_100011215043 [0,1,0,0,0,0|2,0,1]=4 4566 B13R0.54 CC(=O)OCCCCCSCCCO 62a_100011215043_100000033007 [0,1,0,0,0,0|2,0,1]=4 4567 B13R0.54 CC(=O)OCCCCNCCCCO 34a_100000750430_100000033659 [0,1,0,0,0,0|2,0,1]=4 4568 B13R0.54 CC(=O)OCCCCOCCCCO 34a_100000073216_100011216708 [0,1,0,0,0,0|2,0,1]=4 4569 B13R0.54 CC(=O)OCCCCOCCCCO 7a_100000073216_100000210776 [0,1,0,0,0,0|2,0,1]=4 4570 B13R0.54 CC(=O)OCCCCSCCCCO 62a_100000033659_100000210776 [0,1,0,0,0,0|2,0,1]=4 4571 B13R0.54 CC(=O)OCCCCSCCCCO 62a_100000210776_100000033659 [0,1,0,0,0,0|2,0,1]=4 4572 B13R0.54 CC(=O)OCCCNCCCCCO 34a_100000762737_100000042594 [0,1,0,0,0,0|2,0,1]=4 4573 B13R0.54 CC(=O)OCCCSCCCCCO 62a_100000042594_100000746330 [0,1,0,0,0,0|2,0,1]=4 4574 B13R0.54 CC(=O)OCCCSCCCCCO 62a_100000746330_100000042594 [0,1,0,0,0,0|2,0,1]=4 4575 B13R0.54 CC(=O)OCCNCCCCCCO 34a_100000686447_100009814007 [0,1,0,0,0,0|2,0,1]=4 4576 B13R0.54 CC(=O)OCCSCCCCCCO 62a_100000766143_100009814007 [0,1,0,0,0,0|2,0,1]=4 4577 B13R0.54 CC(=O)OCCSCCCCCCO 62a_100009814007_100000766143 [0,1,0,0,0,0|2,0,1]=4 4578 B13R0.54 CC(=O)OCNCCCCCCCO 34a_100011996573_100009813279 [0,1,0,0,0,0|2,0,1]=4 4579 B13R0.54 CC(=O)OCSCCCCCCCO 62a_100000076356_100000760002 [0,1,0,0,0,0|2,0,1]=4 4580 B13R0.54 CC(=O)OCSCCCCCCCO 62a_100000760002_100000076356 [0,1,0,0,0,0|2,0,1]=4 4581 B13R0.54 CC(=O)SCCCCNCCCCO 2230a_100000750430_200010402107 [0,1,0,0,0,0|2,0,1]=4 4582 B13R0.54 CC(=O)SCCCCNCCCCO 34a_100000750430_200010402107 [0,1,0,0,0,0|2,0,1]=4 4583 B13R0.54 CC(=O)SCCCCSCCCCO 62a_100000210776_200010402107 [0,1,0,0,0,0|2,0,1]=4 4584 B13R0.54 CC(=O)SCCCCSCCCCO 62a_200010402107_100000210776 [0,1,0,0,0,0|2,0,1]=4 4585 B13R0.54 CC(=O)SCCCNCCCCCO 2230a_100000762737_100000038929 [0,1,0,0,0,0|2,0,1]=4 4586 B13R0.54 CC(=O)SCCCNCCCCCO 34a_100000762737_100000038929 [0,1,0,0,0,0|2,0,1]=4 4587 B13R0.54 CC(=O)SCCCSCCCCCO 62a_100000038929_100000746330 [0,1,0,0,0,0|2,0,1]=4 4588 B13R0.54 CC(=O)SCCCSCCCCCO 62a_100000746330_100000038929 [0,1,0,0,0,0|2,0,1]=4 4589 B13R0.54 CC(=S)OCCCNCCCCCO 2230a_100000762737_200135323944 [0,1,0,0,0,0|2,0,1]=4 4590 B13R0.54 CC(=S)OCCCNCCCCCO 34a_100000762737_200135323944 [0,1,0,0,0,0|2,0,1]=4 4591 B13R0.54 CC(=S)OCCCSCCCCCO 62a_100000746330_200135323944 [0,1,0,0,0,0|2,0,1]=4 4592 B13R0.54 CC(=S)OCCCSCCCCCO 62a_200135323944_100000746330 [0,1,0,0,0,0|2,0,1]=4 4593 B13R0.54 CC(Br)CCOCCCCCCCO 34a_100009893172_100000760002 [0,1,0,0,0,0|1,0,0]=2 4594 B13R0.54 CC(Br)COCCCCCCCCO 34a_100012180447_100000033203 [0,1,0,0,0,0|1,0,0]=2 4595 B13R0.54 CC(Br)COCCOCCOCCO 34a_100012180447_100000032323 [0,1,0,0,0,0|3,0,0]=4 4596 B13R0.54 CC(C)CCCCCCCOCC#N 7a_200000210741_100011215382 [0,1,0,0,0,0|2,0,1]=4 4597 B13R0.54 CC(C)CCCCCCCOCC=O 34a_200000210741_200009817547 [0,1,0,0,0,0|1,0,2]=4 4598 B13R0.54 CC(C)CCCCCCCOCC=O 7a_200000210741_200015260668 [0,1,0,0,0,0|1,0,2]=4 4599 B13R0.54 CC(C)CCCCCCCOCCF 34a_200000210741_100011217306 [0,1,0,0,0,0|2,0,0]=3 4600 B13R0.54 CC(C)CCCCCCCOCCF 7a_200000210741_100011217306 [0,1,0,0,0,0|2,0,0]=3 4601 B13R0.54 CC(C)CCCCCCCOCCO 34a_200000210741_100000211926 [0,1,0,0,0,0|1,0,0]=2 4602 B13R0.54 CC(C)CCCCCCCOCCO 7a_200000210741_100000211926 [0,1,0,0,0,0|1,0,0]=2 4603 B13R0.54 CC(C)CCCCCCNCCC#N 2230a_100000211014_100011215226 [0,1,0,0,0,0|2,0,1]=4 4604 B13R0.54 CC(C)CCCCCCNCCCF 2230a_100000211014_100011934791 [0,1,0,0,0,0|2,0,0]=3 4605 B13R0.54 CC(C)CCCCCCNCCCF 34a_100000211014_100011934791 [0,1,0,0,0,0|2,0,0]=3 4606 B13R0.54 CC(C)CCCCCCNCCCO 2230a_100000211014_100000230001 [0,1,0,0,0,0|1,0,0]=2 4607 B13R0.54 CC(C)CCCCCCNCCCO 34a_100000211014_100000230001 [0,1,0,0,0,0|1,0,0]=2 4608 B13R0.54 CC(C)CCCCCNCC#CCO 2230a_100011290863_200000047223 [0,1,0,0,0,0|1,0,2]=4 4609 B13R0.54 CC(C)CCCCCNCC#CCO 34a_100011290863_200000047223 [0,1,0,0,0,0|1,0,2]=4 4610 B13R0.54 CC(C)CCCCCNCCCC#N 2230a_100011290863_100000687738 [0,1,0,0,0,0|2,0,1]=4 4611 B13R0.54 CC(C)CCCCCNCCCC=O 2230a_100011290863_200011292268 [0,1,0,0,0,0|1,0,2]=4 4612 B13R0.54 CC(C)CCCCCNCCCCF 2230a_100011290863_100000729493 [0,1,0,0,0,0|2,0,0]=3 4613 B13R0.54 CC(C)CCCCCNCCCCF 34a_100011290863_100000729493 [0,1,0,0,0,0|2,0,0]=3 4614 B13R0.54 CC(C)CCCCCNCCCCO 2230a_100000750430_100000210682 [0,1,0,0,0,0|1,0,0]=2 4615 B13R0.54 CC(C)CCCCCNCCCCO 2230a_100011290863_100000210776 [0,1,0,0,0,0|1,0,0]=2 4616 B13R0.54 CC(C)CCCCCNCCCCO 34a_100000750430_100000210682 [0,1,0,0,0,0|1,0,0]=2 4617 B13R0.54 CC(C)CCCCCNCCCCO 34a_100011290863_100011216708 [0,1,0,0,0,0|1,0,0]=2 4618 B13R0.54 CC(C)CCCCCOCC#CCO 34a_100011995859_200000047223 [0,1,0,0,0,0|1,0,2]=4 4619 B13R0.54 CC(C)CCCCCOCC#CCO 7a_100011995859_200000047223 [0,1,0,0,0,0|1,0,2]=4 4620 B13R0.54 CC(C)CCCCCOCCCC#N 7a_100011995859_100000687738 [0,1,0,0,0,0|2,0,1]=4 4621 B13R0.54 CC(C)CCCCCOCCCC=O 7a_100011995859_200011292268 [0,1,0,0,0,0|1,0,2]=4 4622 B13R0.54 CC(C)CCCCCOCCCCBr 34a_100011216708_100000210682 [0,1,0,0,0,0|2,0,0]=3 4623 B13R0.54 CC(C)CCCCCOCCCCCl 34a_100000210776_100000210682 [0,1,0,0,0,0|2,0,0]=3 4624 B13R0.54 CC(C)CCCCCOCCCCCl 7a_100000210776_100000210682 [0,1,0,0,0,0|2,0,0]=3 4625 B13R0.54 CC(C)CCCCCOCCCCF 34a_100011995726_100000210682 [0,1,0,0,0,0|2,0,0]=3 4626 B13R0.54 CC(C)CCCCCOCCCCF 34a_100011995859_100000729493 [0,1,0,0,0,0|2,0,0]=3 4627 B13R0.54 CC(C)CCCCCOCCCCF 7a_100011995726_100000210682 [0,1,0,0,0,0|2,0,0]=3 4628 B13R0.54 CC(C)CCCCCOCCCCF 7a_100011995859_100000729493 [0,1,0,0,0,0|2,0,0]=3 4629 B13R0.54 CC(C)CCCCCOCCCCI 34a_200012148704_100000210682 [0,1,0,0,0,0|2,0,0]=3 4630 B13R0.54 CC(C)CCCCCOCCCCN 34a_100000750430_100000210682 [0,1,0,0,0,0|2,0,0]=3 4631 B13R0.54 CC(C)CCCCCOCCCCO 34a_100011995859_100011216708 [0,1,0,0,0,0|1,0,0]=2 4632 B13R0.54 CC(C)CCCCCOCCCCO 7a_100011995859_100000210776 [0,1,0,0,0,0|1,0,0]=2 4633 B13R0.54 CC(C)CCCCCSCC#CCO 62a_100000210682_200000047223 [0,1,0,0,0,0|1,0,2]=4 4634 B13R0.54 CC(C)CCCCCSCC#CCO 62a_200000047223_100000210682 [0,1,0,0,0,0|1,0,2]=4 4635 B13R0.54 CC(C)CCCCCSCCCC#N 62a_100000210682_100000687738 [0,1,0,0,0,0|2,0,1]=4 4636 B13R0.54 CC(C)CCCCCSCCCC#N 62a_100000687738_100000210682 [0,1,0,0,0,0|2,0,1]=4 4637 B13R0.54 CC(C)CCCCCSCCCC=O 62a_100000210682_200011292268 [0,1,0,0,0,0|1,0,2]=4 4638 B13R0.54 CC(C)CCCCCSCCCC=O 62a_200011292268_100000210682 [0,1,0,0,0,0|1,0,2]=4 4639 B13R0.54 CC(C)CCCCCSCCCCF 62a_100000210682_100000729493 [0,1,0,0,0,0|2,0,0]=3 4640 B13R0.54 CC(C)CCCCCSCCCCF 62a_100000729493_100000210682 [0,1,0,0,0,0|2,0,0]=3 4641 B13R0.54 CC(C)CCCCCSCCCCO 62a_100000210682_100000210776 [0,1,0,0,0,0|1,0,0]=2 4642 B13R0.54 CC(C)CCCCCSCCCCO 62a_100000210776_100000210682 [0,1,0,0,0,0|1,0,0]=2 4643 B13R0.54 CC(C)CCCCNCCCCCO 2230a_100000762737_100011216152 [0,1,0,0,0,0|1,0,0]=2 4644 B13R0.54 CC(C)CCCCNCCCCCO 34a_100000762737_100011216152 [0,1,0,0,0,0|1,0,0]=2 4645 B13R0.54 CC(C)CCCCNCCOCCO 2230a_100000211614_100011216152 [0,1,0,0,0,0|2,0,0]=3 4646 B13R0.54 CC(C)CCCCNCCOCCO 34a_100000211614_100011216152 [0,1,0,0,0,0|2,0,0]=3 4647 B13R0.54 CC(C)CCCCNCCSCCO 2230a_100011219999_100011216152 [0,1,0,0,0,0|2,0,0]=3 4648 B13R0.54 CC(C)CCCCOCCCCC#N 7a_100011214890_100000211819 [0,1,0,0,0,0|2,0,1]=4 4649 B13R0.54 CC(C)CCCCOCCCCC=O 7a_100011214890_100000139335 [0,1,0,0,0,0|1,0,2]=4 4650 B13R0.54 CC(C)CCCCOCCCCCBr 34a_100000746331_100011216152 [0,1,0,0,0,0|2,0,0]=3 4651 B13R0.54 CC(C)CCCCOCCCCCBr 7a_100000746331_100011216152 [0,1,0,0,0,0|2,0,0]=3 4652 B13R0.54 CC(C)CCCCOCCCCCCl 34a_100000746330_100011216152 [0,1,0,0,0,0|2,0,0]=3 4653 B13R0.54 CC(C)CCCCOCCCCCCl 7a_100000746330_100011216152 [0,1,0,0,0,0|2,0,0]=3 4654 B13R0.54 CC(C)CCCCOCCCCCF 34a_100011214890_100000729378 [0,1,0,0,0,0|2,0,0]=3 4655 B13R0.54 CC(C)CCCCOCCCCCF 7a_100011214890_100000729378 [0,1,0,0,0,0|2,0,0]=3 4656 B13R0.54 CC(C)CCCCOCCCCCI 34a_200012148887_100011216152 [0,1,0,0,0,0|2,0,0]=3 4657 B13R0.54 CC(C)CCCCOCCCCCI 7a_200012148887_100011216152 [0,1,0,0,0,0|2,0,0]=3 4658 B13R0.54 CC(C)CCCCOCCCCCN 34a_100000762737_100011216152 [0,1,0,0,0,0|2,0,0]=3 4659 B13R0.54 CC(C)CCCCOCCCCCO 34a_100011214890_100000746330 [0,1,0,0,0,0|1,0,0]=2 4660 B13R0.54 CC(C)CCCCOCCCCCO 7a_100011214890_100000746330 [0,1,0,0,0,0|1,0,0]=2 4661 B13R0.54 CC(C)CCCCOCCOCCBr 34a_100000692535_100011216152 [0,1,0,0,0,0|3,0,0]=4 4662 B13R0.54 CC(C)CCCCOCCOCCBr 7a_100000692535_100011216152 [0,1,0,0,0,0|3,0,0]=4 4663 B13R0.54 CC(C)CCCCOCCOCCCl 34a_100011215305_100011216152 [0,1,0,0,0,0|3,0,0]=4 4664 B13R0.54 CC(C)CCCCOCCOCCCl 7a_100011215305_100011216152 [0,1,0,0,0,0|3,0,0]=4 4665 B13R0.54 CC(C)CCCCOCCOCCF 34a_200015357709_100011216152 [0,1,0,0,0,0|3,0,0]=4 4666 B13R0.54 CC(C)CCCCOCCOCCF 7a_200015357709_100011216152 [0,1,0,0,0,0|3,0,0]=4 4667 B13R0.54 CC(C)CCCCOCCOCCI 34a_100012149058_100011216152 [0,1,0,0,0,0|3,0,0]=4 4668 B13R0.54 CC(C)CCCCOCCOCCI 7a_100012149058_100011216152 [0,1,0,0,0,0|3,0,0]=4 4669 B13R0.54 CC(C)CCCCOCCOCCN 34a_100000211614_100011216152 [0,1,0,0,0,0|3,0,0]=4 4670 B13R0.54 CC(C)CCCCOCCOCCO 34a_100011214890_100000692535 [0,1,0,0,0,0|2,0,0]=3 4671 B13R0.54 CC(C)CCCCOCCOCCO 7a_100011214890_100011215305 [0,1,0,0,0,0|2,0,0]=3 4672 B13R0.54 CC(C)CCCCSCCCCC#N 62a_100011216152_100000211819 [0,1,0,0,0,0|2,0,1]=4 4673 B13R0.54 CC(C)CCCCSCCCCC#N 62a_100011219923_100011216152 [0,1,0,0,0,0|2,0,1]=4 4674 B13R0.54 CC(C)CCCCSCCCCC=O 62a_100000139335_100011216152 [0,1,0,0,0,0|1,0,2]=4 4675 B13R0.54 CC(C)CCCCSCCCCC=O 62a_100011216152_100000139335 [0,1,0,0,0,0|1,0,2]=4 4676 B13R0.54 CC(C)CCCCSCCCCCF 62a_100000729378_100011216152 [0,1,0,0,0,0|2,0,0]=3 4677 B13R0.54 CC(C)CCCCSCCCCCF 62a_100011216152_100000729378 [0,1,0,0,0,0|2,0,0]=3 4678 B13R0.54 CC(C)CCCCSCCCCCO 62a_100000746330_100011216152 [0,1,0,0,0,0|1,0,0]=2 4679 B13R0.54 CC(C)CCCCSCCCCCO 62a_100011216152_100000746330 [0,1,0,0,0,0|1,0,0]=2 4680 B13R0.54 CC(C)CCCCSCCOCCO 62a_100011215305_100011216152 [0,1,0,0,0,0|2,0,0]=3 4681 B13R0.54 CC(C)CCCCSCCOCCO 62a_100011216152_100011215305 [0,1,0,0,0,0|2,0,0]=3 4682 B13R0.54 CC(C)CCCNCCCCCC#N 2230a_200000737386_100009813376 [0,1,0,0,0,0|2,0,1]=4 4683 B13R0.54 CC(C)CCCNCCCCCC=O 2230a_200000737386_100000139337 [0,1,0,0,0,0|1,0,2]=4 4684 B13R0.54 CC(C)CCCNCCCCCCF 2230a_200000737386_100015922095 [0,1,0,0,0,0|2,0,0]=3 4685 B13R0.54 CC(C)CCCNCCCCCCF 34a_200000737386_100015922095 [0,1,0,0,0,0|2,0,0]=3 4686 B13R0.54 CC(C)CCCNCCCCCCO 2230a_100000686447_100011214892 [0,1,0,0,0,0|1,0,0]=2 4687 B13R0.54 CC(C)CCCNCCCCCCO 2230a_200000737386_100000766143 [0,1,0,0,0,0|1,0,0]=2 4688 B13R0.54 CC(C)CCCNCCCCCCO 34a_100000686447_100011214892 [0,1,0,0,0,0|1,0,0]=2 4689 B13R0.54 CC(C)CCCNCCCCCCO 34a_200000737386_100000766143 [0,1,0,0,0,0|1,0,0]=2 4690 B13R0.54 CC(C)CCCOCCCCCC#N 7a_100000210774_100009813376 [0,1,0,0,0,0|2,0,1]=4 4691 B13R0.54 CC(C)CCCOCCCCCC=O 7a_100000210774_100000139337 [0,1,0,0,0,0|1,0,2]=4 4692 B13R0.54 CC(C)CCCOCCCCCCBr 34a_100011215345_100011214892 [0,1,0,0,0,0|2,0,0]=3 4693 B13R0.54 CC(C)CCCOCCCCCCBr 7a_100011215345_100011214892 [0,1,0,0,0,0|2,0,0]=3 4694 B13R0.54 CC(C)CCCOCCCCCCCl 34a_100000766143_100011214892 [0,1,0,0,0,0|2,0,0]=3 4695 B13R0.54 CC(C)CCCOCCCCCCCl 7a_100000766143_100011214892 [0,1,0,0,0,0|2,0,0]=3 4696 B13R0.54 CC(C)CCCOCCCCCCF 34a_100000210774_100015922095 [0,1,0,0,0,0|2,0,0]=3 4697 B13R0.54 CC(C)CCCOCCCCCCF 34a_100000732779_100011214892 [0,1,0,0,0,0|2,0,0]=3 4698 B13R0.54 CC(C)CCCOCCCCCCF 7a_100000210774_100015922095 [0,1,0,0,0,0|2,0,0]=3 4699 B13R0.54 CC(C)CCCOCCCCCCF 7a_100000732779_100011214892 [0,1,0,0,0,0|2,0,0]=3 4700 B13R0.54 CC(C)CCCOCCCCCCN 34a_100000686447_100011214892 [0,1,0,0,0,0|2,0,0]=3 4701 B13R0.54 CC(C)CCCOCCCCCCO 34a_100000210774_100000766143 [0,1,0,0,0,0|1,0,0]=2 4702 B13R0.54 CC(C)CCCOCCCCCCO 7a_100000210774_100000766143 [0,1,0,0,0,0|1,0,0]=2 4703 B13R0.54 CC(C)CCCSCCCCCC#N 62a_100009813376_100011214892 [0,1,0,0,0,0|2,0,1]=4 4704 B13R0.54 CC(C)CCCSCCCCCC#N 62a_100011214892_100009813376 [0,1,0,0,0,0|2,0,1]=4 4705 B13R0.54 CC(C)CCCSCCCCCC=O 62a_100000139337_100011214892 [0,1,0,0,0,0|1,0,2]=4 4706 B13R0.54 CC(C)CCCSCCCCCC=O 62a_100011214892_100000139337 [0,1,0,0,0,0|1,0,2]=4 4707 B13R0.54 CC(C)CCCSCCCCCCF 62a_100011214892_100015922095 [0,1,0,0,0,0|2,0,0]=3 4708 B13R0.54 CC(C)CCCSCCCCCCF 62a_100015922095_100011214892 [0,1,0,0,0,0|2,0,0]=3 4709 B13R0.54 CC(C)CCCSCCCCCCO 62a_100000766143_100011214892 [0,1,0,0,0,0|1,0,0]=2 4710 B13R0.54 CC(C)CCCSCCCCCCO 62a_100011214892_100000766143 [0,1,0,0,0,0|1,0,0]=2 4711 B13R0.54 CC(C)CCNCCCCCCCO 2230a_100011996573_100000210312 [0,1,0,0,0,0|1,0,0]=2 4712 B13R0.54 CC(C)CCNCCCCCCCO 269862a_100011996573_100000185833 [0,1,0,0,0,0|1,0,0]=2 4713 B13R0.54 CC(C)CCNCCCCCCCO 34a_100011996573_100000210312 [0,1,0,0,0,0|1,0,0]=2 4714 B13R0.54 CC(C)CCNCCCOCCCO 2230a_100011310245_100000210312 [0,1,0,0,0,0|2,0,0]=3 4715 B13R0.54 CC(C)CCNCCCOCCCO 269862a_100011310245_100000185833 [0,1,0,0,0,0|2,0,0]=3 4716 B13R0.54 CC(C)CCNCCCOCCCO 34a_100011310245_100000210312 [0,1,0,0,0,0|2,0,0]=3 4717 B13R0.54 CC(C)CCOCCCCCCC#N 7a_100000210254_100009813337 [0,1,0,0,0,0|2,0,1]=4 4718 B13R0.54 CC(C)CCOCCCCCCCBr 34a_100000760002_100000210312 [0,1,0,0,0,0|2,0,0]=3 4719 B13R0.54 CC(C)CCOCCCCCCCBr 7a_100000760002_100000210626 [0,1,0,0,0,0|2,0,0]=3 4720 B13R0.54 CC(C)CCOCCCCCCCN 34a_100011996573_100000210312 [0,1,0,0,0,0|2,0,0]=3 4721 B13R0.54 CC(C)CCOCCCCCCCO 34a_100000210254_100000760002 [0,1,0,0,0,0|1,0,0]=2 4722 B13R0.54 CC(C)CCOCCCCCCCO 7a_100000210254_100000760002 [0,1,0,0,0,0|1,0,0]=2 4723 B13R0.54 CC(C)CCOCCCOCCCN 34a_100011310245_100000210312 [0,1,0,0,0,0|3,0,0]=4 4724 B13R0.54 CC(C)CCSCCCCCCC#N 62a_100000210312_100009813337 [0,1,0,0,0,0|2,0,1]=4 4725 B13R0.54 CC(C)CCSCCCCCCC#N 62a_100009813337_100000210312 [0,1,0,0,0,0|2,0,1]=4 4726 B13R0.54 CC(C)CCSCCCCCCCO 62a_100000210312_100000760002 [0,1,0,0,0,0|1,0,0]=2 4727 B13R0.54 CC(C)CCSCCCCCCCO 62a_100000760002_100000210312 [0,1,0,0,0,0|1,0,0]=2 4728 B13R0.54 CC(C)CNCCCCCCCCO 2230a_100000210953_100000033203 [0,1,0,0,0,0|1,0,0]=2 4729 B13R0.54 CC(C)CNCCCCCCCCO 2230a_102515433106_100000210760 [0,1,0,0,0,0|1,0,0]=2 4730 B13R0.54 CC(C)CNCCCCCCCCO 270004a_102515433106_100000210432 [0,1,0,0,0,0|1,0,0]=2 4731 B13R0.54 CC(C)CNCCCCCCCCO 34a_100000210953_100000033203 [0,1,0,0,0,0|1,0,0]=2 4732 B13R0.54 CC(C)CNCCCCCCCCO 34a_102515433106_100000210624 [0,1,0,0,0,0|1,0,0]=2 4733 B13R0.54 CC(C)CNCCOCCCCCF 34a_100015185251_100000729378 [0,1,0,0,0,0|3,0,0]=4 4734 B13R0.54 CC(C)CNCCOCCCCCO 34a_100015185251_100000746330 [0,1,0,0,0,0|2,0,0]=3 4735 B13R0.54 CC(C)CNCCOCCOCCO 2230a_100000210953_100000032323 [0,1,0,0,0,0|3,0,0]=4 4736 B13R0.54 CC(C)CNCCOCCOCCO 2230a_100011998139_100000210760 [0,1,0,0,0,0|3,0,0]=4 4737 B13R0.54 CC(C)CNCCOCCOCCO 270004a_100011998139_100000210432 [0,1,0,0,0,0|3,0,0]=4 4738 B13R0.54 CC(C)CNCCOCCOCCO 34a_100000210953_100000032323 [0,1,0,0,0,0|3,0,0]=4 4739 B13R0.54 CC(C)CNCCOCCOCCO 34a_100011998139_100000210624 [0,1,0,0,0,0|3,0,0]=4 4740 B13R0.54 CC(C)CNCCOCCOCCO 34a_100015185251_100000692535 [0,1,0,0,0,0|3,0,0]=4 4741 B13R0.54 CC(C)COCCCCCCCCBr 34a_100009813846_100000210624 [0,1,0,0,0,0|2,0,0]=3 4742 B13R0.54 CC(C)COCCCCCCCCBr 7a_100009813846_100000210760 [0,1,0,0,0,0|2,0,0]=3 4743 B13R0.54 CC(C)COCCCCCCCCCl 34a_100000033203_100000210624 [0,1,0,0,0,0|2,0,0]=3 4744 B13R0.54 CC(C)COCCCCCCCCCl 7a_100000033203_100000210760 [0,1,0,0,0,0|2,0,0]=3 4745 B13R0.54 CC(C)COCCCCCCCCN 34a_102515433106_100000210624 [0,1,0,0,0,0|2,0,0]=3 4746 B13R0.54 CC(C)COCCCCCCCCO 34a_100000210257_100000033203 [0,1,0,0,0,0|1,0,0]=2 4747 B13R0.54 CC(C)COCCCCCNCCN 34a_103619048469_100000210624 [0,1,0,0,0,0|3,0,0]=4 4748 B13R0.54 CC(C)COCCCNCCCCF 2230a_100000205972_100000729493 [0,1,0,0,0,0|3,0,0]=4 4749 B13R0.54 CC(C)COCCCNCCCCF 34a_100000205972_100000729493 [0,1,0,0,0,0|3,0,0]=4 4750 B13R0.54 CC(C)COCCCNCCCCO 2230a_100000205972_100000210776 [0,1,0,0,0,0|2,0,0]=3 4751 B13R0.54 CC(C)COCCCNCCCCO 34a_100000205972_100011216708 [0,1,0,0,0,0|2,0,0]=3 4752 B13R0.54 CC(C)COCCOCCCCCF 34a_100000703358_100000729378 [0,1,0,0,0,0|3,0,0]=4 4753 B13R0.54 CC(C)COCCOCCCCCF 7a_100000703358_100000729378 [0,1,0,0,0,0|3,0,0]=4 4754 B13R0.54 CC(C)COCCOCCCCCO 34a_100000703358_100000746330 [0,1,0,0,0,0|2,0,0]=3 4755 B13R0.54 CC(C)COCCOCCCCCO 7a_100000703358_100000746330 [0,1,0,0,0,0|2,0,0]=3 4756 B13R0.54 CC(C)COCCOCCOCCO 34a_100000210257_100000032323 [0,1,0,0,0,0|3,0,0]=4 4757 B13R0.54 CC(C)COCCOCCOCCO 34a_100000703358_100000692535 [0,1,0,0,0,0|3,0,0]=4 4758 B13R0.54 CC(C)COCCOCCOCCO 7a_100000703358_100011215305 [0,1,0,0,0,0|3,0,0]=4 4759 B13R0.54 CC(C)CSCCCCCCCCO 62a_100000033203_100000210760 [0,1,0,0,0,0|1,0,0]=2 4760 B13R0.54 CC(C)CSCCCCCCCCO 62a_100000210624_100000033203 [0,1,0,0,0,0|1,0,0]=2 4761 B13R0.54 CC(C)CSCCOCCCCCF 34a_200000230437_100000729378 [0,1,0,0,0,0|3,0,0]=4 4762 B13R0.54 CC(C)CSCCOCCCCCF 7a_200000230437_100000729378 [0,1,0,0,0,0|3,0,0]=4 4763 B13R0.54 CC(C)CSCCOCCCCCO 34a_200000230437_100000746330 [0,1,0,0,0,0|2,0,0]=3 4764 B13R0.54 CC(C)CSCCOCCCCCO 7a_200000230437_100000746330 [0,1,0,0,0,0|2,0,0]=3 4765 B13R0.54 CC(C)CSCCOCCOCCO 34a_200000230437_100000692535 [0,1,0,0,0,0|3,0,0]=4 4766 B13R0.54 CC(C)CSCCOCCOCCO 62a_100000032323_100000210760 [0,1,0,0,0,0|3,0,0]=4 4767 B13R0.54 CC(C)CSCCOCCOCCO 62a_100000210624_100000032323 [0,1,0,0,0,0|3,0,0]=4 4768 B13R0.54 CC(C)CSCCOCCOCCO 7a_200000230437_100011215305 [0,1,0,0,0,0|3,0,0]=4 4769 B13R0.54 CC(C)NCCCCCCCCCO 2230a_100000078944_100000210206 [0,1,0,0,0,0|1,0,0]=2 4770 B13R0.54 CC(C)NCCCCCCCCCO 2230a_100138425928_100009813782 [0,1,0,0,0,0|1,0,0]=2 4771 B13R0.54 CC(C)NCCCCCCCCCO 34a_100000078944_100000210206 [0,1,0,0,0,0|1,0,0]=2 4772 B13R0.54 CC(C)NCCCCCCCCCO 34a_100138425928_100009813782 [0,1,0,0,0,0|1,0,0]=2 4773 B13R0.54 CC(C)NCCCCCOCCCF 34a_100011629493_100011934791 [0,1,0,0,0,0|3,0,0]=4 4774 B13R0.54 CC(C)NCCCCCOCCCO 34a_100011629493_100000230001 [0,1,0,0,0,0|2,0,0]=3 4775 B13R0.54 CC(C)NCCCCOCCCCF 34a_100011521146_100000729493 [0,1,0,0,0,0|3,0,0]=4 4776 B13R0.54 CC(C)NCCCCOCCCCO 34a_100011521146_100011216708 [0,1,0,0,0,0|2,0,0]=3 4777 B13R0.54 CC(C)NCCCOCCCCCF 34a_100000182298_100000729378 [0,1,0,0,0,0|3,0,0]=4 4778 B13R0.54 CC(C)NCCCOCCCCCO 34a_100000182298_100000746330 [0,1,0,0,0,0|2,0,0]=3 4779 B13R0.54 CC(C)NCCCOCCOCCO 2230a_100011996194_100000210206 [0,1,0,0,0,0|3,0,0]=4 4780 B13R0.54 CC(C)NCCCOCCOCCO 34a_100000182298_100000692535 [0,1,0,0,0,0|3,0,0]=4 4781 B13R0.54 CC(C)NCCCOCCOCCO 34a_100011996194_100000210206 [0,1,0,0,0,0|3,0,0]=4 4782 B13R0.54 CC(C)NCCOCCCCCCF 34a_100000224655_100015922095 [0,1,0,0,0,0|3,0,0]=4 4783 B13R0.54 CC(C)NCCOCCCCCCO 34a_100000224655_100000766143 [0,1,0,0,0,0|2,0,0]=3 4784 B13R0.54 CC(C)OCCCCCCCCCBr 34a_100009813782_100000210206 [0,1,0,0,0,0|2,0,0]=3 4785 B13R0.54 CC(C)OCCCCCCCCCBr 7a_100009813782_100000210206 [0,1,0,0,0,0|2,0,0]=3 4786 B13R0.54 CC(C)OCCCCCCCCCCl 34a_100009868337_100000210206 [0,1,0,0,0,0|2,0,0]=3 4787 B13R0.54 CC(C)OCCCCCCCCCCl 7a_100009868337_100000210206 [0,1,0,0,0,0|2,0,0]=3 4788 B13R0.54 CC(C)OCCCCCCCCCN 34a_100000078944_100000210206 [0,1,0,0,0,0|2,0,0]=3 4789 B13R0.54 CC(C)OCCCCCCCCCO 34a_100000212225_100009813782 [0,1,0,0,0,0|1,0,0]=2 4790 B13R0.54 CC(C)OCCCNCCCCCF 2230a_100000737246_100000729378 [0,1,0,0,0,0|3,0,0]=4 4791 B13R0.54 CC(C)OCCCNCCCCCF 34a_100000737246_100000729378 [0,1,0,0,0,0|3,0,0]=4 4792 B13R0.54 CC(C)OCCCNCCCCCO 2230a_100000737246_100000746330 [0,1,0,0,0,0|2,0,0]=3 4793 B13R0.54 CC(C)OCCCNCCCCCO 34a_100000737246_100000746330 [0,1,0,0,0,0|2,0,0]=3 4794 B13R0.54 CC(C)OCCCNCCOCCO 2230a_100000737246_100011215305 [0,1,0,0,0,0|3,0,0]=4 4795 B13R0.54 CC(C)OCCCNCCOCCO 34a_100000737246_100000692535 [0,1,0,0,0,0|3,0,0]=4 4796 B13R0.54 CC(C)OCCNCCCCCCF 2230a_100000701111_100015922095 [0,1,0,0,0,0|3,0,0]=4 4797 B13R0.54 CC(C)OCCNCCCCCCF 34a_100000701111_100015922095 [0,1,0,0,0,0|3,0,0]=4 4798 B13R0.54 CC(C)OCCNCCCCCCO 2230a_100000686447_100000211751 [0,1,0,0,0,0|2,0,0]=3 4799 B13R0.54 CC(C)OCCNCCCCCCO 2230a_100000701111_100000766143 [0,1,0,0,0,0|2,0,0]=3 4800 B13R0.54 CC(C)OCCNCCCCCCO 34a_100000686447_100000211751 [0,1,0,0,0,0|2,0,0]=3 4801 B13R0.54 CC(C)OCCNCCCCCCO 34a_100000701111_100000766143 [0,1,0,0,0,0|2,0,0]=3 4802 B13R0.54 CC(C)OCCOCCCCCCBr 34a_100011215345_100000211751 [0,1,0,0,0,0|3,0,0]=4 4803 B13R0.54 CC(C)OCCOCCCCCCBr 7a_100011215345_100000211751 [0,1,0,0,0,0|3,0,0]=4 4804 B13R0.54 CC(C)OCCOCCCCCCCl 34a_100000766143_100000211751 [0,1,0,0,0,0|3,0,0]=4 4805 B13R0.54 CC(C)OCCOCCCCCCCl 7a_100000766143_100000211751 [0,1,0,0,0,0|3,0,0]=4 4806 B13R0.54 CC(C)OCCOCCCCCCF 34a_100000211219_100015922095 [0,1,0,0,0,0|3,0,0]=4 4807 B13R0.54 CC(C)OCCOCCCCCCF 34a_100000732779_100000211751 [0,1,0,0,0,0|3,0,0]=4 4808 B13R0.54 CC(C)OCCOCCCCCCF 7a_100000211219_100015922095 [0,1,0,0,0,0|3,0,0]=4 4809 B13R0.54 CC(C)OCCOCCCCCCF 7a_100000732779_100000211751 [0,1,0,0,0,0|3,0,0]=4 4810 B13R0.54 CC(C)OCCOCCCCCCN 34a_100000686447_100000211751 [0,1,0,0,0,0|3,0,0]=4 4811 B13R0.54 CC(C)OCCOCCCCCCO 34a_100000211219_100000766143 [0,1,0,0,0,0|2,0,0]=3 4812 B13R0.54 CC(C)OCCOCCCCCCO 7a_100000211219_100000766143 [0,1,0,0,0,0|2,0,0]=3 4813 B13R0.54 CC(C)OCCSCCCCCCF 62a_100000211751_100015922095 [0,1,0,0,0,0|3,0,0]=4 4814 B13R0.54 CC(C)OCCSCCCCCCF 62a_100015922095_100000211751 [0,1,0,0,0,0|3,0,0]=4 4815 B13R0.54 CC(C)OCCSCCCCCCO 62a_100000211751_100000766143 [0,1,0,0,0,0|2,0,0]=3 4816 B13R0.54 CC(C)OCCSCCCCCCO 62a_100000766143_100000211751 [0,1,0,0,0,0|2,0,0]=3 4817 B13R0.54 CC(C)OCNCCCCCCCO 2230a_100011996573_100000709892 [0,1,0,0,0,0|2,0,0]=3 4818 B13R0.54 CC(C)OCNCCCCCCCO 34a_100011996573_100000709892 [0,1,0,0,0,0|2,0,0]=3 4819 B13R0.54 CC(C)OCNCCCOCCCO 2230a_100011310245_100000709892 [0,1,0,0,0,0|3,0,0]=4 4820 B13R0.54 CC(C)OCNCCCOCCCO 34a_100011310245_100000709892 [0,1,0,0,0,0|3,0,0]=4 4821 B13R0.54 CC(C)OCOCCCCCCCBr 34a_100000760002_100000709892 [0,1,0,0,0,0|3,0,0]=4 4822 B13R0.54 CC(C)OCOCCCCCCCN 34a_100011996573_100000709892 [0,1,0,0,0,0|3,0,0]=4 4823 B13R0.54 CC(C)OCSCCCCCCCO 62a_100000709892_100000760002 [0,1,0,0,0,0|2,0,0]=3 4824 B13R0.54 CC(C)OCSCCCCCCCO 62a_100000760002_100000709892 [0,1,0,0,0,0|2,0,0]=3 4825 B13R0.54 CC(C)SCCCCCCCCCO 62a_100000210206_100009813782 [0,1,0,0,0,0|1,0,0]=2 4826 B13R0.54 CC(C)SCCCCCCCCCO 62a_100009813782_100000210206 [0,1,0,0,0,0|1,0,0]=2 4827 B13R0.54 CC(C)SCCNCCCCCCF 2230a_100000731138_100015922095 [0,1,0,0,0,0|3,0,0]=4 4828 B13R0.54 CC(C)SCCNCCCCCCF 34a_100000731138_100015922095 [0,1,0,0,0,0|3,0,0]=4 4829 B13R0.54 CC(C)SCCNCCCCCCO 2230a_100000686447_100000730970 [0,1,0,0,0,0|2,0,0]=3 4830 B13R0.54 CC(C)SCCNCCCCCCO 2230a_100000731138_100000766143 [0,1,0,0,0,0|2,0,0]=3 4831 B13R0.54 CC(C)SCCNCCCCCCO 34a_100000686447_100000730970 [0,1,0,0,0,0|2,0,0]=3 4832 B13R0.54 CC(C)SCCNCCCCCCO 34a_100000731138_100000766143 [0,1,0,0,0,0|2,0,0]=3 4833 B13R0.54 CC(C)SCCOCCCCCCBr 34a_100011215345_100000730970 [0,1,0,0,0,0|3,0,0]=4 4834 B13R0.54 CC(C)SCCOCCCCCCBr 7a_100011215345_100000730970 [0,1,0,0,0,0|3,0,0]=4 4835 B13R0.54 CC(C)SCCOCCCCCCCl 34a_100000766143_100000730970 [0,1,0,0,0,0|3,0,0]=4 4836 B13R0.54 CC(C)SCCOCCCCCCCl 7a_100000766143_100000730970 [0,1,0,0,0,0|3,0,0]=4 4837 B13R0.54 CC(C)SCCOCCCCCCF 34a_100000732779_100000730970 [0,1,0,0,0,0|3,0,0]=4 4838 B13R0.54 CC(C)SCCOCCCCCCF 34a_200011212901_100015922095 [0,1,0,0,0,0|3,0,0]=4 4839 B13R0.54 CC(C)SCCOCCCCCCF 7a_100000732779_100000730970 [0,1,0,0,0,0|3,0,0]=4 4840 B13R0.54 CC(C)SCCOCCCCCCF 7a_200011212901_100015922095 [0,1,0,0,0,0|3,0,0]=4 4841 B13R0.54 CC(C)SCCOCCCCCCN 34a_100000686447_100000730970 [0,1,0,0,0,0|3,0,0]=4 4842 B13R0.54 CC(C)SCCOCCCCCCO 34a_200011212901_100000766143 [0,1,0,0,0,0|2,0,0]=3 4843 B13R0.54 CC(C)SCCOCCCCCCO 7a_200011212901_100000766143 [0,1,0,0,0,0|2,0,0]=3 4844 B13R0.54 CC(C)SCCSCCCCCCF 62a_100000730970_100015922095 [0,1,0,0,0,0|3,0,0]=4 4845 B13R0.54 CC(C)SCCSCCCCCCF 62a_100015922095_100000730970 [0,1,0,0,0,0|3,0,0]=4 4846 B13R0.54 CC(C)SCCSCCCCCCO 62a_100000730970_100000766143 [0,1,0,0,0,0|2,0,0]=3 4847 B13R0.54 CC(C)SCCSCCCCCCO 62a_100000766143_100000730970 [0,1,0,0,0,0|2,0,0]=3 4848 B13R0.54 CC(F)COCCCCCCCCO 34a_100015925927_100000033203 [0,1,0,0,0,0|1,0,0]=2 4849 B13R0.54 CC(F)COCCOCCOCCO 34a_100015925927_100000032323 [0,1,0,0,0,0|3,0,0]=4 4850 B13R0.54 CC(O)CCCNCCCCCCO 2230a_100000686447_200000718107 [0,1,0,0,0,0|1,0,0]=2 4851 B13R0.54 CC(O)CCCNCCCCCCO 34a_100000686447_200000718107 [0,1,0,0,0,0|1,0,0]=2 4852 B13R0.54 CC(O)CCCOCCCCCCBr 34a_100011215345_200000718107 [0,1,0,0,0,0|2,0,0]=3 4853 B13R0.54 CC(O)CCCOCCCCCCBr 7a_100011215345_200000718107 [0,1,0,0,0,0|2,0,0]=3 4854 B13R0.54 CC(O)CCCOCCCCCCCl 34a_100000766143_200000718107 [0,1,0,0,0,0|2,0,0]=3 4855 B13R0.54 CC(O)CCCOCCCCCCCl 7a_100000766143_200000718107 [0,1,0,0,0,0|2,0,0]=3 4856 B13R0.54 CC(O)CCCOCCCCCCF 34a_100000732779_200000718107 [0,1,0,0,0,0|2,0,0]=3 4857 B13R0.54 CC(O)CCCOCCCCCCF 7a_100000732779_200000718107 [0,1,0,0,0,0|2,0,0]=3 4858 B13R0.54 CC(O)CCCOCCCCCCN 34a_100000686447_200000718107 [0,1,0,0,0,0|2,0,0]=3 4859 B13R0.54 CC(O)CCCSCCCCCC#N 62a_100009813376_200000718107 [0,1,0,0,0,0|2,0,1]=4 4860 B13R0.54 CC(O)CCCSCCCCCC#N 62a_200000718107_100009813376 [0,1,0,0,0,0|2,0,1]=4 4861 B13R0.54 CC(O)CCCSCCCCCC=O 62a_100000139337_200000718107 [0,1,0,0,0,0|1,0,2]=4 4862 B13R0.54 CC(O)CCCSCCCCCC=O 62a_200000718107_100000139337 [0,1,0,0,0,0|1,0,2]=4 4863 B13R0.54 CC(O)CCCSCCCCCCF 62a_100015922095_200000718107 [0,1,0,0,0,0|2,0,0]=3 4864 B13R0.54 CC(O)CCCSCCCCCCF 62a_200000718107_100015922095 [0,1,0,0,0,0|2,0,0]=3 4865 B13R0.54 CC(O)CCCSCCCCCCO 62a_100000766143_200000718107 [0,1,0,0,0,0|1,0,0]=2 4866 B13R0.54 CC(O)CCCSCCCCCCO 62a_200000718107_100000766143 [0,1,0,0,0,0|1,0,0]=2 4867 B13R0.54 CC(O)CCNCCCCCCC#N 2230a_200000755665_100009813337 [0,1,0,0,0,0|2,0,1]=4 4868 B13R0.54 CC(O)CCNCCCCCCCO 2230a_100011996573_100012276601 [0,1,0,0,0,0|1,0,0]=2 4869 B13R0.54 CC(O)CCNCCCCCCCO 2230a_200000755665_100000760002 [0,1,0,0,0,0|1,0,0]=2 4870 B13R0.54 CC(O)CCNCCCCCCCO 34a_100011996573_100012276601 [0,1,0,0,0,0|1,0,0]=2 4871 B13R0.54 CC(O)CCNCCCOCCCO 2230a_100011310245_100012276601 [0,1,0,0,0,0|2,0,0]=3 4872 B13R0.54 CC(O)CCNCCCOCCCO 34a_100011310245_100012276601 [0,1,0,0,0,0|2,0,0]=3 4873 B13R0.54 CC(O)CCOCCCCCCCBr 34a_100000760002_100012276601 [0,1,0,0,0,0|2,0,0]=3 4874 B13R0.54 CC(O)CCOCCCCCCCBr 7a_100000760002_100012276601 [0,1,0,0,0,0|2,0,0]=3 4875 B13R0.54 CC(O)CCOCCCCCCCN 34a_100011996573_100012276601 [0,1,0,0,0,0|2,0,0]=3 4876 B13R0.54 CC(O)CCOCCCOCCCN 34a_100011310245_100012276601 [0,1,0,0,0,0|3,0,0]=4 4877 B13R0.54 CC(O)CCSCCCCCCC#N 62a_100009813337_100012276601 [0,1,0,0,0,0|2,0,1]=4 4878 B13R0.54 CC(O)CCSCCCCCCC#N 62a_100012276601_100009813337 [0,1,0,0,0,0|2,0,1]=4 4879 B13R0.54 CC(O)CCSCCCCCCCO 62a_100000760002_100012276601 [0,1,0,0,0,0|1,0,0]=2 4880 B13R0.54 CC(O)CCSCCCCCCCO 62a_100012276601_100000760002 [0,1,0,0,0,0|1,0,0]=2 4881 B13R0.54 CC(O)CNCCCCCCCCO 2230a_100000210904_100000033203 [0,1,0,0,0,0|1,0,0]=2 4882 B13R0.54 CC(O)CNCCCCCCCCO 2230a_102515433106_100011218427 [0,1,0,0,0,0|1,0,0]=2 4883 B13R0.54 CC(O)CNCCCCCCCCO 34a_100000210904_100000033203 [0,1,0,0,0,0|1,0,0]=2 4884 B13R0.54 CC(O)CNCCCCCCCCO 34a_102515433106_100011218427 [0,1,0,0,0,0|1,0,0]=2 4885 B13R0.54 CC(O)CNCCOCCOCCO 2230a_100000210904_100000032323 [0,1,0,0,0,0|3,0,0]=4 4886 B13R0.54 CC(O)CNCCOCCOCCO 2230a_100011998139_100011218427 [0,1,0,0,0,0|3,0,0]=4 4887 B13R0.54 CC(O)CNCCOCCOCCO 34a_100000210904_100000032323 [0,1,0,0,0,0|3,0,0]=4 4888 B13R0.54 CC(O)CNCCOCCOCCO 34a_100011998139_100011218427 [0,1,0,0,0,0|3,0,0]=4 4889 B13R0.54 CC(O)COCCCCCCCCBr 34a_100009813846_100011218427 [0,1,0,0,0,0|2,0,0]=3 4890 B13R0.54 CC(O)COCCCCCCCCBr 7a_100009813846_100011218427 [0,1,0,0,0,0|2,0,0]=3 4891 B13R0.54 CC(O)COCCCCCCCCCl 34a_100000033203_100011218427 [0,1,0,0,0,0|2,0,0]=3 4892 B13R0.54 CC(O)COCCCCCCCCCl 7a_100000033203_100011218427 [0,1,0,0,0,0|2,0,0]=3 4893 B13R0.54 CC(O)COCCCCCCCCN 34a_102515433106_100011218427 [0,1,0,0,0,0|2,0,0]=3 4894 B13R0.54 CC(O)COCCCCCNCCN 34a_103619048469_100011218427 [0,1,0,0,0,0|3,0,0]=4 4895 B13R0.54 CC(O)CSCCCCCCCCO 62a_100000033203_100011218427 [0,1,0,0,0,0|1,0,0]=2 4896 B13R0.54 CC(O)CSCCCCCCCCO 62a_100011218427_100000033203 [0,1,0,0,0,0|1,0,0]=2 4897 B13R0.54 CC(O)CSCCOCCOCCO 62a_100000032323_100011218427 [0,1,0,0,0,0|3,0,0]=4 4898 B13R0.54 CC(O)CSCCOCCOCCO 62a_100011218427_100000032323 [0,1,0,0,0,0|3,0,0]=4 4899 B13R0.54 CC/C=C/CCCOCCCC(C)O 34a_100016287902_200000718107 [0,1,0,0,0,0|1,0,2]=4 4900 B13R0.54 CC/C=C/CCCOCCCC(C)O 7a_100016287902_200000718107 [0,1,0,0,0,0|1,0,2]=4 4901 B13R0.54 CC/C=C\CCCCCNCC(C)O 269862a_100000210904_100016288537 [0,1,0,0,0,0|1,0,2]=4 4902 B13R0.54 CC/C=C\CCCCCOCC(C)O 34a_100016268722_100011218427 [0,1,0,0,0,0|1,0,2]=4 4903 B13R0.54 CC/C=C\CCCCCOCC(C)O 7a_100016268722_100011218427 [0,1,0,0,0,0|1,0,2]=4 4904 B13R0.54 CC/C=C\CCCCCOC[C@@H](C)O 34a_100016268722_100009817552 [0,1,0,0,0,0|1,0,2]=4 4905 B13R0.54 CC/C=C\CCCCCOC[C@@H](C)O 7a_100016268722_100009817552 [0,1,0,0,0,0|1,0,2]=4 4906 B13R0.54 CC/C=C\CCCCOCCC(C)O 34a_100016287862_100012276601 [0,1,0,0,0,0|1,0,2]=4 4907 B13R0.54 CC/C=C\CCCCOCCC(C)O 7a_100016287862_100012276601 [0,1,0,0,0,0|1,0,2]=4 4908 B13R0.54 CCCC#CCCOCCCC(C)O 34a_100000042726_200000718107 [0,1,0,0,0,0|1,0,2]=4 4909 B13R0.54 CCCC#CCCOCCCC(C)O 7a_100000042726_200000718107 [0,1,0,0,0,0|1,0,2]=4 4910 B13R0.54 CCCC/C=C/COCCCC(C)O 34a_200016272032_200000718107 [0,1,0,0,0,0|1,0,2]=4 4911 B13R0.54 CCCC/C=C/COCCCC(C)O 7a_200016272032_200000718107 [0,1,0,0,0,0|1,0,2]=4 4912 B13R0.54 CCCC/C=C\CCOCCC(C)O 34a_200016286491_100012276601 [0,1,0,0,0,0|1,0,2]=4 4913 B13R0.54 CCCC/C=C\CCOCCC(C)O 7a_200016286491_100012276601 [0,1,0,0,0,0|1,0,2]=4 4914 B13R0.54 CCCCC#CCCCNCC(C)O 2230a_100000210904_200000047210 [0,1,0,0,0,0|1,0,2]=4 4915 B13R0.54 CCCCC#CCCCNCC(C)O 34a_100000210904_200000047210 [0,1,0,0,0,0|1,0,2]=4 4916 B13R0.54 CCCCC#CCCCSCC(C)O 62a_100011218427_200000047210 [0,1,0,0,0,0|1,0,2]=4 4917 B13R0.54 CCCCC#CCCCSCC(C)O 62a_200000047210_100011218427 [0,1,0,0,0,0|1,0,2]=4 4918 B13R0.54 CCCCC#CCCCSC[C@@H](C)O 62a_100009817552_200000047210 [0,1,0,0,0,0|1,0,2]=4 4919 B13R0.54 CCCCC#CCCCSC[C@@H](C)O 62a_200000047210_100009817552 [0,1,0,0,0,0|1,0,2]=4 4920 B13R0.54 CCCCC#CCCOCCC(C)O 34a_100000037610_100012276601 [0,1,0,0,0,0|1,0,2]=4 4921 B13R0.54 CCCCC#CCCOCCC(C)O 7a_100000037610_100012276601 [0,1,0,0,0,0|1,0,2]=4 4922 B13R0.54 CCCCC#CCOCCCC(C)O 34a_200000034558_200000718107 [0,1,0,0,0,0|1,0,2]=4 4923 B13R0.54 CCCCC#CCOCCCC(C)O 7a_200000034558_200000718107 [0,1,0,0,0,0|1,0,2]=4 4924 B13R0.54 CCCCC/C=C/COCCC(C)O 34a_100016258190_100012276601 [0,1,0,0,0,0|1,0,2]=4 4925 B13R0.54 CCCCC/C=C/COCCC(C)O 7a_100016258190_100012276601 [0,1,0,0,0,0|1,0,2]=4 4926 B13R0.54 CCCCC/C=C\CCOCC(C)O 34a_100016277358_100011218427 [0,1,0,0,0,0|1,0,2]=4 4927 B13R0.54 CCCCC/C=C\CCOCC(C)O 7a_100016277358_100011218427 [0,1,0,0,0,0|1,0,2]=4 4928 B13R0.54 CCCCC/C=C\CCOC[C@@H](C)O 34a_100016277358_100009817552 [0,1,0,0,0,0|1,0,2]=4 4929 B13R0.54 CCCCC/C=C\CCOC[C@@H](C)O 7a_100016277358_100009817552 [0,1,0,0,0,0|1,0,2]=4 4930 B13R0.54 CCCCCC#CCCOCC(C)O 34a_200000042877_100011218427 [0,1,0,0,0,0|1,0,2]=4 4931 B13R0.54 CCCCCC#CCCOCC(C)O 7a_200000042877_100011218427 [0,1,0,0,0,0|1,0,2]=4 4932 B13R0.54 CCCCCC#CCCOC[C@@H](C)O 34a_200000042877_100009817552 [0,1,0,0,0,0|1,0,2]=4 4933 B13R0.54 CCCCCC#CCCOC[C@@H](C)O 7a_200000042877_100009817552 [0,1,0,0,0,0|1,0,2]=4 4934 B13R0.54 CCCCCC#CCNCCC(C)O 2230a_200000755665_100009816472 [0,1,0,0,0,0|1,0,2]=4 4935 B13R0.54 CCCCCC#CCOCCC(C)O 34a_200000033628_100012276601 [0,1,0,0,0,0|1,0,2]=4 4936 B13R0.54 CCCCCC#CCOCCC(C)O 7a_200000033628_100012276601 [0,1,0,0,0,0|1,0,2]=4 4937 B13R0.54 CCCCCC#CCSCCC(C)O 62a_100009816472_100012276601 [0,1,0,0,0,0|1,0,2]=4 4938 B13R0.54 CCCCCC#CCSCCC(C)O 62a_100012276601_100009816472 [0,1,0,0,0,0|1,0,2]=4 4939 B13R0.54 CCCCCC/C=C/COCC(C)O 34a_200016276170_100011218427 [0,1,0,0,0,0|1,0,2]=4 4940 B13R0.54 CCCCCC/C=C/COCC(C)O 7a_200016276170_100011218427 [0,1,0,0,0,0|1,0,2]=4 4941 B13R0.54 CCCCCC/C=C/COC[C@@H](C)O 34a_200016276170_100009817552 [0,1,0,0,0,0|1,0,2]=4 4942 B13R0.54 CCCCCC/C=C/COC[C@@H](C)O 7a_200016276170_100009817552 [0,1,0,0,0,0|1,0,2]=4 4943 B13R0.54 CCCCCCC#CCOCC(C)O 34a_200000037284_100011218427 [0,1,0,0,0,0|1,0,2]=4 4944 B13R0.54 CCCCCCC#CCOCC(C)O 7a_200000037284_100011218427 [0,1,0,0,0,0|1,0,2]=4 4945 B13R0.54 CCCCCCC#CCOC[C@@H](C)O 34a_200000037284_100009817552 [0,1,0,0,0,0|1,0,2]=4 4946 B13R0.54 CCCCCCC#CCOC[C@@H](C)O 7a_200000037284_100009817552 [0,1,0,0,0,0|1,0,2]=4 4947 B13R0.54 CCCCCCCC=NNCC(C)O 4a_200000730056_100000210592 [0,1,0,0,0,0|2,0,1]=4 4948 B13R0.54 CCCCCCCCCCCC(=O)C 1458a_100000070787_100011215454 [0,1,0,0,0,0|0,0,2]=3 4949 B13R0.54 CCCCCCCCCCCC(=O)C 1458a_100000210736_200000210301 [0,1,0,0,0,0|0,0,2]=3 4950 B13R0.54 CCCCCCCCCCCC(=O)[13CH3] 1458a_100000210736_200025704644 [0,1,0,0,0,0|0,0,2]=3 4951 B13R0.54 CCCCCCCCCCCN(C)C 2230a_100102631434_100011215454 [0,1,0,0,0,0|2,0,0]=3 4952 B13R0.54 CCCCCCCCCCCN(C)C 269982a_100102631434_100011215454 [0,1,0,0,0,0|2,0,0]=3 4953 B13R0.54 CCCCCCCCCCNC(=O)C 11a_100000684558_100015343762 [0,1,0,0,0,0|1,0,2]=4 4954 B13R0.54 CCCCCCCCCCNC(=O)C 1626a_100000684558_100015343762 [0,1,0,0,0,0|1,0,2]=4 4955 B13R0.54 CCCCCCCCCCNC(=O)C 240690a_100000684558_100015343762 [0,1,0,0,0,0|1,0,2]=4 4956 B13R0.54 CCCCCCCCCCNC(=O)C 527a_100000684558_100103153847 [0,1,0,0,0,0|1,0,2]=4 4957 B13R0.54 CCCCCCCCCCNC(C)C 2230a_100000684558_100000210206 [0,1,0,0,0,0|2,0,0]=3 4958 B13R0.54 CCCCCCCCCCNC(C)C 2230a_100138425928_100000210320 [0,1,0,0,0,0|2,0,0]=3 4959 B13R0.54 CCCCCCCCCCNC(C)C 34a_100000684558_100000210206 [0,1,0,0,0,0|2,0,0]=3 4960 B13R0.54 CCCCCCCCCCNC(C)C 34a_100138425928_100000210320 [0,1,0,0,0,0|2,0,0]=3 4961 B13R0.54 CCCCCCCCCCOC(C)C 34a_100000210711_100000210206 [0,1,0,0,0,0|2,0,0]=3 4962 B13R0.54 CCCCCCCCCCOC(C)C 34a_100000212225_100000210320 [0,1,0,0,0,0|2,0,0]=3 4963 B13R0.54 CCCCCCCCCCOC(C)C 7a_100000210711_100000210206 [0,1,0,0,0,0|2,0,0]=3 4964 B13R0.54 CCCCCCCCCCSC(C)C 62a_100000210206_100000210320 [0,1,0,0,0,0|2,0,0]=3 4965 B13R0.54 CCCCCCCCCNCC(=O)N 2230a_100000212291_100000747473 [0,1,0,0,0,0|1,0,2]=4 4966 B13R0.54 CCCCCCCCCNCC(=O)N 2230a_100000711301_100011214924 [0,1,0,0,0,0|1,0,2]=4 4967 B13R0.54 CCCCCCCCCNCC(=O)N 34a_100000212291_100000187820 [0,1,0,0,0,0|1,0,2]=4 4968 B13R0.54 CCCCCCCCCNCC(=O)O 269956a_100016091260_100000210670 [0,1,0,0,0,0|1,0,1]=3 4969 B13R0.54 CCCCCCCCCNCC(=O)[O-] 34a_100000212291_100020667443 [0,1,0,0,0,0|1,0,2]=4 4970 B13R0.54 CCCCCCCCCNCC(C)C 2230a_100000210953_100011214924 [0,1,0,0,0,0|2,0,0]=3 4971 B13R0.54 CCCCCCCCCNCC(C)C 2230a_100000212291_100000210760 [0,1,0,0,0,0|2,0,0]=3 4972 B13R0.54 CCCCCCCCCNCC(C)C 270004a_100000212291_100000210432 [0,1,0,0,0,0|2,0,0]=3 4973 B13R0.54 CCCCCCCCCNCC(C)C 34a_100000210953_100011214924 [0,1,0,0,0,0|2,0,0]=3 4974 B13R0.54 CCCCCCCCCNCC(C)C 34a_100000212291_100000210624 [0,1,0,0,0,0|2,0,0]=3 4975 B13R0.54 CCCCCCCCCNCC(C)O 2230a_100000210904_100011214924 [0,1,0,0,0,0|1,0,0]=2 4976 B13R0.54 CCCCCCCCCNCC(C)O 2230a_100000212291_100011218427 [0,1,0,0,0,0|1,0,0]=2 4977 B13R0.54 CCCCCCCCCNCC(C)O 34a_100000210904_100011214924 [0,1,0,0,0,0|1,0,0]=2 4978 B13R0.54 CCCCCCCCCNCC(C)O 34a_100000212291_100011218427 [0,1,0,0,0,0|1,0,0]=2 4979 B13R0.54 CCCCCCCCCNCC(F)F 2230a_100000212291_100011934356 [0,1,0,0,0,0|2,0,0]=3 4980 B13R0.54 CCCCCCCCCNCC(F)F 34a_100000212291_100011934356 [0,1,0,0,0,0|2,0,0]=3 4981 B13R0.54 CCCCCCCCCNCC(F)F 34a_100000765723_100011214924 [0,1,0,0,0,0|2,0,0]=3 4982 B13R0.54 CCCCCCCCCNC[C@@H](C)O 2230a_100000212291_100009817552 [0,1,0,0,0,0|1,0,0]=2 4983 B13R0.54 CCCCCCCCCNC[C@@H](C)O 34a_100000212291_100009817552 [0,1,0,0,0,0|1,0,0]=2 4984 B13R0.54 CCCCCCCCCNC[N+](=O)[O-] 34a_100000212291_100000761209 [0,1,0,0,0,0|2,0,1]=4 4985 B13R0.54 CCCCCCCCCOCC(=O)C 34a_100000211253_100011214924 [0,1,0,0,0,0|1,0,2]=4 4986 B13R0.54 CCCCCCCCCOCC(=O)N 34a_100000210712_100000187820 [0,1,0,0,0,0|1,0,2]=4 4987 B13R0.54 CCCCCCCCCOCC(=O)N 7a_100000210712_100000187820 [0,1,0,0,0,0|1,0,2]=4 4988 B13R0.54 CCCCCCCCCOCC(=O)[O-] 34a_100000210712_100020667443 [0,1,0,0,0,0|1,0,2]=4 4989 B13R0.54 CCCCCCCCCOCC(C)Br 34a_100012180447_100011214924 [0,1,0,0,0,0|2,0,0]=3 4990 B13R0.54 CCCCCCCCCOCC(C)C 34a_100000210257_100011214924 [0,1,0,0,0,0|2,0,0]=3 4991 B13R0.54 CCCCCCCCCOCC(C)C 34a_100000210712_100000210624 [0,1,0,0,0,0|2,0,0]=3 4992 B13R0.54 CCCCCCCCCOCC(C)C 7a_100000210712_100000210760 [0,1,0,0,0,0|2,0,0]=3 4993 B13R0.54 CCCCCCCCCOCC(C)F 34a_100015925927_100011214924 [0,1,0,0,0,0|2,0,0]=3 4994 B13R0.54 CCCCCCCCCOCC(C)O 34a_100000210712_100011218427 [0,1,0,0,0,0|1,0,0]=2 4995 B13R0.54 CCCCCCCCCOCC(C)O 7a_100000210712_100011218427 [0,1,0,0,0,0|1,0,0]=2 4996 B13R0.54 CCCCCCCCCOCC(F)F 34a_100000210712_100011934356 [0,1,0,0,0,0|2,0,0]=3 4997 B13R0.54 CCCCCCCCCOCC(F)F 34a_100000743014_100011214924 [0,1,0,0,0,0|2,0,0]=3 4998 B13R0.54 CCCCCCCCCOCC(F)F 7a_100000210712_100011934356 [0,1,0,0,0,0|2,0,0]=3 4999 B13R0.54 CCCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100011214924 [0,1,0,0,0,0|2,0,0]=3 5000 B13R0.54 CCCCCCCCCOC[C@@H](C)N 34a_100000737577_100011214924 [0,1,0,0,0,0|2,0,0]=3 5001 B13R0.54 CCCCCCCCCOC[C@@H](C)O 34a_100000210712_100009817552 [0,1,0,0,0,0|1,0,0]=2 5002 B13R0.54 CCCCCCCCCOC[C@@H](C)O 7a_100000210712_100009817552 [0,1,0,0,0,0|1,0,0]=2 5003 B13R0.54 CCCCCCCCCOC[N+](=O)[O-] 34a_100000210712_100000761209 [0,1,0,0,0,0|2,0,1]=4 5004 B13R0.54 CCCCCCCCCSCC(=O)N 62a_100000747473_100000210670 [0,1,0,0,0,0|1,0,2]=4 5005 B13R0.54 CCCCCCCCCSCC(=O)[O-] 62a_100020667443_100000210670 [0,1,0,0,0,0|1,0,2]=4 5006 B13R0.54 CCCCCCCCCSCC(C)C 62a_100000210624_100000210670 [0,1,0,0,0,0|2,0,0]=3 5007 B13R0.54 CCCCCCCCCSCC(C)O 62a_100011218427_100000210670 [0,1,0,0,0,0|1,0,0]=2 5008 B13R0.54 CCCCCCCCCSCC(F)F 62a_100011934356_100000210670 [0,1,0,0,0,0|2,0,0]=3 5009 B13R0.54 CCCCCCCCCSC[C@@H](C)O 62a_100009817552_100000210670 [0,1,0,0,0,0|1,0,0]=2 5010 B13R0.54 CCCCCCCCNCCC(=O)N 2230a_100000229939_100000744528 [0,1,0,0,0,0|1,0,2]=4 5011 B13R0.54 CCCCCCCCNCCC(=O)N 34a_100000229939_100000731001 [0,1,0,0,0,0|1,0,2]=4 5012 B13R0.54 CCCCCCCCNCCC(C)C 2230a_100000229939_100000210312 [0,1,0,0,0,0|2,0,0]=3 5013 B13R0.54 CCCCCCCCNCCC(C)C 269862a_100000229939_100000185833 [0,1,0,0,0,0|2,0,0]=3 5014 B13R0.54 CCCCCCCCNCCC(C)C 34a_100000229939_100000210312 [0,1,0,0,0,0|2,0,0]=3 5015 B13R0.54 CCCCCCCCNCCC(C)O 2230a_100000229939_100012276601 [0,1,0,0,0,0|1,0,0]=2 5016 B13R0.54 CCCCCCCCNCCC(C)O 2230a_200000755665_100000210759 [0,1,0,0,0,0|1,0,0]=2 5017 B13R0.54 CCCCCCCCNCCC(C)O 34a_100000229939_100012276601 [0,1,0,0,0,0|1,0,0]=2 5018 B13R0.54 CCCCCCCCNCOC(C)C 2230a_100000229939_100000709892 [0,1,0,0,0,0|3,0,0]=4 5019 B13R0.54 CCCCCCCCNCOC(C)C 34a_100000229939_100000709892 [0,1,0,0,0,0|3,0,0]=4 5020 B13R0.54 CCCCCCCCNOCC(=O)O 269956a_100000106656_100000210759 [0,1,0,0,0,0|2,0,1]=4 5021 B13R0.54 CCCCCCCCOCCC(=O)C 34a_100000759926_100000210759 [0,1,0,0,0,0|1,0,2]=4 5022 B13R0.54 CCCCCCCCOCCC(=O)C 7a_100000210232_100000053229 [0,1,0,0,0,0|1,0,2]=4 5023 B13R0.54 CCCCCCCCOCCC(=O)C 7a_100000759926_100000210759 [0,1,0,0,0,0|1,0,2]=4 5024 B13R0.54 CCCCCCCCOCCC(=O)N 34a_100000210232_100000731001 [0,1,0,0,0,0|1,0,2]=4 5025 B13R0.54 CCCCCCCCOCCC(=O)N 34a_100000757172_100000210759 [0,1,0,0,0,0|1,0,2]=4 5026 B13R0.54 CCCCCCCCOCCC(=O)N 7a_100000210232_100000744528 [0,1,0,0,0,0|1,0,2]=4 5027 B13R0.54 CCCCCCCCOCCC(=O)N 7a_100000757172_100000210759 [0,1,0,0,0,0|1,0,2]=4 5028 B13R0.54 CCCCCCCCOCCC(C)Br 34a_100009893172_100000210759 [0,1,0,0,0,0|2,0,0]=3 5029 B13R0.54 CCCCCCCCOCCC(C)C 34a_100000210232_100000210312 [0,1,0,0,0,0|2,0,0]=3 5030 B13R0.54 CCCCCCCCOCCC(C)C 34a_100000210254_100000210759 [0,1,0,0,0,0|2,0,0]=3 5031 B13R0.54 CCCCCCCCOCCC(C)C 7a_100000210232_100000210626 [0,1,0,0,0,0|2,0,0]=3 5032 B13R0.54 CCCCCCCCOCCC(C)C 7a_100000210254_100000210759 [0,1,0,0,0,0|2,0,0]=3 5033 B13R0.54 CCCCCCCCOCCC(C)O 34a_100000210232_100012276601 [0,1,0,0,0,0|1,0,0]=2 5034 B13R0.54 CCCCCCCCOCCC(C)O 7a_100000210232_100012276601 [0,1,0,0,0,0|1,0,0]=2 5035 B13R0.54 CCCCCCCCOCCC(F)F 34a_100103093639_100000210759 [0,1,0,0,0,0|2,0,0]=3 5036 B13R0.54 CCCCCCCCOCCN(C)C 7a_100000210232_100000755713 [0,1,0,0,0,0|3,0,0]=4 5037 B13R0.54 CCCCCCCCOCC[C@@H](C)N 34a_100000706166_100000210759 [0,1,0,0,0,0|2,0,0]=3 5038 B13R0.54 CCCCCCCCOCOC(C)C 34a_100000210232_100000709892 [0,1,0,0,0,0|3,0,0]=4 5039 B13R0.54 CCCCCCCCSCCC(=O)C 62a_100000053229_100000210317 [0,1,0,0,0,0|1,0,2]=4 5040 B13R0.54 CCCCCCCCSCCC(=O)C 62a_100000210759_100000053229 [0,1,0,0,0,0|1,0,2]=4 5041 B13R0.54 CCCCCCCCSCCC(=O)N 62a_100000210759_100000744528 [0,1,0,0,0,0|1,0,2]=4 5042 B13R0.54 CCCCCCCCSCCC(=O)N 62a_100000744528_100000210317 [0,1,0,0,0,0|1,0,2]=4 5043 B13R0.54 CCCCCCCCSCCC(C)C 62a_100000210312_100000210317 [0,1,0,0,0,0|2,0,0]=3 5044 B13R0.54 CCCCCCCCSCCC(C)C 62a_100000210759_100000210312 [0,1,0,0,0,0|2,0,0]=3 5045 B13R0.54 CCCCCCCCSCCC(C)O 62a_100000210759_100012276601 [0,1,0,0,0,0|1,0,0]=2 5046 B13R0.54 CCCCCCCCSCCC(C)O 62a_100012276601_100000210317 [0,1,0,0,0,0|1,0,0]=2 5047 B13R0.54 CCCCCCCCSCCN(C)C 62a_100000210759_100000755713 [0,1,0,0,0,0|3,0,0]=4 5048 B13R0.54 CCCCCCCCSCOC(C)C 62a_100000210759_100000709892 [0,1,0,0,0,0|3,0,0]=4 5049 B13R0.54 CCCCCCCCSCOC(C)C 62a_100000709892_100000210317 [0,1,0,0,0,0|3,0,0]=4 5050 B13R0.54 CCCCCCCNCCCC(=O)N 34a_100000739312_100000210614 [0,1,0,0,0,0|1,0,2]=4 5051 B13R0.54 CCCCCCCNCCCC(C)C 2230a_100000229938_100011214892 [0,1,0,0,0,0|2,0,0]=3 5052 B13R0.54 CCCCCCCNCCCC(C)C 2230a_200000737386_100000210681 [0,1,0,0,0,0|2,0,0]=3 5053 B13R0.54 CCCCCCCNCCCC(C)C 34a_200000737386_100000210614 [0,1,0,0,0,0|2,0,0]=3 5054 B13R0.54 CCCCCCCNCCCC(C)O 2230a_100000229938_200000718107 [0,1,0,0,0,0|1,0,0]=2 5055 B13R0.54 CCCCCCCNCCCS(=O)C 2230a_200000753449_100000210681 [0,1,0,0,0,0|2,0,1]=4 5056 B13R0.54 CCCCCCCNCCOC(C)C 2230a_100000229938_100000211751 [0,1,0,0,0,0|3,0,0]=4 5057 B13R0.54 CCCCCCCNCCOC(C)C 2230a_100000701111_100000210681 [0,1,0,0,0,0|3,0,0]=4 5058 B13R0.54 CCCCCCCNCCOC(C)C 34a_100000701111_100000210614 [0,1,0,0,0,0|3,0,0]=4 5059 B13R0.54 CCCCCCCNCCSC(C)C 2230a_100000229938_100000730970 [0,1,0,0,0,0|3,0,0]=4 5060 B13R0.54 CCCCCCCNCCSC(C)C 2230a_100000731138_100000210681 [0,1,0,0,0,0|3,0,0]=4 5061 B13R0.54 CCCCCCCNCCSC(C)C 34a_100000731138_100000210614 [0,1,0,0,0,0|3,0,0]=4 5062 B13R0.54 CCCCCCCOCCCC(=O)C 34a_100000210272_100000685027 [0,1,0,0,0,0|1,0,2]=4 5063 B13R0.54 CCCCCCCOCCCC(=O)C 34a_100000759063_100000210614 [0,1,0,0,0,0|1,0,2]=4 5064 B13R0.54 CCCCCCCOCCCC(=O)C 7a_100000210272_100011215641 [0,1,0,0,0,0|1,0,2]=4 5065 B13R0.54 CCCCCCCOCCCC(=O)C 7a_100000759063_100000210614 [0,1,0,0,0,0|1,0,2]=4 5066 B13R0.54 CCCCCCCOCCCC(=O)N 34a_100000210272_100102525003 [0,1,0,0,0,0|1,0,2]=4 5067 B13R0.54 CCCCCCCOCCCC(=O)N 7a_100000210272_100102525003 [0,1,0,0,0,0|1,0,2]=4 5068 B13R0.54 CCCCCCCOCCCC(C)C 34a_100000210272_100011214892 [0,1,0,0,0,0|2,0,0]=3 5069 B13R0.54 CCCCCCCOCCCC(C)C 34a_100000210774_100000210614 [0,1,0,0,0,0|2,0,0]=3 5070 B13R0.54 CCCCCCCOCCCC(C)C 7a_100000210272_100011214892 [0,1,0,0,0,0|2,0,0]=3 5071 B13R0.54 CCCCCCCOCCCC(C)C 7a_100000210774_100000210614 [0,1,0,0,0,0|2,0,0]=3 5072 B13R0.54 CCCCCCCOCCCC(C)O 34a_100000210272_200000718107 [0,1,0,0,0,0|1,0,0]=2 5073 B13R0.54 CCCCCCCOCCCC(C)O 7a_100000210272_200000718107 [0,1,0,0,0,0|1,0,0]=2 5074 B13R0.54 CCCCCCCOCCCN(C)C 7a_100000210272_100000757444 [0,1,0,0,0,0|3,0,0]=4 5075 B13R0.54 CCCCCCCOCCC[N+](=O)[O-] 34a_200000037920_100000210614 [0,1,0,0,0,0|2,0,1]=4 5076 B13R0.54 CCCCCCCOCCNC(C)C 34a_100000224655_100000210614 [0,1,0,0,0,0|3,0,0]=4 5077 B13R0.54 CCCCCCCOCCOC(C)C 34a_100000210272_100000211751 [0,1,0,0,0,0|3,0,0]=4 5078 B13R0.54 CCCCCCCOCCOC(C)C 34a_100000211219_100000210614 [0,1,0,0,0,0|3,0,0]=4 5079 B13R0.54 CCCCCCCOCCOC(C)C 7a_100000210272_100000211751 [0,1,0,0,0,0|3,0,0]=4 5080 B13R0.54 CCCCCCCOCCOC(C)C 7a_100000211219_100000210614 [0,1,0,0,0,0|3,0,0]=4 5081 B13R0.54 CCCCCCCOCCSC(C)C 34a_100000210272_100000730970 [0,1,0,0,0,0|3,0,0]=4 5082 B13R0.54 CCCCCCCOCCSC(C)C 34a_200011212901_100000210614 [0,1,0,0,0,0|3,0,0]=4 5083 B13R0.54 CCCCCCCOCCSC(C)C 7a_100000210272_100000730970 [0,1,0,0,0,0|3,0,0]=4 5084 B13R0.54 CCCCCCCOCCSC(C)C 7a_200011212901_100000210614 [0,1,0,0,0,0|3,0,0]=4 5085 B13R0.54 CCCCCCCSCCCC(=O)C 62a_100000210614_100011215641 [0,1,0,0,0,0|1,0,2]=4 5086 B13R0.54 CCCCCCCSCCCC(=O)C 62a_100011215641_100000210316 [0,1,0,0,0,0|1,0,2]=4 5087 B13R0.54 CCCCCCCSCCCC(=O)N 62a_100000210614_100102525003 [0,1,0,0,0,0|1,0,2]=4 5088 B13R0.54 CCCCCCCSCCCC(=O)N 62a_100102525003_100000210316 [0,1,0,0,0,0|1,0,2]=4 5089 B13R0.54 CCCCCCCSCCCC(C)C 62a_100000210614_100011214892 [0,1,0,0,0,0|2,0,0]=3 5090 B13R0.54 CCCCCCCSCCCC(C)C 62a_100011214892_100000210316 [0,1,0,0,0,0|2,0,0]=3 5091 B13R0.54 CCCCCCCSCCCC(C)O 62a_100000210614_200000718107 [0,1,0,0,0,0|1,0,0]=2 5092 B13R0.54 CCCCCCCSCCCC(C)O 62a_200000718107_100000210316 [0,1,0,0,0,0|1,0,0]=2 5093 B13R0.54 CCCCCCCSCCCN(C)C 62a_100000210614_100000757444 [0,1,0,0,0,0|3,0,0]=4 5094 B13R0.54 CCCCCCCSCCOC(C)C 62a_100000210614_100000211751 [0,1,0,0,0,0|3,0,0]=4 5095 B13R0.54 CCCCCCCSCCOC(C)C 62a_100000211751_100000210316 [0,1,0,0,0,0|3,0,0]=4 5096 B13R0.54 CCCCCCCSCCSC(C)C 62a_100000210614_100000730970 [0,1,0,0,0,0|3,0,0]=4 5097 B13R0.54 CCCCCCCSCCSC(C)C 62a_100000730970_100000210316 [0,1,0,0,0,0|3,0,0]=4 5098 B13R0.54 CCCCCCNCCCCB(O)O 2230a_100000210581_200009817182 [0,1,0,0,0,0|2,0,0]=3 5099 B13R0.54 CCCCCCNCCCCC(=O)N 34a_100000696515_100000210314 [0,1,0,0,0,0|1,0,2]=4 5100 B13R0.54 CCCCCCNCCCCC(C)C 2230a_100000210581_100011216152 [0,1,0,0,0,0|2,0,0]=3 5101 B13R0.54 CCCCCCNCCCOC(C)C 2230a_100000737246_100000210314 [0,1,0,0,0,0|3,0,0]=4 5102 B13R0.54 CCCCCCNCCCOC(C)C 34a_100000737246_100000210314 [0,1,0,0,0,0|3,0,0]=4 5103 B13R0.54 CCCCCCNCCOCC(=O)O 269956a_100000700818_100000210757 [0,1,0,0,0,0|2,0,1]=4 5104 B13R0.54 CCCCCCNCCOCC(F)F 2230a_100000210581_200012177212 [0,1,0,0,0,0|3,0,0]=4 5105 B13R0.54 CCCCCCOCCCCB(O)O 34a_100000210259_200009817182 [0,1,0,0,0,0|2,0,0]=3 5106 B13R0.54 CCCCCCOCCCCB(O)O 7a_100000210259_200009817182 [0,1,0,0,0,0|2,0,0]=3 5107 B13R0.54 CCCCCCOCCCCC(=O)C 34a_100000210259_100009817362 [0,1,0,0,0,0|1,0,2]=4 5108 B13R0.54 CCCCCCOCCCCC(=O)C 7a_100000210259_100000735457 [0,1,0,0,0,0|1,0,2]=4 5109 B13R0.54 CCCCCCOCCCCC(=O)N 34a_100012022536_100000210314 [0,1,0,0,0,0|1,0,2]=4 5110 B13R0.54 CCCCCCOCCCCC(=O)N 7a_100012022536_100000210314 [0,1,0,0,0,0|1,0,2]=4 5111 B13R0.54 CCCCCCOCCCCC(C)C 34a_100000210259_100011216152 [0,1,0,0,0,0|2,0,0]=3 5112 B13R0.54 CCCCCCOCCCCC(C)C 34a_100011214890_100000210314 [0,1,0,0,0,0|2,0,0]=3 5113 B13R0.54 CCCCCCOCCCCC(C)C 7a_100000210259_100011216152 [0,1,0,0,0,0|2,0,0]=3 5114 B13R0.54 CCCCCCOCCCCC(C)C 7a_100011214890_100000210314 [0,1,0,0,0,0|2,0,0]=3 5115 B13R0.54 CCCCCCOCCCC[N+](=O)[O-] 34a_200015379883_100000210314 [0,1,0,0,0,0|2,0,1]=4 5116 B13R0.54 CCCCCCOCCCC[N+](=O)[O-] 7a_200015379883_100000210314 [0,1,0,0,0,0|2,0,1]=4 5117 B13R0.54 CCCCCCOCCCNC(C)C 34a_100000182298_100000210314 [0,1,0,0,0,0|3,0,0]=4 5118 B13R0.54 CCCCCCOCCNCC(C)C 34a_100015185251_100000210314 [0,1,0,0,0,0|3,0,0]=4 5119 B13R0.54 CCCCCCOCCOCC(C)C 34a_100000691444_100000210624 [0,1,0,0,0,0|3,0,0]=4 5120 B13R0.54 CCCCCCOCCOCC(C)C 34a_100000703358_100000210314 [0,1,0,0,0,0|3,0,0]=4 5121 B13R0.54 CCCCCCOCCOCC(C)C 7a_100000691444_100000210760 [0,1,0,0,0,0|3,0,0]=4 5122 B13R0.54 CCCCCCOCCOCC(C)C 7a_100000703358_100000210314 [0,1,0,0,0,0|3,0,0]=4 5123 B13R0.54 CCCCCCOCCOCC(C)O 34a_100000691444_100011218427 [0,1,0,0,0,0|2,0,0]=3 5124 B13R0.54 CCCCCCOCCOCC(C)O 7a_100000691444_100011218427 [0,1,0,0,0,0|2,0,0]=3 5125 B13R0.54 CCCCCCOCCOCC(F)F 34a_100000210259_200012177212 [0,1,0,0,0,0|3,0,0]=4 5126 B13R0.54 CCCCCCOCCOCC(F)F 34a_100000691444_100011934356 [0,1,0,0,0,0|3,0,0]=4 5127 B13R0.54 CCCCCCOCCOCC(F)F 34a_100000704375_100000210314 [0,1,0,0,0,0|3,0,0]=4 5128 B13R0.54 CCCCCCOCCOCC(F)F 7a_100000210259_200012177212 [0,1,0,0,0,0|3,0,0]=4 5129 B13R0.54 CCCCCCOCCOCC(F)F 7a_100000691444_100011934356 [0,1,0,0,0,0|3,0,0]=4 5130 B13R0.54 CCCCCCOCCOCC(F)F 7a_100000704375_100000210314 [0,1,0,0,0,0|3,0,0]=4 5131 B13R0.54 CCCCCCOCCOC[C@@H](C)O 34a_100000691444_100009817552 [0,1,0,0,0,0|2,0,0]=3 5132 B13R0.54 CCCCCCOCCOC[C@@H](C)O 7a_100000691444_100009817552 [0,1,0,0,0,0|2,0,0]=3 5133 B13R0.54 CCCCCCOCCSCC(C)C 34a_200000230437_100000210314 [0,1,0,0,0,0|3,0,0]=4 5134 B13R0.54 CCCCCCOCCSCC(C)C 7a_200000230437_100000210314 [0,1,0,0,0,0|3,0,0]=4 5135 B13R0.54 CCCCCCSCCCCB(O)O 62a_100000210314_200009817182 [0,1,0,0,0,0|2,0,0]=3 5136 B13R0.54 CCCCCCSCCCCB(O)O 62a_200009817182_100000210757 [0,1,0,0,0,0|2,0,0]=3 5137 B13R0.54 CCCCCCSCCCCC(=O)C 62a_100000210314_100000735457 [0,1,0,0,0,0|1,0,2]=4 5138 B13R0.54 CCCCCCSCCCCC(=O)C 62a_100000735457_100000210757 [0,1,0,0,0,0|1,0,2]=4 5139 B13R0.54 CCCCCCSCCCCC(C)C 62a_100000210314_100011216152 [0,1,0,0,0,0|2,0,0]=3 5140 B13R0.54 CCCCCCSCCCCC(C)C 62a_100011216152_100000210757 [0,1,0,0,0,0|2,0,0]=3 5141 B13R0.54 CCCCCCSCCCCN(C)C 62a_100000210314_100000690147 [0,1,0,0,0,0|3,0,0]=4 5142 B13R0.54 CCCCCCSCCOCC(F)F 62a_100000210314_200012177212 [0,1,0,0,0,0|3,0,0]=4 5143 B13R0.54 CCCCCCSCCOCC(F)F 62a_200012177212_100000210757 [0,1,0,0,0,0|3,0,0]=4 5144 B13R0.54 CCCCCNCCCCCB(O)O 2230a_100000209983_200009817188 [0,1,0,0,0,0|2,0,0]=3 5145 B13R0.54 CCCCCNCCCCCC(=O)N 2230a_100000209983_100009817443 [0,1,0,0,0,0|1,0,2]=4 5146 B13R0.54 CCCCCNCCCCCC(C)C 2230a_100000209983_100000210682 [0,1,0,0,0,0|2,0,0]=3 5147 B13R0.54 CCCCCNCCCCCC(C)C 2230a_100011290863_100000210326 [0,1,0,0,0,0|2,0,0]=3 5148 B13R0.54 CCCCCNCCCCCC(C)C 34a_100011290863_100000718602 [0,1,0,0,0,0|2,0,0]=3 5149 B13R0.54 CCCCCNCCCOCC(C)C 2230a_100000205972_100000210326 [0,1,0,0,0,0|3,0,0]=4 5150 B13R0.54 CCCCCNCCCOCC(C)C 34a_100000205972_100000718602 [0,1,0,0,0,0|3,0,0]=4 5151 B13R0.54 CCCCCNCCOCCC(C)C 34a_100000224656_100000210312 [0,1,0,0,0,0|3,0,0]=4 5152 B13R0.54 CCCCCNCCOCCC(C)O 34a_100000224656_100012276601 [0,1,0,0,0,0|2,0,0]=3 5153 B13R0.54 CCCCCOCCCCCB(O)O 34a_100000210253_200009817188 [0,1,0,0,0,0|2,0,0]=3 5154 B13R0.54 CCCCCOCCCCCB(O)O 7a_100000210253_200009817188 [0,1,0,0,0,0|2,0,0]=3 5155 B13R0.54 CCCCCOCCCCCC(=O)N 34a_100000123541_100000718602 [0,1,0,0,0,0|1,0,2]=4 5156 B13R0.54 CCCCCOCCCCCC(=O)N 34a_100000210253_100009817443 [0,1,0,0,0,0|1,0,2]=4 5157 B13R0.54 CCCCCOCCCCCC(=O)N 7a_100000123541_100000210326 [0,1,0,0,0,0|1,0,2]=4 5158 B13R0.54 CCCCCOCCCCCC(=O)N 7a_100000210253_100009817443 [0,1,0,0,0,0|1,0,2]=4 5159 B13R0.54 CCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210326 [0,1,0,0,0,0|1,0,2]=4 5160 B13R0.54 CCCCCOCCCCCC(C)C 34a_100000210253_100000210682 [0,1,0,0,0,0|2,0,0]=3 5161 B13R0.54 CCCCCOCCCCCC(C)C 34a_100011995859_100000718602 [0,1,0,0,0,0|2,0,0]=3 5162 B13R0.54 CCCCCOCCCCCC(C)C 7a_100000210253_100000210682 [0,1,0,0,0,0|2,0,0]=3 5163 B13R0.54 CCCCCOCCCCCC(C)C 7a_100011995859_100000210326 [0,1,0,0,0,0|2,0,0]=3 5164 B13R0.54 CCCCCOCCCCNC(C)C 34a_100011521146_100000718602 [0,1,0,0,0,0|3,0,0]=4 5165 B13R0.54 CCCCCOCCOCCC(C)C 34a_100011215259_100000210312 [0,1,0,0,0,0|3,0,0]=4 5166 B13R0.54 CCCCCOCCOCCC(C)C 7a_100011215259_100000210626 [0,1,0,0,0,0|3,0,0]=4 5167 B13R0.54 CCCCCOCCOCCC(C)O 34a_100011215259_100012276601 [0,1,0,0,0,0|2,0,0]=3 5168 B13R0.54 CCCCCOCCOCCC(C)O 7a_100011215259_100012276601 [0,1,0,0,0,0|2,0,0]=3 5169 B13R0.54 CCCCCSCCCCCB(O)O 62a_100000210326_200009817188 [0,1,0,0,0,0|2,0,0]=3 5170 B13R0.54 CCCCCSCCCCCB(O)O 62a_200009817188_100000210326 [0,1,0,0,0,0|2,0,0]=3 5171 B13R0.54 CCCCCSCCCCCC(=O)N 62a_100000210326_100009817443 [0,1,0,0,0,0|1,0,2]=4 5172 B13R0.54 CCCCCSCCCCCC(=O)N 62a_100009817443_100000210326 [0,1,0,0,0,0|1,0,2]=4 5173 B13R0.54 CCCCCSCCCCCC(C)C 62a_100000210326_100000210682 [0,1,0,0,0,0|2,0,0]=3 5174 B13R0.54 CCCCCSCCCCCC(C)C 62a_100000210682_100000210326 [0,1,0,0,0,0|2,0,0]=3 5175 B13R0.54 CCCCNCCCCCCB(O)O 2230a_100000102301_100009817187 [0,1,0,0,0,0|2,0,0]=3 5176 B13R0.54 CCCCNCCCCCCB(O)O 7a_106832991798_100009817187 [0,1,0,0,0,0|2,0,0]=3 5177 B13R0.54 CCCCNCCCCCCC(C)C 2230a_100000211014_100000210211 [0,1,0,0,0,0|2,0,0]=3 5178 B13R0.54 CCCCNCCCCCCC(C)C 34a_100000211014_100000210210 [0,1,0,0,0,0|2,0,0]=3 5179 B13R0.54 CCCCNCCCCOCC(C)C 34a_200011216965_100000210624 [0,1,0,0,0,0|3,0,0]=4 5180 B13R0.54 CCCCNCCCCOCC(C)O 34a_200011216965_100011218427 [0,1,0,0,0,0|2,0,0]=3 5181 B13R0.54 CCCCNCCCCOCC(F)F 34a_200011216965_100011934356 [0,1,0,0,0,0|3,0,0]=4 5182 B13R0.54 CCCCNCCCCOC[C@@H](C)O 34a_200011216965_100009817552 [0,1,0,0,0,0|2,0,0]=3 5183 B13R0.54 CCCCOCCCCCCB(O)O 34a_100000210227_100009817187 [0,1,0,0,0,0|2,0,0]=3 5184 B13R0.54 CCCCOCCCCCCB(O)O 7a_100000210227_100009817187 [0,1,0,0,0,0|2,0,0]=3 5185 B13R0.54 CCCCOCCCCCNC(C)C 34a_100011629493_100000210210 [0,1,0,0,0,0|3,0,0]=4 5186 B13R0.54 CCCCOCCCCOCC(C)C 34a_200000760531_100000210624 [0,1,0,0,0,0|3,0,0]=4 5187 B13R0.54 CCCCOCCCCOCC(C)C 7a_200000760531_100000210760 [0,1,0,0,0,0|3,0,0]=4 5188 B13R0.54 CCCCOCCCCOCC(C)O 34a_200000760531_100011218427 [0,1,0,0,0,0|2,0,0]=3 5189 B13R0.54 CCCCOCCCCOCC(C)O 7a_200000760531_100011218427 [0,1,0,0,0,0|2,0,0]=3 5190 B13R0.54 CCCCOCCCCOCC(F)F 34a_200000760531_100011934356 [0,1,0,0,0,0|3,0,0]=4 5191 B13R0.54 CCCCOCCCCOCC(F)F 7a_200000760531_100011934356 [0,1,0,0,0,0|3,0,0]=4 5192 B13R0.54 CCCCOCCCCOC[C@@H](C)O 34a_200000760531_100009817552 [0,1,0,0,0,0|2,0,0]=3 5193 B13R0.54 CCCCOCCCCOC[C@@H](C)O 7a_200000760531_100009817552 [0,1,0,0,0,0|2,0,0]=3 5194 B13R0.54 CCCCOCCCNCCC(C)C 2230a_200000211371_100000210312 [0,1,0,0,0,0|3,0,0]=4 5195 B13R0.54 CCCCOCCCNCCC(C)C 269862a_200000211371_100000185833 [0,1,0,0,0,0|3,0,0]=4 5196 B13R0.54 CCCCOCCCNCCC(C)C 34a_200000211371_100000210312 [0,1,0,0,0,0|3,0,0]=4 5197 B13R0.54 CCCCOCCCNCCC(C)O 2230a_200000211371_100012276601 [0,1,0,0,0,0|2,0,0]=3 5198 B13R0.54 CCCCOCCCNCCC(C)O 34a_200000211371_100012276601 [0,1,0,0,0,0|2,0,0]=3 5199 B13R0.54 CCCCOCCCOCCC(C)C 34a_200011215613_100000210312 [0,1,0,0,0,0|3,0,0]=4 5200 B13R0.54 CCCCOCCCOCCC(C)C 7a_200011215613_100000210626 [0,1,0,0,0,0|3,0,0]=4 5201 B13R0.54 CCCCOCCCOCCC(C)O 34a_200011215613_100012276601 [0,1,0,0,0,0|2,0,0]=3 5202 B13R0.54 CCCCOCCCOCCC(C)O 7a_200011215613_100012276601 [0,1,0,0,0,0|2,0,0]=3 5203 B13R0.54 CCCCOCCNCCCC(C)C 2230a_200000737386_100000743108 [0,1,0,0,0,0|3,0,0]=4 5204 B13R0.54 CCCCOCCNCCCC(C)C 34a_200000737386_100000743108 [0,1,0,0,0,0|3,0,0]=4 5205 B13R0.54 CCCCOCCOCCCC(C)C 34a_100000210238_100011214892 [0,1,0,0,0,0|3,0,0]=4 5206 B13R0.54 CCCCOCCOCCCC(C)C 34a_100000210774_100000743108 [0,1,0,0,0,0|3,0,0]=4 5207 B13R0.54 CCCCOCCOCCCC(C)C 7a_100000210238_100011214892 [0,1,0,0,0,0|3,0,0]=4 5208 B13R0.54 CCCCOCCOCCCC(C)C 7a_100000210774_100000743108 [0,1,0,0,0,0|3,0,0]=4 5209 B13R0.54 CCCCOCCOCCCC(C)O 34a_100000210238_200000718107 [0,1,0,0,0,0|2,0,0]=3 5210 B13R0.54 CCCCOCCOCCCC(C)O 7a_100000210238_200000718107 [0,1,0,0,0,0|2,0,0]=3 5211 B13R0.54 CCCCOCCSCCCC(C)C 62a_100000743108_100011214892 [0,1,0,0,0,0|3,0,0]=4 5212 B13R0.54 CCCCOCCSCCCC(C)C 62a_100011214892_100000743108 [0,1,0,0,0,0|3,0,0]=4 5213 B13R0.54 CCCCOCCSCCCC(C)O 62a_100000743108_200000718107 [0,1,0,0,0,0|2,0,0]=3 5214 B13R0.54 CCCCOCCSCCCC(C)O 62a_200000718107_100000743108 [0,1,0,0,0,0|2,0,0]=3 5215 B13R0.54 CCCCOCOCCCCC(C)C 34a_100011214890_100011995733 [0,1,0,0,0,0|3,0,0]=4 5216 B13R0.54 CCCCOCSCCCCB(O)O 62a_100011995733_200009817182 [0,1,0,0,0,0|3,0,0]=4 5217 B13R0.54 CCCCOCSCCCCB(O)O 62a_200009817182_100011995733 [0,1,0,0,0,0|3,0,0]=4 5218 B13R0.54 CCCCOCSCCCCC(C)C 62a_100011216152_100011995733 [0,1,0,0,0,0|3,0,0]=4 5219 B13R0.54 CCCCOCSCCCCC(C)C 62a_100011995733_100011216152 [0,1,0,0,0,0|3,0,0]=4 5220 B13R0.54 CCCCSCCCCCCB(O)O 62a_100000210211_100009817187 [0,1,0,0,0,0|2,0,0]=3 5221 B13R0.54 CCCCSCCCCCCB(O)O 62a_100009817187_100000210210 [0,1,0,0,0,0|2,0,0]=3 5222 B13R0.54 CCCCSCCNCCCC(C)C 2230a_100025743550_100011214892 [0,1,0,0,0,0|3,0,0]=4 5223 B13R0.54 CCCCSCCNCCCC(C)O 2230a_100025743550_200000718107 [0,1,0,0,0,0|2,0,0]=3 5224 B13R0.54 CCCCSCCOCCCC(C)C 34a_200000230436_100011214892 [0,1,0,0,0,0|3,0,0]=4 5225 B13R0.54 CCCCSCCOCCCC(C)C 7a_200000230436_100011214892 [0,1,0,0,0,0|3,0,0]=4 5226 B13R0.54 CCCCSCCOCCCC(C)O 34a_200000230436_200000718107 [0,1,0,0,0,0|2,0,0]=3 5227 B13R0.54 CCCCSCCOCCCC(C)O 7a_200000230436_200000718107 [0,1,0,0,0,0|2,0,0]=3 5228 B13R0.54 CCCOCCCCCCCC(C)C 34a_200000210741_100000210303 [0,1,0,0,0,0|2,0,0]=3 5229 B13R0.54 CCCOCCCCCCCC(C)C 7a_200000210741_100000210303 [0,1,0,0,0,0|2,0,0]=3 5230 B13R0.54 CCCOCCCNCCCC(C)C 2230a_100011217757_100011214892 [0,1,0,0,0,0|3,0,0]=4 5231 B13R0.54 CCCOCCCNCCCC(C)C 34a_100011217757_100011214892 [0,1,0,0,0,0|3,0,0]=4 5232 B13R0.54 CCCOCCCNCCCC(C)O 2230a_100011217757_200000718107 [0,1,0,0,0,0|2,0,0]=3 5233 B13R0.54 CCCOCCCNCCCC(C)O 34a_100011217757_200000718107 [0,1,0,0,0,0|2,0,0]=3 5234 B13R0.54 CCCOCCNCCCCB(O)O 2230a_100161115042_200009817182 [0,1,0,0,0,0|3,0,0]=4 5235 B13R0.54 CCCOCCNCCCCB(O)O 34a_100161115042_200009817182 [0,1,0,0,0,0|3,0,0]=4 5236 B13R0.54 CCCOCCNCCCCC(C)C 2230a_100161115042_100011216152 [0,1,0,0,0,0|3,0,0]=4 5237 B13R0.54 CCCOCCNCCCCC(C)C 34a_100161115042_100011216152 [0,1,0,0,0,0|3,0,0]=4 5238 B13R0.54 CCCOCCOCCCCB(O)O 34a_100000752267_200009817182 [0,1,0,0,0,0|3,0,0]=4 5239 B13R0.54 CCCOCCOCCCCB(O)O 7a_100000752267_200009817182 [0,1,0,0,0,0|3,0,0]=4 5240 B13R0.54 CCCOCCOCCCCC(C)C 34a_100000752267_100011216152 [0,1,0,0,0,0|3,0,0]=4 5241 B13R0.54 CCCOCCOCCCCC(C)C 34a_100011214890_100011215938 [0,1,0,0,0,0|3,0,0]=4 5242 B13R0.54 CCCOCCOCCCCC(C)C 7a_100000752267_100011216152 [0,1,0,0,0,0|3,0,0]=4 5243 B13R0.54 CCCOCCOCCCCC(C)C 7a_100011214890_100011215938 [0,1,0,0,0,0|3,0,0]=4 5244 B13R0.54 CCCOCCOCCNCC(C)O 2230a_200011904461_100011218427 [0,1,0,0,0,0|3,0,0]=4 5245 B13R0.54 CCCOCCOCCNCC(C)O 34a_200011904461_100011218427 [0,1,0,0,0,0|3,0,0]=4 5246 B13R0.54 CCCOCCOCCNC[C@@H](C)O 2230a_200011904461_100009817552 [0,1,0,0,0,0|3,0,0]=4 5247 B13R0.54 CCCOCCOCCNC[C@@H](C)O 34a_200011904461_100009817552 [0,1,0,0,0,0|3,0,0]=4 5248 B13R0.54 CCCOCCSCCCCB(O)O 62a_100011215938_200009817182 [0,1,0,0,0,0|3,0,0]=4 5249 B13R0.54 CCCOCCSCCCCB(O)O 62a_200009817182_100011215938 [0,1,0,0,0,0|3,0,0]=4 5250 B13R0.54 CCCOCCSCCCCC(C)C 62a_100011215938_100011216152 [0,1,0,0,0,0|3,0,0]=4 5251 B13R0.54 CCCOCCSCCCCC(C)C 62a_100011216152_100011215938 [0,1,0,0,0,0|3,0,0]=4 5252 B13R0.54 CCCSCCNCCCCB(O)O 2230a_100020603323_200009817182 [0,1,0,0,0,0|3,0,0]=4 5253 B13R0.54 CCCSCCNCCCCC(C)C 2230a_100020603323_100011216152 [0,1,0,0,0,0|3,0,0]=4 5254 B13R0.54 CCCSCCOCCCCB(O)O 34a_200000230433_200009817182 [0,1,0,0,0,0|3,0,0]=4 5255 B13R0.54 CCCSCCOCCCCB(O)O 7a_200000230433_200009817182 [0,1,0,0,0,0|3,0,0]=4 5256 B13R0.54 CCCSCCOCCCCC(C)C 34a_200000230433_100011216152 [0,1,0,0,0,0|3,0,0]=4 5257 B13R0.54 CCCSCCOCCCCC(C)C 7a_200000230433_100011216152 [0,1,0,0,0,0|3,0,0]=4 5258 B13R0.54 CCOCCCNCCCCB(O)O 2230a_100000210961_200009817182 [0,1,0,0,0,0|3,0,0]=4 5259 B13R0.54 CCOCCCNCCCCB(O)O 34a_100000210961_200009817182 [0,1,0,0,0,0|3,0,0]=4 5260 B13R0.54 CCOCCCNCCCCC(C)C 2230a_100000210961_100011216152 [0,1,0,0,0,0|3,0,0]=4 5261 B13R0.54 CCOCCCNCCCCC(C)C 34a_100000210961_100011216152 [0,1,0,0,0,0|3,0,0]=4 5262 B13R0.54 CCOCCCOCCCCB(O)O 34a_100000757476_200009817182 [0,1,0,0,0,0|3,0,0]=4 5263 B13R0.54 CCOCCCOCCCCB(O)O 7a_100000757476_200009817182 [0,1,0,0,0,0|3,0,0]=4 5264 B13R0.54 CCOCCCOCCCCC(C)C 34a_100000757476_100011216152 [0,1,0,0,0,0|3,0,0]=4 5265 B13R0.54 CCOCCCOCCCCC(C)C 34a_100011214890_100012232248 [0,1,0,0,0,0|3,0,0]=4 5266 B13R0.54 CCOCCCOCCCCC(C)C 7a_100000757476_100011216152 [0,1,0,0,0,0|3,0,0]=4 5267 B13R0.54 CCOCCCOCCCCC(C)C 7a_100011214890_100012232248 [0,1,0,0,0,0|3,0,0]=4 5268 B13R0.54 CCOCCCSCCCCB(O)O 62a_100012232248_200009817182 [0,1,0,0,0,0|3,0,0]=4 5269 B13R0.54 CCOCCCSCCCCB(O)O 62a_200009817182_100012232248 [0,1,0,0,0,0|3,0,0]=4 5270 B13R0.54 CCOCCCSCCCCC(C)C 62a_100011216152_100012232248 [0,1,0,0,0,0|3,0,0]=4 5271 B13R0.54 CCOCCCSCCCCC(C)C 62a_100012232248_100011216152 [0,1,0,0,0,0|3,0,0]=4 5272 B13R0.54 CCOCCNCCCCCB(O)O 2230a_102516460346_200009817188 [0,1,0,0,0,0|3,0,0]=4 5273 B13R0.54 CCOCCNCCCCCB(O)O 34a_102516460346_200009817188 [0,1,0,0,0,0|3,0,0]=4 5274 B13R0.54 CCOCCNCCCCCC(C)C 2230a_100011290863_100011215890 [0,1,0,0,0,0|3,0,0]=4 5275 B13R0.54 CCOCCNCCCCCC(C)C 2230a_102516460346_100000210682 [0,1,0,0,0,0|3,0,0]=4 5276 B13R0.54 CCOCCNCCCCCC(C)C 34a_100011290863_100000210147 [0,1,0,0,0,0|3,0,0]=4 5277 B13R0.54 CCOCCNCCCCCC(C)C 34a_102516460346_100000210682 [0,1,0,0,0,0|3,0,0]=4 5278 B13R0.54 CCOCCOCCCCCB(O)O 34a_100000210136_200009817188 [0,1,0,0,0,0|3,0,0]=4 5279 B13R0.54 CCOCCOCCCCCB(O)O 7a_100000210136_200009817188 [0,1,0,0,0,0|3,0,0]=4 5280 B13R0.54 CCOCCOCCCCCC(C)C 34a_100000210136_100000210682 [0,1,0,0,0,0|3,0,0]=4 5281 B13R0.54 CCOCCOCCCCCC(C)C 34a_100011995859_100000210147 [0,1,0,0,0,0|3,0,0]=4 5282 B13R0.54 CCOCCOCCCCCC(C)C 7a_100000210136_100000210682 [0,1,0,0,0,0|3,0,0]=4 5283 B13R0.54 CCOCCOCCCCCC(C)C 7a_100011995859_100011215890 [0,1,0,0,0,0|3,0,0]=4 5284 B13R0.54 CCOCCOCCNCCC(C)O 2230a_100102712874_100012276601 [0,1,0,0,0,0|3,0,0]=4 5285 B13R0.54 CCOCCOCCNCCC(C)O 2230a_200000755665_100011211534 [0,1,0,0,0,0|3,0,0]=4 5286 B13R0.54 CCOCCOCCNCCC(C)O 34a_100102712874_100012276601 [0,1,0,0,0,0|3,0,0]=4 5287 B13R0.54 CCOCCOCCOCCC(C)O 34a_100000210240_100012276601 [0,1,0,0,0,0|3,0,0]=4 5288 B13R0.54 CCOCCOCCOCCC(C)O 7a_100000210240_100012276601 [0,1,0,0,0,0|3,0,0]=4 5289 B13R0.54 CCOCCOCCSCCC(C)O 62a_100011211534_100012276601 [0,1,0,0,0,0|3,0,0]=4 5290 B13R0.54 CCOCCOCCSCCC(C)O 62a_100012276601_100011211534 [0,1,0,0,0,0|3,0,0]=4 5291 B13R0.54 CCOCCSCCCCCB(O)O 62a_100000210147_200009817188 [0,1,0,0,0,0|3,0,0]=4 5292 B13R0.54 CCOCCSCCCCCB(O)O 62a_200009817188_100011215890 [0,1,0,0,0,0|3,0,0]=4 5293 B13R0.54 CCOCCSCCCCCC(C)C 62a_100000210147_100000210682 [0,1,0,0,0,0|3,0,0]=4 5294 B13R0.54 CCOCCSCCCCCC(C)C 62a_100000210682_100011215890 [0,1,0,0,0,0|3,0,0]=4 5295 B13R0.54 CCOCSCCCCCCB(O)O 62a_100000739092_100009817187 [0,1,0,0,0,0|3,0,0]=4 5296 B13R0.54 CCOCSCCCCCCB(O)O 62a_100009817187_100000739092 [0,1,0,0,0,0|3,0,0]=4 5297 B13R0.54 CCSCCCOCCCCB(O)O 34a_100011216438_200009817182 [0,1,0,0,0,0|3,0,0]=4 5298 B13R0.54 CCSCCCOCCCCB(O)O 7a_100011216438_200009817182 [0,1,0,0,0,0|3,0,0]=4 5299 B13R0.54 CCSCCCOCCCCC(C)C 34a_100011216438_100011216152 [0,1,0,0,0,0|3,0,0]=4 5300 B13R0.54 CCSCCCOCCCCC(C)C 7a_100011216438_100011216152 [0,1,0,0,0,0|3,0,0]=4 5301 B13R0.54 CCSCCNCCCCCB(O)O 2230a_100000106463_200009817188 [0,1,0,0,0,0|3,0,0]=4 5302 B13R0.54 CCSCCNCCCCCC(C)C 2230a_100000106463_100000210682 [0,1,0,0,0,0|3,0,0]=4 5303 B13R0.54 CCSCCNCCCCCC(C)C 2230a_100011290863_100000757381 [0,1,0,0,0,0|3,0,0]=4 5304 B13R0.54 CCSCCNCCCCCC(C)C 34a_100011290863_100000757381 [0,1,0,0,0,0|3,0,0]=4 5305 B13R0.54 CCSCCOCCCCCB(O)O 34a_100000212035_200009817188 [0,1,0,0,0,0|3,0,0]=4 5306 B13R0.54 CCSCCOCCCCCB(O)O 7a_100000212035_200009817188 [0,1,0,0,0,0|3,0,0]=4 5307 B13R0.54 CCSCCOCCCCCC(C)C 34a_100000212035_100000210682 [0,1,0,0,0,0|3,0,0]=4 5308 B13R0.54 CCSCCOCCCCCC(C)C 34a_100011995859_100000757381 [0,1,0,0,0,0|3,0,0]=4 5309 B13R0.54 CCSCCOCCCCCC(C)C 7a_100000212035_100000210682 [0,1,0,0,0,0|3,0,0]=4 5310 B13R0.54 CCSCCOCCCCCC(C)C 7a_100011995859_100000757381 [0,1,0,0,0,0|3,0,0]=4 5311 B13R0.54 CCSCCSCCCCCB(O)O 62a_100000757381_200009817188 [0,1,0,0,0,0|3,0,0]=4 5312 B13R0.54 CCSCCSCCCCCB(O)O 62a_200009817188_100000757381 [0,1,0,0,0,0|3,0,0]=4 5313 B13R0.54 CCSCCSCCCCCC(C)C 62a_100000210682_100000757381 [0,1,0,0,0,0|3,0,0]=4 5314 B13R0.54 CCSCCSCCCCCC(C)C 62a_100000757381_100000210682 [0,1,0,0,0,0|3,0,0]=4 5315 B13R0.54 CN(C)CCCCCCCCCCO 2230a_100102631434_100009813290 [0,1,0,0,0,0|1,0,0]=2 5316 B13R0.54 CN(C)CCCCCCCCCCO 269982a_100102631434_100009813290 [0,1,0,0,0,0|1,0,0]=2 5317 B13R0.54 CN(C)CCCCSCCCCCF 62a_100000729378_100000690147 [0,1,0,0,0,0|3,0,0]=4 5318 B13R0.54 CN(C)CCCCSCCCCCO 62a_100000746330_100000690147 [0,1,0,0,0,0|2,0,0]=3 5319 B13R0.54 CN(C)CCCCSCCOCCO 62a_100011215305_100000690147 [0,1,0,0,0,0|3,0,0]=4 5320 B13R0.54 CN(C)CCCOCCCCCCBr 7a_100011215345_100000757444 [0,1,0,0,0,0|3,0,0]=4 5321 B13R0.54 CN(C)CCCOCCCCCCCl 7a_100000766143_100000757444 [0,1,0,0,0,0|3,0,0]=4 5322 B13R0.54 CN(C)CCCOCCCCCCF 7a_100000732779_100000757444 [0,1,0,0,0,0|3,0,0]=4 5323 B13R0.54 CN(C)CCCSCCCCCCF 62a_100015922095_100000757444 [0,1,0,0,0,0|3,0,0]=4 5324 B13R0.54 CN(C)CCCSCCCCCCO 62a_100000766143_100000757444 [0,1,0,0,0,0|2,0,0]=3 5325 B13R0.54 CN(C)CCOCCCCCCCBr 7a_100000760002_100000755713 [0,1,0,0,0,0|3,0,0]=4 5326 B13R0.54 CN(C)CCSCCCCCCCO 62a_100000760002_100000755713 [0,1,0,0,0,0|2,0,0]=3 5327 B13R0.54 CNCCCCCOCCCC(C)C 34a_100000722520_100011214892 [0,1,0,0,0,0|3,0,0]=4 5328 B13R0.54 CNCCCCCOCCCC(C)O 34a_100000722520_200000718107 [0,1,0,0,0,0|2,0,0]=3 5329 B13R0.54 CNCCCOCCCCCB(O)O 34a_100000213112_200009817188 [0,1,0,0,0,0|3,0,0]=4 5330 B13R0.54 CNCCCOCCCCCC(C)C 34a_100000213112_100000210682 [0,1,0,0,0,0|3,0,0]=4 5331 B13R0.54 CNCCOCCOCCCC(C)O 34a_100000228057_200000718107 [0,1,0,0,0,0|3,0,0]=4 5332 B13R0.54 COCCCCCCNCCC(C)O 2230a_200000755665_100011998445 [0,1,0,0,0,0|2,0,0]=3 5333 B13R0.54 COCCCCCCOCCC(C)Br 34a_100009893172_100011998445 [0,1,0,0,0,0|3,0,0]=4 5334 B13R0.54 COCCCCCCOCCC(C)C 34a_100000210254_100011998445 [0,1,0,0,0,0|3,0,0]=4 5335 B13R0.54 COCCCCCCOCCC(C)C 34a_200012092642_100000210312 [0,1,0,0,0,0|3,0,0]=4 5336 B13R0.54 COCCCCCCOCCC(C)C 7a_100000210254_100011998445 [0,1,0,0,0,0|3,0,0]=4 5337 B13R0.54 COCCCCCCOCCC(C)C 7a_200012092642_100000210626 [0,1,0,0,0,0|3,0,0]=4 5338 B13R0.54 COCCCCCCOCCC(C)O 34a_200012092642_100012276601 [0,1,0,0,0,0|2,0,0]=3 5339 B13R0.54 COCCCCCCOCCC(C)O 7a_200012092642_100012276601 [0,1,0,0,0,0|2,0,0]=3 5340 B13R0.54 COCCCCCCOCCC(F)F 34a_100103093639_100011998445 [0,1,0,0,0,0|3,0,0]=4 5341 B13R0.54 COCCCCCCOCC[C@@H](C)N 34a_100000706166_100011998445 [0,1,0,0,0,0|3,0,0]=4 5342 B13R0.54 COCCCCCCSCCC(C)C 62a_100000210312_100011998445 [0,1,0,0,0,0|3,0,0]=4 5343 B13R0.54 COCCCCCCSCCC(C)C 62a_100011998445_100000210312 [0,1,0,0,0,0|3,0,0]=4 5344 B13R0.54 COCCCCCCSCCC(C)O 62a_100011998445_100012276601 [0,1,0,0,0,0|2,0,0]=3 5345 B13R0.54 COCCCCCCSCCC(C)O 62a_100012276601_100011998445 [0,1,0,0,0,0|2,0,0]=3 5346 B13R0.54 COCCCCCNCCCC(C)C 2230a_100000747528_100011214892 [0,1,0,0,0,0|3,0,0]=4 5347 B13R0.54 COCCCCCNCCCC(C)C 34a_100000747528_100011214892 [0,1,0,0,0,0|3,0,0]=4 5348 B13R0.54 COCCCCCNCCCC(C)O 2230a_100000747528_200000718107 [0,1,0,0,0,0|2,0,0]=3 5349 B13R0.54 COCCCCCNCCCC(C)O 34a_100000747528_200000718107 [0,1,0,0,0,0|2,0,0]=3 5350 B13R0.54 COCCCCOCCCCB(O)O 34a_100000740925_200009817182 [0,1,0,0,0,0|3,0,0]=4 5351 B13R0.54 COCCCCOCCCCC(C)C 34a_100000740925_100011216152 [0,1,0,0,0,0|3,0,0]=4 5352 B13R0.54 COCCCCOCCCCC(C)C 34a_100011214890_100000755781 [0,1,0,0,0,0|3,0,0]=4 5353 B13R0.54 COCCCCOCCCCC(C)C 7a_100011214890_100000730899 [0,1,0,0,0,0|3,0,0]=4 5354 B13R0.54 COCCCCSCCCCB(O)O 62a_100000730899_200009817182 [0,1,0,0,0,0|3,0,0]=4 5355 B13R0.54 COCCCCSCCCCB(O)O 62a_200009817182_100000730899 [0,1,0,0,0,0|3,0,0]=4 5356 B13R0.54 COCCCCSCCCCC(C)C 62a_100000730899_100011216152 [0,1,0,0,0,0|3,0,0]=4 5357 B13R0.54 COCCCCSCCCCC(C)C 62a_100011216152_100000730899 [0,1,0,0,0,0|3,0,0]=4 5358 B13R0.54 COCCCNCCCCCB(O)O 34a_100150723488_200009817188 [0,1,0,0,0,0|3,0,0]=4 5359 B13R0.54 COCCCNCCCCCC(C)C 2230a_100011290863_100000740836 [0,1,0,0,0,0|3,0,0]=4 5360 B13R0.54 COCCCNCCCCCC(C)C 34a_100011290863_100000740836 [0,1,0,0,0,0|3,0,0]=4 5361 B13R0.54 COCCCNCCCCCC(C)C 34a_100150723488_100000210682 [0,1,0,0,0,0|3,0,0]=4 5362 B13R0.54 COCCCOCCCCCB(O)O 34a_100000740835_200009817188 [0,1,0,0,0,0|3,0,0]=4 5363 B13R0.54 COCCCOCCCCCC(C)C 34a_100000740835_100000210682 [0,1,0,0,0,0|3,0,0]=4 5364 B13R0.54 COCCCOCCCCCC(C)C 34a_100011995859_100000740836 [0,1,0,0,0,0|3,0,0]=4 5365 B13R0.54 COCCCOCCCCCC(C)C 7a_100011995859_100000740836 [0,1,0,0,0,0|3,0,0]=4 5366 B13R0.54 COCCCOCCCOCC(C)O 34a_200011215475_100011218427 [0,1,0,0,0,0|3,0,0]=4 5367 B13R0.54 COCCCOCCCOCC(C)O 7a_200011215475_100011218427 [0,1,0,0,0,0|3,0,0]=4 5368 B13R0.54 COCCCOCCCOC[C@@H](C)O 34a_200011215475_100009817552 [0,1,0,0,0,0|3,0,0]=4 5369 B13R0.54 COCCCOCCCOC[C@@H](C)O 7a_200011215475_100009817552 [0,1,0,0,0,0|3,0,0]=4 5370 B13R0.54 COCCCSCCCCCB(O)O 62a_100000709357_200009817188 [0,1,0,0,0,0|3,0,0]=4 5371 B13R0.54 COCCCSCCCCCB(O)O 62a_200009817188_100000709357 [0,1,0,0,0,0|3,0,0]=4 5372 B13R0.54 COCCCSCCCCCC(C)C 62a_100000210682_100000709357 [0,1,0,0,0,0|3,0,0]=4 5373 B13R0.54 COCCCSCCCCCC(C)C 62a_100000709357_100000210682 [0,1,0,0,0,0|3,0,0]=4 5374 B13R0.54 COCCNCCCCCCB(O)O 2230a_100000209980_100009817187 [0,1,0,0,0,0|3,0,0]=4 5375 B13R0.54 COCCNCCCCCCC(C)C 2230a_100000211014_100011201679 [0,1,0,0,0,0|3,0,0]=4 5376 B13R0.54 COCCNCCCCCCC(C)C 34a_100000211014_100011201679 [0,1,0,0,0,0|3,0,0]=4 5377 B13R0.54 COCCOCCCCCCB(O)O 34a_100000210237_100009817187 [0,1,0,0,0,0|3,0,0]=4 5378 B13R0.54 COCCOCCCNCCC(C)O 2230a_100000206027_100012276601 [0,1,0,0,0,0|3,0,0]=4 5379 B13R0.54 COCCOCCCNCCC(C)O 2230a_200000755665_100011216529 [0,1,0,0,0,0|3,0,0]=4 5380 B13R0.54 COCCOCCCNCCC(C)O 34a_100000206027_100012276601 [0,1,0,0,0,0|3,0,0]=4 5381 B13R0.54 COCCOCCCSCCC(C)O 62a_100011216529_100012276601 [0,1,0,0,0,0|3,0,0]=4 5382 B13R0.54 COCCOCCCSCCC(C)O 62a_100012276601_100011216529 [0,1,0,0,0,0|3,0,0]=4 5383 B13R0.54 COCCOCCNCCCC(C)O 2230a_100000745349_200000718107 [0,1,0,0,0,0|3,0,0]=4 5384 B13R0.54 COCCOCCNCCCC(C)O 34a_100000745349_200000718107 [0,1,0,0,0,0|3,0,0]=4 5385 B13R0.54 COCCOCCOCCCC(C)O 34a_100011215163_200000718107 [0,1,0,0,0,0|3,0,0]=4 5386 B13R0.54 COCCOCCOCCCC(C)O 7a_100011215163_200000718107 [0,1,0,0,0,0|3,0,0]=4 5387 B13R0.54 COCCOCCSCCCC(C)O 62a_100000695917_200000718107 [0,1,0,0,0,0|3,0,0]=4 5388 B13R0.54 COCCOCCSCCCC(C)O 62a_200000718107_100000695917 [0,1,0,0,0,0|3,0,0]=4 5389 B13R0.54 COCCSCCCCCCB(O)O 62a_100000233755_100009817187 [0,1,0,0,0,0|3,0,0]=4 5390 B13R0.54 COCCSCCCCCCB(O)O 62a_100009817187_100000233755 [0,1,0,0,0,0|3,0,0]=4 5391 B13R0.54 CS(=O)CCCNCCCCCCF 2230a_200000753449_100015922095 [0,1,0,0,0,0|3,0,0]=4 5392 B13R0.54 CS(=O)CCCNCCCCCCO 2230a_200000753449_100000766143 [0,1,0,0,0,0|2,0,0]=3 5393 B13R0.54 CSCCCCOCCCCB(O)O 34a_100011217163_200009817182 [0,1,0,0,0,0|3,0,0]=4 5394 B13R0.54 CSCCCCOCCCCB(O)O 7a_100011217163_200009817182 [0,1,0,0,0,0|3,0,0]=4 5395 B13R0.54 CSCCCCOCCCCC(C)C 34a_100011217163_100011216152 [0,1,0,0,0,0|3,0,0]=4 5396 B13R0.54 CSCCCCOCCCCC(C)C 7a_100011217163_100011216152 [0,1,0,0,0,0|3,0,0]=4 5397 B13R0.54 CSCCCNCCCCCB(O)O 2230a_100000749238_200009817188 [0,1,0,0,0,0|3,0,0]=4 5398 B13R0.54 CSCCCNCCCCCC(C)C 2230a_100000749238_100000210682 [0,1,0,0,0,0|3,0,0]=4 5399 B13R0.54 CSCCCOCCCCCB(O)O 34a_100000690336_200009817188 [0,1,0,0,0,0|3,0,0]=4 5400 B13R0.54 CSCCCOCCCCCB(O)O 7a_100000690336_200009817188 [0,1,0,0,0,0|3,0,0]=4 5401 B13R0.54 CSCCCOCCCCCC(C)C 34a_100000690336_100000210682 [0,1,0,0,0,0|3,0,0]=4 5402 B13R0.54 CSCCCOCCCCCC(C)C 7a_100000690336_100000210682 [0,1,0,0,0,0|3,0,0]=4 5403 B13R0.54 CSCCNCCCCCCB(O)O 2230a_100020590264_100009817187 [0,1,0,0,0,0|3,0,0]=4 5404 B13R0.54 CSCCNCCCCCCC(C)C 2230a_100000211014_100000751147 [0,1,0,0,0,0|3,0,0]=4 5405 B13R0.54 CSCCNCCCCCCC(C)C 34a_100000211014_100000212216 [0,1,0,0,0,0|3,0,0]=4 5406 B13R0.54 CSCCOCCCCCCB(O)O 34a_100000230434_100009817187 [0,1,0,0,0,0|3,0,0]=4 5407 B13R0.54 CSCCOCCCCCCB(O)O 7a_100000230434_100009817187 [0,1,0,0,0,0|3,0,0]=4 5408 B13R0.54 CSCCSCCCCCCB(O)O 62a_100000212216_100009817187 [0,1,0,0,0,0|3,0,0]=4 5409 B13R0.54 CSCCSCCCCCCB(O)O 62a_100009817187_100000751147 [0,1,0,0,0,0|3,0,0]=4 5410 B13R0.54 CSCOCCCCCCCC(C)C 34a_200000210741_100011218213 [0,1,0,0,0,0|3,0,0]=4 5411 B13R0.54 C[C@@H](Cl)COCCCCCCCCO 34a_100016084084_100000033203 [0,1,0,0,0,0|1,0,0]=2 5412 B13R0.54 C[C@@H](Cl)COCCOCCOCCO 34a_100016084084_100000032323 [0,1,0,0,0,0|3,0,0]=4 5413 B13R0.54 C[C@@H](N)CCOCCCCCCCO 34a_100000706166_100000760002 [0,1,0,0,0,0|1,0,0]=2 5414 B13R0.54 C[C@@H](N)COCCCCCCCCO 34a_100000737577_100000033203 [0,1,0,0,0,0|1,0,0]=2 5415 B13R0.54 C[C@@H](N)COCCOCCOCCO 34a_100000737577_100000032323 [0,1,0,0,0,0|3,0,0]=4 5416 B13R0.54 C[C@@H](O)CNCCCCCCCCO 2230a_102515433106_100009817552 [0,1,0,0,0,0|1,0,0]=2 5417 B13R0.54 C[C@@H](O)CNCCCCCCCCO 34a_102515433106_100009817552 [0,1,0,0,0,0|1,0,0]=2 5418 B13R0.54 C[C@@H](O)CNCCOCCOCCO 2230a_100011998139_100009817552 [0,1,0,0,0,0|3,0,0]=4 5419 B13R0.54 C[C@@H](O)CNCCOCCOCCO 34a_100011998139_100009817552 [0,1,0,0,0,0|3,0,0]=4 5420 B13R0.54 C[C@@H](O)COCCCCCCCCBr 34a_100009813846_100009817552 [0,1,0,0,0,0|2,0,0]=3 5421 B13R0.54 C[C@@H](O)COCCCCCCCCBr 7a_100009813846_100009817552 [0,1,0,0,0,0|2,0,0]=3 5422 B13R0.54 C[C@@H](O)COCCCCCCCCCl 34a_100000033203_100009817552 [0,1,0,0,0,0|2,0,0]=3 5423 B13R0.54 C[C@@H](O)COCCCCCCCCCl 7a_100000033203_100009817552 [0,1,0,0,0,0|2,0,0]=3 5424 B13R0.54 C[C@@H](O)COCCCCCCCCN 34a_102515433106_100009817552 [0,1,0,0,0,0|2,0,0]=3 5425 B13R0.54 C[C@@H](O)COCCCCCNCCN 34a_103619048469_100009817552 [0,1,0,0,0,0|3,0,0]=4 5426 B13R0.54 C[C@@H](O)CSCCCCCCCCO 62a_100000033203_100009817552 [0,1,0,0,0,0|1,0,0]=2 5427 B13R0.54 C[C@@H](O)CSCCCCCCCCO 62a_100009817552_100000033203 [0,1,0,0,0,0|1,0,0]=2 5428 B13R0.54 C[C@@H](O)CSCCOCCOCCO 62a_100000032323_100009817552 [0,1,0,0,0,0|3,0,0]=4 5429 B13R0.54 C[C@@H](O)CSCCOCCOCCO 62a_100009817552_100000032323 [0,1,0,0,0,0|3,0,0]=4 5430 B13R0.54 FC(F)COCCCCCCCCBr 34a_100009813846_100011934356 [0,1,0,0,0,0|3,0,0]=4 5431 B13R0.54 FC(F)COCCCCCCCCBr 7a_100009813846_100011934356 [0,1,0,0,0,0|3,0,0]=4 5432 B13R0.54 FC(F)COCCCCCCCCCl 34a_100000033203_100011934356 [0,1,0,0,0,0|3,0,0]=4 5433 B13R0.54 FC(F)COCCCCCCCCCl 7a_100000033203_100011934356 [0,1,0,0,0,0|3,0,0]=4 5434 B13R0.54 NC(=O)CCCCCNCCCCO 2230a_100000750430_100009817443 [0,1,0,0,0,0|2,0,1]=4 5435 B13R0.54 NC(=O)CCCCCNCCCCO 34a_100000750430_100009817443 [0,1,0,0,0,0|2,0,1]=4 5436 B13R0.54 NC(=O)CCCCCOCCCCO 34a_100000123541_100011216708 [0,1,0,0,0,0|2,0,1]=4 5437 B13R0.54 NC(=O)CCCCCOCCCCO 7a_100000123541_100000210776 [0,1,0,0,0,0|2,0,1]=4 5438 B13R0.54 NC(=O)CCCCCSCCCCO 62a_100000210776_100009817443 [0,1,0,0,0,0|2,0,1]=4 5439 B13R0.54 NC(=O)CCCCCSCCCCO 62a_100009817443_100000210776 [0,1,0,0,0,0|2,0,1]=4 5440 B13R0.54 NC(=O)CCCCNCCCCCO 34a_100000696515_100000746330 [0,1,0,0,0,0|2,0,1]=4 5441 B13R0.54 NC(=O)CCCCOCCCCCO 34a_100012022536_100000746330 [0,1,0,0,0,0|2,0,1]=4 5442 B13R0.54 NC(=O)CCCCOCCCCCO 7a_100012022536_100000746330 [0,1,0,0,0,0|2,0,1]=4 5443 B13R0.54 NC(=O)CCCNCCCCCCO 34a_100000686447_100102525003 [0,1,0,0,0,0|2,0,1]=4 5444 B13R0.54 NC(=O)CCCNCCCCCCO 34a_100000739312_100000766143 [0,1,0,0,0,0|2,0,1]=4 5445 B13R0.54 NC(=O)CCCSCCCCCCO 62a_100000766143_100102525003 [0,1,0,0,0,0|2,0,1]=4 5446 B13R0.54 NC(=O)CCCSCCCCCCO 62a_100102525003_100000766143 [0,1,0,0,0,0|2,0,1]=4 5447 B13R0.54 NC(=O)CCNCCCCCCCO 2230a_100011996573_100000744528 [0,1,0,0,0,0|2,0,1]=4 5448 B13R0.54 NC(=O)CCNCCCCCCCO 34a_100011996573_100000731001 [0,1,0,0,0,0|2,0,1]=4 5449 B13R0.54 NC(=O)CCOCCCCCCCO 34a_100000757172_100000760002 [0,1,0,0,0,0|2,0,1]=4 5450 B13R0.54 NC(=O)CCOCCCCCCCO 7a_100000757172_100000760002 [0,1,0,0,0,0|2,0,1]=4 5451 B13R0.54 NC(=O)CCSCCCCCCCO 62a_100000744528_100000760002 [0,1,0,0,0,0|2,0,1]=4 5452 B13R0.54 NC(=O)CCSCCCCCCCO 62a_100000760002_100000744528 [0,1,0,0,0,0|2,0,1]=4 5453 B13R0.54 NC(=O)CNCCCCCCCCO 2230a_100000711301_100000033203 [0,1,0,0,0,0|2,0,1]=4 5454 B13R0.54 NC(=O)CNCCCCCCCCO 2230a_102515433106_100000747473 [0,1,0,0,0,0|2,0,1]=4 5455 B13R0.54 NC(=O)CNCCCCCCCCO 34a_102515433106_100000187820 [0,1,0,0,0,0|2,0,1]=4 5456 B13R0.54 NC(=O)CSCCCCCCCCO 62a_100000033203_100000747473 [0,1,0,0,0,0|2,0,1]=4 5457 B13R0.54 NC(=O)CSCCCCCCCCO 62a_100000747473_100000033203 [0,1,0,0,0,0|2,0,1]=4 5458 B13R0.54 NCCCCCCCCOCC(F)F 34a_102515433106_100011934356 [0,1,0,0,0,0|3,0,0]=4 5459 B13R0.54 NCCCCCOCCCCB(O)O 34a_100000762737_200009817182 [0,1,0,0,0,0|3,0,0]=4 5460 B13R0.54 NCCCCOCCCCCB(O)O 34a_100000750430_200009817188 [0,1,0,0,0,0|3,0,0]=4 5461 B13R0.54 NCCCOCCCCCCB(O)O 34a_100000182051_100009817187 [0,1,0,0,0,0|3,0,0]=4 5462 B13R0.54 O=C(O)CNCCCCCCCCO 269956a_100016091260_100000033203 [0,1,0,0,0,0|2,0,1]=4 5463 B13R0.54 O=C([O-])CCCCCOCCCCO 7a_100102619762_100000210776 [0,1,0,0,0,0|2,0,1]=4 5464 B13R0.54 O=C([O-])CNCCCCCCCCO 34a_102515433106_100020667443 [0,1,0,0,0,0|2,0,1]=4 5465 B13R0.54 O=C([O-])CSCCCCCCCCO 62a_100000033203_100020667443 [0,1,0,0,0,0|2,0,1]=4 5466 B13R0.54 O=C([O-])CSCCCCCCCCO 62a_100020667443_100000033203 [0,1,0,0,0,0|2,0,1]=4 5467 B13R0.54 O=[N+]([O-])CCCCOCCCCCO 34a_200015379883_100000746330 [0,1,0,0,0,0|3,0,0]=4 5468 B13R0.54 O=[N+]([O-])CCCCOCCCCCO 7a_200015379883_100000746330 [0,1,0,0,0,0|3,0,0]=4 5469 B13R0.54 O=[N+]([O-])CCCOCCCCCCO 34a_200000037920_100000766143 [0,1,0,0,0,0|3,0,0]=4 5470 B13R0.54 O=[N+]([O-])CNCCCCCCCCO 34a_102515433106_100000761209 [0,1,0,0,0,0|3,0,0]=4 5471 B13R0.54 O=[N+]([O-])CSCCCCCCCCO 62a_100000033203_100000761209 [0,1,0,0,0,0|3,0,0]=4 5472 B13R0.54 OB(O)CCCCCCNCCCF 2230a_100015189416_100009817187 [0,1,0,0,0,0|3,0,0]=4 5473 B13R0.54 OB(O)CCCCCCNCCCF 34a_100015189416_100009817187 [0,1,0,0,0,0|3,0,0]=4 5474 B13R0.54 OB(O)CCCCCCOCCCBr 34a_100011217188_100009817187 [0,1,0,0,0,0|3,0,0]=4 5475 B13R0.54 OB(O)CCCCCCOCCCCl 34a_100000230001_100009817187 [0,1,0,0,0,0|3,0,0]=4 5476 B13R0.54 OB(O)CCCCCCOCCCF 34a_100000759539_100009817187 [0,1,0,0,0,0|3,0,0]=4 5477 B13R0.54 OB(O)CCCCCCSCCCF 62a_100009817187_100011934791 [0,1,0,0,0,0|3,0,0]=4 5478 B13R0.54 OB(O)CCCCCCSCCCF 62a_100011934791_100009817187 [0,1,0,0,0,0|3,0,0]=4 5479 B13R0.54 OB(O)CCCCCOCCCCBr 34a_100011216708_200009817188 [0,1,0,0,0,0|3,0,0]=4 5480 B13R0.54 OB(O)CCCCCOCCCCCl 34a_100000210776_200009817188 [0,1,0,0,0,0|3,0,0]=4 5481 B13R0.54 OB(O)CCCCCOCCCCCl 7a_100000210776_200009817188 [0,1,0,0,0,0|3,0,0]=4 5482 B13R0.54 OB(O)CCCCCOCCCCF 34a_100011995726_200009817188 [0,1,0,0,0,0|3,0,0]=4 5483 B13R0.54 OB(O)CCCCCOCCCCF 7a_100011995726_200009817188 [0,1,0,0,0,0|3,0,0]=4 5484 B13R0.54 OB(O)CCCCCOCCCCI 34a_200012148704_200009817188 [0,1,0,0,0,0|3,0,0]=4 5485 B13R0.54 OB(O)CCCCCSCCCCF 62a_100000729493_200009817188 [0,1,0,0,0,0|3,0,0]=4 5486 B13R0.54 OB(O)CCCCCSCCCCF 62a_200009817188_100000729493 [0,1,0,0,0,0|3,0,0]=4 5487 B13R0.54 OB(O)CCCCOCCCCCBr 34a_100000746331_200009817182 [0,1,0,0,0,0|3,0,0]=4 5488 B13R0.54 OB(O)CCCCOCCCCCBr 7a_100000746331_200009817182 [0,1,0,0,0,0|3,0,0]=4 5489 B13R0.54 OB(O)CCCCOCCCCCCl 34a_100000746330_200009817182 [0,1,0,0,0,0|3,0,0]=4 5490 B13R0.54 OB(O)CCCCOCCCCCCl 7a_100000746330_200009817182 [0,1,0,0,0,0|3,0,0]=4 5491 B13R0.54 OB(O)CCCCOCCCCCI 34a_200012148887_200009817182 [0,1,0,0,0,0|3,0,0]=4 5492 B13R0.54 OB(O)CCCCOCCCCCI 7a_200012148887_200009817182 [0,1,0,0,0,0|3,0,0]=4 5493 B13R0.54 OB(O)CCCCSCCCCCF 62a_100000729378_200009817182 [0,1,0,0,0,0|3,0,0]=4 5494 B13R0.54 OB(O)CCCCSCCCCCF 62a_200009817182_100000729378 [0,1,0,0,0,0|3,0,0]=4 5495 B13R0.54 OCCCCCCCCNCC(F)F 2230a_102515433106_100011934356 [0,1,0,0,0,0|2,0,0]=3 5496 B13R0.54 OCCCCCCCCNCC(F)F 34a_100000765723_100000033203 [0,1,0,0,0,0|2,0,0]=3 5497 B13R0.54 OCCCCCCCCNCC(F)F 34a_102515433106_100011934356 [0,1,0,0,0,0|2,0,0]=3 5498 B13R0.54 OCCCCCCCCOCC(F)F 34a_100000743014_100000033203 [0,1,0,0,0,0|2,0,0]=3 5499 B13R0.54 OCCCCCCCCSCC(F)F 62a_100000033203_100011934356 [0,1,0,0,0,0|2,0,0]=3 5500 B13R0.54 OCCCCCCCCSCC(F)F 62a_100011934356_100000033203 [0,1,0,0,0,0|2,0,0]=3 5501 B13R0.54 OCCCCCCCOCCC(F)F 34a_100103093639_100000760002 [0,1,0,0,0,0|2,0,0]=3 5502 B13R0.54 OCCCCCNCCCCB(O)O 2230a_100000762737_200009817182 [0,1,0,0,0,0|3,0,0]=4 5503 B13R0.54 OCCCCCNCCCCB(O)O 34a_100000762737_200009817182 [0,1,0,0,0,0|3,0,0]=4 5504 B13R0.54 OCCCCCNCCOCC(F)F 2230a_100000762737_200012177212 [0,1,0,0,0,0|3,0,0]=4 5505 B13R0.54 OCCCCCNCCOCC(F)F 34a_100000762737_200012177212 [0,1,0,0,0,0|3,0,0]=4 5506 B13R0.54 OCCCCCOCCOCC(F)F 34a_100000704375_100000746330 [0,1,0,0,0,0|3,0,0]=4 5507 B13R0.54 OCCCCCOCCOCC(F)F 7a_100000704375_100000746330 [0,1,0,0,0,0|3,0,0]=4 5508 B13R0.54 OCCCCCSCCCCB(O)O 62a_100000746330_200009817182 [0,1,0,0,0,0|3,0,0]=4 5509 B13R0.54 OCCCCCSCCCCB(O)O 62a_200009817182_100000746330 [0,1,0,0,0,0|3,0,0]=4 5510 B13R0.54 OCCCCCSCCOCC(F)F 62a_100000746330_200012177212 [0,1,0,0,0,0|3,0,0]=4 5511 B13R0.54 OCCCCCSCCOCC(F)F 62a_200012177212_100000746330 [0,1,0,0,0,0|3,0,0]=4 5512 B13R0.54 OCCCCNCCCCCB(O)O 2230a_100000750430_200009817188 [0,1,0,0,0,0|3,0,0]=4 5513 B13R0.54 OCCCCNCCCCCB(O)O 34a_100000750430_200009817188 [0,1,0,0,0,0|3,0,0]=4 5514 B13R0.54 OCCCCSCCCCCB(O)O 62a_100000210776_200009817188 [0,1,0,0,0,0|3,0,0]=4 5515 B13R0.54 OCCCCSCCCCCB(O)O 62a_200009817188_100000210776 [0,1,0,0,0,0|3,0,0]=4 5516 B13R0.54 OCCCSCCCCCCB(O)O 62a_100009817187_100011215043 [0,1,0,0,0,0|3,0,0]=4 5517 B13R0.54 OCCCSCCCCCCB(O)O 62a_100011215043_100009817187 [0,1,0,0,0,0|3,0,0]=4 5518 B13R0.66 C#CCCC(=O)CCCCCCCC 1458a_100000210188_100000753159 [0,1,0,0,0,0|1,0,2]=4 5519 B13R0.66 C#CCCC(=O)CCCCCCCC 1458a_100000692101_100000210759 [0,1,0,0,0,0|1,0,2]=4 5520 B13R0.66 C#CCCC(=O)CCCCCCCO 1458a_100000692101_100000760002 [0,1,0,0,0,0|0,0,3]=4 5521 B13R0.66 C#CCCC(=O)CCCCCCCO 1458a_100011219782_100000753159 [0,1,0,0,0,0|0,0,3]=4 5522 B13R0.66 C#CCCCCCCC(=O)CCCC 1458a_100000034748_100000210211 [0,1,0,0,0,0|1,0,2]=4 5523 B13R0.66 C#CCCCCCCC(=O)CCCC 1458a_100000210183_100012276617 [0,1,0,0,0,0|1,0,2]=4 5524 B13R0.66 C#CCCCCCCC(=O)CCCO 1458a_100000034748_100011215043 [0,1,0,0,0,0|0,0,3]=4 5525 B13R0.66 C#CCCCCCCN(C)CCCC 2230a_100000207549_100012276617 [0,1,0,0,0,0|2,0,1]=4 5526 B13R0.66 C#CCCCCCCN(C)CCCC 269982a_100000207549_100012276617 [0,1,0,0,0,0|2,0,1]=4 5527 B13R0.66 C#CCCCCCCN(C)CCCO 2230a_100000213112_100012276617 [0,1,0,0,0,0|1,0,2]=4 5528 B13R0.66 C#CCCCCCCN(C)CCCO 269982a_100000213112_100012276617 [0,1,0,0,0,0|1,0,2]=4 5529 B13R0.66 C#CCCCCCNC(C)CCCC 2230a_100000126638_100012094781 [0,1,0,0,0,0|2,0,1]=4 5530 B13R0.66 C#CCCCCCOC(C)CCCC 34a_100000687866_100012094781 [0,1,0,0,0,0|2,0,1]=4 5531 B13R0.66 C#CCCCCCOC(C)CCCC 34a_100000766912_200011215066 [0,1,0,0,0,0|2,0,1]=4 5532 B13R0.66 C#CCCCCCOC(C)CCCC 7a_100000687866_100012094781 [0,1,0,0,0,0|2,0,1]=4 5533 B13R0.66 C#CCCCCCOC(C)CCCC 7a_100000766912_200011215066 [0,1,0,0,0,0|2,0,1]=4 5534 B13R0.66 C#CCCCCCSC(C)CCCC 62a_100012094781_200011215066 [0,1,0,0,0,0|2,0,1]=4 5535 B13R0.66 C#CCCCCCSC(C)CCCC 62a_200011215066_100012094781 [0,1,0,0,0,0|2,0,1]=4 5536 B13R0.66 C#CCCCCNC[C@H](C)CCCO 2230a_100160569302_100010269958 [0,1,0,0,0,0|1,0,2]=4 5537 B13R0.66 C#CCCCCNC[C@H](C)CCCO 34a_100160569302_100010269958 [0,1,0,0,0,0|1,0,2]=4 5538 B13R0.66 C#CCCCCOCC(C)CCCC 34a_100011995851_100010269958 [0,1,0,0,0,0|2,0,1]=4 5539 B13R0.66 C#CCCCCOCC(C)CCCC 7a_100011995851_100010269958 [0,1,0,0,0,0|2,0,1]=4 5540 B13R0.66 C#CCCCCOC[C@@H](N)CCCC 34a_100011934283_100010269958 [0,1,0,0,0,0|2,0,1]=4 5541 B13R0.66 C#CCCN(C)CCCCCCCC 2230a_100000207567_100000688953 [0,1,0,0,0,0|2,0,1]=4 5542 B13R0.66 C#CCCN(C)CCCCCCCC 269982a_100000207567_100000730999 [0,1,0,0,0,0|2,0,1]=4 5543 B13R0.66 C#CCOC(C)CCCCCCCC 34a_100000210740_100000184674 [0,1,0,0,0,0|2,0,1]=4 5544 B13R0.66 C#CCOC(C)CCCCCCCC 7a_100000210740_100000038162 [0,1,0,0,0,0|2,0,1]=4 5545 B13R0.66 C#CCOCCCCC(C)CCCC 34a_200011021034_100000184674 [0,1,0,0,0,0|2,0,1]=4 5546 B13R0.66 C#CCOCCCCC(C)CCCC 7a_200011021034_100000038162 [0,1,0,0,0,0|2,0,1]=4 5547 B13R0.66 C/C=C/CC(=O)CCCCCCCO 1458a_100011219782_100102629194 [0,1,0,0,0,0|0,0,3]=4 5548 B13R0.66 C=CCCC(=O)CCCCCCCC 1458a_100000210188_100000754431 [0,1,0,0,0,0|1,0,2]=4 5549 B13R0.66 C=CCCC(=O)CCCCCCCC 1458a_100000749702_100000210759 [0,1,0,0,0,0|1,0,2]=4 5550 B13R0.66 C=CCCC(=O)CCCCCCCO 1458a_100000749702_100000760002 [0,1,0,0,0,0|0,0,3]=4 5551 B13R0.66 C=CCCC(=O)CCCCCCCO 1458a_100011219782_100000754431 [0,1,0,0,0,0|0,0,3]=4 5552 B13R0.66 C=CCCC(C)NCCCCCCC 270004a_100000229938_100000762624 [0,1,0,0,0,0|2,0,1]=4 5553 B13R0.66 C=CCCC(C)NCCCCCCO 270004a_100000686447_100000762624 [0,1,0,0,0,0|1,0,2]=4 5554 B13R0.66 C=CCCC(C)OCCCCCCC 34a_100000765329_100000210614 [0,1,0,0,0,0|2,0,1]=4 5555 B13R0.66 C=CCCC(C)OCCCCCCC 7a_100000765329_100000210614 [0,1,0,0,0,0|2,0,1]=4 5556 B13R0.66 C=CCCC(C)OCCCCCCO 34a_100000765329_100000766143 [0,1,0,0,0,0|1,0,2]=4 5557 B13R0.66 C=CCCC(C)OCCCCCCO 7a_100000765329_100000766143 [0,1,0,0,0,0|1,0,2]=4 5558 B13R0.66 C=CCCCCCCC(=O)CCCC 1458a_100000210183_100011215473 [0,1,0,0,0,0|1,0,2]=4 5559 B13R0.66 C=CCCCCCCC(=O)CCCC 1458a_100011809334_100000210211 [0,1,0,0,0,0|1,0,2]=4 5560 B13R0.66 C=CCCCCCCC(=O)CCCO 1458a_100011809334_100011215043 [0,1,0,0,0,0|0,0,3]=4 5561 B13R0.66 C=CCCCCCCN(C)CCCC 2230a_100000207549_100011215473 [0,1,0,0,0,0|2,0,1]=4 5562 B13R0.66 C=CCCCCCCN(C)CCCC 269982a_100000207549_100011215473 [0,1,0,0,0,0|2,0,1]=4 5563 B13R0.66 C=CCCCCCCN(C)CCCO 2230a_100000213112_100011215473 [0,1,0,0,0,0|1,0,2]=4 5564 B13R0.66 C=CCCCCCCN(C)CCCO 269982a_100000213112_100011215473 [0,1,0,0,0,0|1,0,2]=4 5565 B13R0.66 C=CCCCCCNC(C)CCCC 2230a_100000126638_100000700193 [0,1,0,0,0,0|2,0,1]=4 5566 B13R0.66 C=CCCCCCOC(C)CCCC 34a_100000687866_100000700193 [0,1,0,0,0,0|2,0,1]=4 5567 B13R0.66 C=CCCCCCOC(C)CCCC 34a_100011216702_200011215066 [0,1,0,0,0,0|2,0,1]=4 5568 B13R0.66 C=CCCCCCOC(C)CCCC 7a_100000687866_100000700193 [0,1,0,0,0,0|2,0,1]=4 5569 B13R0.66 C=CCCCCCOC(C)CCCC 7a_100011216702_200011215066 [0,1,0,0,0,0|2,0,1]=4 5570 B13R0.66 C=CCCCCCSC(C)CCCC 62a_100000700193_200011215066 [0,1,0,0,0,0|2,0,1]=4 5571 B13R0.66 C=CCCCCCSC(C)CCCC 62a_200011215066_100000700193 [0,1,0,0,0,0|2,0,1]=4 5572 B13R0.66 C=CCCCCNC[C@H](C)CCCO 2230a_100160569302_100011215482 [0,1,0,0,0,0|1,0,2]=4 5573 B13R0.66 C=CCCCCNC[C@H](C)CCCO 34a_100160569302_100011215482 [0,1,0,0,0,0|1,0,2]=4 5574 B13R0.66 C=CCCCCOCC(C)CCCC 34a_100011995851_100011215482 [0,1,0,0,0,0|2,0,1]=4 5575 B13R0.66 C=CCCCCOCC(C)CCCC 7a_100011995851_100011215482 [0,1,0,0,0,0|2,0,1]=4 5576 B13R0.66 C=CCCCCOC[C@@H](N)CCCC 34a_100011934283_100011215482 [0,1,0,0,0,0|2,0,1]=4 5577 B13R0.66 C=CCCN(C)CCCCCCCC 2230a_100000207567_100000754431 [0,1,0,0,0,0|2,0,1]=4 5578 B13R0.66 C=CCCN(C)CCCCCCCC 2230a_100020639649_100000210759 [0,1,0,0,0,0|2,0,1]=4 5579 B13R0.66 C=CCCN(C)CCCCCCCC 269982a_100000207567_100000754431 [0,1,0,0,0,0|2,0,1]=4 5580 B13R0.66 C=CCCN(C)CCCCCCCC 269982a_100020639649_100000210759 [0,1,0,0,0,0|2,0,1]=4 5581 B13R0.66 C=CCCN(C)CCCCCCCO 2230a_100020639649_100000760002 [0,1,0,0,0,0|1,0,2]=4 5582 B13R0.66 C=CCCN(C)CCCCCCCO 269982a_100020639649_100000760002 [0,1,0,0,0,0|1,0,2]=4 5583 B13R0.66 C=CCNC(C)CCCCCCCC 270004a_100020586998_100011216694 [0,1,0,0,0,0|2,0,1]=4 5584 B13R0.66 C=CCOC(C)CCCCCCCC 34a_100000210740_100015514636 [0,1,0,0,0,0|2,0,1]=4 5585 B13R0.66 C=CCOC(C)CCCCCCCC 7a_100000210740_100015514636 [0,1,0,0,0,0|2,0,1]=4 5586 B13R0.66 C=CCOCCCCC(C)CCCC 34a_200011021034_100015514636 [0,1,0,0,0,0|2,0,1]=4 5587 B13R0.66 C=CCOCCCCC(C)CCCC 7a_200011021034_100015514636 [0,1,0,0,0,0|2,0,1]=4 5588 B13R0.66 CC#CCC(=O)CCCCCCCO 1458a_100011219782_100000748600 [0,1,0,0,0,0|0,0,3]=4 5589 B13R0.66 CC(CCCCl)OCCCCCCF 34a_200000718107_100015922095 [0,1,0,0,0,0|3,0,0]=4 5590 B13R0.66 CC(CCCCl)OCCCCCCF 7a_200000718107_100015922095 [0,1,0,0,0,0|3,0,0]=4 5591 B13R0.66 CC(CCCCl)OCCCCCCO 34a_200000718107_100000766143 [0,1,0,0,0,0|2,0,0]=3 5592 B13R0.66 CC(CCCCl)OCCCCCCO 7a_200000718107_100000766143 [0,1,0,0,0,0|2,0,0]=3 5593 B13R0.66 CC/C=C\CCNC[C@H](C)CCCO 2230a_100160569302_100015370543 [0,1,0,0,0,0|1,0,2]=4 5594 B13R0.66 CC/C=C\CCNC[C@H](C)CCCO 34a_100160569302_100015370543 [0,1,0,0,0,0|1,0,2]=4 5595 B13R0.66 CC=CCC(=O)CCCCCCCO 1458a_100011219782_100000070051 [0,1,0,0,0,0|0,0,3]=4 5596 B13R0.66 CC=CCC(=O)CCCCCCCO 1458a_100121576822_100000760002 [0,1,0,0,0,0|0,0,3]=4 5597 B13R0.66 CCC#CC(=O)CCCCCCCO 1458a_100011827653_100000760002 [0,1,0,0,0,0|0,0,3]=4 5598 B13R0.66 CCC#CC(C)OCCCCCCO 34a_100000033903_100000766143 [0,1,0,0,0,0|1,0,2]=4 5599 B13R0.66 CCC#CC(C)OCCCCCCO 7a_100000033903_100000766143 [0,1,0,0,0,0|1,0,2]=4 5600 B13R0.66 CCC=CC(=O)CCCCCCCO 1458a_100000212282_100000760002 [0,1,0,0,0,0|0,0,3]=4 5601 B13R0.66 CCCCC(=O)CCCCCCC#N 1458a_100000210183_100009813337 [0,1,0,0,0,0|1,0,2]=4 5602 B13R0.66 CCCCC(=O)CCCCCCCO 1458a_100000210183_100000760002 [0,1,0,0,0,0|0,0,1]=2 5603 B13R0.66 CCCCC(=O)CCCCCCCO 1458a_100011219782_100000210211 [0,1,0,0,0,0|0,0,1]=2 5604 B13R0.66 CCCCC(=O)CCCCCCOC 1458a_100000210183_100011998445 [0,1,0,0,0,0|2,0,1]=4 5605 B13R0.66 CCCCC(=O)COCCOCCO 1458a_106645077154_100000210211 [0,1,0,0,0,0|2,0,1]=4 5606 B13R0.66 CCCCC(=O)NCCCCCCO 240690a_100000686447_100000210183 [0,1,0,0,0,0|1,0,1]=3 5607 B13R0.66 CCCCC(=O)NCCCCCCO 527a_100000686447_100000210183 [0,1,0,0,0,0|1,0,1]=3 5608 B13R0.66 CCCCC(C)CCCCOCC#N 7a_200011021034_100011215382 [0,1,0,0,0,0|2,0,1]=4 5609 B13R0.66 CCCCC(C)CCCCOCC=O 34a_200011021034_200009817547 [0,1,0,0,0,0|1,0,2]=4 5610 B13R0.66 CCCCC(C)CCCCOCC=O 7a_200011021034_200015260668 [0,1,0,0,0,0|1,0,2]=4 5611 B13R0.66 CCCCC(C)CCCCOCCC 34a_200011021034_100000210303 [0,1,0,0,0,0|2,0,0]=3 5612 B13R0.66 CCCCC(C)CCCCOCCC 7a_200011021034_100000210303 [0,1,0,0,0,0|2,0,0]=3 5613 B13R0.66 CCCCC(C)CCCCOCCF 34a_200011021034_100011217306 [0,1,0,0,0,0|2,0,0]=3 5614 B13R0.66 CCCCC(C)CCCCOCCF 7a_200011021034_100011217306 [0,1,0,0,0,0|2,0,0]=3 5615 B13R0.66 CCCCC(C)CCCCOCCO 34a_200011021034_100000211926 [0,1,0,0,0,0|1,0,0]=2 5616 B13R0.66 CCCCC(C)CCCCOCCO 7a_200011021034_100000211926 [0,1,0,0,0,0|1,0,0]=2 5617 B13R0.66 CCCCC(C)CCCCOCSC 34a_200011021034_100011218213 [0,1,0,0,0,0|3,0,0]=4 5618 B13R0.66 CCCCC(C)COCCCCC#N 7a_100011995851_100000211819 [0,1,0,0,0,0|2,0,1]=4 5619 B13R0.66 CCCCC(C)COCCCCC=O 7a_100011995851_100000139335 [0,1,0,0,0,0|1,0,2]=4 5620 B13R0.66 CCCCC(C)COCCCCCF 34a_100011995851_100000729378 [0,1,0,0,0,0|2,0,0]=3 5621 B13R0.66 CCCCC(C)COCCCCCF 7a_100011995851_100000729378 [0,1,0,0,0,0|2,0,0]=3 5622 B13R0.66 CCCCC(C)COCCCCCO 34a_100011995851_100000746330 [0,1,0,0,0,0|1,0,0]=2 5623 B13R0.66 CCCCC(C)COCCCCCO 7a_100011995851_100000746330 [0,1,0,0,0,0|1,0,0]=2 5624 B13R0.66 CCCCC(C)COCCCCOC 34a_100011995851_100000755781 [0,1,0,0,0,0|3,0,0]=4 5625 B13R0.66 CCCCC(C)COCCCCOC 7a_100011995851_100000730899 [0,1,0,0,0,0|3,0,0]=4 5626 B13R0.66 CCCCC(C)COCCCOCC 34a_100011995851_100012232248 [0,1,0,0,0,0|3,0,0]=4 5627 B13R0.66 CCCCC(C)COCCCOCC 7a_100011995851_100012232248 [0,1,0,0,0,0|3,0,0]=4 5628 B13R0.66 CCCCC(C)COCCOCCC 34a_100011995851_100011215938 [0,1,0,0,0,0|3,0,0]=4 5629 B13R0.66 CCCCC(C)COCCOCCC 7a_100011995851_100011215938 [0,1,0,0,0,0|3,0,0]=4 5630 B13R0.66 CCCCC(C)COCCOCCO 34a_100011995851_100000692535 [0,1,0,0,0,0|2,0,0]=3 5631 B13R0.66 CCCCC(C)COCCOCCO 7a_100011995851_100011215305 [0,1,0,0,0,0|2,0,0]=3 5632 B13R0.66 CCCCC(C)NCCCCCC#N 2230a_100000126638_100009813376 [0,1,0,0,0,0|2,0,1]=4 5633 B13R0.66 CCCCC(C)NCCCCCC#N 270004a_100000061152_100000210087 [0,1,0,0,0,0|2,0,1]=4 5634 B13R0.66 CCCCC(C)NCCCCCC=O 2230a_100000126638_100000139337 [0,1,0,0,0,0|1,0,2]=4 5635 B13R0.66 CCCCC(C)NCCCCCCF 2230a_100000126638_100015922095 [0,1,0,0,0,0|2,0,0]=3 5636 B13R0.66 CCCCC(C)NCCCCCCO 2230a_100000126638_100000766143 [0,1,0,0,0,0|1,0,0]=2 5637 B13R0.66 CCCCC(C)NCCCCCCO 2230a_100000686447_200011215066 [0,1,0,0,0,0|1,0,0]=2 5638 B13R0.66 CCCCC(C)NCCCCCCO 270004a_100000686447_100000210087 [0,1,0,0,0,0|1,0,0]=2 5639 B13R0.66 CCCCC(C)NCCCCCCO 34a_100000686447_200011215066 [0,1,0,0,0,0|1,0,0]=2 5640 B13R0.66 CCCCC(C)NCCCCCOC 2230a_100000747528_200011215066 [0,1,0,0,0,0|3,0,0]=4 5641 B13R0.66 CCCCC(C)NCCCCCOC 270004a_100000747528_100000210087 [0,1,0,0,0,0|3,0,0]=4 5642 B13R0.66 CCCCC(C)NCCCCCOC 34a_100000747528_200011215066 [0,1,0,0,0,0|3,0,0]=4 5643 B13R0.66 CCCCC(C)NCCCOCCC 2230a_100011217757_200011215066 [0,1,0,0,0,0|3,0,0]=4 5644 B13R0.66 CCCCC(C)NCCCOCCC 270004a_100011217757_100000210087 [0,1,0,0,0,0|3,0,0]=4 5645 B13R0.66 CCCCC(C)NCCCOCCC 34a_100011217757_200011215066 [0,1,0,0,0,0|3,0,0]=4 5646 B13R0.66 CCCCC(C)OCCCCCC#N 7a_100000687866_100009813376 [0,1,0,0,0,0|2,0,1]=4 5647 B13R0.66 CCCCC(C)OCCCCCC=O 7a_100000687866_100000139337 [0,1,0,0,0,0|1,0,2]=4 5648 B13R0.66 CCCCC(C)OCCCCCCBr 34a_100011215345_200011215066 [0,1,0,0,0,0|2,0,0]=3 5649 B13R0.66 CCCCC(C)OCCCCCCBr 7a_100011215345_200011215066 [0,1,0,0,0,0|2,0,0]=3 5650 B13R0.66 CCCCC(C)OCCCCCCCl 34a_100000766143_200011215066 [0,1,0,0,0,0|2,0,0]=3 5651 B13R0.66 CCCCC(C)OCCCCCCCl 7a_100000766143_200011215066 [0,1,0,0,0,0|2,0,0]=3 5652 B13R0.66 CCCCC(C)OCCCCCCF 34a_100000687866_100015922095 [0,1,0,0,0,0|2,0,0]=3 5653 B13R0.66 CCCCC(C)OCCCCCCF 34a_100000732779_200011215066 [0,1,0,0,0,0|2,0,0]=3 5654 B13R0.66 CCCCC(C)OCCCCCCF 7a_100000687866_100015922095 [0,1,0,0,0,0|2,0,0]=3 5655 B13R0.66 CCCCC(C)OCCCCCCF 7a_100000732779_200011215066 [0,1,0,0,0,0|2,0,0]=3 5656 B13R0.66 CCCCC(C)OCCCCCCN 34a_100000686447_200011215066 [0,1,0,0,0,0|2,0,0]=3 5657 B13R0.66 CCCCC(C)OCCCCCCO 34a_100000687866_100000766143 [0,1,0,0,0,0|1,0,0]=2 5658 B13R0.66 CCCCC(C)OCCCCCCO 7a_100000687866_100000766143 [0,1,0,0,0,0|1,0,0]=2 5659 B13R0.66 CCCCC(C)OCCCCCNC 34a_100000722520_200011215066 [0,1,0,0,0,0|3,0,0]=4 5660 B13R0.66 CCCCC(C)SCCCCCC#N 62a_100009813376_200011215066 [0,1,0,0,0,0|2,0,1]=4 5661 B13R0.66 CCCCC(C)SCCCCCC#N 62a_200011215066_100009813376 [0,1,0,0,0,0|2,0,1]=4 5662 B13R0.66 CCCCC(C)SCCCCCC=O 62a_100000139337_200011215066 [0,1,0,0,0,0|1,0,2]=4 5663 B13R0.66 CCCCC(C)SCCCCCC=O 62a_200011215066_100000139337 [0,1,0,0,0,0|1,0,2]=4 5664 B13R0.66 CCCCC(C)SCCCCCCF 62a_100015922095_200011215066 [0,1,0,0,0,0|2,0,0]=3 5665 B13R0.66 CCCCC(C)SCCCCCCF 62a_200011215066_100015922095 [0,1,0,0,0,0|2,0,0]=3 5666 B13R0.66 CCCCC(C)SCCCCCCO 62a_100000766143_200011215066 [0,1,0,0,0,0|1,0,0]=2 5667 B13R0.66 CCCCC(C)SCCCCCCO 62a_200011215066_100000766143 [0,1,0,0,0,0|1,0,0]=2 5668 B13R0.66 CCCCC/C=C/CC(=O)CCCO 1458a_100020675968_100011215043 [0,1,0,0,0,0|0,0,3]=4 5669 B13R0.66 CCCCCC#CCN(C)CCCO 2230a_100000213112_100009816472 [0,1,0,0,0,0|1,0,2]=4 5670 B13R0.66 CCCCCC#CCN(C)CCCO 269982a_100000213112_100009816472 [0,1,0,0,0,0|1,0,2]=4 5671 B13R0.66 CCCCCCC=CC(=O)CCCO 1458a_200015324643_100011215043 [0,1,0,0,0,0|0,0,3]=4 5672 B13R0.66 CCCCCCCCC(=O)C#CCO 1458a_100000049017_100000210759 [0,1,0,0,0,0|0,0,3]=4 5673 B13R0.66 CCCCCCCCC(=O)CCC#N 1458a_100000210188_100011215226 [0,1,0,0,0,0|1,0,2]=4 5674 B13R0.66 CCCCCCCCC(=O)CCC#N 1458a_100011934036_100000210759 [0,1,0,0,0,0|1,0,2]=4 5675 B13R0.66 CCCCCCCCC(=O)CCCC 1458a_100000210183_100000210759 [0,1,0,0,0,0|1,0,1]=3 5676 B13R0.66 CCCCCCCCC(=O)CCCC 1458a_100000210188_100000210211 [0,1,0,0,0,0|1,0,1]=3 5677 B13R0.66 CCCCCCCCC(=O)CCCF 1458a_100000210188_100011934791 [0,1,0,0,0,0|1,0,1]=3 5678 B13R0.66 CCCCCCCCC(=O)CCCO 1458a_100000210188_100011215043 [0,1,0,0,0,0|0,0,1]=2 5679 B13R0.66 CCCCCCCCC(=O)CCOC 1458a_100000210188_100000233755 [0,1,0,0,0,0|2,0,1]=4 5680 B13R0.66 CCCCCCCCC(=O)CCOC 1458a_100000749529_100000210759 [0,1,0,0,0,0|2,0,1]=4 5681 B13R0.66 CCCCCCCCC(=O)CCSC 1458a_100000174002_100000210759 [0,1,0,0,0,0|2,0,1]=4 5682 B13R0.66 CCCCCCCCC(=O)CCSC 1458a_100000210188_100000751147 [0,1,0,0,0,0|2,0,1]=4 5683 B13R0.66 CCCCCCCCC(=O)COCC 1458a_100000211967_100000210759 [0,1,0,0,0,0|2,0,1]=4 5684 B13R0.66 CCCCCCCCC(=O)CSCC 1458a_100000230394_100000210759 [0,1,0,0,0,0|2,0,1]=4 5685 B13R0.66 CCCCCCCCC(=O)NCCC 11a_100020643023_100000210188 [0,1,0,0,0,0|2,0,1]=4 5686 B13R0.66 CCCCCCCCC(=O)NCCC 1626a_100020643023_100000210188 [0,1,0,0,0,0|2,0,1]=4 5687 B13R0.66 CCCCCCCCC(=O)NCCC 240690a_100020643023_100000210188 [0,1,0,0,0,0|2,0,1]=4 5688 B13R0.66 CCCCCCCCC(=O)NCCC 527a_100020643023_100000210188 [0,1,0,0,0,0|2,0,1]=4 5689 B13R0.66 CCCCCCCCC(=O)NCCF 11a_100000724931_100000210188 [0,1,0,0,0,0|2,0,1]=4 5690 B13R0.66 CCCCCCCCC(=O)NCCF 1626a_100000724931_100000210188 [0,1,0,0,0,0|2,0,1]=4 5691 B13R0.66 CCCCCCCCC(=O)NCCF 240690a_100000724931_100000210188 [0,1,0,0,0,0|2,0,1]=4 5692 B13R0.66 CCCCCCCCC(=O)NCCF 527a_100000724931_100000210188 [0,1,0,0,0,0|2,0,1]=4 5693 B13R0.66 CCCCCCCCC(=O)NCCO 240690a_100000210304_100000210188 [0,1,0,0,0,0|1,0,1]=3 5694 B13R0.66 CCCCCCCCC(=O)NCCO 527a_100000210304_100000210188 [0,1,0,0,0,0|1,0,1]=3 5695 B13R0.66 CCCCCCCCC(C)CNCC 270004a_100015525214_100011995885 [0,1,0,0,0,0|2,0,0]=3 5696 B13R0.66 CCCCCCCCC(C)COCC 34a_200012125181_100000210202 [0,1,0,0,0,0|2,0,0]=3 5697 B13R0.66 CCCCCCCCC(C)COCC 7a_200012125181_100000210202 [0,1,0,0,0,0|2,0,0]=3 5698 B13R0.66 CCCCCCCCC(C)COCF 34a_200012125181_100015361967 [0,1,0,0,0,0|2,0,0]=3 5699 B13R0.66 CCCCCCCCC(C)COCF 7a_200012125181_100015361967 [0,1,0,0,0,0|2,0,0]=3 5700 B13R0.66 CCCCCCCCC(C)NCCC 270004a_100020643023_100011216694 [0,1,0,0,0,0|2,0,0]=3 5701 B13R0.66 CCCCCCCCC(C)NCCO 270004a_100000210304_100011216694 [0,1,0,0,0,0|1,0,0]=2 5702 B13R0.66 CCCCCCCCC(C)OCC#N 7a_100000210740_100011215382 [0,1,0,0,0,0|2,0,1]=4 5703 B13R0.66 CCCCCCCCC(C)OCC=O 34a_100000210740_200009817547 [0,1,0,0,0,0|1,0,2]=4 5704 B13R0.66 CCCCCCCCC(C)OCC=O 7a_100000210740_200015260668 [0,1,0,0,0,0|1,0,2]=4 5705 B13R0.66 CCCCCCCCC(C)OCCC 34a_100000210740_100000210303 [0,1,0,0,0,0|2,0,0]=3 5706 B13R0.66 CCCCCCCCC(C)OCCC 7a_100000210740_100000210303 [0,1,0,0,0,0|2,0,0]=3 5707 B13R0.66 CCCCCCCCC(C)OCCF 34a_100000210740_100011217306 [0,1,0,0,0,0|2,0,0]=3 5708 B13R0.66 CCCCCCCCC(C)OCCF 7a_100000210740_100011217306 [0,1,0,0,0,0|2,0,0]=3 5709 B13R0.66 CCCCCCCCC(C)OCCO 34a_100000210740_100000211926 [0,1,0,0,0,0|1,0,0]=2 5710 B13R0.66 CCCCCCCCC(C)OCCO 7a_100000210740_100000211926 [0,1,0,0,0,0|1,0,0]=2 5711 B13R0.66 CCCCCCCCC(C)OCSC 34a_100000210740_100011218213 [0,1,0,0,0,0|3,0,0]=4 5712 B13R0.66 CCCCCCCCN(C)CCC#N 2230a_100000184479_100000210759 [0,1,0,0,0,0|2,0,1]=4 5713 B13R0.66 CCCCCCCCN(C)CCC#N 2230a_100000207567_100011215226 [0,1,0,0,0,0|2,0,1]=4 5714 B13R0.66 CCCCCCCCN(C)CCC#N 2230a_200000208009_200000210301 [0,1,0,0,0,0|2,0,1]=4 5715 B13R0.66 CCCCCCCCN(C)CCC#N 269982a_100000207567_100011215226 [0,1,0,0,0,0|2,0,1]=4 5716 B13R0.66 CCCCCCCCN(C)CCCC 2230a_100000207549_100000210759 [0,1,0,0,0,0|2,0,0]=3 5717 B13R0.66 CCCCCCCCN(C)CCCC 2230a_100000207567_100000210211 [0,1,0,0,0,0|2,0,0]=3 5718 B13R0.66 CCCCCCCCN(C)CCCC 269982a_100000207549_100000210759 [0,1,0,0,0,0|2,0,0]=3 5719 B13R0.66 CCCCCCCCN(C)CCCC 269982a_100000207567_100000210211 [0,1,0,0,0,0|2,0,0]=3 5720 B13R0.66 CCCCCCCCN(C)CCCF 2230a_100000207567_100011934791 [0,1,0,0,0,0|2,0,0]=3 5721 B13R0.66 CCCCCCCCN(C)CCCF 269982a_100000207567_100011934791 [0,1,0,0,0,0|2,0,0]=3 5722 B13R0.66 CCCCCCCCN(C)CCCO 2230a_100000207567_100000230001 [0,1,0,0,0,0|1,0,0]=2 5723 B13R0.66 CCCCCCCCN(C)CCCO 2230a_100000213112_100000210759 [0,1,0,0,0,0|1,0,0]=2 5724 B13R0.66 CCCCCCCCN(C)CCCO 269982a_100000207567_100011215043 [0,1,0,0,0,0|1,0,0]=2 5725 B13R0.66 CCCCCCCCN(C)CCCO 269982a_100000213112_100000210759 [0,1,0,0,0,0|1,0,0]=2 5726 B13R0.66 CCCCCCCCN(C)CCOC 2230a_100000207567_100011201679 [0,1,0,0,0,0|3,0,0]=4 5727 B13R0.66 CCCCCCCCN(C)CCOC 2230a_100000743101_100000210759 [0,1,0,0,0,0|3,0,0]=4 5728 B13R0.66 CCCCCCCCN(C)CCOC 269982a_100000207567_100000233755 [0,1,0,0,0,0|3,0,0]=4 5729 B13R0.66 CCCCCCCCN(C)CCOC 269982a_100000743101_100000210759 [0,1,0,0,0,0|3,0,0]=4 5730 B13R0.66 CCCCCCCCN(C)CCSC 2230a_100000207567_100000751147 [0,1,0,0,0,0|3,0,0]=4 5731 B13R0.66 CCCCCCCCN(C)CCSC 2230a_100000686725_100000210759 [0,1,0,0,0,0|3,0,0]=4 5732 B13R0.66 CCCCCCCCN(C)CCSC 269982a_100000207567_100000212216 [0,1,0,0,0,0|3,0,0]=4 5733 B13R0.66 CCCCCCCCN(C)CCSC 269982a_100000686725_100000210759 [0,1,0,0,0,0|3,0,0]=4 5734 B13R0.66 CCCCCCCCN(C)COCC 269982a_100000207567_100000739092 [0,1,0,0,0,0|3,0,0]=4 5735 B13R0.66 CCCCCCCCN([13CH3])CCC#N 2230a_200000208009_200025704644 [0,1,0,0,0,0|2,0,1]=4 5736 B13R0.66 CCCCCCCNC(=O)CCCC 11a_100000229938_100000210183 [0,1,0,0,0,0|2,0,1]=4 5737 B13R0.66 CCCCCCCNC(=O)CCCC 1626a_100000229938_100000210183 [0,1,0,0,0,0|2,0,1]=4 5738 B13R0.66 CCCCCCCNC(=O)CCCC 240690a_100000229938_100000210183 [0,1,0,0,0,0|2,0,1]=4 5739 B13R0.66 CCCCCCCNC(=O)CCCC 527a_100000229938_100000210183 [0,1,0,0,0,0|2,0,1]=4 5740 B13R0.66 CCCCCCCNC(=O)NCCO 2708a_100000229938_100000210304 [0,1,0,0,0,0|2,0,1]=4 5741 B13R0.66 CCCCCCCNC(=O)NCCO 273464a_100000210304_100000229938 [0,1,0,0,0,0|2,0,1]=4 5742 B13R0.66 CCCCCCCNC(=O)NCCO 273464a_100000229938_100000210304 [0,1,0,0,0,0|2,0,1]=4 5743 B13R0.66 CCCCCCCNC(=O)NCCO 512a_100000229938_100000210304 [0,1,0,0,0,0|2,0,1]=4 5744 B13R0.66 CCCCCCCNC(C)CCCC 2230a_100000126638_100000210681 [0,1,0,0,0,0|2,0,0]=3 5745 B13R0.66 CCCCCCCNC(C)CCCC 2230a_100000229938_200011215066 [0,1,0,0,0,0|2,0,0]=3 5746 B13R0.66 CCCCCCCNC(C)CCCC 270004a_100000229938_100000210087 [0,1,0,0,0,0|2,0,0]=3 5747 B13R0.66 CCCCCCCNC(C)CCOC 270004a_100000229938_100000742357 [0,1,0,0,0,0|3,0,0]=4 5748 B13R0.66 CCCCCCCNC(C)CCSC 270004a_100000229938_100011217047 [0,1,0,0,0,0|3,0,0]=4 5749 B13R0.66 CCCCCCCNC(C)CSCC 270004a_100000229938_200011216171 [0,1,0,0,0,0|3,0,0]=4 5750 B13R0.66 CCCCCCCOC(C)CCCC 34a_100000210272_200011215066 [0,1,0,0,0,0|2,0,0]=3 5751 B13R0.66 CCCCCCCOC(C)CCCC 34a_100000687866_100000210614 [0,1,0,0,0,0|2,0,0]=3 5752 B13R0.66 CCCCCCCOC(C)CCCC 7a_100000210272_200011215066 [0,1,0,0,0,0|2,0,0]=3 5753 B13R0.66 CCCCCCCOC(C)CCCC 7a_100000687866_100000210614 [0,1,0,0,0,0|2,0,0]=3 5754 B13R0.66 CCCCCCCOC(C)CCCCl 34a_200000718107_100000210614 [0,1,0,0,0,0|2,0,0]=3 5755 B13R0.66 CCCCCCCOC(C)CCCCl 7a_200000718107_100000210614 [0,1,0,0,0,0|2,0,0]=3 5756 B13R0.66 CCCCCCCOC(C)COCC 34a_100000718985_100000210614 [0,1,0,0,0,0|3,0,0]=4 5757 B13R0.66 CCCCCCCOC(C)COCC 7a_100000718985_100000210614 [0,1,0,0,0,0|3,0,0]=4 5758 B13R0.66 CCCCCCCSC(C)CCCC 62a_100000210614_200011215066 [0,1,0,0,0,0|2,0,0]=3 5759 B13R0.66 CCCCCCCSC(C)CCCC 62a_200011215066_100000210316 [0,1,0,0,0,0|2,0,0]=3 5760 B13R0.66 CCCCCCNCC(C)OCCC 2230a_100015185124_100000210314 [0,1,0,0,0,0|3,0,0]=4 5761 B13R0.66 CCCCCCNCC(C)OCCC 34a_100015185124_100000210314 [0,1,0,0,0,0|3,0,0]=4 5762 B13R0.66 CCCCCCNCC(O)COCC 2230a_102515437182_100000210314 [0,1,0,0,0,0|3,0,0]=4 5763 B13R0.66 CCCCCCNCC(O)COCC 34a_102515437182_100000210314 [0,1,0,0,0,0|3,0,0]=4 5764 B13R0.66 CCCCCCNC[C@H](C)CCCO 2230a_100160569302_100000210314 [0,1,0,0,0,0|1,0,0]=2 5765 B13R0.66 CCCCCCNC[C@H](C)CCCO 34a_100160569302_100000210314 [0,1,0,0,0,0|1,0,0]=2 5766 B13R0.66 CCCCCCOCC(C)CCCC 34a_100011995851_100000210314 [0,1,0,0,0,0|2,0,0]=3 5767 B13R0.66 CCCCCCOCC(C)CCCC 7a_100011995851_100000210314 [0,1,0,0,0,0|2,0,0]=3 5768 B13R0.66 CCCCCCOC[C@@H](N)CCCC 34a_100011934283_100000210314 [0,1,0,0,0,0|2,0,0]=3 5769 B13R0.66 CCCCCCOC[C@@H](N)CCSC 34a_100011827619_100000210314 [0,1,0,0,0,0|3,0,0]=4 5770 B13R0.66 CCCCN(C)CCCCCCC#N 2230a_100000207549_100009813337 [0,1,0,0,0,0|2,0,1]=4 5771 B13R0.66 CCCCN(C)CCCCCCC#N 269982a_100000207549_100009813337 [0,1,0,0,0,0|2,0,1]=4 5772 B13R0.66 CCCCN(C)CCCCCCCO 2230a_100000207549_100000760002 [0,1,0,0,0,0|1,0,0]=2 5773 B13R0.66 CCCCN(C)CCCCCCCO 269982a_100000207549_100000760002 [0,1,0,0,0,0|1,0,0]=2 5774 B13R0.66 CCCCN(C)CCCCCCOC 2230a_100000207549_100011998445 [0,1,0,0,0,0|3,0,0]=4 5775 B13R0.66 CCCCN(C)CCCCCCOC 269982a_100000207549_100011998445 [0,1,0,0,0,0|3,0,0]=4 5776 B13R0.66 CCCCOCCNC(C)CCCC 2230a_100000126638_100000743108 [0,1,0,0,0,0|3,0,0]=4 5777 B13R0.66 CCCCOCCOC(C)CCCC 34a_100000210238_200011215066 [0,1,0,0,0,0|3,0,0]=4 5778 B13R0.66 CCCCOCCOC(C)CCCC 34a_100000687866_100000743108 [0,1,0,0,0,0|3,0,0]=4 5779 B13R0.66 CCCCOCCOC(C)CCCC 7a_100000210238_200011215066 [0,1,0,0,0,0|3,0,0]=4 5780 B13R0.66 CCCCOCCOC(C)CCCC 7a_100000687866_100000743108 [0,1,0,0,0,0|3,0,0]=4 5781 B13R0.66 CCCCOCCOC(C)CCCCl 34a_200000718107_100000743108 [0,1,0,0,0,0|3,0,0]=4 5782 B13R0.66 CCCCOCCOC(C)CCCCl 7a_200000718107_100000743108 [0,1,0,0,0,0|3,0,0]=4 5783 B13R0.66 CCCCOCCSC(C)CCCC 62a_100000743108_200011215066 [0,1,0,0,0,0|3,0,0]=4 5784 B13R0.66 CCCCOCCSC(C)CCCC 62a_200011215066_100000743108 [0,1,0,0,0,0|3,0,0]=4 5785 B13R0.66 CCCCOCNC[C@H](C)CCCO 2230a_100160569302_100011995733 [0,1,0,0,0,0|2,0,0]=3 5786 B13R0.66 CCCCOCNC[C@H](C)CCCO 34a_100160569302_100011995733 [0,1,0,0,0,0|2,0,0]=3 5787 B13R0.66 CCCCOCOCC(C)CCCC 34a_100011995851_100011995733 [0,1,0,0,0,0|3,0,0]=4 5788 B13R0.66 CCCCOCOC[C@@H](N)CCCC 34a_100011934283_100011995733 [0,1,0,0,0,0|3,0,0]=4 5789 B13R0.66 CCCCSCCNC(C)CCCC 2230a_100025743550_200011215066 [0,1,0,0,0,0|3,0,0]=4 5790 B13R0.66 CCCCSCCNC(C)CCCC 270004a_100025743550_100000210087 [0,1,0,0,0,0|3,0,0]=4 5791 B13R0.66 CCCCSCCOC(C)CCCC 34a_200000230436_200011215066 [0,1,0,0,0,0|3,0,0]=4 5792 B13R0.66 CCCCSCCOC(C)CCCC 7a_200000230436_200011215066 [0,1,0,0,0,0|3,0,0]=4 5793 B13R0.66 CCCC[C@H](N)COCCCCCF 34a_100011934283_100000729378 [0,1,0,0,0,0|2,0,0]=3 5794 B13R0.66 CCCC[C@H](N)COCCCCCO 34a_100011934283_100000746330 [0,1,0,0,0,0|1,0,0]=2 5795 B13R0.66 CCCC[C@H](N)COCCCCOC 34a_100011934283_100000755781 [0,1,0,0,0,0|3,0,0]=4 5796 B13R0.66 CCCC[C@H](N)COCCCOCC 34a_100011934283_100012232248 [0,1,0,0,0,0|3,0,0]=4 5797 B13R0.66 CCCC[C@H](N)COCCOCCC 34a_100011934283_100011215938 [0,1,0,0,0,0|3,0,0]=4 5798 B13R0.66 CCCC[C@H](N)COCCOCCO 34a_100011934283_100000692535 [0,1,0,0,0,0|2,0,0]=3 5799 B13R0.66 CCCNC(=O)CCCCCCCO 240690a_100020643023_100011219782 [0,1,0,0,0,0|1,0,1]=3 5800 B13R0.66 CCCNC(=O)CCCSCCCO 62a_100011194427_100011215043 [0,1,0,0,0,0|2,0,1]=4 5801 B13R0.66 CCCNC(=O)CCCSCCCO 62a_100011215043_100011194427 [0,1,0,0,0,0|2,0,1]=4 5802 B13R0.66 CCCNC(=O)CNCCCCCO 2230a_100000174927_100000746330 [0,1,0,0,0,0|2,0,1]=4 5803 B13R0.66 CCCNC(=O)CNCCCCCO 2230a_100000762737_100000183358 [0,1,0,0,0,0|2,0,1]=4 5804 B13R0.66 CCCNC(=O)CNCCCCCO 34a_100000762737_100000183358 [0,1,0,0,0,0|2,0,1]=4 5805 B13R0.66 CCCNC(=O)CSCCCCCO 62a_100000183358_100000746330 [0,1,0,0,0,0|2,0,1]=4 5806 B13R0.66 CCCNC(=O)CSCCCCCO 62a_100000746330_100000183358 [0,1,0,0,0,0|2,0,1]=4 5807 B13R0.66 CCCNC(=O)NCCCCCCO 2708a_100020643023_100000686447 [0,1,0,0,0,0|2,0,1]=4 5808 B13R0.66 CCCNC(=O)NCCCCCCO 273464a_100000686447_100020643023 [0,1,0,0,0,0|2,0,1]=4 5809 B13R0.66 CCCNC(=O)NCCCCCCO 273464a_100020643023_100000686447 [0,1,0,0,0,0|2,0,1]=4 5810 B13R0.66 CCCNC(=O)NCCCCCCO 512a_100000686447_100020643023 [0,1,0,0,0,0|2,0,1]=4 5811 B13R0.66 CCCNC(=O)NCCCCCCO 512a_100020643023_100000686447 [0,1,0,0,0,0|2,0,1]=4 5812 B13R0.66 CCCOC(=O)CNCCCCCO 2230a_100000762737_200011215008 [0,1,0,0,0,0|2,0,1]=4 5813 B13R0.66 CCCOC(=O)CNCCCCCO 34a_100000762737_200011215008 [0,1,0,0,0,0|2,0,1]=4 5814 B13R0.66 CCCOC(=O)CSCCCCCO 62a_100000746330_200011215008 [0,1,0,0,0,0|2,0,1]=4 5815 B13R0.66 CCCOC(=O)CSCCCCCO 62a_200011215008_100000746330 [0,1,0,0,0,0|2,0,1]=4 5816 B13R0.66 CCCOC(C)CNCCCCCF 2230a_100015185124_100000729378 [0,1,0,0,0,0|3,0,0]=4 5817 B13R0.66 CCCOC(C)CNCCCCCF 34a_100015185124_100000729378 [0,1,0,0,0,0|3,0,0]=4 5818 B13R0.66 CCCOC(C)CNCCCCCO 2230a_100015185124_100000746330 [0,1,0,0,0,0|2,0,0]=3 5819 B13R0.66 CCCOC(C)CNCCCCCO 34a_100015185124_100000746330 [0,1,0,0,0,0|2,0,0]=3 5820 B13R0.66 CCCOC(C)CNCCOCCO 2230a_100015185124_100011215305 [0,1,0,0,0,0|3,0,0]=4 5821 B13R0.66 CCCOC(C)CNCCOCCO 34a_100015185124_100000692535 [0,1,0,0,0,0|3,0,0]=4 5822 B13R0.66 CCCOCCNC[C@H](C)CCCO 2230a_100160569302_100011215938 [0,1,0,0,0,0|2,0,0]=3 5823 B13R0.66 CCCOCCNC[C@H](C)CCCO 34a_100160569302_100011215938 [0,1,0,0,0,0|2,0,0]=3 5824 B13R0.66 CCNNC(=O)CCCCCCCO 22a_100000756455_100011219782 [0,1,0,0,0,0|2,0,1]=4 5825 B13R0.66 CCOCC(=O)CCCCCCCO 1458a_100000211967_100000760002 [0,1,0,0,0,0|1,0,1]=3 5826 B13R0.66 CCOCC(=O)NCCCCCCO 240690a_100000686447_100000211967 [0,1,0,0,0,0|2,0,1]=4 5827 B13R0.66 CCOCC(=O)NCCCCCCO 527a_100000686447_100000211967 [0,1,0,0,0,0|2,0,1]=4 5828 B13R0.66 CCOCC(C)OCCCCCCF 34a_100000718985_100015922095 [0,1,0,0,0,0|3,0,0]=4 5829 B13R0.66 CCOCC(C)OCCCCCCF 7a_100000718985_100015922095 [0,1,0,0,0,0|3,0,0]=4 5830 B13R0.66 CCOCC(C)OCCCCCCO 34a_100000718985_100000766143 [0,1,0,0,0,0|2,0,0]=3 5831 B13R0.66 CCOCC(C)OCCCCCCO 7a_100000718985_100000766143 [0,1,0,0,0,0|2,0,0]=3 5832 B13R0.66 CCOCC(O)CNCCCCCF 2230a_102515437182_100000729378 [0,1,0,0,0,0|3,0,0]=4 5833 B13R0.66 CCOCC(O)CNCCCCCF 34a_102515437182_100000729378 [0,1,0,0,0,0|3,0,0]=4 5834 B13R0.66 CCOCC(O)CNCCCCCO 2230a_102515437182_100000746330 [0,1,0,0,0,0|2,0,0]=3 5835 B13R0.66 CCOCC(O)CNCCCCCO 34a_102515437182_100000746330 [0,1,0,0,0,0|2,0,0]=3 5836 B13R0.66 CCOCC(O)CNCCOCCO 2230a_102515437182_100011215305 [0,1,0,0,0,0|3,0,0]=4 5837 B13R0.66 CCOCC(O)CNCCOCCO 34a_102515437182_100000692535 [0,1,0,0,0,0|3,0,0]=4 5838 B13R0.66 CCOCCCNC[C@H](C)CCCO 2230a_100160569302_100012232248 [0,1,0,0,0,0|2,0,0]=3 5839 B13R0.66 CCOCCCNC[C@H](C)CCCO 34a_100160569302_100012232248 [0,1,0,0,0,0|2,0,0]=3 5840 B13R0.66 CCOCCOCCN(C)CCCO 2230a_100000213112_100011211534 [0,1,0,0,0,0|3,0,0]=4 5841 B13R0.66 CCOCCOCCN(C)CCCO 269982a_100000213112_100011211534 [0,1,0,0,0,0|3,0,0]=4 5842 B13R0.66 CCSCC(=O)CCCCCCCO 1458a_100000230394_100000760002 [0,1,0,0,0,0|1,0,1]=3 5843 B13R0.66 CCSCC(=O)NCCCCCCO 240690a_100000686447_100000230394 [0,1,0,0,0,0|2,0,1]=4 5844 B13R0.66 CCSCC(=O)NCCCCCCO 527a_100000686447_100000230394 [0,1,0,0,0,0|2,0,1]=4 5845 B13R0.66 CCSCC(C)NCCCCCCO 270004a_100000686447_200011216171 [0,1,0,0,0,0|2,0,0]=3 5846 B13R0.66 CN(CCC#N)CCCCCCCO 2230a_100000184479_100000760002 [0,1,0,0,0,0|2,0,1]=4 5847 B13R0.66 CN(CCCO)CCCCCCC#N 2230a_100000213112_100009813337 [0,1,0,0,0,0|2,0,1]=4 5848 B13R0.66 CN(CCCO)CCCCCCC#N 269982a_100000213112_100009813337 [0,1,0,0,0,0|2,0,1]=4 5849 B13R0.66 CN(CCCO)CCCCCCCO 2230a_100000213112_100000760002 [0,1,0,0,0,0|2,0,0]=3 5850 B13R0.66 CN(CCCO)CCCCCCCO 269982a_100000213112_100000760002 [0,1,0,0,0,0|2,0,0]=3 5851 B13R0.66 COCCC(=O)CCCCCCCO 1458a_100000749529_100000760002 [0,1,0,0,0,0|1,0,1]=3 5852 B13R0.66 COCCC(=O)CCCCCCCO 1458a_100011219782_100000233755 [0,1,0,0,0,0|1,0,1]=3 5853 B13R0.66 COCCC(=O)NCCCCCCO 240690a_100000686447_100000749529 [0,1,0,0,0,0|2,0,1]=4 5854 B13R0.66 COCCC(=O)NCCCCCCO 527a_100000686447_100000749529 [0,1,0,0,0,0|2,0,1]=4 5855 B13R0.66 COCCC(C)NCCCCCCO 270004a_100000686447_100000742357 [0,1,0,0,0,0|2,0,0]=3 5856 B13R0.66 COCCCCCCN(C)CCCO 2230a_100000213112_100011998445 [0,1,0,0,0,0|2,0,0]=3 5857 B13R0.66 COCCCCCCN(C)CCCO 269982a_100000213112_100011998445 [0,1,0,0,0,0|2,0,0]=3 5858 B13R0.66 COCCCCNC[C@H](C)CCCO 2230a_100160569302_100000730899 [0,1,0,0,0,0|2,0,0]=3 5859 B13R0.66 COCCCCNC[C@H](C)CCCO 34a_100160569302_100000755781 [0,1,0,0,0,0|2,0,0]=3 5860 B13R0.66 COCCN(C)CCCCCCCO 2230a_100000743101_100000760002 [0,1,0,0,0,0|2,0,0]=3 5861 B13R0.66 COCCN(C)CCCCCCCO 269982a_100000743101_100000760002 [0,1,0,0,0,0|2,0,0]=3 5862 B13R0.66 COCCOCCCN(C)CCCO 2230a_100000213112_100011216529 [0,1,0,0,0,0|3,0,0]=4 5863 B13R0.66 COCCOCCCN(C)CCCO 269982a_100000213112_100011216529 [0,1,0,0,0,0|3,0,0]=4 5864 B13R0.66 COCCOCNC[C@H](C)CCCO 2230a_100160569302_100000231047 [0,1,0,0,0,0|3,0,0]=4 5865 B13R0.66 COCO[C@H](C)COCCCCCO 34a_100016172286_100000746330 [0,1,0,0,0,0|3,0,0]=4 5866 B13R0.66 COCO[C@H](C)COCCCCCO 7a_100016172286_100000746330 [0,1,0,0,0,0|3,0,0]=4 5867 B13R0.66 CSCCC(=O)CCCCCCCO 1458a_100000174002_100000760002 [0,1,0,0,0,0|1,0,1]=3 5868 B13R0.66 CSCCC(=O)CCCCCCCO 1458a_100011219782_100000751147 [0,1,0,0,0,0|1,0,1]=3 5869 B13R0.66 CSCCC(=O)NCCCCCCO 240690a_100000686447_100000174002 [0,1,0,0,0,0|2,0,1]=4 5870 B13R0.66 CSCCC(=O)NCCCCCCO 527a_100000686447_100000174002 [0,1,0,0,0,0|2,0,1]=4 5871 B13R0.66 CSCCC(C)NCCCCCCO 270004a_100000686447_100011217047 [0,1,0,0,0,0|2,0,0]=3 5872 B13R0.66 CSCCN(C)CCCCCCCO 2230a_100000686725_100000760002 [0,1,0,0,0,0|2,0,0]=3 5873 B13R0.66 CSCCN(C)CCCCCCCO 269982a_100000686725_100000760002 [0,1,0,0,0,0|2,0,0]=3 5874 B13R0.66 CSCC[C@H](N)COCCCCCF 34a_100011827619_100000729378 [0,1,0,0,0,0|3,0,0]=4 5875 B13R0.66 CSCC[C@H](N)COCCCCCO 34a_100011827619_100000746330 [0,1,0,0,0,0|2,0,0]=3 5876 B13R0.66 CSCC[C@H](N)COCCOCCO 34a_100011827619_100000692535 [0,1,0,0,0,0|3,0,0]=4 5877 B13R0.66 C[C@H](CCCO)CNCCCCC#N 2230a_100160569302_100000211819 [0,1,0,0,0,0|2,0,1]=4 5878 B13R0.66 C[C@H](CCCO)CNCCCCC=O 2230a_100160569302_100000139335 [0,1,0,0,0,0|2,0,1]=4 5879 B13R0.66 C[C@H](CCCO)CNCCCCCF 2230a_100160569302_100000729378 [0,1,0,0,0,0|2,0,0]=3 5880 B13R0.66 C[C@H](CCCO)CNCCCCCF 34a_100160569302_100000729378 [0,1,0,0,0,0|2,0,0]=3 5881 B13R0.66 C[C@H](CCCO)CNCCCCCO 2230a_100160569302_100000746330 [0,1,0,0,0,0|2,0,0]=3 5882 B13R0.66 C[C@H](CCCO)CNCCCCCO 34a_100160569302_100000746330 [0,1,0,0,0,0|2,0,0]=3 5883 B13R0.66 C[C@H](CCCO)CNCCOCCO 2230a_100160569302_100011215305 [0,1,0,0,0,0|3,0,0]=4 5884 B13R0.66 C[C@H](CCCO)CNCCOCCO 34a_100160569302_100000692535 [0,1,0,0,0,0|3,0,0]=4 5885 B13R0.66 N#CCCC(=O)CCCCCCCO 1458a_100011219782_100011215226 [0,1,0,0,0,0|1,0,2]=4 5886 B13R0.66 N#CCCC(=O)CCCCCCCO 1458a_100011934036_100000760002 [0,1,0,0,0,0|1,0,2]=4 5887 B13R0.66 O=C(CCCCCCCO)NCCF 240690a_100000724931_100011219782 [0,1,0,0,0,0|2,0,1]=4 5888 B13R0.66 O=C(CCCCCCCO)NCCO 240690a_100000210304_100011219782 [0,1,0,0,0,0|2,0,1]=4 5889 B13R0.66 O=C(CCCF)CCCCCCCO 1458a_100011219782_100011934791 [0,1,0,0,0,0|1,0,1]=3 5890 B13R0.66 O=C(CCCO)CCCCCCCO 1458a_100011219782_100011215043 [0,1,0,0,0,0|1,0,1]=3 5891 B13R0.147 C#CC(=O)CCCCCCCCCC 1458a_100000211873_100000210319 [0,1,0,0,0,0|1,0,2]=4 5892 B13R0.147 C#CC(=O)CCCCCCCCCO 1458a_100000211873_100009813782 [0,1,0,0,0,0|0,0,3]=4 5893 B13R0.147 C#CC(C)NCCCCCCCCC 2230a_100000707721_100011214924 [0,1,0,0,0,0|2,0,1]=4 5894 B13R0.147 C#CC(C)NCCCCCCCCC 34a_100000212291_200000035995 [0,1,0,0,0,0|2,0,1]=4 5895 B13R0.147 C#CC(C)NCCCCCCCCC 34a_100000707721_100011214924 [0,1,0,0,0,0|2,0,1]=4 5896 B13R0.147 C#CC(C)NCCCCCCCCO 2230a_100000707721_100000033203 [0,1,0,0,0,0|1,0,2]=4 5897 B13R0.147 C#CC(C)NCCCCCCCCO 34a_100000707721_100000033203 [0,1,0,0,0,0|1,0,2]=4 5898 B13R0.147 C#CC(C)NCCCCCCCCO 34a_102515433106_200000035995 [0,1,0,0,0,0|1,0,2]=4 5899 B13R0.147 C#CC(C)OCCCCCCCCC 34a_100000210712_200000035995 [0,1,0,0,0,0|2,0,1]=4 5900 B13R0.147 C#CC(C)SCCCCCCCCC 62a_200000035995_100000210670 [0,1,0,0,0,0|2,0,1]=4 5901 B13R0.147 C#CC(C)SCCCCCCCCO 62a_200000035995_100000033203 [0,1,0,0,0,0|1,0,2]=4 5902 B13R0.147 C#CC(O)CCCCCNCCCC 2230a_100000102301_200010408556 [0,1,0,0,0,0|2,0,1]=4 5903 B13R0.147 C#CC(O)CCCCCNCCCC 7a_106832991798_200010408556 [0,1,0,0,0,0|2,0,1]=4 5904 B13R0.147 C#CC(O)CCCCCOCCCC 34a_100000210227_200010408556 [0,1,0,0,0,0|2,0,1]=4 5905 B13R0.147 C#CC(O)CCCCCOCCCC 7a_100000210227_200010408556 [0,1,0,0,0,0|2,0,1]=4 5906 B13R0.147 C#CC(O)CCCCCSCCCC 62a_100000210211_200010408556 [0,1,0,0,0,0|2,0,1]=4 5907 B13R0.147 C#CC(O)CCCCCSCCCC 62a_200010408556_100000210210 [0,1,0,0,0,0|2,0,1]=4 5908 B13R0.147 C#CC(O)CCCCCSCCCO 62a_100011215043_200010408556 [0,1,0,0,0,0|1,0,2]=4 5909 B13R0.147 C#CC(O)CCCCCSCCCO 62a_200010408556_100011215043 [0,1,0,0,0,0|1,0,2]=4 5910 B13R0.147 C#CCCCCCCCCC(=O)CC 1458a_100000029693_100000210202 [0,1,0,0,0,0|1,0,2]=4 5911 B13R0.147 C#CCCCCCCCNC(C)CC 2230a_100000209981_100153394163 [0,1,0,0,0,0|2,0,1]=4 5912 B13R0.147 C#CCCCCCCCN[C@H](C)CO 2230a_100000737577_100153394163 [0,1,0,0,0,0|1,0,2]=4 5913 B13R0.147 C#CCCCCCCCOC(C)CC 34a_100000054614_100011215416 [0,1,0,0,0,0|2,0,1]=4 5914 B13R0.147 C#CCCCCCCCOC(C)CC 7a_100000054614_100000758301 [0,1,0,0,0,0|2,0,1]=4 5915 B13R0.147 C#CCCCCCCCOC(C)CC 7a_100000210228_100153394163 [0,1,0,0,0,0|2,0,1]=4 5916 B13R0.147 C#CCCCCCCCOC(C)CO 34a_100000054614_100012180447 [0,1,0,0,0,0|1,0,2]=4 5917 B13R0.147 C#CCCCCCCCOC(C)CO 7a_100000054614_100012180447 [0,1,0,0,0,0|1,0,2]=4 5918 B13R0.147 C#CCCCCCCCSC(C)CC 62a_100000758301_100153394163 [0,1,0,0,0,0|2,0,1]=4 5919 B13R0.147 C#CCCCCCCCSC(C)CC 62a_100153394163_100000758301 [0,1,0,0,0,0|2,0,1]=4 5920 B13R0.147 C#CCCCCCCCSC(C)CO 62a_100012180447_100153394163 [0,1,0,0,0,0|1,0,2]=4 5921 B13R0.147 C#CCCCCCCCS[C@H](C)CO 62a_100016084084_100153394163 [0,1,0,0,0,0|1,0,2]=4 5922 B13R0.147 C#CCCCCCCCS[C@H](C)CO 62a_100153394163_100016084084 [0,1,0,0,0,0|1,0,2]=4 5923 B13R0.147 C#CCCCCCCNCC(C)CC 2230a_100020588543_100012276617 [0,1,0,0,0,0|2,0,1]=4 5924 B13R0.147 C#CCCCCCCNCC(C)CO 34a_100000744482_100012276617 [0,1,0,0,0,0|1,0,2]=4 5925 B13R0.147 C#CCCCCCCNCC(O)CC 2230a_100011218483_100012276617 [0,1,0,0,0,0|2,0,1]=4 5926 B13R0.147 C#CCCCCCCNC[C@@H](F)CO 34a_100015665980_100012276617 [0,1,0,0,0,0|1,0,2]=4 5927 B13R0.147 C#CCCCCCCNC[C@H](O)CO 2230a_100020644852_100012276617 [0,1,0,0,0,0|1,0,2]=4 5928 B13R0.147 C#CCCCCCCOCC(C)CC 34a_100011217361_100000748023 [0,1,0,0,0,0|2,0,1]=4 5929 B13R0.147 C#CCCCCCCOCC(C)CC 7a_100011217361_100000748023 [0,1,0,0,0,0|2,0,1]=4 5930 B13R0.147 C#CCCCCCCOCC(O)CC 34a_100011217361_100011218378 [0,1,0,0,0,0|2,0,1]=4 5931 B13R0.147 C#CCCCCCCOCC(O)CC 7a_100011217361_100011218378 [0,1,0,0,0,0|2,0,1]=4 5932 B13R0.147 C#CCCCCCCOCC(O)CO 34a_100011217361_100011219619 [0,1,0,0,0,0|1,0,2]=4 5933 B13R0.147 C#CCCCCCCOCC(O)CO 7a_100011217361_100011219619 [0,1,0,0,0,0|1,0,2]=4 5934 B13R0.147 C#CCCCCCCOC[C@@H](C)CC 34a_100011217361_100009816398 [0,1,0,0,0,0|2,0,1]=4 5935 B13R0.147 C#CCCCCCCOC[C@@H](C)CC 7a_100009816381_100012276617 [0,1,0,0,0,0|2,0,1]=4 5936 B13R0.147 C#CCCCCCCOC[C@@H](C)CC 7a_100011217361_100009816398 [0,1,0,0,0,0|2,0,1]=4 5937 B13R0.147 C#CCCCCCCOC[C@@H](C)CO 34a_100011217361_100000059175 [0,1,0,0,0,0|1,0,2]=4 5938 B13R0.147 C#CCCCCCCOC[C@@H](C)CO 7a_100011217361_100000059175 [0,1,0,0,0,0|1,0,2]=4 5939 B13R0.147 C#CCCCCCCOC[C@@H](O)CO 34a_100011217361_100009815848 [0,1,0,0,0,0|1,0,2]=4 5940 B13R0.147 C#CCCCCCCOC[C@@H](O)CO 7a_100011217361_100009815848 [0,1,0,0,0,0|1,0,2]=4 5941 B13R0.147 C#CCCCCCCSCC(C)CC 62a_100000748023_100012276617 [0,1,0,0,0,0|2,0,1]=4 5942 B13R0.147 C#CCCCCCCSCC(C)CC 62a_100012276617_100000748023 [0,1,0,0,0,0|2,0,1]=4 5943 B13R0.147 C#CCCCCCCSCC(O)CC 62a_100011218378_100012276617 [0,1,0,0,0,0|2,0,1]=4 5944 B13R0.147 C#CCCCCCCSCC(O)CC 62a_100012276617_100011218378 [0,1,0,0,0,0|2,0,1]=4 5945 B13R0.147 C#CCCCCCCSCC(O)CO 62a_100011219619_100012276617 [0,1,0,0,0,0|1,0,2]=4 5946 B13R0.147 C#CCCCCCCSCC(O)CO 62a_100012276617_100011219619 [0,1,0,0,0,0|1,0,2]=4 5947 B13R0.147 C#CCCCCCCSC[C@@H](C)CC 62a_100009816398_100012276617 [0,1,0,0,0,0|2,0,1]=4 5948 B13R0.147 C#CCCCCCCSC[C@@H](C)CC 62a_100012276617_100009816398 [0,1,0,0,0,0|2,0,1]=4 5949 B13R0.147 C#CCCCCCCSC[C@@H](C)CO 62a_100000059175_100012276617 [0,1,0,0,0,0|1,0,2]=4 5950 B13R0.147 C#CCCCCCCSC[C@@H](C)CO 62a_100012276617_100000059175 [0,1,0,0,0,0|1,0,2]=4 5951 B13R0.147 C#CCCCCCCSC[C@@H](O)CO 62a_100009815848_100012276617 [0,1,0,0,0,0|1,0,2]=4 5952 B13R0.147 C#CCCCCCCSC[C@@H](O)CO 62a_100012276617_100009815848 [0,1,0,0,0,0|1,0,2]=4 5953 B13R0.147 C#CCCCCCNCCC(C)CC 2230a_100020591266_100012094781 [0,1,0,0,0,0|2,0,1]=4 5954 B13R0.147 C#CCCCCCNCCC(C)CO 2230a_106354213184_100012094781 [0,1,0,0,0,0|1,0,2]=4 5955 B13R0.147 C#CCCCCCNCCC(C)CO 34a_106354213184_100012094781 [0,1,0,0,0,0|1,0,2]=4 5956 B13R0.147 C#CCCCCCOCCC(C)CC 7a_100011215188_100012094781 [0,1,0,0,0,0|2,0,1]=4 5957 B13R0.147 C#CCCCCOCCCC(C)CC 7a_100011216074_100010269958 [0,1,0,0,0,0|2,0,1]=4 5958 B13R0.147 C#CCCOCCCCCC(C)CC 7a_200000035636_100000688953 [0,1,0,0,0,0|2,0,1]=4 5959 B13R0.147 C#C[C@@H](C)OCCCCCCCCC 34a_100009815206_100011214924 [0,1,0,0,0,0|2,0,1]=4 5960 B13R0.147 C#C[C@@H](C)OCCCCCCCCC 7a_100009815206_100000210328 [0,1,0,0,0,0|2,0,1]=4 5961 B13R0.147 C#C[C@@H](C)OCCCCCCCCO 34a_100009815206_100000033203 [0,1,0,0,0,0|1,0,2]=4 5962 B13R0.147 C#C[C@@H](C)OCCCCCCCCO 7a_100009815206_100000033203 [0,1,0,0,0,0|1,0,2]=4 5963 B13R0.147 C=CC(=O)CCCCCCCCCC 1458a_100000185746_100000210319 [0,1,0,0,0,0|1,0,2]=4 5964 B13R0.147 C=CC(=O)CCCCCCCCCO 1458a_100000185746_100009813782 [0,1,0,0,0,0|0,0,3]=4 5965 B13R0.147 C=CC(C)COCCCCCCCC 34a_100011215527_100000210759 [0,1,0,0,0,0|2,0,1]=4 5966 B13R0.147 C=CC(C)COCCCCCCCC 7a_100011215527_100000210759 [0,1,0,0,0,0|2,0,1]=4 5967 B13R0.147 C=CC(C)COCCCCCCCO 34a_100011215527_100000760002 [0,1,0,0,0,0|1,0,2]=4 5968 B13R0.147 C=CC(C)COCCCCCCCO 7a_100011215527_100000760002 [0,1,0,0,0,0|1,0,2]=4 5969 B13R0.147 C=CC(C)OCCCCCCCCC 34a_100000695699_100011214924 [0,1,0,0,0,0|2,0,1]=4 5970 B13R0.147 C=CC(C)OCCCCCCCCO 34a_100000695699_100000033203 [0,1,0,0,0,0|1,0,2]=4 5971 B13R0.147 C=CC(C)SCCCCCCCCC 62a_100011215867_100000210670 [0,1,0,0,0,0|2,0,1]=4 5972 B13R0.147 C=CC(C)SCCCCCCCCO 62a_100011215867_100000033203 [0,1,0,0,0,0|1,0,2]=4 5973 B13R0.147 C=CC(O)CNCCCCCCCC 2230a_100000229939_100000730141 [0,1,0,0,0,0|2,0,1]=4 5974 B13R0.147 C=CC(O)CNCCCCCCCC 34a_100000229939_100000730141 [0,1,0,0,0,0|2,0,1]=4 5975 B13R0.147 C=CC(O)CNCCCCCCCO 2230a_100011996573_100000730141 [0,1,0,0,0,0|1,0,2]=4 5976 B13R0.147 C=CC(O)CNCCCCCCCO 34a_100011996573_100000730141 [0,1,0,0,0,0|1,0,2]=4 5977 B13R0.147 C=CC(O)COCCCCCCCC 34a_100000210232_100000730141 [0,1,0,0,0,0|2,0,1]=4 5978 B13R0.147 C=CC(O)COCCCCCCCC 7a_100000210232_100000730141 [0,1,0,0,0,0|2,0,1]=4 5979 B13R0.147 C=CC(O)CSCCCCCCCC 62a_100000210759_100000730141 [0,1,0,0,0,0|2,0,1]=4 5980 B13R0.147 C=CC(O)CSCCCCCCCC 62a_100000730141_100000210317 [0,1,0,0,0,0|2,0,1]=4 5981 B13R0.147 C=CC(O)CSCCCCCCCO 62a_100000730141_100000760002 [0,1,0,0,0,0|1,0,2]=4 5982 B13R0.147 C=CC(O)CSCCCCCCCO 62a_100000760002_100000730141 [0,1,0,0,0,0|1,0,2]=4 5983 B13R0.147 C=CCCCCCCCCC(=O)CC 1458a_100000210414_100011933949 [0,1,0,0,0,0|1,0,2]=4 5984 B13R0.147 C=CCCCCCCCCC(=O)CC 1458a_100000211349_100000210202 [0,1,0,0,0,0|1,0,2]=4 5985 B13R0.147 C=CCCCCCCCCC(=O)CO 1458a_100000210174_100011933949 [0,1,0,0,0,0|0,0,3]=4 5986 B13R0.147 C=CCCCCCCCCN(C)CC 2230a_100000225621_100011933949 [0,1,0,0,0,0|2,0,1]=4 5987 B13R0.147 C=CCCCCCCCCN(C)CC 269982a_100000225621_100011933949 [0,1,0,0,0,0|2,0,1]=4 5988 B13R0.147 C=CCCCCCCCNC(C)CC 2230a_100000209981_100012355270 [0,1,0,0,0,0|2,0,1]=4 5989 B13R0.147 C=CCCCCCCCN[C@H](C)CO 2230a_100000737577_100012355270 [0,1,0,0,0,0|1,0,2]=4 5990 B13R0.147 C=CCCCCCCCOC(C)CC 34a_100000730831_100011215416 [0,1,0,0,0,0|2,0,1]=4 5991 B13R0.147 C=CCCCCCCCOC(C)CC 7a_100000210228_100012355270 [0,1,0,0,0,0|2,0,1]=4 5992 B13R0.147 C=CCCCCCCCOC(C)CC 7a_100000730831_100000758301 [0,1,0,0,0,0|2,0,1]=4 5993 B13R0.147 C=CCCCCCCCOC(C)CO 34a_100000730831_100012180447 [0,1,0,0,0,0|1,0,2]=4 5994 B13R0.147 C=CCCCCCCCOC(C)CO 7a_100000730831_100012180447 [0,1,0,0,0,0|1,0,2]=4 5995 B13R0.147 C=CCCCCCCCSC(C)CC 62a_100000758301_100012355270 [0,1,0,0,0,0|2,0,1]=4 5996 B13R0.147 C=CCCCCCCCSC(C)CC 62a_100012355270_100000758301 [0,1,0,0,0,0|2,0,1]=4 5997 B13R0.147 C=CCCCCCCCSC(C)CO 62a_100012180447_100012355270 [0,1,0,0,0,0|1,0,2]=4 5998 B13R0.147 C=CCCCCCCCS[C@H](C)CO 62a_100012355270_100016084084 [0,1,0,0,0,0|1,0,2]=4 5999 B13R0.147 C=CCCCCCCCS[C@H](C)CO 62a_100016084084_100012355270 [0,1,0,0,0,0|1,0,2]=4 6000 B13R0.147 C=CCCCCCCNCC(C)CC 2230a_100020588543_100011215473 [0,1,0,0,0,0|2,0,1]=4 6001 B13R0.147 C=CCCCCCCNCC(C)CO 34a_100000744482_100011215473 [0,1,0,0,0,0|1,0,2]=4 6002 B13R0.147 C=CCCCCCCNCC(O)CC 2230a_100011218483_100011215473 [0,1,0,0,0,0|2,0,1]=4 6003 B13R0.147 C=CCCCCCCNC[C@@H](F)CO 34a_100015665980_100011215473 [0,1,0,0,0,0|1,0,2]=4 6004 B13R0.147 C=CCCCCCCNC[C@H](O)CO 2230a_100020644852_100011215473 [0,1,0,0,0,0|1,0,2]=4 6005 B13R0.147 C=CCCCCCCOCC(C)CC 34a_200011216477_100000748023 [0,1,0,0,0,0|2,0,1]=4 6006 B13R0.147 C=CCCCCCCOCC(C)CC 7a_200011216477_100000748023 [0,1,0,0,0,0|2,0,1]=4 6007 B13R0.147 C=CCCCCCCOCC(O)CC 34a_200011216477_100011218378 [0,1,0,0,0,0|2,0,1]=4 6008 B13R0.147 C=CCCCCCCOCC(O)CC 7a_200011216477_100011218378 [0,1,0,0,0,0|2,0,1]=4 6009 B13R0.147 C=CCCCCCCOCC(O)CO 34a_200011216477_100011219619 [0,1,0,0,0,0|1,0,2]=4 6010 B13R0.147 C=CCCCCCCOCC(O)CO 7a_200011216477_100011219619 [0,1,0,0,0,0|1,0,2]=4 6011 B13R0.147 C=CCCCCCCOC[C@@H](C)CC 34a_200011216477_100009816398 [0,1,0,0,0,0|2,0,1]=4 6012 B13R0.147 C=CCCCCCCOC[C@@H](C)CC 7a_100009816381_100011215473 [0,1,0,0,0,0|2,0,1]=4 6013 B13R0.147 C=CCCCCCCOC[C@@H](C)CC 7a_200011216477_100009816398 [0,1,0,0,0,0|2,0,1]=4 6014 B13R0.147 C=CCCCCCCOC[C@@H](C)CO 34a_200011216477_100000059175 [0,1,0,0,0,0|1,0,2]=4 6015 B13R0.147 C=CCCCCCCOC[C@@H](C)CO 7a_200011216477_100000059175 [0,1,0,0,0,0|1,0,2]=4 6016 B13R0.147 C=CCCCCCCOC[C@@H](O)CO 34a_200011216477_100009815848 [0,1,0,0,0,0|1,0,2]=4 6017 B13R0.147 C=CCCCCCCOC[C@@H](O)CO 7a_200011216477_100009815848 [0,1,0,0,0,0|1,0,2]=4 6018 B13R0.147 C=CCCCCCCSCC(C)CC 62a_100000748023_100011215473 [0,1,0,0,0,0|2,0,1]=4 6019 B13R0.147 C=CCCCCCCSCC(C)CC 62a_100011215473_100000748023 [0,1,0,0,0,0|2,0,1]=4 6020 B13R0.147 C=CCCCCCCSCC(O)CC 62a_100011215473_100011218378 [0,1,0,0,0,0|2,0,1]=4 6021 B13R0.147 C=CCCCCCCSCC(O)CC 62a_100011218378_100011215473 [0,1,0,0,0,0|2,0,1]=4 6022 B13R0.147 C=CCCCCCCSCC(O)CO 62a_100011215473_100011219619 [0,1,0,0,0,0|1,0,2]=4 6023 B13R0.147 C=CCCCCCCSCC(O)CO 62a_100011219619_100011215473 [0,1,0,0,0,0|1,0,2]=4 6024 B13R0.147 C=CCCCCCCSC[C@@H](C)CC 62a_100009816398_100011215473 [0,1,0,0,0,0|2,0,1]=4 6025 B13R0.147 C=CCCCCCCSC[C@@H](C)CC 62a_100011215473_100009816398 [0,1,0,0,0,0|2,0,1]=4 6026 B13R0.147 C=CCCCCCCSC[C@@H](C)CO 62a_100000059175_100011215473 [0,1,0,0,0,0|1,0,2]=4 6027 B13R0.147 C=CCCCCCCSC[C@@H](C)CO 62a_100011215473_100000059175 [0,1,0,0,0,0|1,0,2]=4 6028 B13R0.147 C=CCCCCCCSC[C@@H](O)CO 62a_100009815848_100011215473 [0,1,0,0,0,0|1,0,2]=4 6029 B13R0.147 C=CCCCCCCSC[C@@H](O)CO 62a_100011215473_100009815848 [0,1,0,0,0,0|1,0,2]=4 6030 B13R0.147 C=CCCCCCNCCC(C)CC 2230a_100020591266_100000700193 [0,1,0,0,0,0|2,0,1]=4 6031 B13R0.147 C=CCCCCCNCCC(C)CO 2230a_106354213184_100000700193 [0,1,0,0,0,0|1,0,2]=4 6032 B13R0.147 C=CCCCCCNCCC(C)CO 34a_106354213184_100000700193 [0,1,0,0,0,0|1,0,2]=4 6033 B13R0.147 C=CCCCCCOCCC(C)CC 7a_100011215188_100000700193 [0,1,0,0,0,0|2,0,1]=4 6034 B13R0.147 C=CCCCCOCCCC(C)CC 7a_100011216074_100011215482 [0,1,0,0,0,0|2,0,1]=4 6035 B13R0.147 C=CCCOCCCCCC(C)CC 7a_200000035636_100000754431 [0,1,0,0,0,0|2,0,1]=4 6036 B13R0.147 C=C[C@H](N)COCCCCCCCC 34a_100016989147_100000210759 [0,1,0,0,0,0|2,0,1]=4 6037 B13R0.147 C=C[C@H](N)COCCCCCCCO 34a_100016989147_100000760002 [0,1,0,0,0,0|1,0,2]=4 6038 B13R0.147 CC(C#N)NCCCCCCCCO 2230a_100000737613_100000033203 [0,1,0,0,0,0|2,0,1]=4 6039 B13R0.147 CC(C#N)NCCCCCCCCO 2230a_102515433106_100000184139 [0,1,0,0,0,0|2,0,1]=4 6040 B13R0.147 CC(C#N)OCCCCCCCCO 34a_100011218135_100000033203 [0,1,0,0,0,0|2,0,1]=4 6041 B13R0.147 CC(C#N)SCCCCCCCCO 62a_100000033203_100000703298 [0,1,0,0,0,0|2,0,1]=4 6042 B13R0.147 CC(C#N)SCCCCCCCCO 62a_100000703298_100000033203 [0,1,0,0,0,0|2,0,1]=4 6043 B13R0.147 CC(CF)OCCCCCCCCO 34a_100016041109_100000033203 [0,1,0,0,0,0|2,0,0]=3 6044 B13R0.147 CC(CF)OCCCCCCCCO 7a_100016041109_100000033203 [0,1,0,0,0,0|2,0,0]=3 6045 B13R0.147 CC(CN)COCCCCCCCO 34a_100000744482_100000760002 [0,1,0,0,0,0|2,0,0]=3 6046 B13R0.147 CC(CN)OCCCCCCCCO 34a_100000210904_100000033203 [0,1,0,0,0,0|2,0,0]=3 6047 B13R0.147 CC(CO)CCNCCCCCC#N 2230a_106354213184_100009813376 [0,1,0,0,0,0|2,0,1]=4 6048 B13R0.147 CC(CO)CCNCCCCCC=O 2230a_106354213184_100000139337 [0,1,0,0,0,0|2,0,1]=4 6049 B13R0.147 CC(CO)CCNCCCCCCF 2230a_106354213184_100015922095 [0,1,0,0,0,0|2,0,0]=3 6050 B13R0.147 CC(CO)CCNCCCCCCF 34a_106354213184_100015922095 [0,1,0,0,0,0|2,0,0]=3 6051 B13R0.147 CC(CO)CCNCCCCCCO 2230a_106354213184_100000766143 [0,1,0,0,0,0|2,0,0]=3 6052 B13R0.147 CC(CO)CCNCCCCCCO 34a_106354213184_100000766143 [0,1,0,0,0,0|2,0,0]=3 6053 B13R0.147 CC(CO)CNCCCCCCCO 34a_100000744482_100000760002 [0,1,0,0,0,0|2,0,0]=3 6054 B13R0.147 CC(CO)NCCCCCCCCO 2230a_102515433106_100012180447 [0,1,0,0,0,0|2,0,0]=3 6055 B13R0.147 CC(CO)NCCCCCCCCO 34a_102515433106_100012180447 [0,1,0,0,0,0|2,0,0]=3 6056 B13R0.147 CC(CO)OCCCCCCCCBr 34a_100009813846_100012180447 [0,1,0,0,0,0|2,0,0]=3 6057 B13R0.147 CC(CO)OCCCCCCCCBr 7a_100009813846_100012180447 [0,1,0,0,0,0|2,0,0]=3 6058 B13R0.147 CC(CO)OCCCCCCCCCl 34a_100000033203_100012180447 [0,1,0,0,0,0|2,0,0]=3 6059 B13R0.147 CC(CO)OCCCCCCCCCl 7a_100000033203_100012180447 [0,1,0,0,0,0|2,0,0]=3 6060 B13R0.147 CC(CO)OCCCCCCCCN 34a_102515433106_100012180447 [0,1,0,0,0,0|2,0,0]=3 6061 B13R0.147 CC(CO)OCCCCCNCCN 34a_103619048469_100012180447 [0,1,0,0,0,0|3,0,0]=4 6062 B13R0.147 CC(CO)SCCCCCCCCO 62a_100012180447_100000033203 [0,1,0,0,0,0|2,0,0]=3 6063 B13R0.147 CC/C=C\CCCCCN[C@H](C)CO 269862a_100000737577_100016288537 [0,1,0,0,0,0|1,0,2]=4 6064 B13R0.147 CC/C=C\CCCCCOC(C)CO 34a_100016268722_100012180447 [0,1,0,0,0,0|1,0,2]=4 6065 B13R0.147 CC/C=C\CCCCCOC(C)CO 7a_100016268722_100012180447 [0,1,0,0,0,0|1,0,2]=4 6066 B13R0.147 CC/C=C\CCCCOCC(O)CO 34a_100016287862_100011219619 [0,1,0,0,0,0|1,0,2]=4 6067 B13R0.147 CC/C=C\CCCCOCC(O)CO 7a_100016287862_100011219619 [0,1,0,0,0,0|1,0,2]=4 6068 B13R0.147 CC/C=C\CCCCOC[C@@H](C)CO 34a_100016287862_100000059175 [0,1,0,0,0,0|1,0,2]=4 6069 B13R0.147 CC/C=C\CCCCOC[C@@H](C)CO 7a_100016287862_100000059175 [0,1,0,0,0,0|1,0,2]=4 6070 B13R0.147 CC/C=C\CCCCOC[C@@H](O)CO 34a_100016287862_100009815848 [0,1,0,0,0,0|1,0,2]=4 6071 B13R0.147 CC/C=C\CCCCOC[C@@H](O)CO 7a_100016287862_100009815848 [0,1,0,0,0,0|1,0,2]=4 6072 B13R0.147 CCC#CCCCCCCC(=O)CO 1458a_100000210174_200000036426 [0,1,0,0,0,0|0,0,3]=4 6073 B13R0.147 CCC(=O)CCCCCCCCCF 1458a_200009909015_100000210202 [0,1,0,0,0,0|1,0,1]=3 6074 B13R0.147 CCC(=O)CCCCCCCCCO 1458a_100000210414_100009813782 [0,1,0,0,0,0|0,0,1]=2 6075 B13R0.147 CCC(=O)COCCCCCCCBr 7a_100000760002_100000747405 [0,1,0,0,0,0|2,0,1]=4 6076 B13R0.147 CCC(=O)COCCCCCCCO 34a_100000725409_100000760002 [0,1,0,0,0,0|1,0,1]=3 6077 B13R0.147 CCC(=O)CSCCCCCCCO 62a_100000747405_100000760002 [0,1,0,0,0,0|1,0,1]=3 6078 B13R0.147 CCC(=O)CSCCCCCCCO 62a_100000760002_100000747405 [0,1,0,0,0,0|1,0,1]=3 6079 B13R0.147 CCC(=O)NCCCCCCCCO 240690a_102515433106_100000210414 [0,1,0,0,0,0|1,0,1]=3 6080 B13R0.147 CCC(=O)NCCNCCCCCO 34a_100132302217_100000746330 [0,1,0,0,0,0|2,0,1]=4 6081 B13R0.147 CCC(=O)NCCOCCCCCO 34a_200000158885_100000746330 [0,1,0,0,0,0|2,0,1]=4 6082 B13R0.147 CCC(=O)NCCOCCCCCO 7a_200000158885_100000746330 [0,1,0,0,0,0|2,0,1]=4 6083 B13R0.147 CCC(=O)OCCOCCCCCO 7a_200000031056_100000746330 [0,1,0,0,0,0|2,0,1]=4 6084 B13R0.147 CCC(C)CCCCCOCCC#N 7a_200000035636_100000184422 [0,1,0,0,0,0|2,0,1]=4 6085 B13R0.147 CCC(C)CCCCCOCCCF 7a_200000035636_100011934791 [0,1,0,0,0,0|2,0,0]=3 6086 B13R0.147 CCC(C)CCCCCOCCCO 7a_200000035636_100011215043 [0,1,0,0,0,0|1,0,0]=2 6087 B13R0.147 CCC(C)CCCCCOCCOC 7a_200000035636_100000233755 [0,1,0,0,0,0|3,0,0]=4 6088 B13R0.147 CCC(C)CCCCCOCCSC 7a_200000035636_100000212216 [0,1,0,0,0,0|3,0,0]=4 6089 B13R0.147 CCC(C)CCCOCCCCC#N 7a_100011216074_100000211819 [0,1,0,0,0,0|2,0,1]=4 6090 B13R0.147 CCC(C)CCCOCCCCC=O 7a_100011216074_100000139335 [0,1,0,0,0,0|1,0,2]=4 6091 B13R0.147 CCC(C)CCCOCCCCCF 7a_100011216074_100000729378 [0,1,0,0,0,0|2,0,0]=3 6092 B13R0.147 CCC(C)CCCOCCCCCO 7a_100011216074_100000746330 [0,1,0,0,0,0|1,0,0]=2 6093 B13R0.147 CCC(C)CCCOCCCCOC 7a_100011216074_100000730899 [0,1,0,0,0,0|3,0,0]=4 6094 B13R0.147 CCC(C)CCCOCCOCCO 7a_100011216074_100011215305 [0,1,0,0,0,0|2,0,0]=3 6095 B13R0.147 CCC(C)CCNCCCCCC#N 2230a_100020591266_100009813376 [0,1,0,0,0,0|2,0,1]=4 6096 B13R0.147 CCC(C)CCNCCCCCC=O 2230a_100020591266_100000139337 [0,1,0,0,0,0|1,0,2]=4 6097 B13R0.147 CCC(C)CCNCCCCCCF 2230a_100020591266_100015922095 [0,1,0,0,0,0|2,0,0]=3 6098 B13R0.147 CCC(C)CCNCCCCCCO 2230a_100020591266_100000766143 [0,1,0,0,0,0|1,0,0]=2 6099 B13R0.147 CCC(C)CCOCCCCCC#N 7a_100011215188_100009813376 [0,1,0,0,0,0|2,0,1]=4 6100 B13R0.147 CCC(C)CCOCCCCCC=O 7a_100011215188_100000139337 [0,1,0,0,0,0|1,0,2]=4 6101 B13R0.147 CCC(C)CCOCCCCCCF 7a_100011215188_100015922095 [0,1,0,0,0,0|2,0,0]=3 6102 B13R0.147 CCC(C)CCOCCCCCCO 7a_100011215188_100000766143 [0,1,0,0,0,0|1,0,0]=2 6103 B13R0.147 CCC(C)CNCCCCCCC#N 2230a_100020588543_100009813337 [0,1,0,0,0,0|2,0,1]=4 6104 B13R0.147 CCC(C)CNCCCCCCCO 2230a_100011996573_100000748023 [0,1,0,0,0,0|1,0,0]=2 6105 B13R0.147 CCC(C)CNCCCCCCCO 2230a_100020588543_100000760002 [0,1,0,0,0,0|1,0,0]=2 6106 B13R0.147 CCC(C)CNCCCCCCCO 270004a_100011996573_100000243153 [0,1,0,0,0,0|1,0,0]=2 6107 B13R0.147 CCC(C)CNCCCCCCCO 34a_100011996573_100000748023 [0,1,0,0,0,0|1,0,0]=2 6108 B13R0.147 CCC(C)CNCCCCCCOC 2230a_100020588543_100011998445 [0,1,0,0,0,0|3,0,0]=4 6109 B13R0.147 CCC(C)CNCCCOCCCO 2230a_100011310245_100000748023 [0,1,0,0,0,0|2,0,0]=3 6110 B13R0.147 CCC(C)CNCCCOCCCO 270004a_100011310245_100000243153 [0,1,0,0,0,0|2,0,0]=3 6111 B13R0.147 CCC(C)CNCCCOCCCO 34a_100011310245_100000748023 [0,1,0,0,0,0|2,0,0]=3 6112 B13R0.147 CCC(C)COCCCCCCCBr 34a_100000760002_100000748023 [0,1,0,0,0,0|2,0,0]=3 6113 B13R0.147 CCC(C)COCCCCCCCBr 7a_100000760002_100000748023 [0,1,0,0,0,0|2,0,0]=3 6114 B13R0.147 CCC(C)COCCCCCCCN 34a_100011996573_100000748023 [0,1,0,0,0,0|2,0,0]=3 6115 B13R0.147 CCC(C)COCCCCCCOC 34a_200012092642_100000748023 [0,1,0,0,0,0|3,0,0]=4 6116 B13R0.147 CCC(C)COCCCCCCOC 7a_200012092642_100000748023 [0,1,0,0,0,0|3,0,0]=4 6117 B13R0.147 CCC(C)COCCCOCCCN 34a_100011310245_100000748023 [0,1,0,0,0,0|3,0,0]=4 6118 B13R0.147 CCC(C)CSCCCCCCC#N 62a_100000748023_100009813337 [0,1,0,0,0,0|2,0,1]=4 6119 B13R0.147 CCC(C)CSCCCCCCC#N 62a_100009813337_100000748023 [0,1,0,0,0,0|2,0,1]=4 6120 B13R0.147 CCC(C)CSCCCCCCCO 62a_100000748023_100000760002 [0,1,0,0,0,0|1,0,0]=2 6121 B13R0.147 CCC(C)CSCCCCCCCO 62a_100000760002_100000748023 [0,1,0,0,0,0|1,0,0]=2 6122 B13R0.147 CCC(C)CSCCCCCCOC 62a_100000748023_100011998445 [0,1,0,0,0,0|3,0,0]=4 6123 B13R0.147 CCC(C)CSCCCCCCOC 62a_100011998445_100000748023 [0,1,0,0,0,0|3,0,0]=4 6124 B13R0.147 CCC(C)NCCCCCCCCO 2230a_100000209981_100000033203 [0,1,0,0,0,0|1,0,0]=2 6125 B13R0.147 CCC(C)NCCCCCCCCO 2230a_102515433106_100000758301 [0,1,0,0,0,0|1,0,0]=2 6126 B13R0.147 CCC(C)NCCCCCCCCO 34a_102515433106_100011215416 [0,1,0,0,0,0|1,0,0]=2 6127 B13R0.147 CCC(C)NCCOCCOCCO 2230a_100000209981_100000032323 [0,1,0,0,0,0|3,0,0]=4 6128 B13R0.147 CCC(C)NCCOCCOCCO 2230a_100011998139_100000758301 [0,1,0,0,0,0|3,0,0]=4 6129 B13R0.147 CCC(C)NCCOCCOCCO 34a_100011998139_100011215416 [0,1,0,0,0,0|3,0,0]=4 6130 B13R0.147 CCC(C)OCCCCCCCCBr 34a_100009813846_100011215416 [0,1,0,0,0,0|2,0,0]=3 6131 B13R0.147 CCC(C)OCCCCCCCCBr 7a_100009813846_100000758301 [0,1,0,0,0,0|2,0,0]=3 6132 B13R0.147 CCC(C)OCCCCCCCCCl 34a_100000033203_100011215416 [0,1,0,0,0,0|2,0,0]=3 6133 B13R0.147 CCC(C)OCCCCCCCCCl 7a_100000033203_100000758301 [0,1,0,0,0,0|2,0,0]=3 6134 B13R0.147 CCC(C)OCCCCCCCCN 34a_102515433106_100011215416 [0,1,0,0,0,0|2,0,0]=3 6135 B13R0.147 CCC(C)OCCCCCCCCO 7a_100000210228_100000033203 [0,1,0,0,0,0|1,0,0]=2 6136 B13R0.147 CCC(C)OCCCCCNCCN 34a_103619048469_100011215416 [0,1,0,0,0,0|3,0,0]=4 6137 B13R0.147 CCC(C)OCCOCCOCCO 7a_100000210228_100000032323 [0,1,0,0,0,0|3,0,0]=4 6138 B13R0.147 CCC(C)SCCCCCCCCO 62a_100000033203_100000758301 [0,1,0,0,0,0|1,0,0]=2 6139 B13R0.147 CCC(C)SCCCCCCCCO 62a_100000758301_100000033203 [0,1,0,0,0,0|1,0,0]=2 6140 B13R0.147 CCC(C)SCCOCCOCCO 62a_100000032323_100000758301 [0,1,0,0,0,0|3,0,0]=4 6141 B13R0.147 CCC(C)SCCOCCOCCO 62a_100000758301_100000032323 [0,1,0,0,0,0|3,0,0]=4 6142 B13R0.147 CCC(O)CNCCCCCCC#N 2230a_100011218483_100009813337 [0,1,0,0,0,0|2,0,1]=4 6143 B13R0.147 CCC(O)CNCCCCCCCO 2230a_100011218483_100000760002 [0,1,0,0,0,0|1,0,0]=2 6144 B13R0.147 CCC(O)CNCCCCCCCO 2230a_100011996573_100011218378 [0,1,0,0,0,0|1,0,0]=2 6145 B13R0.147 CCC(O)CNCCCCCCCO 34a_100011996573_100011218378 [0,1,0,0,0,0|1,0,0]=2 6146 B13R0.147 CCC(O)CNCCCCCCOC 2230a_100011218483_100011998445 [0,1,0,0,0,0|3,0,0]=4 6147 B13R0.147 CCC(O)CNCCCOCCCO 2230a_100011310245_100011218378 [0,1,0,0,0,0|2,0,0]=3 6148 B13R0.147 CCC(O)CNCCCOCCCO 34a_100011310245_100011218378 [0,1,0,0,0,0|2,0,0]=3 6149 B13R0.147 CCC(O)COCCCCCCCBr 34a_100000760002_100011218378 [0,1,0,0,0,0|2,0,0]=3 6150 B13R0.147 CCC(O)COCCCCCCCBr 7a_100000760002_100011218378 [0,1,0,0,0,0|2,0,0]=3 6151 B13R0.147 CCC(O)COCCCCCCCN 34a_100011996573_100011218378 [0,1,0,0,0,0|2,0,0]=3 6152 B13R0.147 CCC(O)COCCCCCCOC 34a_200012092642_100011218378 [0,1,0,0,0,0|3,0,0]=4 6153 B13R0.147 CCC(O)COCCCCCCOC 7a_200012092642_100011218378 [0,1,0,0,0,0|3,0,0]=4 6154 B13R0.147 CCC(O)COCCCOCCCN 34a_100011310245_100011218378 [0,1,0,0,0,0|3,0,0]=4 6155 B13R0.147 CCC(O)CSCCCCCCC#N 62a_100009813337_100011218378 [0,1,0,0,0,0|2,0,1]=4 6156 B13R0.147 CCC(O)CSCCCCCCC#N 62a_100011218378_100009813337 [0,1,0,0,0,0|2,0,1]=4 6157 B13R0.147 CCC(O)CSCCCCCCCO 62a_100000760002_100011218378 [0,1,0,0,0,0|1,0,0]=2 6158 B13R0.147 CCC(O)CSCCCCCCCO 62a_100011218378_100000760002 [0,1,0,0,0,0|1,0,0]=2 6159 B13R0.147 CCC(O)CSCCCCCCOC 62a_100011218378_100011998445 [0,1,0,0,0,0|3,0,0]=4 6160 B13R0.147 CCC(O)CSCCCCCCOC 62a_100011998445_100011218378 [0,1,0,0,0,0|3,0,0]=4 6161 B13R0.147 CCCC/C=C\CCOCC(O)CO 34a_200016286491_100011219619 [0,1,0,0,0,0|1,0,2]=4 6162 B13R0.147 CCCC/C=C\CCOCC(O)CO 7a_200016286491_100011219619 [0,1,0,0,0,0|1,0,2]=4 6163 B13R0.147 CCCC/C=C\CCOC[C@@H](C)CO 34a_200016286491_100000059175 [0,1,0,0,0,0|1,0,2]=4 6164 B13R0.147 CCCC/C=C\CCOC[C@@H](C)CO 7a_200016286491_100000059175 [0,1,0,0,0,0|1,0,2]=4 6165 B13R0.147 CCCC/C=C\CCOC[C@@H](O)CO 34a_200016286491_100009815848 [0,1,0,0,0,0|1,0,2]=4 6166 B13R0.147 CCCC/C=C\CCOC[C@@H](O)CO 7a_200016286491_100009815848 [0,1,0,0,0,0|1,0,2]=4 6167 B13R0.147 CCCCC#CCCCN[C@H](C)CO 2230a_100000737577_200000047210 [0,1,0,0,0,0|1,0,2]=4 6168 B13R0.147 CCCCC#CCCCSC(C)CO 62a_100012180447_200000047210 [0,1,0,0,0,0|1,0,2]=4 6169 B13R0.147 CCCCC#CCCCS[C@H](C)CO 62a_100016084084_200000047210 [0,1,0,0,0,0|1,0,2]=4 6170 B13R0.147 CCCCC#CCCCS[C@H](C)CO 62a_200000047210_100016084084 [0,1,0,0,0,0|1,0,2]=4 6171 B13R0.147 CCCCC#CCCOCC(O)CO 34a_100000037610_100011219619 [0,1,0,0,0,0|1,0,2]=4 6172 B13R0.147 CCCCC#CCCOCC(O)CO 7a_100000037610_100011219619 [0,1,0,0,0,0|1,0,2]=4 6173 B13R0.147 CCCCC#CCCOC[C@@H](C)CO 34a_100000037610_100000059175 [0,1,0,0,0,0|1,0,2]=4 6174 B13R0.147 CCCCC#CCCOC[C@@H](C)CO 7a_100000037610_100000059175 [0,1,0,0,0,0|1,0,2]=4 6175 B13R0.147 CCCCC#CCCOC[C@@H](O)CO 34a_100000037610_100009815848 [0,1,0,0,0,0|1,0,2]=4 6176 B13R0.147 CCCCC#CCCOC[C@@H](O)CO 7a_100000037610_100009815848 [0,1,0,0,0,0|1,0,2]=4 6177 B13R0.147 CCCCC/C=C/COCC(O)CO 34a_100016258190_100011219619 [0,1,0,0,0,0|1,0,2]=4 6178 B13R0.147 CCCCC/C=C/COCC(O)CO 7a_100016258190_100011219619 [0,1,0,0,0,0|1,0,2]=4 6179 B13R0.147 CCCCC/C=C/COC[C@@H](C)CO 34a_100016258190_100000059175 [0,1,0,0,0,0|1,0,2]=4 6180 B13R0.147 CCCCC/C=C/COC[C@@H](C)CO 7a_100016258190_100000059175 [0,1,0,0,0,0|1,0,2]=4 6181 B13R0.147 CCCCC/C=C/COC[C@@H](O)CO 34a_100016258190_100009815848 [0,1,0,0,0,0|1,0,2]=4 6182 B13R0.147 CCCCC/C=C/COC[C@@H](O)CO 7a_100016258190_100009815848 [0,1,0,0,0,0|1,0,2]=4 6183 B13R0.147 CCCCC/C=C\CCOC(C)CO 34a_100016277358_100012180447 [0,1,0,0,0,0|1,0,2]=4 6184 B13R0.147 CCCCC/C=C\CCOC(C)CO 7a_100016277358_100012180447 [0,1,0,0,0,0|1,0,2]=4 6185 B13R0.147 CCCCCC#CCCOC(C)CO 34a_200000042877_100012180447 [0,1,0,0,0,0|1,0,2]=4 6186 B13R0.147 CCCCCC#CCCOC(C)CO 7a_200000042877_100012180447 [0,1,0,0,0,0|1,0,2]=4 6187 B13R0.147 CCCCCC#CCNCC(C)CO 34a_100000744482_100009816472 [0,1,0,0,0,0|1,0,2]=4 6188 B13R0.147 CCCCCC#CCNC[C@@H](F)CO 34a_100015665980_100009816472 [0,1,0,0,0,0|1,0,2]=4 6189 B13R0.147 CCCCCC#CCNC[C@H](O)CO 2230a_100020644852_100009816472 [0,1,0,0,0,0|1,0,2]=4 6190 B13R0.147 CCCCCC#CCOCC(O)CO 34a_200000033628_100011219619 [0,1,0,0,0,0|1,0,2]=4 6191 B13R0.147 CCCCCC#CCOCC(O)CO 7a_200000033628_100011219619 [0,1,0,0,0,0|1,0,2]=4 6192 B13R0.147 CCCCCC#CCOC[C@@H](C)CO 34a_200000033628_100000059175 [0,1,0,0,0,0|1,0,2]=4 6193 B13R0.147 CCCCCC#CCOC[C@@H](C)CO 7a_200000033628_100000059175 [0,1,0,0,0,0|1,0,2]=4 6194 B13R0.147 CCCCCC#CCOC[C@@H](O)CO 34a_200000033628_100009815848 [0,1,0,0,0,0|1,0,2]=4 6195 B13R0.147 CCCCCC#CCOC[C@@H](O)CO 7a_200000033628_100009815848 [0,1,0,0,0,0|1,0,2]=4 6196 B13R0.147 CCCCCC#CCSCC(O)CO 62a_100009816472_100011219619 [0,1,0,0,0,0|1,0,2]=4 6197 B13R0.147 CCCCCC#CCSCC(O)CO 62a_100011219619_100009816472 [0,1,0,0,0,0|1,0,2]=4 6198 B13R0.147 CCCCCC#CCSC[C@@H](C)CO 62a_100000059175_100009816472 [0,1,0,0,0,0|1,0,2]=4 6199 B13R0.147 CCCCCC#CCSC[C@@H](C)CO 62a_100009816472_100000059175 [0,1,0,0,0,0|1,0,2]=4 6200 B13R0.147 CCCCCC#CCSC[C@@H](O)CO 62a_100009815848_100009816472 [0,1,0,0,0,0|1,0,2]=4 6201 B13R0.147 CCCCCC#CCSC[C@@H](O)CO 62a_100009816472_100009815848 [0,1,0,0,0,0|1,0,2]=4 6202 B13R0.147 CCCCCC/C=C/COC(C)CO 34a_200016276170_100012180447 [0,1,0,0,0,0|1,0,2]=4 6203 B13R0.147 CCCCCC/C=C/COC(C)CO 7a_200016276170_100012180447 [0,1,0,0,0,0|1,0,2]=4 6204 B13R0.147 CCCCCCC#CCOC(C)CO 34a_200000037284_100012180447 [0,1,0,0,0,0|1,0,2]=4 6205 B13R0.147 CCCCCCC#CCOC(C)CO 7a_200000037284_100012180447 [0,1,0,0,0,0|1,0,2]=4 6206 B13R0.147 CCCCCCCCCCC(=O)CC 1458a_100000210375_100000210202 [0,1,0,0,0,0|1,0,1]=3 6207 B13R0.147 CCCCCCCCCCC(=O)CC 1458a_100000210414_100000210319 [0,1,0,0,0,0|1,0,1]=3 6208 B13R0.147 CCCCCCCCCCC(=O)CF 1458a_100000210375_100015361967 [0,1,0,0,0,0|1,0,1]=3 6209 B13R0.147 CCCCCCCCCCC(=O)CO 1458a_100000210174_100000210319 [0,1,0,0,0,0|0,0,1]=2 6210 B13R0.147 CCCCCCCCCCC(=O)NC 11a_106832991635_100000210375 [0,1,0,0,0,0|2,0,1]=4 6211 B13R0.147 CCCCCCCCCCC(=O)NC 1626a_100102657272_100000210375 [0,1,0,0,0,0|2,0,1]=4 6212 B13R0.147 CCCCCCCCCCC(=O)NC 240690a_100102657272_100000210375 [0,1,0,0,0,0|2,0,1]=4 6213 B13R0.147 CCCCCCCCCCC(C)NC 270004a_106832991635_200011219864 [0,1,0,0,0,0|2,0,0]=3 6214 B13R0.147 CCCCCCCCCCC(C)OC 34a_100011215000_200000210301 [0,1,0,0,0,0|2,0,0]=3 6215 B13R0.147 CCCCCCCCCCC(C)OC 7a_100011215000_200000210301 [0,1,0,0,0,0|2,0,0]=3 6216 B13R0.147 CCCCCCCCCCC(C)O[13CH3] 34a_100011215000_200025704644 [0,1,0,0,0,0|2,0,0]=3 6217 B13R0.147 CCCCCCCCCCC(C)O[13CH3] 7a_100011215000_200025704644 [0,1,0,0,0,0|2,0,0]=3 6218 B13R0.147 CCCCCCCCCCN(C)CC 2230a_100000207566_100000210202 [0,1,0,0,0,0|2,0,0]=3 6219 B13R0.147 CCCCCCCCCCN(C)CC 2230a_100000225621_100000210320 [0,1,0,0,0,0|2,0,0]=3 6220 B13R0.147 CCCCCCCCCCN(C)CC 269982a_100000207566_100000204670 [0,1,0,0,0,0|2,0,0]=3 6221 B13R0.147 CCCCCCCCCCN(C)CC 269982a_100000225621_100000210320 [0,1,0,0,0,0|2,0,0]=3 6222 B13R0.147 CCCCCCCCCCN(C)CF 269982a_100000207566_100015361967 [0,1,0,0,0,0|2,0,0]=3 6223 B13R0.147 CCCCCCCCCNC(=O)CC 11a_100000212291_100000210414 [0,1,0,0,0,0|2,0,1]=4 6224 B13R0.147 CCCCCCCCCNC(=O)CC 1626a_100000212291_100000210414 [0,1,0,0,0,0|2,0,1]=4 6225 B13R0.147 CCCCCCCCCNC(=O)CC 240690a_100000212291_100000210414 [0,1,0,0,0,0|2,0,1]=4 6226 B13R0.147 CCCCCCCCCNC(=O)CC 527a_100000212291_100000210414 [0,1,0,0,0,0|2,0,1]=4 6227 B13R0.147 CCCCCCCCCNC(=O)CO 240690a_100000212291_100000210174 [0,1,0,0,0,0|1,0,1]=3 6228 B13R0.147 CCCCCCCCCNC(=O)CO 527a_100000212291_100000210174 [0,1,0,0,0,0|1,0,1]=3 6229 B13R0.147 CCCCCCCCCNC(C)C#N 2230a_100000212291_100000184139 [0,1,0,0,0,0|2,0,1]=4 6230 B13R0.147 CCCCCCCCCNC(C)C#N 2230a_100000737613_100011214924 [0,1,0,0,0,0|2,0,1]=4 6231 B13R0.147 CCCCCCCCCNC(C)CC 2230a_100000209981_100011214924 [0,1,0,0,0,0|2,0,0]=3 6232 B13R0.147 CCCCCCCCCNC(C)CC 2230a_100000212291_100000758301 [0,1,0,0,0,0|2,0,0]=3 6233 B13R0.147 CCCCCCCCCNC(C)CC 34a_100000212291_100011215416 [0,1,0,0,0,0|2,0,0]=3 6234 B13R0.147 CCCCCCCCCNC(C)CO 2230a_100000212291_100012180447 [0,1,0,0,0,0|1,0,0]=2 6235 B13R0.147 CCCCCCCCCNC(C)CO 34a_100000212291_100012180447 [0,1,0,0,0,0|1,0,0]=2 6236 B13R0.147 CCCCCCCCCN[C@H](C)CO 2230a_100000737577_100011214924 [0,1,0,0,0,0|1,0,0]=2 6237 B13R0.147 CCCCCCCCCOC(C)C#N 34a_100011218135_100011214924 [0,1,0,0,0,0|2,0,1]=4 6238 B13R0.147 CCCCCCCCCOC(C)C#N 7a_100000210712_100000703298 [0,1,0,0,0,0|2,0,1]=4 6239 B13R0.147 CCCCCCCCCOC(C)CC 34a_100000210712_100011215416 [0,1,0,0,0,0|2,0,0]=3 6240 B13R0.147 CCCCCCCCCOC(C)CC 7a_100000210228_100000210328 [0,1,0,0,0,0|2,0,0]=3 6241 B13R0.147 CCCCCCCCCOC(C)CC 7a_100000210712_100000758301 [0,1,0,0,0,0|2,0,0]=3 6242 B13R0.147 CCCCCCCCCOC(C)CF 34a_100016041109_100011214924 [0,1,0,0,0,0|2,0,0]=3 6243 B13R0.147 CCCCCCCCCOC(C)CF 7a_100016041109_100000210328 [0,1,0,0,0,0|2,0,0]=3 6244 B13R0.147 CCCCCCCCCOC(C)CN 34a_100000210904_100011214924 [0,1,0,0,0,0|2,0,0]=3 6245 B13R0.147 CCCCCCCCCOC(C)CO 34a_100000210712_100012180447 [0,1,0,0,0,0|1,0,0]=2 6246 B13R0.147 CCCCCCCCCOC(C)CO 7a_100000210712_100012180447 [0,1,0,0,0,0|1,0,0]=2 6247 B13R0.147 CCCCCCCCCSC(C)C#N 62a_100000703298_100000210670 [0,1,0,0,0,0|2,0,1]=4 6248 B13R0.147 CCCCCCCCCSC(C)CC 62a_100000758301_100000210670 [0,1,0,0,0,0|2,0,0]=3 6249 B13R0.147 CCCCCCCCCSC(C)CO 62a_100012180447_100000210670 [0,1,0,0,0,0|1,0,0]=2 6250 B13R0.147 CCCCCCCCCSC(C)OC 62a_100009879195_100000210670 [0,1,0,0,0,0|3,0,0]=4 6251 B13R0.147 CCCCCCCCCSC(F)C#N 62a_200000117898_100000210670 [0,1,0,0,0,0|2,0,1]=4 6252 B13R0.147 CCCCCCCCCS[C@H](C)CO 62a_100016084084_100000210670 [0,1,0,0,0,0|1,0,0]=2 6253 B13R0.147 CCCCCCCCNCC(C)CC 2230a_100000229939_100000748023 [0,1,0,0,0,0|2,0,0]=3 6254 B13R0.147 CCCCCCCCNCC(C)CC 2230a_100020588543_100000210759 [0,1,0,0,0,0|2,0,0]=3 6255 B13R0.147 CCCCCCCCNCC(C)CC 270004a_100000229939_100000243153 [0,1,0,0,0,0|2,0,0]=3 6256 B13R0.147 CCCCCCCCNCC(C)CC 34a_100000229939_100000748023 [0,1,0,0,0,0|2,0,0]=3 6257 B13R0.147 CCCCCCCCNCC(C)CO 34a_100000744482_100000210759 [0,1,0,0,0,0|1,0,0]=2 6258 B13R0.147 CCCCCCCCNCC(O)CC 2230a_100000229939_100011218378 [0,1,0,0,0,0|2,0,0]=3 6259 B13R0.147 CCCCCCCCNCC(O)CC 2230a_100011218483_100000210759 [0,1,0,0,0,0|2,0,0]=3 6260 B13R0.147 CCCCCCCCNCC(O)CC 34a_100000229939_100011218378 [0,1,0,0,0,0|2,0,0]=3 6261 B13R0.147 CCCCCCCCNCC(O)CO 2230a_100000229939_100011219619 [0,1,0,0,0,0|1,0,0]=2 6262 B13R0.147 CCCCCCCCNCC(O)CO 34a_100000229939_100011219619 [0,1,0,0,0,0|1,0,0]=2 6263 B13R0.147 CCCCCCCCNC[C@@H](C)CC 2230a_100000229939_100009816398 [0,1,0,0,0,0|2,0,0]=3 6264 B13R0.147 CCCCCCCCNC[C@@H](C)CC 34a_100000229939_100009816398 [0,1,0,0,0,0|2,0,0]=3 6265 B13R0.147 CCCCCCCCNC[C@@H](C)CO 2230a_100000229939_100000059175 [0,1,0,0,0,0|1,0,0]=2 6266 B13R0.147 CCCCCCCCNC[C@@H](C)CO 34a_100000229939_100000059175 [0,1,0,0,0,0|1,0,0]=2 6267 B13R0.147 CCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100000210759 [0,1,0,0,0,0|3,0,0]=4 6268 B13R0.147 CCCCCCCCNC[C@@H](F)CO 34a_100015665980_100000210759 [0,1,0,0,0,0|1,0,0]=2 6269 B13R0.147 CCCCCCCCNC[C@@H](O)CF 2230a_100000229939_100015614560 [0,1,0,0,0,0|2,0,0]=3 6270 B13R0.147 CCCCCCCCNC[C@@H](O)CF 34a_100000229939_100015614560 [0,1,0,0,0,0|2,0,0]=3 6271 B13R0.147 CCCCCCCCNC[C@@H](O)CO 2230a_100000229939_100009815848 [0,1,0,0,0,0|1,0,0]=2 6272 B13R0.147 CCCCCCCCNC[C@@H](O)CO 34a_100000229939_100009815848 [0,1,0,0,0,0|1,0,0]=2 6273 B13R0.147 CCCCCCCCNC[C@H](O)CO 2230a_100020644852_100000210759 [0,1,0,0,0,0|1,0,0]=2 6274 B13R0.147 CCCCCCCCOCC(=O)CC 1458a_100000759886_100000210202 [0,1,0,0,0,0|2,0,1]=4 6275 B13R0.147 CCCCCCCCOCC(=O)CC 34a_100000725409_100000210759 [0,1,0,0,0,0|2,0,1]=4 6276 B13R0.147 CCCCCCCCOCC(=O)CC 7a_100000210232_100000747405 [0,1,0,0,0,0|2,0,1]=4 6277 B13R0.147 CCCCCCCCOCC(=O)CF 1458a_100000759886_100015361967 [0,1,0,0,0,0|2,0,1]=4 6278 B13R0.147 CCCCCCCCOCC(C)CC 34a_100000210232_100000748023 [0,1,0,0,0,0|2,0,0]=3 6279 B13R0.147 CCCCCCCCOCC(C)CC 7a_100000210232_100000748023 [0,1,0,0,0,0|2,0,0]=3 6280 B13R0.147 CCCCCCCCOCC(C)CN 34a_100000744482_100000210759 [0,1,0,0,0,0|2,0,0]=3 6281 B13R0.147 CCCCCCCCOCC(C)OC 34a_100000690652_100000210759 [0,1,0,0,0,0|3,0,0]=4 6282 B13R0.147 CCCCCCCCOCC(Cl)CCl 34a_100000033668_100000210759 [0,1,0,0,0,0|2,0,0]=3 6283 B13R0.147 CCCCCCCCOCC(O)CC 34a_100000210232_100011218378 [0,1,0,0,0,0|2,0,0]=3 6284 B13R0.147 CCCCCCCCOCC(O)CC 7a_100000210232_100011218378 [0,1,0,0,0,0|2,0,0]=3 6285 B13R0.147 CCCCCCCCOCC(O)CO 34a_100000210232_100011219619 [0,1,0,0,0,0|1,0,0]=2 6286 B13R0.147 CCCCCCCCOCC(O)CO 7a_100000210232_100011219619 [0,1,0,0,0,0|1,0,0]=2 6287 B13R0.147 CCCCCCCCOC[C@@H](C)CC 34a_100000210232_100009816398 [0,1,0,0,0,0|2,0,0]=3 6288 B13R0.147 CCCCCCCCOC[C@@H](C)CC 7a_100000210232_100009816398 [0,1,0,0,0,0|2,0,0]=3 6289 B13R0.147 CCCCCCCCOC[C@@H](C)CC 7a_100009816381_100000210759 [0,1,0,0,0,0|2,0,0]=3 6290 B13R0.147 CCCCCCCCOC[C@@H](C)CO 34a_100000210232_100000059175 [0,1,0,0,0,0|1,0,0]=2 6291 B13R0.147 CCCCCCCCOC[C@@H](C)CO 7a_100000210232_100000059175 [0,1,0,0,0,0|1,0,0]=2 6292 B13R0.147 CCCCCCCCOC[C@@H](O)CF 34a_100000210232_100015614560 [0,1,0,0,0,0|2,0,0]=3 6293 B13R0.147 CCCCCCCCOC[C@@H](O)CF 7a_100000210232_100015614560 [0,1,0,0,0,0|2,0,0]=3 6294 B13R0.147 CCCCCCCCOC[C@@H](O)CO 34a_100000210232_100009815848 [0,1,0,0,0,0|1,0,0]=2 6295 B13R0.147 CCCCCCCCOC[C@@H](O)CO 7a_100000210232_100009815848 [0,1,0,0,0,0|1,0,0]=2 6296 B13R0.147 CCCCCCCCOC[C@H](F)CN 34a_100015665980_100000210759 [0,1,0,0,0,0|2,0,0]=3 6297 B13R0.147 CCCCCCCCSCC(=O)CC 62a_100000210759_100000747405 [0,1,0,0,0,0|2,0,1]=4 6298 B13R0.147 CCCCCCCCSCC(=O)CC 62a_100000747405_100000210317 [0,1,0,0,0,0|2,0,1]=4 6299 B13R0.147 CCCCCCCCSCC(C)CC 62a_100000210759_100000748023 [0,1,0,0,0,0|2,0,0]=3 6300 B13R0.147 CCCCCCCCSCC(C)CC 62a_100000748023_100000210317 [0,1,0,0,0,0|2,0,0]=3 6301 B13R0.147 CCCCCCCCSCC(O)CC 62a_100000210759_100011218378 [0,1,0,0,0,0|2,0,0]=3 6302 B13R0.147 CCCCCCCCSCC(O)CC 62a_100011218378_100000210317 [0,1,0,0,0,0|2,0,0]=3 6303 B13R0.147 CCCCCCCCSCC(O)CO 62a_100000210759_100011219619 [0,1,0,0,0,0|1,0,0]=2 6304 B13R0.147 CCCCCCCCSCC(O)CO 62a_100011219619_100000210317 [0,1,0,0,0,0|1,0,0]=2 6305 B13R0.147 CCCCCCCCSC[C@@H](C)CC 62a_100000210759_100009816398 [0,1,0,0,0,0|2,0,0]=3 6306 B13R0.147 CCCCCCCCSC[C@@H](C)CC 62a_100009816398_100000210317 [0,1,0,0,0,0|2,0,0]=3 6307 B13R0.147 CCCCCCCCSC[C@@H](C)CO 62a_100000059175_100000210317 [0,1,0,0,0,0|1,0,0]=2 6308 B13R0.147 CCCCCCCCSC[C@@H](C)CO 62a_100000210759_100000059175 [0,1,0,0,0,0|1,0,0]=2 6309 B13R0.147 CCCCCCCCSC[C@@H](O)CF 62a_100000210759_100015614560 [0,1,0,0,0,0|2,0,0]=3 6310 B13R0.147 CCCCCCCCSC[C@@H](O)CF 62a_100015614560_100000210317 [0,1,0,0,0,0|2,0,0]=3 6311 B13R0.147 CCCCCCCCSC[C@@H](O)CO 62a_100000210759_100009815848 [0,1,0,0,0,0|1,0,0]=2 6312 B13R0.147 CCCCCCCCSC[C@@H](O)CO 62a_100009815848_100000210317 [0,1,0,0,0,0|1,0,0]=2 6313 B13R0.147 CCCCCCCNCCC(C)CC 2230a_100020591266_100000210681 [0,1,0,0,0,0|2,0,0]=3 6314 B13R0.147 CCCCCCCNCCC(C)CO 2230a_106354213184_100000210681 [0,1,0,0,0,0|1,0,0]=2 6315 B13R0.147 CCCCCCCNCCC(C)CO 34a_106354213184_100000210614 [0,1,0,0,0,0|1,0,0]=2 6316 B13R0.147 CCCCCCCOCCC(=NO)N 34a_100000749954_100000210614 [0,1,0,0,0,0|2,0,1]=4 6317 B13R0.147 CCCCCCCOCCC(C)CC 7a_100011215188_100000210614 [0,1,0,0,0,0|2,0,0]=3 6318 B13R0.147 CCCCCCCOCCC(C)OC 7a_100000764861_100000210614 [0,1,0,0,0,0|3,0,0]=4 6319 B13R0.147 CCCCCCNCCCN(C)CC 2230a_100000210581_100015186262 [0,1,0,0,0,0|3,0,0]=4 6320 B13R0.147 CCCCCCOCCCC(C)CC 7a_100011216074_100000210314 [0,1,0,0,0,0|2,0,0]=3 6321 B13R0.147 CCCCCCOCCCN(C)CC 7a_100000210259_100015186262 [0,1,0,0,0,0|3,0,0]=4 6322 B13R0.147 CCCCCCOCCC[C@@H](C)CN 34a_100160569302_100000210314 [0,1,0,0,0,0|2,0,0]=3 6323 B13R0.147 CCCCCCOCCOC(C)CC 34a_100000691444_100011215416 [0,1,0,0,0,0|3,0,0]=4 6324 B13R0.147 CCCCCCOCCOC(C)CC 7a_100000691444_100000758301 [0,1,0,0,0,0|3,0,0]=4 6325 B13R0.147 CCCCCCOCCOC(C)CO 34a_100000691444_100012180447 [0,1,0,0,0,0|2,0,0]=3 6326 B13R0.147 CCCCCCOCCOC(C)CO 7a_100000691444_100012180447 [0,1,0,0,0,0|2,0,0]=3 6327 B13R0.147 CCCCCCSCCCN(C)CC 62a_100000210314_100015186262 [0,1,0,0,0,0|3,0,0]=4 6328 B13R0.147 CCCCCNCCOCC(C)CC 34a_100000224656_100000748023 [0,1,0,0,0,0|3,0,0]=4 6329 B13R0.147 CCCCCNCCOCC(O)CC 34a_100000224656_100011218378 [0,1,0,0,0,0|3,0,0]=4 6330 B13R0.147 CCCCCNCCOCC(O)CO 34a_100000224656_100011219619 [0,1,0,0,0,0|2,0,0]=3 6331 B13R0.147 CCCCCNCCOC[C@@H](C)CC 34a_100000224656_100009816398 [0,1,0,0,0,0|3,0,0]=4 6332 B13R0.147 CCCCCNCCOC[C@@H](C)CO 34a_100000224656_100000059175 [0,1,0,0,0,0|2,0,0]=3 6333 B13R0.147 CCCCCNCCOC[C@@H](O)CF 34a_100000224656_100015614560 [0,1,0,0,0,0|3,0,0]=4 6334 B13R0.147 CCCCCNCCOC[C@@H](O)CO 34a_100000224656_100009815848 [0,1,0,0,0,0|2,0,0]=3 6335 B13R0.147 CCCCCOCCOCC(C)CC 34a_100011215259_100000748023 [0,1,0,0,0,0|3,0,0]=4 6336 B13R0.147 CCCCCOCCOCC(C)CC 7a_100011215259_100000748023 [0,1,0,0,0,0|3,0,0]=4 6337 B13R0.147 CCCCCOCCOCC(O)CC 34a_100011215259_100011218378 [0,1,0,0,0,0|3,0,0]=4 6338 B13R0.147 CCCCCOCCOCC(O)CC 7a_100011215259_100011218378 [0,1,0,0,0,0|3,0,0]=4 6339 B13R0.147 CCCCCOCCOCC(O)CO 34a_100011215259_100011219619 [0,1,0,0,0,0|2,0,0]=3 6340 B13R0.147 CCCCCOCCOCC(O)CO 7a_100011215259_100011219619 [0,1,0,0,0,0|2,0,0]=3 6341 B13R0.147 CCCCCOCCOC[C@@H](C)CC 34a_100011215259_100009816398 [0,1,0,0,0,0|3,0,0]=4 6342 B13R0.147 CCCCCOCCOC[C@@H](C)CC 7a_100011215259_100009816398 [0,1,0,0,0,0|3,0,0]=4 6343 B13R0.147 CCCCCOCCOC[C@@H](C)CO 34a_100011215259_100000059175 [0,1,0,0,0,0|2,0,0]=3 6344 B13R0.147 CCCCCOCCOC[C@@H](C)CO 7a_100011215259_100000059175 [0,1,0,0,0,0|2,0,0]=3 6345 B13R0.147 CCCCCOCCOC[C@@H](O)CF 34a_100011215259_100015614560 [0,1,0,0,0,0|3,0,0]=4 6346 B13R0.147 CCCCCOCCOC[C@@H](O)CF 7a_100011215259_100015614560 [0,1,0,0,0,0|3,0,0]=4 6347 B13R0.147 CCCCCOCCOC[C@@H](O)CO 34a_100011215259_100009815848 [0,1,0,0,0,0|2,0,0]=3 6348 B13R0.147 CCCCCOCCOC[C@@H](O)CO 7a_100011215259_100009815848 [0,1,0,0,0,0|2,0,0]=3 6349 B13R0.147 CCCCNCCCCOC(C)CC 34a_200011216965_100011215416 [0,1,0,0,0,0|3,0,0]=4 6350 B13R0.147 CCCCNCCCCOC(C)CO 34a_200011216965_100012180447 [0,1,0,0,0,0|2,0,0]=3 6351 B13R0.147 CCCCOCCCCCC(C)CC 7a_200000035636_100000210211 [0,1,0,0,0,0|2,0,0]=3 6352 B13R0.147 CCCCOCCCCOC(C)CC 34a_200000760531_100011215416 [0,1,0,0,0,0|3,0,0]=4 6353 B13R0.147 CCCCOCCCCOC(C)CC 7a_200000760531_100000758301 [0,1,0,0,0,0|3,0,0]=4 6354 B13R0.147 CCCCOCCCCOC(C)CO 34a_200000760531_100012180447 [0,1,0,0,0,0|2,0,0]=3 6355 B13R0.147 CCCCOCCCCOC(C)CO 7a_200000760531_100012180447 [0,1,0,0,0,0|2,0,0]=3 6356 B13R0.147 CCCCOCCCNCC(C)CC 2230a_200000211371_100000748023 [0,1,0,0,0,0|3,0,0]=4 6357 B13R0.147 CCCCOCCCNCC(C)CC 270004a_200000211371_100000243153 [0,1,0,0,0,0|3,0,0]=4 6358 B13R0.147 CCCCOCCCNCC(C)CC 34a_200000211371_100000748023 [0,1,0,0,0,0|3,0,0]=4 6359 B13R0.147 CCCCOCCCNCC(O)CC 2230a_200000211371_100011218378 [0,1,0,0,0,0|3,0,0]=4 6360 B13R0.147 CCCCOCCCNCC(O)CC 34a_200000211371_100011218378 [0,1,0,0,0,0|3,0,0]=4 6361 B13R0.147 CCCCOCCCNCC(O)CO 2230a_200000211371_100011219619 [0,1,0,0,0,0|2,0,0]=3 6362 B13R0.147 CCCCOCCCNCC(O)CO 34a_200000211371_100011219619 [0,1,0,0,0,0|2,0,0]=3 6363 B13R0.147 CCCCOCCCNC[C@@H](C)CC 2230a_200000211371_100009816398 [0,1,0,0,0,0|3,0,0]=4 6364 B13R0.147 CCCCOCCCNC[C@@H](C)CC 34a_200000211371_100009816398 [0,1,0,0,0,0|3,0,0]=4 6365 B13R0.147 CCCCOCCCNC[C@@H](C)CO 2230a_200000211371_100000059175 [0,1,0,0,0,0|2,0,0]=3 6366 B13R0.147 CCCCOCCCNC[C@@H](C)CO 34a_200000211371_100000059175 [0,1,0,0,0,0|2,0,0]=3 6367 B13R0.147 CCCCOCCCNC[C@@H](O)CF 2230a_200000211371_100015614560 [0,1,0,0,0,0|3,0,0]=4 6368 B13R0.147 CCCCOCCCNC[C@@H](O)CF 34a_200000211371_100015614560 [0,1,0,0,0,0|3,0,0]=4 6369 B13R0.147 CCCCOCCCNC[C@@H](O)CO 2230a_200000211371_100009815848 [0,1,0,0,0,0|2,0,0]=3 6370 B13R0.147 CCCCOCCCNC[C@@H](O)CO 34a_200000211371_100009815848 [0,1,0,0,0,0|2,0,0]=3 6371 B13R0.147 CCCCOCCCOCC(C)CC 34a_200011215613_100000748023 [0,1,0,0,0,0|3,0,0]=4 6372 B13R0.147 CCCCOCCCOCC(C)CC 7a_200011215613_100000748023 [0,1,0,0,0,0|3,0,0]=4 6373 B13R0.147 CCCCOCCCOCC(O)CC 34a_200011215613_100011218378 [0,1,0,0,0,0|3,0,0]=4 6374 B13R0.147 CCCCOCCCOCC(O)CC 7a_200011215613_100011218378 [0,1,0,0,0,0|3,0,0]=4 6375 B13R0.147 CCCCOCCCOCC(O)CO 34a_200011215613_100011219619 [0,1,0,0,0,0|2,0,0]=3 6376 B13R0.147 CCCCOCCCOCC(O)CO 7a_200011215613_100011219619 [0,1,0,0,0,0|2,0,0]=3 6377 B13R0.147 CCCCOCCCOC[C@@H](C)CC 34a_200011215613_100009816398 [0,1,0,0,0,0|3,0,0]=4 6378 B13R0.147 CCCCOCCCOC[C@@H](C)CC 7a_200011215613_100009816398 [0,1,0,0,0,0|3,0,0]=4 6379 B13R0.147 CCCCOCCCOC[C@@H](C)CO 34a_200011215613_100000059175 [0,1,0,0,0,0|2,0,0]=3 6380 B13R0.147 CCCCOCCCOC[C@@H](C)CO 7a_200011215613_100000059175 [0,1,0,0,0,0|2,0,0]=3 6381 B13R0.147 CCCCOCCCOC[C@@H](O)CF 34a_200011215613_100015614560 [0,1,0,0,0,0|3,0,0]=4 6382 B13R0.147 CCCCOCCCOC[C@@H](O)CF 7a_200011215613_100015614560 [0,1,0,0,0,0|3,0,0]=4 6383 B13R0.147 CCCCOCCCOC[C@@H](O)CO 34a_200011215613_100009815848 [0,1,0,0,0,0|2,0,0]=3 6384 B13R0.147 CCCCOCCCOC[C@@H](O)CO 7a_200011215613_100009815848 [0,1,0,0,0,0|2,0,0]=3 6385 B13R0.147 CCCCOCCNCCC(C)CC 2230a_100020591266_100000743108 [0,1,0,0,0,0|3,0,0]=4 6386 B13R0.147 CCCCOCCNCCC(C)CO 2230a_106354213184_100000743108 [0,1,0,0,0,0|2,0,0]=3 6387 B13R0.147 CCCCOCCNCCC(C)CO 34a_106354213184_100000743108 [0,1,0,0,0,0|2,0,0]=3 6388 B13R0.147 CCCCOCCOCCC(C)CC 7a_100011215188_100000743108 [0,1,0,0,0,0|3,0,0]=4 6389 B13R0.147 CCCCOCOCCC[C@@H](C)CN 34a_100160569302_100011995733 [0,1,0,0,0,0|3,0,0]=4 6390 B13R0.147 CCCOCCOCCCC(C)CC 7a_100011216074_100011215938 [0,1,0,0,0,0|3,0,0]=4 6391 B13R0.147 CCCOCCOCCC[C@@H](C)CN 34a_100160569302_100011215938 [0,1,0,0,0,0|3,0,0]=4 6392 B13R0.147 CCCOCCOCCNC(C)CO 2230a_200011904461_100012180447 [0,1,0,0,0,0|3,0,0]=4 6393 B13R0.147 CCCOCCOCCNC(C)CO 34a_200011904461_100012180447 [0,1,0,0,0,0|3,0,0]=4 6394 B13R0.147 CCN(C)CCCCCCCCCO 2230a_100000225621_100009813782 [0,1,0,0,0,0|1,0,0]=2 6395 B13R0.147 CCN(C)CCCCCCCCCO 269982a_100000225621_100009813782 [0,1,0,0,0,0|1,0,0]=2 6396 B13R0.147 CCN(C)CCCNCCCCCO 2230a_100000762737_100015186262 [0,1,0,0,0,0|2,0,0]=3 6397 B13R0.147 CCN(C)CCCNCCOCCO 2230a_100000211614_100015186262 [0,1,0,0,0,0|3,0,0]=4 6398 B13R0.147 CCN(C)CCCNCCSCCO 2230a_100011219999_100015186262 [0,1,0,0,0,0|3,0,0]=4 6399 B13R0.147 CCN(C)CCCOCCCCCBr 7a_100000746331_100015186262 [0,1,0,0,0,0|3,0,0]=4 6400 B13R0.147 CCN(C)CCCOCCCCCCl 7a_100000746330_100015186262 [0,1,0,0,0,0|3,0,0]=4 6401 B13R0.147 CCN(C)CCCOCCCCCI 7a_200012148887_100015186262 [0,1,0,0,0,0|3,0,0]=4 6402 B13R0.147 CCN(C)CCCSCCCCCF 62a_100000729378_100015186262 [0,1,0,0,0,0|3,0,0]=4 6403 B13R0.147 CCN(C)CCCSCCCCCO 62a_100000746330_100015186262 [0,1,0,0,0,0|2,0,0]=3 6404 B13R0.147 CCN(C)CCCSCCOCCO 62a_100011215305_100015186262 [0,1,0,0,0,0|3,0,0]=4 6405 B13R0.147 CCOCCCOCCCC(C)CC 7a_100011216074_100012232248 [0,1,0,0,0,0|3,0,0]=4 6406 B13R0.147 CCOCCCOCCC[C@@H](C)CN 34a_100160569302_100012232248 [0,1,0,0,0,0|3,0,0]=4 6407 B13R0.147 CCOCCOCCNCC(C)CO 34a_100000744482_100011211534 [0,1,0,0,0,0|3,0,0]=4 6408 B13R0.147 CCOCCOCCNCC(O)CO 2230a_100102712874_100011219619 [0,1,0,0,0,0|3,0,0]=4 6409 B13R0.147 CCOCCOCCNCC(O)CO 34a_100102712874_100011219619 [0,1,0,0,0,0|3,0,0]=4 6410 B13R0.147 CCOCCOCCNC[C@@H](C)CO 2230a_100102712874_100000059175 [0,1,0,0,0,0|3,0,0]=4 6411 B13R0.147 CCOCCOCCNC[C@@H](C)CO 34a_100102712874_100000059175 [0,1,0,0,0,0|3,0,0]=4 6412 B13R0.147 CCOCCOCCNC[C@@H](F)CO 34a_100015665980_100011211534 [0,1,0,0,0,0|3,0,0]=4 6413 B13R0.147 CCOCCOCCNC[C@@H](O)CO 2230a_100102712874_100009815848 [0,1,0,0,0,0|3,0,0]=4 6414 B13R0.147 CCOCCOCCNC[C@@H](O)CO 34a_100102712874_100009815848 [0,1,0,0,0,0|3,0,0]=4 6415 B13R0.147 CCOCCOCCNC[C@H](O)CO 2230a_100020644852_100011211534 [0,1,0,0,0,0|3,0,0]=4 6416 B13R0.147 CCOCCOCCOCC(O)CO 34a_100000210240_100011219619 [0,1,0,0,0,0|3,0,0]=4 6417 B13R0.147 CCOCCOCCOCC(O)CO 7a_100000210240_100011219619 [0,1,0,0,0,0|3,0,0]=4 6418 B13R0.147 CCOCCOCCOC[C@@H](C)CO 34a_100000210240_100000059175 [0,1,0,0,0,0|3,0,0]=4 6419 B13R0.147 CCOCCOCCOC[C@@H](C)CO 7a_100000210240_100000059175 [0,1,0,0,0,0|3,0,0]=4 6420 B13R0.147 CCOCCOCCOC[C@@H](O)CO 34a_100000210240_100009815848 [0,1,0,0,0,0|3,0,0]=4 6421 B13R0.147 CCOCCOCCOC[C@@H](O)CO 7a_100000210240_100009815848 [0,1,0,0,0,0|3,0,0]=4 6422 B13R0.147 CCOCCOCCSCC(O)CO 62a_100011211534_100011219619 [0,1,0,0,0,0|3,0,0]=4 6423 B13R0.147 CCOCCOCCSCC(O)CO 62a_100011219619_100011211534 [0,1,0,0,0,0|3,0,0]=4 6424 B13R0.147 CCOCCOCCSC[C@@H](C)CO 62a_100000059175_100011211534 [0,1,0,0,0,0|3,0,0]=4 6425 B13R0.147 CCOCCOCCSC[C@@H](C)CO 62a_100011211534_100000059175 [0,1,0,0,0,0|3,0,0]=4 6426 B13R0.147 CCOCCOCCSC[C@@H](O)CO 62a_100009815848_100011211534 [0,1,0,0,0,0|3,0,0]=4 6427 B13R0.147 CCOCCOCCSC[C@@H](O)CO 62a_100011211534_100009815848 [0,1,0,0,0,0|3,0,0]=4 6428 B13R0.147 CC[C@H](C)CNCCCCCCCO 2230a_100011996573_100009816398 [0,1,0,0,0,0|1,0,0]=2 6429 B13R0.147 CC[C@H](C)CNCCCCCCCO 34a_100011996573_100009816398 [0,1,0,0,0,0|1,0,0]=2 6430 B13R0.147 CC[C@H](C)CNCCCOCCCO 2230a_100011310245_100009816398 [0,1,0,0,0,0|2,0,0]=3 6431 B13R0.147 CC[C@H](C)CNCCCOCCCO 34a_100011310245_100009816398 [0,1,0,0,0,0|2,0,0]=3 6432 B13R0.147 CC[C@H](C)COCCCCCCC#N 7a_100009816381_100009813337 [0,1,0,0,0,0|2,0,1]=4 6433 B13R0.147 CC[C@H](C)COCCCCCCCBr 34a_100000760002_100009816398 [0,1,0,0,0,0|2,0,0]=3 6434 B13R0.147 CC[C@H](C)COCCCCCCCBr 7a_100000760002_100009816398 [0,1,0,0,0,0|2,0,0]=3 6435 B13R0.147 CC[C@H](C)COCCCCCCCN 34a_100011996573_100009816398 [0,1,0,0,0,0|2,0,0]=3 6436 B13R0.147 CC[C@H](C)COCCCCCCCO 7a_100009816381_100000760002 [0,1,0,0,0,0|1,0,0]=2 6437 B13R0.147 CC[C@H](C)COCCCCCCOC 34a_200012092642_100009816398 [0,1,0,0,0,0|3,0,0]=4 6438 B13R0.147 CC[C@H](C)COCCCCCCOC 7a_100009816381_100011998445 [0,1,0,0,0,0|3,0,0]=4 6439 B13R0.147 CC[C@H](C)COCCCCCCOC 7a_200012092642_100009816398 [0,1,0,0,0,0|3,0,0]=4 6440 B13R0.147 CC[C@H](C)COCCCOCCCN 34a_100011310245_100009816398 [0,1,0,0,0,0|3,0,0]=4 6441 B13R0.147 CC[C@H](C)CSCCCCCCC#N 62a_100009813337_100009816398 [0,1,0,0,0,0|2,0,1]=4 6442 B13R0.147 CC[C@H](C)CSCCCCCCC#N 62a_100009816398_100009813337 [0,1,0,0,0,0|2,0,1]=4 6443 B13R0.147 CC[C@H](C)CSCCCCCCCO 62a_100000760002_100009816398 [0,1,0,0,0,0|1,0,0]=2 6444 B13R0.147 CC[C@H](C)CSCCCCCCCO 62a_100009816398_100000760002 [0,1,0,0,0,0|1,0,0]=2 6445 B13R0.147 CC[C@H](C)CSCCCCCCOC 62a_100009816398_100011998445 [0,1,0,0,0,0|3,0,0]=4 6446 B13R0.147 CC[C@H](C)CSCCCCCCOC 62a_100011998445_100009816398 [0,1,0,0,0,0|3,0,0]=4 6447 B13R0.147 CNC(=O)CCCCCCCCCF 11a_106832991635_200009909015 [0,1,0,0,0,0|2,0,1]=4 6448 B13R0.147 CNC(=O)CCCCCCCCCF 240690a_100102657272_200009909015 [0,1,0,0,0,0|2,0,1]=4 6449 B13R0.147 CNC(=O)CCCCCCCCCF 527a_100102657272_200009909015 [0,1,0,0,0,0|2,0,1]=4 6450 B13R0.147 CNC(=O)CCCCCCCCCO 240690a_100102657272_100000032657 [0,1,0,0,0,0|1,0,1]=3 6451 B13R0.147 CNC(=O)CCCNCCCCCO 2230a_100000740002_100000746330 [0,1,0,0,0,0|2,0,1]=4 6452 B13R0.147 CNC(=O)CCCNCCCCCO 2230a_100000762737_100000741757 [0,1,0,0,0,0|2,0,1]=4 6453 B13R0.147 CNC(=O)CCCNCCCCCO 34a_100000740002_100000746330 [0,1,0,0,0,0|2,0,1]=4 6454 B13R0.147 CNC(=O)CCCNCCCCCO 34a_100000762737_100000741757 [0,1,0,0,0,0|2,0,1]=4 6455 B13R0.147 CNC(=O)CCCSCCCCCO 62a_100000741757_100000746330 [0,1,0,0,0,0|2,0,1]=4 6456 B13R0.147 CNC(=O)CCCSCCCCCO 62a_100000746330_100000741757 [0,1,0,0,0,0|2,0,1]=4 6457 B13R0.147 CNC(=O)CCNCCCCCCO 2230a_100000686447_100000737683 [0,1,0,0,0,0|2,0,1]=4 6458 B13R0.147 CNC(=O)CCNCCCCCCO 2230a_100000738227_100000766143 [0,1,0,0,0,0|2,0,1]=4 6459 B13R0.147 CNC(=O)CCNCCCCCCO 34a_100000686447_100012179268 [0,1,0,0,0,0|2,0,1]=4 6460 B13R0.147 CNC(=O)CCNCCCCCCO 34a_100000738227_100000766143 [0,1,0,0,0,0|2,0,1]=4 6461 B13R0.147 CNC(=O)CCOCCCCCCO 34a_100000754576_100000766143 [0,1,0,0,0,0|2,0,1]=4 6462 B13R0.147 CNC(=O)CCSCCCCCCO 62a_100000737683_100000766143 [0,1,0,0,0,0|2,0,1]=4 6463 B13R0.147 CNC(=O)CCSCCCCCCO 62a_100000766143_100000737683 [0,1,0,0,0,0|2,0,1]=4 6464 B13R0.147 CNC(=O)CNCCCCCCCO 2230a_100000693194_100000760002 [0,1,0,0,0,0|2,0,1]=4 6465 B13R0.147 CNC(=O)CNCCCCCCCO 2230a_100011996573_100000183359 [0,1,0,0,0,0|2,0,1]=4 6466 B13R0.147 CNC(=O)CNCCCCCCCO 34a_100011996573_100000183359 [0,1,0,0,0,0|2,0,1]=4 6467 B13R0.147 CNC(=O)COCCCCCCCO 34a_100000750040_100000760002 [0,1,0,0,0,0|2,0,1]=4 6468 B13R0.147 CNC(=O)CSCCCCCCCO 62a_100000183359_100000760002 [0,1,0,0,0,0|2,0,1]=4 6469 B13R0.147 CNC(=O)CSCCCCCCCO 62a_100000760002_100000183359 [0,1,0,0,0,0|2,0,1]=4 6470 B13R0.147 CNC(=O)NCCCCCCCCO 2708a_100102657272_102515433106 [0,1,0,0,0,0|2,0,1]=4 6471 B13R0.147 CNC(=O)NCCCCCCCCO 2708a_102515433106_106832991635 [0,1,0,0,0,0|2,0,1]=4 6472 B13R0.147 CNC(=O)NCCCCCCCCO 273464a_100102657272_102515433106 [0,1,0,0,0,0|2,0,1]=4 6473 B13R0.147 CNC(=O)NCCCCCCCCO 273464a_102515433106_100102657272 [0,1,0,0,0,0|2,0,1]=4 6474 B13R0.147 CNC(=O)NCCCCCCCCO 512a_102515433106_100102657272 [0,1,0,0,0,0|2,0,1]=4 6475 B13R0.147 CNC(=O)NCCCCCCCCO 512a_106832991638_102515433106 [0,1,0,0,0,0|2,0,1]=4 6476 B13R0.147 COC(=O)CCCCCCNCCO 2230a_100016997473_100009815986 [0,1,0,0,0,0|2,0,1]=4 6477 B13R0.147 COC(=O)CCCCCCNCCO 34a_100016990907_100009815986 [0,1,0,0,0,0|2,0,1]=4 6478 B13R0.147 COC(=O)CCCCCCOCCO 34a_100009863599_100000211926 [0,1,0,0,0,0|2,0,1]=4 6479 B13R0.147 COC(=O)CCCCCCOCCO 7a_100009863599_100000211926 [0,1,0,0,0,0|2,0,1]=4 6480 B13R0.147 COC(=O)CCCCCCSCCO 62a_100000211926_100009815986 [0,1,0,0,0,0|2,0,1]=4 6481 B13R0.147 COC(=O)CCCCCCSCCO 62a_100009815986_100000211926 [0,1,0,0,0,0|2,0,1]=4 6482 B13R0.147 COC(=O)CCCCCOCCCO 34a_100000074720_100000230001 [0,1,0,0,0,0|2,0,1]=4 6483 B13R0.147 COC(=O)CCCCCOCCCO 7a_100000074720_100011215043 [0,1,0,0,0,0|2,0,1]=4 6484 B13R0.147 COC(=O)CCCCCSCCCO 62a_100009816466_100011215043 [0,1,0,0,0,0|2,0,1]=4 6485 B13R0.147 COC(=O)CCCCCSCCCO 62a_100011215043_100009816466 [0,1,0,0,0,0|2,0,1]=4 6486 B13R0.147 COC(=O)CCCCNCCCCO 2230a_100000750430_100000204269 [0,1,0,0,0,0|2,0,1]=4 6487 B13R0.147 COC(=O)CCCCNCCCCO 34a_100000750430_100000204269 [0,1,0,0,0,0|2,0,1]=4 6488 B13R0.147 COC(=O)CCCCOCCCCO 34a_100000059025_100011216708 [0,1,0,0,0,0|2,0,1]=4 6489 B13R0.147 COC(=O)CCCCOCCCCO 7a_100000059025_100000210776 [0,1,0,0,0,0|2,0,1]=4 6490 B13R0.147 COC(=O)CCCCSCCCCO 62a_100000204269_100000210776 [0,1,0,0,0,0|2,0,1]=4 6491 B13R0.147 COC(=O)CCCCSCCCCO 62a_100000210776_100000204269 [0,1,0,0,0,0|2,0,1]=4 6492 B13R0.147 COC(=O)CCCNCCCCCO 2230a_100000762737_100011218270 [0,1,0,0,0,0|2,0,1]=4 6493 B13R0.147 COC(=O)CCCNCCCCCO 34a_100000762737_100000742333 [0,1,0,0,0,0|2,0,1]=4 6494 B13R0.147 COC(=O)CCCSCCCCCO 62a_100000746330_100011218270 [0,1,0,0,0,0|2,0,1]=4 6495 B13R0.147 COC(=O)CCCSCCCCCO 62a_100011218270_100000746330 [0,1,0,0,0,0|2,0,1]=4 6496 B13R0.147 COC(=O)CCNCCCCCCO 2230a_100000686447_100000204255 [0,1,0,0,0,0|2,0,1]=4 6497 B13R0.147 COC(=O)CCNCCCCCCO 34a_100000686447_100000742370 [0,1,0,0,0,0|2,0,1]=4 6498 B13R0.147 COC(=O)CCSCCCCCCO 62a_100000204255_100000766143 [0,1,0,0,0,0|2,0,1]=4 6499 B13R0.147 COC(=O)CCSCCCCCCO 62a_100000766143_100000204255 [0,1,0,0,0,0|2,0,1]=4 6500 B13R0.147 COC(=O)CNCCCCCCCO 2230a_100011996573_100000747449 [0,1,0,0,0,0|2,0,1]=4 6501 B13R0.147 COC(=O)CNCCCCCCCO 34a_100011996573_100000747449 [0,1,0,0,0,0|2,0,1]=4 6502 B13R0.147 COC(=O)CSCCCCCCCO 62a_100000747449_100000760002 [0,1,0,0,0,0|2,0,1]=4 6503 B13R0.147 COC(=O)CSCCCCCCCO 62a_100000760002_100000747449 [0,1,0,0,0,0|2,0,1]=4 6504 B13R0.147 COC(C)CCOCCCCCCF 7a_100000764861_100015922095 [0,1,0,0,0,0|3,0,0]=4 6505 B13R0.147 COC(C)CCOCCCCCCO 7a_100000764861_100000766143 [0,1,0,0,0,0|2,0,0]=3 6506 B13R0.147 COC(C)COCCCCCCCO 34a_100000690652_100000760002 [0,1,0,0,0,0|2,0,0]=3 6507 B13R0.147 COC(C)SCCCCCCCCO 62a_100000033203_100009879195 [0,1,0,0,0,0|2,0,0]=3 6508 B13R0.147 COC(C)SCCCCCCCCO 62a_100009879195_100000033203 [0,1,0,0,0,0|2,0,0]=3 6509 B13R0.147 COCCCCCCNCC(C)CO 34a_100000744482_100011998445 [0,1,0,0,0,0|2,0,0]=3 6510 B13R0.147 COCCCCCCNC[C@@H](F)CO 34a_100015665980_100011998445 [0,1,0,0,0,0|2,0,0]=3 6511 B13R0.147 COCCCCCCNC[C@H](O)CO 2230a_100020644852_100011998445 [0,1,0,0,0,0|2,0,0]=3 6512 B13R0.147 COCCCCCCOCC(C)CN 34a_100000744482_100011998445 [0,1,0,0,0,0|3,0,0]=4 6513 B13R0.147 COCCCCCCOCC(Cl)CCl 34a_100000033668_100011998445 [0,1,0,0,0,0|3,0,0]=4 6514 B13R0.147 COCCCCCCOCC(O)CO 34a_200012092642_100011219619 [0,1,0,0,0,0|2,0,0]=3 6515 B13R0.147 COCCCCCCOCC(O)CO 7a_200012092642_100011219619 [0,1,0,0,0,0|2,0,0]=3 6516 B13R0.147 COCCCCCCOC[C@@H](C)CO 34a_200012092642_100000059175 [0,1,0,0,0,0|2,0,0]=3 6517 B13R0.147 COCCCCCCOC[C@@H](C)CO 7a_200012092642_100000059175 [0,1,0,0,0,0|2,0,0]=3 6518 B13R0.147 COCCCCCCOC[C@@H](O)CF 34a_200012092642_100015614560 [0,1,0,0,0,0|3,0,0]=4 6519 B13R0.147 COCCCCCCOC[C@@H](O)CF 7a_200012092642_100015614560 [0,1,0,0,0,0|3,0,0]=4 6520 B13R0.147 COCCCCCCOC[C@@H](O)CO 34a_200012092642_100009815848 [0,1,0,0,0,0|2,0,0]=3 6521 B13R0.147 COCCCCCCOC[C@@H](O)CO 7a_200012092642_100009815848 [0,1,0,0,0,0|2,0,0]=3 6522 B13R0.147 COCCCCCCOC[C@H](F)CN 34a_100015665980_100011998445 [0,1,0,0,0,0|3,0,0]=4 6523 B13R0.147 COCCCCCCSCC(O)CO 62a_100011219619_100011998445 [0,1,0,0,0,0|2,0,0]=3 6524 B13R0.147 COCCCCCCSCC(O)CO 62a_100011998445_100011219619 [0,1,0,0,0,0|2,0,0]=3 6525 B13R0.147 COCCCCCCSC[C@@H](C)CO 62a_100000059175_100011998445 [0,1,0,0,0,0|2,0,0]=3 6526 B13R0.147 COCCCCCCSC[C@@H](C)CO 62a_100011998445_100000059175 [0,1,0,0,0,0|2,0,0]=3 6527 B13R0.147 COCCCCCCSC[C@@H](O)CF 62a_100011998445_100015614560 [0,1,0,0,0,0|3,0,0]=4 6528 B13R0.147 COCCCCCCSC[C@@H](O)CF 62a_100015614560_100011998445 [0,1,0,0,0,0|3,0,0]=4 6529 B13R0.147 COCCCCCCSC[C@@H](O)CO 62a_100009815848_100011998445 [0,1,0,0,0,0|2,0,0]=3 6530 B13R0.147 COCCCCCCSC[C@@H](O)CO 62a_100011998445_100009815848 [0,1,0,0,0,0|2,0,0]=3 6531 B13R0.147 COCCCCOCCC[C@@H](C)CN 34a_100160569302_100000755781 [0,1,0,0,0,0|3,0,0]=4 6532 B13R0.147 COCCCOCCCOC(C)CO 34a_200011215475_100012180447 [0,1,0,0,0,0|3,0,0]=4 6533 B13R0.147 COCCCOCCCOC(C)CO 7a_200011215475_100012180447 [0,1,0,0,0,0|3,0,0]=4 6534 B13R0.147 COCCOCCCNCC(C)CO 34a_100000744482_100011216529 [0,1,0,0,0,0|3,0,0]=4 6535 B13R0.147 COCCOCCCNCC(O)CO 2230a_100000206027_100011219619 [0,1,0,0,0,0|3,0,0]=4 6536 B13R0.147 COCCOCCCNCC(O)CO 34a_100000206027_100011219619 [0,1,0,0,0,0|3,0,0]=4 6537 B13R0.147 COCCOCCCNC[C@@H](C)CO 2230a_100000206027_100000059175 [0,1,0,0,0,0|3,0,0]=4 6538 B13R0.147 COCCOCCCNC[C@@H](C)CO 34a_100000206027_100000059175 [0,1,0,0,0,0|3,0,0]=4 6539 B13R0.147 COCCOCCCNC[C@@H](F)CO 34a_100015665980_100011216529 [0,1,0,0,0,0|3,0,0]=4 6540 B13R0.147 COCCOCCCNC[C@@H](O)CO 2230a_100000206027_100009815848 [0,1,0,0,0,0|3,0,0]=4 6541 B13R0.147 COCCOCCCNC[C@@H](O)CO 34a_100000206027_100009815848 [0,1,0,0,0,0|3,0,0]=4 6542 B13R0.147 COCCOCCCNC[C@H](O)CO 2230a_100020644852_100011216529 [0,1,0,0,0,0|3,0,0]=4 6543 B13R0.147 COCCOCCCSCC(O)CO 62a_100011216529_100011219619 [0,1,0,0,0,0|3,0,0]=4 6544 B13R0.147 COCCOCCCSCC(O)CO 62a_100011219619_100011216529 [0,1,0,0,0,0|3,0,0]=4 6545 B13R0.147 COCCOCCCSC[C@@H](C)CO 62a_100000059175_100011216529 [0,1,0,0,0,0|3,0,0]=4 6546 B13R0.147 COCCOCCCSC[C@@H](C)CO 62a_100011216529_100000059175 [0,1,0,0,0,0|3,0,0]=4 6547 B13R0.147 COCCOCCCSC[C@@H](O)CO 62a_100009815848_100011216529 [0,1,0,0,0,0|3,0,0]=4 6548 B13R0.147 COCCOCCCSC[C@@H](O)CO 62a_100011216529_100009815848 [0,1,0,0,0,0|3,0,0]=4 6549 B13R0.147 COCCOCCNCCC(C)CO 2230a_106354213184_100000695917 [0,1,0,0,0,0|3,0,0]=4 6550 B13R0.147 COCCOCCNCCC(C)CO 34a_106354213184_100000695917 [0,1,0,0,0,0|3,0,0]=4 6551 B13R0.147 CO[C@H](C)CNCCCCCCCO 2230a_100020591295_100000760002 [0,1,0,0,0,0|2,0,0]=3 6552 B13R0.147 C[C@@H](CN)CCCOCCCCCF 34a_100160569302_100000729378 [0,1,0,0,0,0|3,0,0]=4 6553 B13R0.147 C[C@@H](CN)CCCOCCCCCO 34a_100160569302_100000746330 [0,1,0,0,0,0|2,0,0]=3 6554 B13R0.147 C[C@@H](CN)CCCOCCOCCO 34a_100160569302_100000692535 [0,1,0,0,0,0|3,0,0]=4 6555 B13R0.147 C[C@@H](CO)CNCCCCCCCO 2230a_100011996573_100000059175 [0,1,0,0,0,0|2,0,0]=3 6556 B13R0.147 C[C@@H](CO)CNCCCCCCCO 34a_100011996573_100000059175 [0,1,0,0,0,0|2,0,0]=3 6557 B13R0.147 C[C@@H](CO)CNCCCOCCCO 2230a_100011310245_100000059175 [0,1,0,0,0,0|3,0,0]=4 6558 B13R0.147 C[C@@H](CO)CNCCCOCCCO 34a_100011310245_100000059175 [0,1,0,0,0,0|3,0,0]=4 6559 B13R0.147 C[C@@H](CO)COCCCCCCCBr 34a_100000760002_100000059175 [0,1,0,0,0,0|2,0,0]=3 6560 B13R0.147 C[C@@H](CO)COCCCCCCCBr 7a_100000760002_100000059175 [0,1,0,0,0,0|2,0,0]=3 6561 B13R0.147 C[C@@H](CO)COCCCCCCCN 34a_100011996573_100000059175 [0,1,0,0,0,0|2,0,0]=3 6562 B13R0.147 C[C@@H](CO)COCCCOCCCN 34a_100011310245_100000059175 [0,1,0,0,0,0|3,0,0]=4 6563 B13R0.147 C[C@@H](CO)CSCCCCCCC#N 62a_100000059175_100009813337 [0,1,0,0,0,0|2,0,1]=4 6564 B13R0.147 C[C@@H](CO)CSCCCCCCC#N 62a_100009813337_100000059175 [0,1,0,0,0,0|2,0,1]=4 6565 B13R0.147 C[C@@H](CO)CSCCCCCCCO 62a_100000059175_100000760002 [0,1,0,0,0,0|2,0,0]=3 6566 B13R0.147 C[C@@H](CO)CSCCCCCCCO 62a_100000760002_100000059175 [0,1,0,0,0,0|2,0,0]=3 6567 B13R0.147 C[C@H](CO)NCCCCCCCCO 2230a_100000737577_100000033203 [0,1,0,0,0,0|2,0,0]=3 6568 B13R0.147 C[C@H](CO)SCCCCCCCCO 62a_100000033203_100016084084 [0,1,0,0,0,0|2,0,0]=3 6569 B13R0.147 C[C@H](CO)SCCCCCCCCO 62a_100016084084_100000033203 [0,1,0,0,0,0|2,0,0]=3 6570 B13R0.147 N#CC(F)SCCCCCCCCO 62a_100000033203_200000117898 [0,1,0,0,0,0|2,0,1]=4 6571 B13R0.147 N#CC(F)SCCCCCCCCO 62a_200000117898_100000033203 [0,1,0,0,0,0|2,0,1]=4 6572 B13R0.147 N#CCCCCCCNC[C@H](O)CO 2230a_100020644852_100009813337 [0,1,0,0,0,0|2,0,1]=4 6573 B13R0.147 N#CCCCCCCSCC(O)CO 62a_100009813337_100011219619 [0,1,0,0,0,0|2,0,1]=4 6574 B13R0.147 N#CCCCCCCSCC(O)CO 62a_100011219619_100009813337 [0,1,0,0,0,0|2,0,1]=4 6575 B13R0.147 N#CCCCCCCSC[C@@H](O)CO 62a_100009813337_100009815848 [0,1,0,0,0,0|2,0,1]=4 6576 B13R0.147 N#CCCCCCCSC[C@@H](O)CO 62a_100009815848_100009813337 [0,1,0,0,0,0|2,0,1]=4 6577 B13R0.147 NCCCCCCCOCC(O)CO 34a_100011996573_100011219619 [0,1,0,0,0,0|2,0,0]=3 6578 B13R0.147 NCCCCCCCOC[C@@H](O)CF 34a_100011996573_100015614560 [0,1,0,0,0,0|3,0,0]=4 6579 B13R0.147 NCCCCCCCOC[C@@H](O)CO 34a_100011996573_100009815848 [0,1,0,0,0,0|2,0,0]=3 6580 B13R0.147 NCCCOCCCOCC(O)CO 34a_100011310245_100011219619 [0,1,0,0,0,0|3,0,0]=4 6581 B13R0.147 NCCCOCCCOC[C@@H](O)CO 34a_100011310245_100009815848 [0,1,0,0,0,0|3,0,0]=4 6582 B13R0.147 NC[C@@H](F)COCCCCCCCO 34a_100015665980_100000760002 [0,1,0,0,0,0|2,0,0]=3 6583 B13R0.147 O=C(CF)CCCCCCCCCF 1458a_200009909015_100015361967 [0,1,0,0,0,0|2,0,1]=4 6584 B13R0.147 O=C(CO)CCCCCCCCCO 1458a_100000210174_100009813782 [0,1,0,0,0,0|1,0,1]=3 6585 B13R0.147 O=C(CO)NCCCCCCCCO 240690a_102515433106_100000210174 [0,1,0,0,0,0|2,0,1]=4 6586 B13R0.147 OCC(O)COCCCCCCCBr 34a_100000760002_100011219619 [0,1,0,0,0,0|2,0,0]=3 6587 B13R0.147 OCC(O)COCCCCCCCBr 7a_100000760002_100011219619 [0,1,0,0,0,0|2,0,0]=3 6588 B13R0.147 OCCCCCCCNCC(O)CO 2230a_100011996573_100011219619 [0,1,0,0,0,0|2,0,0]=3 6589 B13R0.147 OCCCCCCCNCC(O)CO 34a_100011996573_100011219619 [0,1,0,0,0,0|2,0,0]=3 6590 B13R0.147 OCCCCCCCNC[C@@H](F)CO 34a_100015665980_100000760002 [0,1,0,0,0,0|2,0,0]=3 6591 B13R0.147 OCCCCCCCNC[C@@H](O)CF 2230a_100011996573_100015614560 [0,1,0,0,0,0|2,0,0]=3 6592 B13R0.147 OCCCCCCCNC[C@@H](O)CF 34a_100011996573_100015614560 [0,1,0,0,0,0|2,0,0]=3 6593 B13R0.147 OCCCCCCCNC[C@@H](O)CO 2230a_100011996573_100009815848 [0,1,0,0,0,0|2,0,0]=3 6594 B13R0.147 OCCCCCCCNC[C@@H](O)CO 34a_100011996573_100009815848 [0,1,0,0,0,0|2,0,0]=3 6595 B13R0.147 OCCCCCCCNC[C@H](O)CO 2230a_100020644852_100000760002 [0,1,0,0,0,0|2,0,0]=3 6596 B13R0.147 OCCCCCCCOCC(Cl)CCl 34a_100000033668_100000760002 [0,1,0,0,0,0|2,0,0]=3 6597 B13R0.147 OCCCCCCCSCC(O)CO 62a_100000760002_100011219619 [0,1,0,0,0,0|2,0,0]=3 6598 B13R0.147 OCCCCCCCSCC(O)CO 62a_100011219619_100000760002 [0,1,0,0,0,0|2,0,0]=3 6599 B13R0.147 OCCCCCCCSC[C@@H](O)CF 62a_100000760002_100015614560 [0,1,0,0,0,0|2,0,0]=3 6600 B13R0.147 OCCCCCCCSC[C@@H](O)CF 62a_100015614560_100000760002 [0,1,0,0,0,0|2,0,0]=3 6601 B13R0.147 OCCCCCCCSC[C@@H](O)CO 62a_100000760002_100009815848 [0,1,0,0,0,0|2,0,0]=3 6602 B13R0.147 OCCCCCCCSC[C@@H](O)CO 62a_100009815848_100000760002 [0,1,0,0,0,0|2,0,0]=3 6603 B13R0.147 OCCCOCCCNCC(O)CO 2230a_100011310245_100011219619 [0,1,0,0,0,0|3,0,0]=4 6604 B13R0.147 OCCCOCCCNCC(O)CO 34a_100011310245_100011219619 [0,1,0,0,0,0|3,0,0]=4 6605 B13R0.147 OCCCOCCCNC[C@@H](O)CF 2230a_100011310245_100015614560 [0,1,0,0,0,0|3,0,0]=4 6606 B13R0.147 OCCCOCCCNC[C@@H](O)CF 34a_100011310245_100015614560 [0,1,0,0,0,0|3,0,0]=4 6607 B13R0.147 OCCCOCCCNC[C@@H](O)CO 2230a_100011310245_100009815848 [0,1,0,0,0,0|3,0,0]=4 6608 B13R0.147 OCCCOCCCNC[C@@H](O)CO 34a_100011310245_100009815848 [0,1,0,0,0,0|3,0,0]=4 6609 B13R0.147 OC[C@H](O)COCCCCCCCBr 34a_100000760002_100009815848 [0,1,0,0,0,0|2,0,0]=3 6610 B13R0.147 OC[C@H](O)COCCCCCCCBr 7a_100000760002_100009815848 [0,1,0,0,0,0|2,0,0]=3 6611 B13R0.147 O[C@@H](CF)COCCCCCCCBr 34a_100000760002_100015614560 [0,1,0,0,0,0|3,0,0]=4 6612 B13R0.147 O[C@@H](CF)COCCCCCCCBr 7a_100000760002_100015614560 [0,1,0,0,0,0|3,0,0]=4 6613 B13R0.165 C#CCCCCC(=O)CCCCCC 1458a_100000696528_100000210757 [0,1,0,0,0,0|1,0,2]=4 6614 B13R0.165 C#CCCCCC(=O)CCCCCC 1458a_100102632555_100010269958 [0,1,0,0,0,0|1,0,2]=4 6615 B13R0.165 C#CCCCCC(=O)CCCCCO 1458a_100000696528_100000746330 [0,1,0,0,0,0|0,0,3]=4 6616 B13R0.165 C#CCCCCC(=O)CCCCCO 1458a_100102619762_100010269958 [0,1,0,0,0,0|0,0,3]=4 6617 B13R0.165 C#CCCCCN(C)CCCCCC 2230a_106256046315_100010269958 [0,1,0,0,0,0|2,0,1]=4 6618 B13R0.165 C#CCCCCN(C)CCCCCC 269982a_106256046315_100010269958 [0,1,0,0,0,0|2,0,1]=4 6619 B13R0.165 C#CCCCCN(C)CCCCCO 2230a_100000722520_100010269958 [0,1,0,0,0,0|1,0,2]=4 6620 B13R0.165 C#CCCCCN(C)CCCCCO 269982a_100000722520_100010269958 [0,1,0,0,0,0|1,0,2]=4 6621 B13R0.165 C#CCCCNC(C)CCCCCC 2230a_100000210919_100000731252 [0,1,0,0,0,0|2,0,1]=4 6622 B13R0.165 C#CCCCNC(C)CCCCCC 270004a_100000718082_100000210826 [0,1,0,0,0,0|2,0,1]=4 6623 B13R0.165 C#CCCCNC(C)CCCCCC 34a_100000210919_100000695029 [0,1,0,0,0,0|2,0,1]=4 6624 B13R0.165 C#CCCCNC(C)CCCCCC 34a_100000718082_100011215978 [0,1,0,0,0,0|2,0,1]=4 6625 B13R0.165 C#CCCCOC(C)CCCCCC 34a_100000210265_100000695029 [0,1,0,0,0,0|2,0,1]=4 6626 B13R0.165 C#CCCCOC(C)CCCCCC 34a_100000215630_100011215978 [0,1,0,0,0,0|2,0,1]=4 6627 B13R0.165 C#CCCCOC(C)CCCCCC 7a_100000210265_100011215417 [0,1,0,0,0,0|2,0,1]=4 6628 B13R0.165 C#CCCCOC(C)CCCCCC 7a_100000215630_100011215978 [0,1,0,0,0,0|2,0,1]=4 6629 B13R0.165 C#CCCCSC(C)CCCCCC 62a_100011215417_100011215978 [0,1,0,0,0,0|2,0,1]=4 6630 B13R0.165 C#CCCCSC(C)CCCCCC 62a_100011215978_100011215417 [0,1,0,0,0,0|2,0,1]=4 6631 B13R0.165 C#CCOCCC(C)CCCCCC 34a_200011024964_100000184674 [0,1,0,0,0,0|2,0,1]=4 6632 B13R0.165 C#CCOCCC(C)CCCCCC 7a_200011024964_100000038162 [0,1,0,0,0,0|2,0,1]=4 6633 B13R0.165 C=CCCCCC(=O)CCCCCC 1458a_100011215552_100000210757 [0,1,0,0,0,0|1,0,2]=4 6634 B13R0.165 C=CCCCCC(=O)CCCCCC 1458a_100102632555_100011215482 [0,1,0,0,0,0|1,0,2]=4 6635 B13R0.165 C=CCCCCC(=O)CCCCCO 1458a_100011215552_100000746330 [0,1,0,0,0,0|0,0,3]=4 6636 B13R0.165 C=CCCCCC(=O)CCCCCO 1458a_100102619762_100011215482 [0,1,0,0,0,0|0,0,3]=4 6637 B13R0.165 C=CCCCCN(C)CCCCCC 2230a_100012000471_100000210314 [0,1,0,0,0,0|2,0,1]=4 6638 B13R0.165 C=CCCCCN(C)CCCCCC 2230a_106256046315_100011215482 [0,1,0,0,0,0|2,0,1]=4 6639 B13R0.165 C=CCCCCN(C)CCCCCC 269982a_100012000471_100000210757 [0,1,0,0,0,0|2,0,1]=4 6640 B13R0.165 C=CCCCCN(C)CCCCCC 269982a_106256046315_100011215482 [0,1,0,0,0,0|2,0,1]=4 6641 B13R0.165 C=CCCCCN(C)CCCCCO 2230a_100000722520_100011215482 [0,1,0,0,0,0|1,0,2]=4 6642 B13R0.165 C=CCCCCN(C)CCCCCO 2230a_100012000471_100000746330 [0,1,0,0,0,0|1,0,2]=4 6643 B13R0.165 C=CCCCCN(C)CCCCCO 269982a_100000722520_100011215482 [0,1,0,0,0,0|1,0,2]=4 6644 B13R0.165 C=CCCCCN(C)CCCCCO 269982a_100012000471_100000746330 [0,1,0,0,0,0|1,0,2]=4 6645 B13R0.165 C=CCCCNC(C)CCCCCC 2230a_100000210919_100011713584 [0,1,0,0,0,0|2,0,1]=4 6646 B13R0.165 C=CCCCNC(C)CCCCCC 2230a_100000700776_100011215978 [0,1,0,0,0,0|2,0,1]=4 6647 B13R0.165 C=CCCCNC(C)CCCCCC 270004a_100000700776_100000210826 [0,1,0,0,0,0|2,0,1]=4 6648 B13R0.165 C=CCCCNC(C)CCCCCC 34a_100000210919_100000757094 [0,1,0,0,0,0|2,0,1]=4 6649 B13R0.165 C=CCCCNC(C)CCCCCC 34a_100000700776_100011215978 [0,1,0,0,0,0|2,0,1]=4 6650 B13R0.165 C=CCCCOC(C)CCCCCC 34a_100000210265_100000757094 [0,1,0,0,0,0|2,0,1]=4 6651 B13R0.165 C=CCCCOC(C)CCCCCC 34a_100000758997_100011215978 [0,1,0,0,0,0|2,0,1]=4 6652 B13R0.165 C=CCCCOC(C)CCCCCC 7a_100000210265_100000757094 [0,1,0,0,0,0|2,0,1]=4 6653 B13R0.165 C=CCCCOC(C)CCCCCC 7a_100000758997_100011215978 [0,1,0,0,0,0|2,0,1]=4 6654 B13R0.165 C=CCCCSC(C)CCCCCC 62a_100011215978_100000757094 [0,1,0,0,0,0|2,0,1]=4 6655 B13R0.165 C=CCCCSC(C)CCCCCC 62a_100011713584_100011215978 [0,1,0,0,0,0|2,0,1]=4 6656 B13R0.165 C=CCOCCC(C)CCCCCC 34a_200011024964_100015514636 [0,1,0,0,0,0|2,0,1]=4 6657 B13R0.165 C=CCOCCC(C)CCCCCC 7a_200011024964_100015514636 [0,1,0,0,0,0|2,0,1]=4 6658 B13R0.165 CC/C=C\CCC(=O)CCCCCO 1458a_100102619762_100015370543 [0,1,0,0,0,0|0,0,3]=4 6659 B13R0.165 CC/C=C\CCN(C)CCCCCO 2230a_100000722520_100015370543 [0,1,0,0,0,0|1,0,2]=4 6660 B13R0.165 CC/C=C\CCN(C)CCCCCO 269982a_100000722520_100015370543 [0,1,0,0,0,0|1,0,2]=4 6661 B13R0.165 CCC/C=C/CC(=O)CCCCCO 1458a_200016266809_100000746330 [0,1,0,0,0,0|0,0,3]=4 6662 B13R0.165 CCCCC=CC(=O)CCCCCO 1458a_100016266645_100000746330 [0,1,0,0,0,0|0,0,3]=4 6663 B13R0.165 CCCCCCC(=O)CCCCC#N 1458a_100102632555_100000211819 [0,1,0,0,0,0|1,0,2]=4 6664 B13R0.165 CCCCCCC(=O)CCCCCC 1458a_100102632555_100000210757 [0,1,0,0,0,0|1,0,1]=3 6665 B13R0.165 CCCCCCC(=O)CCCCCF 1458a_100102632555_100000729378 [0,1,0,0,0,0|1,0,1]=3 6666 B13R0.165 CCCCCCC(=O)CCCCCO 1458a_100102619762_100000210757 [0,1,0,0,0,0|0,0,1]=2 6667 B13R0.165 CCCCCCC(=O)CCCCCO 1458a_100102632555_100000746330 [0,1,0,0,0,0|0,0,1]=2 6668 B13R0.165 CCCCCCC(=O)CCCCOC 1458a_100102632555_100000755781 [0,1,0,0,0,0|2,0,1]=4 6669 B13R0.165 CCCCCCC(=O)CCCOCC 1458a_100102632555_100012232248 [0,1,0,0,0,0|2,0,1]=4 6670 B13R0.165 CCCCCCC(=O)CCOCCC 1458a_100102632555_100011215938 [0,1,0,0,0,0|2,0,1]=4 6671 B13R0.165 CCCCCCC(=O)CCOCCO 1458a_100011229844_100000210757 [0,1,0,0,0,0|1,0,1]=3 6672 B13R0.165 CCCCCCC(=O)CCOCCO 1458a_100102632555_100011215305 [0,1,0,0,0,0|1,0,1]=3 6673 B13R0.165 CCCCCCC(=O)COCCCC 1458a_100000757543_100000210757 [0,1,0,0,0,0|2,0,1]=4 6674 B13R0.165 CCCCCCC(=O)COCCCC 1458a_100102632555_100011995733 [0,1,0,0,0,0|2,0,1]=4 6675 B13R0.165 CCCCCCC(=O)CSCCCC 1458a_100000191162_100000210757 [0,1,0,0,0,0|2,0,1]=4 6676 B13R0.165 CCCCCCC(=O)NCCCCC 11a_100000209983_100102632555 [0,1,0,0,0,0|2,0,1]=4 6677 B13R0.165 CCCCCCC(=O)NCCCCC 1626a_100000209983_100102632555 [0,1,0,0,0,0|2,0,1]=4 6678 B13R0.165 CCCCCCC(=O)NCCCCC 240690a_100000209983_100102632555 [0,1,0,0,0,0|2,0,1]=4 6679 B13R0.165 CCCCCCC(=O)NCCCCC 527a_100000209983_100102632555 [0,1,0,0,0,0|2,0,1]=4 6680 B13R0.165 CCCCCCC(=O)NCCCCO 240690a_100000750430_100102632555 [0,1,0,0,0,0|1,0,1]=3 6681 B13R0.165 CCCCCCC(=O)NCCCCO 527a_100000750430_100102632555 [0,1,0,0,0,0|1,0,1]=3 6682 B13R0.165 CCCCCCC(C)CCOCC#N 7a_200011024964_100011215382 [0,1,0,0,0,0|2,0,1]=4 6683 B13R0.165 CCCCCCC(C)CCOCC=O 34a_200011024964_200009817547 [0,1,0,0,0,0|1,0,2]=4 6684 B13R0.165 CCCCCCC(C)CCOCC=O 7a_200011024964_200015260668 [0,1,0,0,0,0|1,0,2]=4 6685 B13R0.165 CCCCCCC(C)CCOCCC 34a_200011024964_100000210303 [0,1,0,0,0,0|2,0,0]=3 6686 B13R0.165 CCCCCCC(C)CCOCCC 7a_200011024964_100000210303 [0,1,0,0,0,0|2,0,0]=3 6687 B13R0.165 CCCCCCC(C)CCOCCF 34a_200011024964_100011217306 [0,1,0,0,0,0|2,0,0]=3 6688 B13R0.165 CCCCCCC(C)CCOCCF 7a_200011024964_100011217306 [0,1,0,0,0,0|2,0,0]=3 6689 B13R0.165 CCCCCCC(C)CCOCCO 34a_200011024964_100000211926 [0,1,0,0,0,0|1,0,0]=2 6690 B13R0.165 CCCCCCC(C)CCOCCO 7a_200011024964_100000211926 [0,1,0,0,0,0|1,0,0]=2 6691 B13R0.165 CCCCCCC(C)CCOCSC 34a_200011024964_100011218213 [0,1,0,0,0,0|3,0,0]=4 6692 B13R0.165 CCCCCCC(C)NCC#CCO 2230a_100000210919_200000047223 [0,1,0,0,0,0|1,0,2]=4 6693 B13R0.165 CCCCCCC(C)NCC#CCO 34a_100000210919_200000047223 [0,1,0,0,0,0|1,0,2]=4 6694 B13R0.165 CCCCCCC(C)NCCCC#N 2230a_100000210919_100000687738 [0,1,0,0,0,0|2,0,1]=4 6695 B13R0.165 CCCCCCC(C)NCCCC=O 2230a_100000210919_200011292268 [0,1,0,0,0,0|1,0,2]=4 6696 B13R0.165 CCCCCCC(C)NCCCCC 2230a_100000209983_100011215978 [0,1,0,0,0,0|2,0,0]=3 6697 B13R0.165 CCCCCCC(C)NCCCCC 2230a_100000210919_100000210326 [0,1,0,0,0,0|2,0,0]=3 6698 B13R0.165 CCCCCCC(C)NCCCCC 270004a_100000209983_100000210826 [0,1,0,0,0,0|2,0,0]=3 6699 B13R0.165 CCCCCCC(C)NCCCCC 34a_100000210919_100000718602 [0,1,0,0,0,0|2,0,0]=3 6700 B13R0.165 CCCCCCC(C)NCCCCF 2230a_100000210919_100000729493 [0,1,0,0,0,0|2,0,0]=3 6701 B13R0.165 CCCCCCC(C)NCCCCF 34a_100000210919_100000729493 [0,1,0,0,0,0|2,0,0]=3 6702 B13R0.165 CCCCCCC(C)NCCCCO 2230a_100000210919_100000210776 [0,1,0,0,0,0|1,0,0]=2 6703 B13R0.165 CCCCCCC(C)NCCCCO 2230a_100000750430_100011215978 [0,1,0,0,0,0|1,0,0]=2 6704 B13R0.165 CCCCCCC(C)NCCCCO 270004a_100000750430_100000210826 [0,1,0,0,0,0|1,0,0]=2 6705 B13R0.165 CCCCCCC(C)NCCCCO 34a_100000210919_100011216708 [0,1,0,0,0,0|1,0,0]=2 6706 B13R0.165 CCCCCCC(C)NCCCCO 34a_100000750430_100011215978 [0,1,0,0,0,0|1,0,0]=2 6707 B13R0.165 CCCCCCC(C)NCCCOC 2230a_100000210919_100000740836 [0,1,0,0,0,0|3,0,0]=4 6708 B13R0.165 CCCCCCC(C)NCCCOC 270004a_100150723488_100000210826 [0,1,0,0,0,0|3,0,0]=4 6709 B13R0.165 CCCCCCC(C)NCCCOC 34a_100000210919_100000740836 [0,1,0,0,0,0|3,0,0]=4 6710 B13R0.165 CCCCCCC(C)NCCCOC 34a_100150723488_100011215978 [0,1,0,0,0,0|3,0,0]=4 6711 B13R0.165 CCCCCCC(C)NCCCSC 2230a_100000749238_100011215978 [0,1,0,0,0,0|3,0,0]=4 6712 B13R0.165 CCCCCCC(C)NCCCSC 270004a_100000749238_100000210826 [0,1,0,0,0,0|3,0,0]=4 6713 B13R0.165 CCCCCCC(C)NCCOCC 2230a_100000210919_100011215890 [0,1,0,0,0,0|3,0,0]=4 6714 B13R0.165 CCCCCCC(C)NCCOCC 2230a_102516460346_100011215978 [0,1,0,0,0,0|3,0,0]=4 6715 B13R0.165 CCCCCCC(C)NCCOCC 270004a_102516460346_100000210826 [0,1,0,0,0,0|3,0,0]=4 6716 B13R0.165 CCCCCCC(C)NCCOCC 34a_100000210919_100000210147 [0,1,0,0,0,0|3,0,0]=4 6717 B13R0.165 CCCCCCC(C)NCCOCC 34a_102516460346_100011215978 [0,1,0,0,0,0|3,0,0]=4 6718 B13R0.165 CCCCCCC(C)NCCSCC 2230a_100000106463_100011215978 [0,1,0,0,0,0|3,0,0]=4 6719 B13R0.165 CCCCCCC(C)NCCSCC 2230a_100000210919_100000757381 [0,1,0,0,0,0|3,0,0]=4 6720 B13R0.165 CCCCCCC(C)NCCSCC 270004a_100000106463_100000210826 [0,1,0,0,0,0|3,0,0]=4 6721 B13R0.165 CCCCCCC(C)NCCSCC 34a_100000210919_100000757381 [0,1,0,0,0,0|3,0,0]=4 6722 B13R0.165 CCCCCCC(C)OCC#CCO 34a_100000210265_200000047223 [0,1,0,0,0,0|1,0,2]=4 6723 B13R0.165 CCCCCCC(C)OCC#CCO 7a_100000210265_200000047223 [0,1,0,0,0,0|1,0,2]=4 6724 B13R0.165 CCCCCCC(C)OCCCC#N 7a_100000210265_100000687738 [0,1,0,0,0,0|2,0,1]=4 6725 B13R0.165 CCCCCCC(C)OCCCC=O 7a_100000210265_200011292268 [0,1,0,0,0,0|1,0,2]=4 6726 B13R0.165 CCCCCCC(C)OCCCCBr 34a_100011216708_100011215978 [0,1,0,0,0,0|2,0,0]=3 6727 B13R0.165 CCCCCCC(C)OCCCCC 34a_100000210253_100011215978 [0,1,0,0,0,0|2,0,0]=3 6728 B13R0.165 CCCCCCC(C)OCCCCC 34a_100000210265_100000718602 [0,1,0,0,0,0|2,0,0]=3 6729 B13R0.165 CCCCCCC(C)OCCCCC 7a_100000210253_100011215978 [0,1,0,0,0,0|2,0,0]=3 6730 B13R0.165 CCCCCCC(C)OCCCCC 7a_100000210265_100000210326 [0,1,0,0,0,0|2,0,0]=3 6731 B13R0.165 CCCCCCC(C)OCCCCCl 34a_100000210776_100011215978 [0,1,0,0,0,0|2,0,0]=3 6732 B13R0.165 CCCCCCC(C)OCCCCCl 7a_100000210776_100011215978 [0,1,0,0,0,0|2,0,0]=3 6733 B13R0.165 CCCCCCC(C)OCCCCF 34a_100000210265_100000729493 [0,1,0,0,0,0|2,0,0]=3 6734 B13R0.165 CCCCCCC(C)OCCCCF 34a_100011995726_100011215978 [0,1,0,0,0,0|2,0,0]=3 6735 B13R0.165 CCCCCCC(C)OCCCCF 7a_100000210265_100000729493 [0,1,0,0,0,0|2,0,0]=3 6736 B13R0.165 CCCCCCC(C)OCCCCF 7a_100011995726_100011215978 [0,1,0,0,0,0|2,0,0]=3 6737 B13R0.165 CCCCCCC(C)OCCCCI 34a_200012148704_100011215978 [0,1,0,0,0,0|2,0,0]=3 6738 B13R0.165 CCCCCCC(C)OCCCCN 34a_100000750430_100011215978 [0,1,0,0,0,0|2,0,0]=3 6739 B13R0.165 CCCCCCC(C)OCCCCO 34a_100000210265_100011216708 [0,1,0,0,0,0|1,0,0]=2 6740 B13R0.165 CCCCCCC(C)OCCCCO 7a_100000210265_100000210776 [0,1,0,0,0,0|1,0,0]=2 6741 B13R0.165 CCCCCCC(C)OCCCNC 34a_100000213112_100011215978 [0,1,0,0,0,0|3,0,0]=4 6742 B13R0.165 CCCCCCC(C)OCCCOC 34a_100000210265_100000740836 [0,1,0,0,0,0|3,0,0]=4 6743 B13R0.165 CCCCCCC(C)OCCCOC 34a_100000740835_100011215978 [0,1,0,0,0,0|3,0,0]=4 6744 B13R0.165 CCCCCCC(C)OCCCOC 7a_100000210265_100000740836 [0,1,0,0,0,0|3,0,0]=4 6745 B13R0.165 CCCCCCC(C)OCCCSC 34a_100000690336_100011215978 [0,1,0,0,0,0|3,0,0]=4 6746 B13R0.165 CCCCCCC(C)OCCCSC 7a_100000690336_100011215978 [0,1,0,0,0,0|3,0,0]=4 6747 B13R0.165 CCCCCCC(C)OCCOCC 34a_100000210136_100011215978 [0,1,0,0,0,0|3,0,0]=4 6748 B13R0.165 CCCCCCC(C)OCCOCC 34a_100000210265_100000210147 [0,1,0,0,0,0|3,0,0]=4 6749 B13R0.165 CCCCCCC(C)OCCOCC 7a_100000210136_100011215978 [0,1,0,0,0,0|3,0,0]=4 6750 B13R0.165 CCCCCCC(C)OCCOCC 7a_100000210265_100011215890 [0,1,0,0,0,0|3,0,0]=4 6751 B13R0.165 CCCCCCC(C)OCCSCC 34a_100000210265_100000757381 [0,1,0,0,0,0|3,0,0]=4 6752 B13R0.165 CCCCCCC(C)OCCSCC 34a_100000212035_100011215978 [0,1,0,0,0,0|3,0,0]=4 6753 B13R0.165 CCCCCCC(C)OCCSCC 7a_100000210265_100000757381 [0,1,0,0,0,0|3,0,0]=4 6754 B13R0.165 CCCCCCC(C)OCCSCC 7a_100000212035_100011215978 [0,1,0,0,0,0|3,0,0]=4 6755 B13R0.165 CCCCCCC(C)SCC#CCO 62a_100011215978_200000047223 [0,1,0,0,0,0|1,0,2]=4 6756 B13R0.165 CCCCCCC(C)SCC#CCO 62a_200000047223_100011215978 [0,1,0,0,0,0|1,0,2]=4 6757 B13R0.165 CCCCCCC(C)SCCCC#N 62a_100000687738_100011215978 [0,1,0,0,0,0|2,0,1]=4 6758 B13R0.165 CCCCCCC(C)SCCCC#N 62a_100011215978_100000687738 [0,1,0,0,0,0|2,0,1]=4 6759 B13R0.165 CCCCCCC(C)SCCCC=O 62a_100011215978_200011292268 [0,1,0,0,0,0|1,0,2]=4 6760 B13R0.165 CCCCCCC(C)SCCCC=O 62a_200011292268_100011215978 [0,1,0,0,0,0|1,0,2]=4 6761 B13R0.165 CCCCCCC(C)SCCCCC 62a_100000210326_100011215978 [0,1,0,0,0,0|2,0,0]=3 6762 B13R0.165 CCCCCCC(C)SCCCCC 62a_100011215978_100000210326 [0,1,0,0,0,0|2,0,0]=3 6763 B13R0.165 CCCCCCC(C)SCCCCF 62a_100000729493_100011215978 [0,1,0,0,0,0|2,0,0]=3 6764 B13R0.165 CCCCCCC(C)SCCCCF 62a_100011215978_100000729493 [0,1,0,0,0,0|2,0,0]=3 6765 B13R0.165 CCCCCCC(C)SCCCCO 62a_100000210776_100011215978 [0,1,0,0,0,0|1,0,0]=2 6766 B13R0.165 CCCCCCC(C)SCCCCO 62a_100011215978_100000210776 [0,1,0,0,0,0|1,0,0]=2 6767 B13R0.165 CCCCCCC(C)SCCCOC 62a_100000709357_100011215978 [0,1,0,0,0,0|3,0,0]=4 6768 B13R0.165 CCCCCCC(C)SCCCOC 62a_100011215978_100000709357 [0,1,0,0,0,0|3,0,0]=4 6769 B13R0.165 CCCCCCC(C)SCCOCC 62a_100000210147_100011215978 [0,1,0,0,0,0|3,0,0]=4 6770 B13R0.165 CCCCCCC(C)SCCOCC 62a_100011215978_100011215890 [0,1,0,0,0,0|3,0,0]=4 6771 B13R0.165 CCCCCCC(C)SCCSCC 62a_100000757381_100011215978 [0,1,0,0,0,0|3,0,0]=4 6772 B13R0.165 CCCCCCC(C)SCCSCC 62a_100011215978_100000757381 [0,1,0,0,0,0|3,0,0]=4 6773 B13R0.165 CCCCCCN(C)CCCCC#N 2230a_106256046315_100000211819 [0,1,0,0,0,0|2,0,1]=4 6774 B13R0.165 CCCCCCN(C)CCCCC#N 269982a_106256046315_100011219923 [0,1,0,0,0,0|2,0,1]=4 6775 B13R0.165 CCCCCCN(C)CCCCC=O 2230a_106256046315_100000139335 [0,1,0,0,0,0|1,0,2]=4 6776 B13R0.165 CCCCCCN(C)CCCCC=O 269982a_106256046315_100000139335 [0,1,0,0,0,0|1,0,2]=4 6777 B13R0.165 CCCCCCN(C)CCCCCC 2230a_100000210582_200000210301 [0,1,0,0,0,0|2,0,0]=3 6778 B13R0.165 CCCCCCN(C)CCCCCC 2230a_106256046315_100000210314 [0,1,0,0,0,0|2,0,0]=3 6779 B13R0.165 CCCCCCN(C)CCCCCC 269982a_100000210582_200000210301 [0,1,0,0,0,0|2,0,0]=3 6780 B13R0.165 CCCCCCN(C)CCCCCC 269982a_106256046315_100000210757 [0,1,0,0,0,0|2,0,0]=3 6781 B13R0.165 CCCCCCN(C)CCCCCF 2230a_106256046315_100000729378 [0,1,0,0,0,0|2,0,0]=3 6782 B13R0.165 CCCCCCN(C)CCCCCF 269982a_106256046315_100000729378 [0,1,0,0,0,0|2,0,0]=3 6783 B13R0.165 CCCCCCN(C)CCCCCO 2230a_100000722520_100000210314 [0,1,0,0,0,0|1,0,0]=2 6784 B13R0.165 CCCCCCN(C)CCCCCO 2230a_106256046315_100000746330 [0,1,0,0,0,0|1,0,0]=2 6785 B13R0.165 CCCCCCN(C)CCCCCO 269982a_100000722520_100000210757 [0,1,0,0,0,0|1,0,0]=2 6786 B13R0.165 CCCCCCN(C)CCCCCO 269982a_106256046315_100000746330 [0,1,0,0,0,0|1,0,0]=2 6787 B13R0.165 CCCCCCN(C)CCCCOC 2230a_106256046315_100000730899 [0,1,0,0,0,0|3,0,0]=4 6788 B13R0.165 CCCCCCN(C)CCCCOC 269982a_106256046315_100000730899 [0,1,0,0,0,0|3,0,0]=4 6789 B13R0.165 CCCCCCN(C)CCCOCC 2230a_106256046315_100012232248 [0,1,0,0,0,0|3,0,0]=4 6790 B13R0.165 CCCCCCN(C)CCCOCC 269982a_106256046315_100012232248 [0,1,0,0,0,0|3,0,0]=4 6791 B13R0.165 CCCCCCN(C)CCOCCC 2230a_106256046315_100011215938 [0,1,0,0,0,0|3,0,0]=4 6792 B13R0.165 CCCCCCN(C)CCOCCC 269982a_106256046315_100011215938 [0,1,0,0,0,0|3,0,0]=4 6793 B13R0.165 CCCCCCN(C)CCOCCO 2230a_100000228057_100000210314 [0,1,0,0,0,0|2,0,0]=3 6794 B13R0.165 CCCCCCN(C)CCOCCO 2230a_106256046315_100011215305 [0,1,0,0,0,0|2,0,0]=3 6795 B13R0.165 CCCCCCN(C)CCOCCO 269982a_100000228057_100000210757 [0,1,0,0,0,0|2,0,0]=3 6796 B13R0.165 CCCCCCN(C)CCOCCO 269982a_106256046315_100011215305 [0,1,0,0,0,0|2,0,0]=3 6797 B13R0.165 CCCCCCN(C)COCCCC 2230a_106256046315_100011995733 [0,1,0,0,0,0|3,0,0]=4 6798 B13R0.165 CCCCCCN(C)COCCCC 269982a_106256046315_100011995733 [0,1,0,0,0,0|3,0,0]=4 6799 B13R0.165 CCCCCCN([13CH3])CCCCCC 2230a_100000210582_200025704644 [0,1,0,0,0,0|2,0,0]=3 6800 B13R0.165 CCCCCCN([13CH3])CCCCCC 269982a_100000210582_200025704644 [0,1,0,0,0,0|2,0,0]=3 6801 B13R0.165 CCCCCNC(=O)CCCCCO 240690a_100000209983_100102619762 [0,1,0,0,0,0|1,0,1]=3 6802 B13R0.165 CCCCCNC(=O)CCOCCO 1626a_100000209983_100011229844 [0,1,0,0,0,0|2,0,1]=4 6803 B13R0.165 CCCCCNC(=O)CCOCCO 240690a_100000209983_100011229844 [0,1,0,0,0,0|2,0,1]=4 6804 B13R0.165 CCCCCNC(=O)CSCCCO 62a_100000230301_100011215043 [0,1,0,0,0,0|2,0,1]=4 6805 B13R0.165 CCCCCNC(=O)CSCCCO 62a_100011215043_100000230301 [0,1,0,0,0,0|2,0,1]=4 6806 B13R0.165 CCCCCNC(=O)NCCCCO 2708a_100000209983_100000750430 [0,1,0,0,0,0|2,0,1]=4 6807 B13R0.165 CCCCCNC(=O)NCCCCO 2708a_100000750430_100000209983 [0,1,0,0,0,0|2,0,1]=4 6808 B13R0.165 CCCCCNC(=O)NCCCCO 273464a_100000209983_100000750430 [0,1,0,0,0,0|2,0,1]=4 6809 B13R0.165 CCCCCNC(=O)NCCCCO 273464a_100000750430_100000209983 [0,1,0,0,0,0|2,0,1]=4 6810 B13R0.165 CCCCCNC(=O)NCCCCO 512a_100000209983_100000750430 [0,1,0,0,0,0|2,0,1]=4 6811 B13R0.165 CCCCCNC(=O)NCCCCO 512a_100000750430_100000209983 [0,1,0,0,0,0|2,0,1]=4 6812 B13R0.165 CCCCCOC(C)COCCCC 34a_100011217071_100000718602 [0,1,0,0,0,0|3,0,0]=4 6813 B13R0.165 CCCCCOC(C)COCCCC 7a_100011217071_100000210326 [0,1,0,0,0,0|3,0,0]=4 6814 B13R0.165 CCCCNNC(=O)CCCCCO 22a_100025702795_100102619762 [0,1,0,0,0,0|2,0,1]=4 6815 B13R0.165 CCCCOCC(=O)CCCCCF 1458a_100000757543_100000729378 [0,1,0,0,0,0|2,0,1]=4 6816 B13R0.165 CCCCOCC(=O)CCCCCO 1458a_100000757543_100000746330 [0,1,0,0,0,0|1,0,1]=3 6817 B13R0.165 CCCCOCC(=O)CCCCCO 1458a_100102619762_100011995733 [0,1,0,0,0,0|1,0,1]=3 6818 B13R0.165 CCCCOCC(=O)CCOCCO 1458a_100000757543_100011215305 [0,1,0,0,0,0|2,0,1]=4 6819 B13R0.165 CCCCOCC(=O)CCOCCO 1458a_100011229844_100011995733 [0,1,0,0,0,0|2,0,1]=4 6820 B13R0.165 CCCCOCC(=O)NCCCCO 240690a_100000750430_100000757543 [0,1,0,0,0,0|2,0,1]=4 6821 B13R0.165 CCCCOCC(=O)NCCCCO 527a_100000750430_100000757543 [0,1,0,0,0,0|2,0,1]=4 6822 B13R0.165 CCCCOCC(C)OCCCCF 34a_100011217071_100000729493 [0,1,0,0,0,0|3,0,0]=4 6823 B13R0.165 CCCCOCC(C)OCCCCF 7a_100011217071_100000729493 [0,1,0,0,0,0|3,0,0]=4 6824 B13R0.165 CCCCOCC(C)OCCCCO 34a_100011217071_100011216708 [0,1,0,0,0,0|2,0,0]=3 6825 B13R0.165 CCCCOCC(C)OCCCCO 7a_100011217071_100000210776 [0,1,0,0,0,0|2,0,0]=3 6826 B13R0.165 CCCCOCN(C)CCCCCO 2230a_100000722520_100011995733 [0,1,0,0,0,0|2,0,0]=3 6827 B13R0.165 CCCCOCN(C)CCCCCO 269982a_100000722520_100011995733 [0,1,0,0,0,0|2,0,0]=3 6828 B13R0.165 CCCCOCN(C)CCOCCO 2230a_100000228057_100011995733 [0,1,0,0,0,0|3,0,0]=4 6829 B13R0.165 CCCCOCN(C)CCOCCO 269982a_100000228057_100011995733 [0,1,0,0,0,0|3,0,0]=4 6830 B13R0.165 CCCCSCC(=O)CCCCCF 1458a_100000191162_100000729378 [0,1,0,0,0,0|2,0,1]=4 6831 B13R0.165 CCCCSCC(=O)CCCCCO 1458a_100000191162_100000746330 [0,1,0,0,0,0|1,0,1]=3 6832 B13R0.165 CCCCSCC(=O)CCOCCO 1458a_100000191162_100011215305 [0,1,0,0,0,0|2,0,1]=4 6833 B13R0.165 CCCCSCC(=O)NCCCCO 240690a_100000750430_100000191162 [0,1,0,0,0,0|2,0,1]=4 6834 B13R0.165 CCCCSCC(=O)NCCCCO 527a_100000750430_100000191162 [0,1,0,0,0,0|2,0,1]=4 6835 B13R0.165 CCCOCCC(=O)CCCCCO 1458a_100102619762_100011215938 [0,1,0,0,0,0|1,0,1]=3 6836 B13R0.165 CCCOCCC(=O)CCOCCO 1458a_100011229844_100011215938 [0,1,0,0,0,0|2,0,1]=4 6837 B13R0.165 CCCOCCN(C)CCCCCO 2230a_100000722520_100011215938 [0,1,0,0,0,0|2,0,0]=3 6838 B13R0.165 CCCOCCN(C)CCCCCO 269982a_100000722520_100011215938 [0,1,0,0,0,0|2,0,0]=3 6839 B13R0.165 CCCOCCN(C)CCOCCO 2230a_100000228057_100011215938 [0,1,0,0,0,0|3,0,0]=4 6840 B13R0.165 CCCOCCN(C)CCOCCO 269982a_100000228057_100011215938 [0,1,0,0,0,0|3,0,0]=4 6841 B13R0.165 CCOCCCC(=O)CCCCCO 1458a_100102619762_100012232248 [0,1,0,0,0,0|1,0,1]=3 6842 B13R0.165 CCOCCCC(=O)CCOCCO 1458a_100011229844_100012232248 [0,1,0,0,0,0|2,0,1]=4 6843 B13R0.165 CCOCCCN(C)CCCCCO 2230a_100000722520_100012232248 [0,1,0,0,0,0|2,0,0]=3 6844 B13R0.165 CCOCCCN(C)CCCCCO 269982a_100000722520_100012232248 [0,1,0,0,0,0|2,0,0]=3 6845 B13R0.165 CCOCCCN(C)CCOCCO 2230a_100000228057_100012232248 [0,1,0,0,0,0|3,0,0]=4 6846 B13R0.165 CCOCCCN(C)CCOCCO 269982a_100000228057_100012232248 [0,1,0,0,0,0|3,0,0]=4 6847 B13R0.165 CCOCCNC(=O)CCCCCO 240690a_100011200944_100102619762 [0,1,0,0,0,0|2,0,1]=4 6848 B13R0.165 CCSCCNC(=O)CCCCCO 240690a_100000106463_100102619762 [0,1,0,0,0,0|2,0,1]=4 6849 B13R0.165 CN(CCCCC#N)CCCCCO 2230a_100000722520_100000211819 [0,1,0,0,0,0|2,0,1]=4 6850 B13R0.165 CN(CCCCC#N)CCCCCO 269982a_100000722520_100011219923 [0,1,0,0,0,0|2,0,1]=4 6851 B13R0.165 CN(CCCCC=O)CCCCCO 2230a_100000722520_100000139335 [0,1,0,0,0,0|2,0,1]=4 6852 B13R0.165 CN(CCCCC=O)CCCCCO 269982a_100000722520_100000139335 [0,1,0,0,0,0|2,0,1]=4 6853 B13R0.165 CN(CCCCCF)CCOCCO 2230a_100000228057_100000729378 [0,1,0,0,0,0|3,0,0]=4 6854 B13R0.165 CN(CCCCCF)CCOCCO 269982a_100000228057_100000729378 [0,1,0,0,0,0|3,0,0]=4 6855 B13R0.165 CN(CCCCCO)CCCCCF 2230a_100000722520_100000729378 [0,1,0,0,0,0|2,0,0]=3 6856 B13R0.165 CN(CCCCCO)CCCCCF 269982a_100000722520_100000729378 [0,1,0,0,0,0|2,0,0]=3 6857 B13R0.165 CN(CCCCCO)CCCCCO 2230a_100000722520_100000746330 [0,1,0,0,0,0|2,0,0]=3 6858 B13R0.165 CN(CCCCCO)CCCCCO 269982a_100000722520_100000746330 [0,1,0,0,0,0|2,0,0]=3 6859 B13R0.165 CN(CCCCCO)CCOCCO 2230a_100000228057_100000746330 [0,1,0,0,0,0|3,0,0]=4 6860 B13R0.165 CN(CCCCCO)CCOCCO 2230a_100000722520_100011215305 [0,1,0,0,0,0|3,0,0]=4 6861 B13R0.165 CN(CCCCCO)CCOCCO 269982a_100000228057_100000746330 [0,1,0,0,0,0|3,0,0]=4 6862 B13R0.165 CN(CCCCCO)CCOCCO 269982a_100000722520_100011215305 [0,1,0,0,0,0|3,0,0]=4 6863 B13R0.165 COCCCCC(=O)CCCCCO 1458a_100102619762_100000755781 [0,1,0,0,0,0|1,0,1]=3 6864 B13R0.165 COCCCCC(=O)CCOCCO 1458a_100011229844_100000755781 [0,1,0,0,0,0|2,0,1]=4 6865 B13R0.165 COCCCCN(C)CCCCCO 2230a_100000722520_100000730899 [0,1,0,0,0,0|2,0,0]=3 6866 B13R0.165 COCCCCN(C)CCCCCO 269982a_100000722520_100000730899 [0,1,0,0,0,0|2,0,0]=3 6867 B13R0.165 COCCCCN(C)CCOCCO 2230a_100000228057_100000730899 [0,1,0,0,0,0|3,0,0]=4 6868 B13R0.165 COCCCCN(C)CCOCCO 269982a_100000228057_100000730899 [0,1,0,0,0,0|3,0,0]=4 6869 B13R0.165 COCCCNC(=O)CCCCCO 240690a_100150723488_100102619762 [0,1,0,0,0,0|2,0,1]=4 6870 B13R0.165 COCCOCC(=O)CCCCCO 1458a_100000211095_100000746330 [0,1,0,0,0,0|2,0,1]=4 6871 B13R0.165 COCCOCN(C)CCCCCO 2230a_100000722520_100000231047 [0,1,0,0,0,0|3,0,0]=4 6872 B13R0.165 COCCOCN(C)CCCCCO 269982a_100000722520_100000231047 [0,1,0,0,0,0|3,0,0]=4 6873 B13R0.165 CSCCCNC(=O)CCCCCO 240690a_100000749238_100102619762 [0,1,0,0,0,0|2,0,1]=4 6874 B13R0.165 N#CCCCCC(=O)CCCCCO 1458a_100102619762_100000211819 [0,1,0,0,0,0|1,0,2]=4 6875 B13R0.165 O=C(CCCCCF)CCOCCO 1458a_100011229844_100000729378 [0,1,0,0,0,0|2,0,1]=4 6876 B13R0.165 O=C(CCCCCO)CCCCCF 1458a_100102619762_100000729378 [0,1,0,0,0,0|1,0,1]=3 6877 B13R0.165 O=C(CCCCCO)CCCCCO 1458a_100102619762_100000746330 [0,1,0,0,0,0|1,0,1]=3 6878 B13R0.165 O=C(CCCCCO)CCOCCO 1458a_100011229844_100000746330 [0,1,0,0,0,0|2,0,1]=4 6879 B13R0.165 O=C(CCCCCO)CCOCCO 1458a_100102619762_100011215305 [0,1,0,0,0,0|2,0,1]=4 6880 B13R0.165 O=C(CCCCCO)NCCCCO 240690a_100000750430_100102619762 [0,1,0,0,0,0|2,0,1]=4 6881 B13R0.336 C#CCCCCCCCCCCOC 34a_100000054667_200000210301 [0,1,0,0,0,0|0,0,2]=3 6882 B13R0.336 C#CCCCCCCCCCCOC 7a_100000054667_200000210301 [0,1,0,0,0,0|0,0,2]=3 6883 B13R0.336 C#CCCCCCCCCCCO[13CH3] 34a_100000054667_200025704644 [0,1,0,0,0,0|0,0,2]=3 6884 B13R0.336 C#CCCCCCCCCCCO[13CH3] 7a_100000054667_200025704644 [0,1,0,0,0,0|0,0,2]=3 6885 B13R0.336 C#CCCCCCCCCCOCC 34a_100000034437_100000210202 [0,1,0,0,0,0|1,0,1]=3 6886 B13R0.336 C#CCCCCCCCCCOCC 7a_100000034437_100000210202 [0,1,0,0,0,0|1,0,1]=3 6887 B13R0.336 C#CCCCCCCCCCOCF 34a_100000034437_100015361967 [0,1,0,0,0,0|1,0,2]=4 6888 B13R0.336 C#CCCCCCCCCCOCF 7a_100000034437_100015361967 [0,1,0,0,0,0|1,0,2]=4 6889 B13R0.336 C#CCCCCCCCCOCCC 34a_100000065265_100000210303 [0,1,0,0,0,0|1,0,1]=3 6890 B13R0.336 C#CCCCCCCCCOCCC 7a_100000065265_100000210303 [0,1,0,0,0,0|1,0,1]=3 6891 B13R0.336 C#CCCCCCCCCOCCF 34a_100000065265_100011217306 [0,1,0,0,0,0|1,0,2]=4 6892 B13R0.336 C#CCCCCCCCCOCCF 7a_100000065265_100011217306 [0,1,0,0,0,0|1,0,2]=4 6893 B13R0.336 C#CCCCCCCCCOCCO 34a_100000065265_100000211926 [0,1,0,0,0,0|0,0,2]=3 6894 B13R0.336 C#CCCCCCCCCOCCO 7a_100000065265_100000211926 [0,1,0,0,0,0|0,0,2]=3 6895 B13R0.336 C#CCCCCCCCCOCSC 34a_100000065265_100011218213 [0,1,0,0,0,0|2,0,1]=4 6896 B13R0.336 C#CCCCCCCCNCCCC 2230a_100000102301_100153394163 [0,1,0,0,0,0|1,0,1]=3 6897 B13R0.336 C#CCCCCCCCNCCCC 7a_106832991798_100153394163 [0,1,0,0,0,0|1,0,1]=3 6898 B13R0.336 C#CCCCCCCCNCCCF 2230a_100015189416_100153394163 [0,1,0,0,0,0|1,0,2]=4 6899 B13R0.336 C#CCCCCCCCNCCCF 34a_100015189416_100153394163 [0,1,0,0,0,0|1,0,2]=4 6900 B13R0.336 C#CCCCCCCCNCCOC 2230a_100000209980_100153394163 [0,1,0,0,0,0|1,0,2]=4 6901 B13R0.336 C#CCCCCCCCNCCSC 2230a_100020590264_100153394163 [0,1,0,0,0,0|2,0,1]=4 6902 B13R0.336 C#CCCCCCCCOCCCBr 34a_100011217188_100153394163 [0,1,0,0,0,0|1,0,2]=4 6903 B13R0.336 C#CCCCCCCCOCCCC 34a_100000054614_100000210210 [0,1,0,0,0,0|1,0,1]=3 6904 B13R0.336 C#CCCCCCCCOCCCC 34a_100000210227_100153394163 [0,1,0,0,0,0|1,0,1]=3 6905 B13R0.336 C#CCCCCCCCOCCCC 7a_100000054614_100000210211 [0,1,0,0,0,0|1,0,1]=3 6906 B13R0.336 C#CCCCCCCCOCCCC 7a_100000210227_100153394163 [0,1,0,0,0,0|1,0,1]=3 6907 B13R0.336 C#CCCCCCCCOCCCCl 34a_100000230001_100153394163 [0,1,0,0,0,0|1,0,2]=4 6908 B13R0.336 C#CCCCCCCCOCCCF 34a_100000054614_100011934791 [0,1,0,0,0,0|1,0,2]=4 6909 B13R0.336 C#CCCCCCCCOCCCF 34a_100000759539_100153394163 [0,1,0,0,0,0|1,0,2]=4 6910 B13R0.336 C#CCCCCCCCOCCCF 7a_100000054614_100011934791 [0,1,0,0,0,0|1,0,2]=4 6911 B13R0.336 C#CCCCCCCCOCCCN 34a_100000182051_100153394163 [0,1,0,0,0,0|1,0,2]=4 6912 B13R0.336 C#CCCCCCCCOCCCO 34a_100000054614_100000230001 [0,1,0,0,0,0|0,0,2]=3 6913 B13R0.336 C#CCCCCCCCOCCCO 7a_100000054614_100011215043 [0,1,0,0,0,0|0,0,2]=3 6914 B13R0.336 C#CCCCCCCCOCCOC 34a_100000054614_100011201679 [0,1,0,0,0,0|1,0,2]=4 6915 B13R0.336 C#CCCCCCCCOCCOC 34a_100000210237_100153394163 [0,1,0,0,0,0|1,0,2]=4 6916 B13R0.336 C#CCCCCCCCOCCOC 7a_100000054614_100000233755 [0,1,0,0,0,0|1,0,2]=4 6917 B13R0.336 C#CCCCCCCCOCCON 34a_100000700252_100153394163 [0,1,0,0,0,0|1,0,2]=4 6918 B13R0.336 C#CCCCCCCCOCCSC 34a_100000054614_100000212216 [0,1,0,0,0,0|2,0,1]=4 6919 B13R0.336 C#CCCCCCCCOCCSC 34a_100000230434_100153394163 [0,1,0,0,0,0|2,0,1]=4 6920 B13R0.336 C#CCCCCCCCOCCSC 7a_100000054614_100000212216 [0,1,0,0,0,0|2,0,1]=4 6921 B13R0.336 C#CCCCCCCCOCCSC 7a_100000230434_100153394163 [0,1,0,0,0,0|2,0,1]=4 6922 B13R0.336 C#CCCCCCCCSCCCC 62a_100000210211_100153394163 [0,1,0,0,0,0|1,0,1]=3 6923 B13R0.336 C#CCCCCCCCSCCCC 62a_100153394163_100000210210 [0,1,0,0,0,0|1,0,1]=3 6924 B13R0.336 C#CCCCCCCCSCCCF 62a_100011934791_100153394163 [0,1,0,0,0,0|1,0,2]=4 6925 B13R0.336 C#CCCCCCCCSCCCF 62a_100153394163_100011934791 [0,1,0,0,0,0|1,0,2]=4 6926 B13R0.336 C#CCCCCCCCSCCCO 62a_100011215043_100153394163 [0,1,0,0,0,0|0,0,2]=3 6927 B13R0.336 C#CCCCCCCCSCCCO 62a_100153394163_100011215043 [0,1,0,0,0,0|0,0,2]=3 6928 B13R0.336 C#CCCCCCCCSCCOC 62a_100000233755_100153394163 [0,1,0,0,0,0|1,0,2]=4 6929 B13R0.336 C#CCCCCCCCSCCOC 62a_100153394163_100000233755 [0,1,0,0,0,0|1,0,2]=4 6930 B13R0.336 C#CCCCCCCCSCCSC 62a_100000212216_100153394163 [0,1,0,0,0,0|2,0,1]=4 6931 B13R0.336 C#CCCCCCCCSCCSC 62a_100153394163_100000751147 [0,1,0,0,0,0|2,0,1]=4 6932 B13R0.336 C#CCCCCCCCSCOCC 62a_100000739092_100153394163 [0,1,0,0,0,0|2,0,1]=4 6933 B13R0.336 C#CCCCCCCCSCOCC 62a_100153394163_100000739092 [0,1,0,0,0,0|2,0,1]=4 6934 B13R0.336 C#CCCCCCCNCCCCC 2230a_100000209983_100012276617 [0,1,0,0,0,0|1,0,1]=3 6935 B13R0.336 C#CCCCCCCNCCCCO 2230a_100000750430_100012276617 [0,1,0,0,0,0|0,0,2]=3 6936 B13R0.336 C#CCCCCCCNCCCCO 34a_100000750430_100012276617 [0,1,0,0,0,0|0,0,2]=3 6937 B13R0.336 C#CCCCCCCNCCCOC 34a_100150723488_100012276617 [0,1,0,0,0,0|1,0,2]=4 6938 B13R0.336 C#CCCCCCCNCCCSC 2230a_100000749238_100012276617 [0,1,0,0,0,0|2,0,1]=4 6939 B13R0.336 C#CCCCCCCNCCOCC 2230a_102516460346_100012276617 [0,1,0,0,0,0|2,0,1]=4 6940 B13R0.336 C#CCCCCCCNCCOCC 34a_102516460346_100012276617 [0,1,0,0,0,0|2,0,1]=4 6941 B13R0.336 C#CCCCCCCNCCSCC 2230a_100000106463_100012276617 [0,1,0,0,0,0|2,0,1]=4 6942 B13R0.336 C#CCCCCCCOCCCCBr 34a_100011216708_100012276617 [0,1,0,0,0,0|1,0,2]=4 6943 B13R0.336 C#CCCCCCCOCCCCC 34a_100000210253_100012276617 [0,1,0,0,0,0|1,0,1]=3 6944 B13R0.336 C#CCCCCCCOCCCCC 34a_100011217361_100000718602 [0,1,0,0,0,0|1,0,1]=3 6945 B13R0.336 C#CCCCCCCOCCCCC 7a_100000210253_100012276617 [0,1,0,0,0,0|1,0,1]=3 6946 B13R0.336 C#CCCCCCCOCCCCC 7a_100011217361_100000210326 [0,1,0,0,0,0|1,0,1]=3 6947 B13R0.336 C#CCCCCCCOCCCCCl 34a_100000210776_100012276617 [0,1,0,0,0,0|1,0,2]=4 6948 B13R0.336 C#CCCCCCCOCCCCCl 7a_100000210776_100012276617 [0,1,0,0,0,0|1,0,2]=4 6949 B13R0.336 C#CCCCCCCOCCCCF 34a_100011217361_100000729493 [0,1,0,0,0,0|1,0,2]=4 6950 B13R0.336 C#CCCCCCCOCCCCF 34a_100011995726_100012276617 [0,1,0,0,0,0|1,0,2]=4 6951 B13R0.336 C#CCCCCCCOCCCCF 7a_100011217361_100000729493 [0,1,0,0,0,0|1,0,2]=4 6952 B13R0.336 C#CCCCCCCOCCCCF 7a_100011995726_100012276617 [0,1,0,0,0,0|1,0,2]=4 6953 B13R0.336 C#CCCCCCCOCCCCI 34a_200012148704_100012276617 [0,1,0,0,0,0|1,0,2]=4 6954 B13R0.336 C#CCCCCCCOCCCCN 34a_100000750430_100012276617 [0,1,0,0,0,0|1,0,2]=4 6955 B13R0.336 C#CCCCCCCOCCCCO 34a_100011217361_100011216708 [0,1,0,0,0,0|0,0,2]=3 6956 B13R0.336 C#CCCCCCCOCCCCO 7a_100011217361_100000210776 [0,1,0,0,0,0|0,0,2]=3 6957 B13R0.336 C#CCCCCCCOCCCNC 34a_100000213112_100012276617 [0,1,0,0,0,0|2,0,1]=4 6958 B13R0.336 C#CCCCCCCOCCCOC 34a_100000740835_100012276617 [0,1,0,0,0,0|1,0,2]=4 6959 B13R0.336 C#CCCCCCCOCCCOC 34a_100011217361_100000740836 [0,1,0,0,0,0|1,0,2]=4 6960 B13R0.336 C#CCCCCCCOCCCOC 7a_100011217361_100000740836 [0,1,0,0,0,0|1,0,2]=4 6961 B13R0.336 C#CCCCCCCOCCCSC 34a_100000690336_100012276617 [0,1,0,0,0,0|2,0,1]=4 6962 B13R0.336 C#CCCCCCCOCCCSC 7a_100000690336_100012276617 [0,1,0,0,0,0|2,0,1]=4 6963 B13R0.336 C#CCCCCCCOCCOCC 34a_100000210136_100012276617 [0,1,0,0,0,0|2,0,1]=4 6964 B13R0.336 C#CCCCCCCOCCOCC 34a_100011217361_100000210147 [0,1,0,0,0,0|2,0,1]=4 6965 B13R0.336 C#CCCCCCCOCCOCC 7a_100000210136_100012276617 [0,1,0,0,0,0|2,0,1]=4 6966 B13R0.336 C#CCCCCCCOCCOCC 7a_100011217361_100011215890 [0,1,0,0,0,0|2,0,1]=4 6967 B13R0.336 C#CCCCCCCOCCSCC 34a_100000212035_100012276617 [0,1,0,0,0,0|2,0,1]=4 6968 B13R0.336 C#CCCCCCCOCCSCC 34a_100011217361_100000757381 [0,1,0,0,0,0|2,0,1]=4 6969 B13R0.336 C#CCCCCCCOCCSCC 7a_100000212035_100012276617 [0,1,0,0,0,0|2,0,1]=4 6970 B13R0.336 C#CCCCCCCOCCSCC 7a_100011217361_100000757381 [0,1,0,0,0,0|2,0,1]=4 6971 B13R0.336 C#CCCCCCCSCCCCC 62a_100000210326_100012276617 [0,1,0,0,0,0|1,0,1]=3 6972 B13R0.336 C#CCCCCCCSCCCCC 62a_100012276617_100000210326 [0,1,0,0,0,0|1,0,1]=3 6973 B13R0.336 C#CCCCCCCSCCCCF 62a_100000729493_100012276617 [0,1,0,0,0,0|1,0,2]=4 6974 B13R0.336 C#CCCCCCCSCCCCF 62a_100012276617_100000729493 [0,1,0,0,0,0|1,0,2]=4 6975 B13R0.336 C#CCCCCCCSCCCCO 62a_100000210776_100012276617 [0,1,0,0,0,0|0,0,2]=3 6976 B13R0.336 C#CCCCCCCSCCCCO 62a_100012276617_100000210776 [0,1,0,0,0,0|0,0,2]=3 6977 B13R0.336 C#CCCCCCCSCCCOC 62a_100000709357_100012276617 [0,1,0,0,0,0|1,0,2]=4 6978 B13R0.336 C#CCCCCCCSCCCOC 62a_100012276617_100000709357 [0,1,0,0,0,0|1,0,2]=4 6979 B13R0.336 C#CCCCCCCSCCOCC 62a_100000210147_100012276617 [0,1,0,0,0,0|2,0,1]=4 6980 B13R0.336 C#CCCCCCCSCCOCC 62a_100012276617_100011215890 [0,1,0,0,0,0|2,0,1]=4 6981 B13R0.336 C#CCCCCCCSCCSCC 62a_100000757381_100012276617 [0,1,0,0,0,0|2,0,1]=4 6982 B13R0.336 C#CCCCCCCSCCSCC 62a_100012276617_100000757381 [0,1,0,0,0,0|2,0,1]=4 6983 B13R0.336 C#CCCCCCNCCCCCC 2230a_100000210581_100012094781 [0,1,0,0,0,0|1,0,1]=3 6984 B13R0.336 C#CCCCCCNCCCCCO 2230a_100000762737_100012094781 [0,1,0,0,0,0|0,0,2]=3 6985 B13R0.336 C#CCCCCCNCCCCCO 34a_100000762737_100012094781 [0,1,0,0,0,0|0,0,2]=3 6986 B13R0.336 C#CCCCCCNCCCOCC 2230a_100000210961_100012094781 [0,1,0,0,0,0|2,0,1]=4 6987 B13R0.336 C#CCCCCCNCCCOCC 34a_100000210961_100012094781 [0,1,0,0,0,0|2,0,1]=4 6988 B13R0.336 C#CCCCCCNCCOCCC 2230a_100161115042_100012094781 [0,1,0,0,0,0|2,0,1]=4 6989 B13R0.336 C#CCCCCCNCCOCCC 34a_100161115042_100012094781 [0,1,0,0,0,0|2,0,1]=4 6990 B13R0.336 C#CCCCCCNCCOCCO 2230a_100000211614_100012094781 [0,1,0,0,0,0|1,0,2]=4 6991 B13R0.336 C#CCCCCCNCCOCCO 34a_100000211614_100012094781 [0,1,0,0,0,0|1,0,2]=4 6992 B13R0.336 C#CCCCCCNCCSCCC 2230a_100020603323_100012094781 [0,1,0,0,0,0|2,0,1]=4 6993 B13R0.336 C#CCCCCCNCCSCCO 2230a_100011219999_100012094781 [0,1,0,0,0,0|1,0,2]=4 6994 B13R0.336 C#CCCCCCOCCCCCBr 34a_100000746331_100012094781 [0,1,0,0,0,0|1,0,2]=4 6995 B13R0.336 C#CCCCCCOCCCCCBr 7a_100000746331_100012094781 [0,1,0,0,0,0|1,0,2]=4 6996 B13R0.336 C#CCCCCCOCCCCCC 34a_100000210259_100012094781 [0,1,0,0,0,0|1,0,1]=3 6997 B13R0.336 C#CCCCCCOCCCCCC 34a_100000766912_100000210314 [0,1,0,0,0,0|1,0,1]=3 6998 B13R0.336 C#CCCCCCOCCCCCC 7a_100000210259_100012094781 [0,1,0,0,0,0|1,0,1]=3 6999 B13R0.336 C#CCCCCCOCCCCCC 7a_100000766912_100000210314 [0,1,0,0,0,0|1,0,1]=3 7000 B13R0.336 C#CCCCCCOCCCCCCl 34a_100000746330_100012094781 [0,1,0,0,0,0|1,0,2]=4 7001 B13R0.336 C#CCCCCCOCCCCCCl 7a_100000746330_100012094781 [0,1,0,0,0,0|1,0,2]=4 7002 B13R0.336 C#CCCCCCOCCCCCF 34a_100000766912_100000729378 [0,1,0,0,0,0|1,0,2]=4 7003 B13R0.336 C#CCCCCCOCCCCCF 7a_100000766912_100000729378 [0,1,0,0,0,0|1,0,2]=4 7004 B13R0.336 C#CCCCCCOCCCCCI 34a_200012148887_100012094781 [0,1,0,0,0,0|1,0,2]=4 7005 B13R0.336 C#CCCCCCOCCCCCI 7a_200012148887_100012094781 [0,1,0,0,0,0|1,0,2]=4 7006 B13R0.336 C#CCCCCCOCCCCCN 34a_100000762737_100012094781 [0,1,0,0,0,0|1,0,2]=4 7007 B13R0.336 C#CCCCCCOCCCCCO 34a_100000766912_100000746330 [0,1,0,0,0,0|0,0,2]=3 7008 B13R0.336 C#CCCCCCOCCCCCO 7a_100000766912_100000746330 [0,1,0,0,0,0|0,0,2]=3 7009 B13R0.336 C#CCCCCCOCCCCOC 34a_100000740925_100012094781 [0,1,0,0,0,0|1,0,2]=4 7010 B13R0.336 C#CCCCCCOCCCCOC 34a_100000766912_100000755781 [0,1,0,0,0,0|1,0,2]=4 7011 B13R0.336 C#CCCCCCOCCCCOC 7a_100000766912_100000730899 [0,1,0,0,0,0|1,0,2]=4 7012 B13R0.336 C#CCCCCCOCCCCSC 34a_100011217163_100012094781 [0,1,0,0,0,0|2,0,1]=4 7013 B13R0.336 C#CCCCCCOCCCCSC 7a_100011217163_100012094781 [0,1,0,0,0,0|2,0,1]=4 7014 B13R0.336 C#CCCCCCOCCCOCC 34a_100000757476_100012094781 [0,1,0,0,0,0|2,0,1]=4 7015 B13R0.336 C#CCCCCCOCCCOCC 34a_100000766912_100012232248 [0,1,0,0,0,0|2,0,1]=4 7016 B13R0.336 C#CCCCCCOCCCOCC 7a_100000757476_100012094781 [0,1,0,0,0,0|2,0,1]=4 7017 B13R0.336 C#CCCCCCOCCCOCC 7a_100000766912_100012232248 [0,1,0,0,0,0|2,0,1]=4 7018 B13R0.336 C#CCCCCCOCCCSCC 34a_100011216438_100012094781 [0,1,0,0,0,0|2,0,1]=4 7019 B13R0.336 C#CCCCCCOCCCSCC 7a_100011216438_100012094781 [0,1,0,0,0,0|2,0,1]=4 7020 B13R0.336 C#CCCCCCOCCOCCC 34a_100000752267_100012094781 [0,1,0,0,0,0|2,0,1]=4 7021 B13R0.336 C#CCCCCCOCCOCCC 34a_100000766912_100011215938 [0,1,0,0,0,0|2,0,1]=4 7022 B13R0.336 C#CCCCCCOCCOCCC 7a_100000752267_100012094781 [0,1,0,0,0,0|2,0,1]=4 7023 B13R0.336 C#CCCCCCOCCOCCC 7a_100000766912_100011215938 [0,1,0,0,0,0|2,0,1]=4 7024 B13R0.336 C#CCCCCCOCCOCCO 34a_100000766912_100000692535 [0,1,0,0,0,0|1,0,2]=4 7025 B13R0.336 C#CCCCCCOCCOCCO 7a_100000766912_100011215305 [0,1,0,0,0,0|1,0,2]=4 7026 B13R0.336 C#CCCCCCOCCSCCC 34a_200000230433_100012094781 [0,1,0,0,0,0|2,0,1]=4 7027 B13R0.336 C#CCCCCCOCCSCCC 7a_200000230433_100012094781 [0,1,0,0,0,0|2,0,1]=4 7028 B13R0.336 C#CCCCCCOCOCCCC 34a_100000766912_100011995733 [0,1,0,0,0,0|2,0,1]=4 7029 B13R0.336 C#CCCCCCSCCCCCC 62a_100000210314_100012094781 [0,1,0,0,0,0|1,0,1]=3 7030 B13R0.336 C#CCCCCCSCCCCCC 62a_100012094781_100000210757 [0,1,0,0,0,0|1,0,1]=3 7031 B13R0.336 C#CCCCCCSCCCCCF 62a_100000729378_100012094781 [0,1,0,0,0,0|1,0,2]=4 7032 B13R0.336 C#CCCCCCSCCCCCF 62a_100012094781_100000729378 [0,1,0,0,0,0|1,0,2]=4 7033 B13R0.336 C#CCCCCCSCCCCCO 62a_100000746330_100012094781 [0,1,0,0,0,0|0,0,2]=3 7034 B13R0.336 C#CCCCCCSCCCCCO 62a_100012094781_100000746330 [0,1,0,0,0,0|0,0,2]=3 7035 B13R0.336 C#CCCCCCSCCCCOC 62a_100000730899_100012094781 [0,1,0,0,0,0|1,0,2]=4 7036 B13R0.336 C#CCCCCCSCCCCOC 62a_100012094781_100000730899 [0,1,0,0,0,0|1,0,2]=4 7037 B13R0.336 C#CCCCCCSCCCOCC 62a_100012094781_100012232248 [0,1,0,0,0,0|2,0,1]=4 7038 B13R0.336 C#CCCCCCSCCCOCC 62a_100012232248_100012094781 [0,1,0,0,0,0|2,0,1]=4 7039 B13R0.336 C#CCCCCCSCCOCCC 62a_100011215938_100012094781 [0,1,0,0,0,0|2,0,1]=4 7040 B13R0.336 C#CCCCCCSCCOCCC 62a_100012094781_100011215938 [0,1,0,0,0,0|2,0,1]=4 7041 B13R0.336 C#CCCCCCSCCOCCO 62a_100011215305_100012094781 [0,1,0,0,0,0|1,0,2]=4 7042 B13R0.336 C#CCCCCCSCCOCCO 62a_100012094781_100011215305 [0,1,0,0,0,0|1,0,2]=4 7043 B13R0.336 C#CCCCCCSCOCCCC 62a_100011995733_100012094781 [0,1,0,0,0,0|2,0,1]=4 7044 B13R0.336 C#CCCCCCSCOCCCC 62a_100012094781_100011995733 [0,1,0,0,0,0|2,0,1]=4 7045 B13R0.336 C#CCCCCNCCCCCCC 2230a_100000229938_100010269958 [0,1,0,0,0,0|1,0,1]=3 7046 B13R0.336 C#CCCCCNCCCCCCC 2230a_100000706060_100000210681 [0,1,0,0,0,0|1,0,1]=3 7047 B13R0.336 C#CCCCCNCCCCCCC 34a_100000706060_100000210614 [0,1,0,0,0,0|1,0,1]=3 7048 B13R0.336 C#CCCCCNCCCCCCF 2230a_100000706060_100015922095 [0,1,0,0,0,0|1,0,2]=4 7049 B13R0.336 C#CCCCCNCCCCCCF 34a_100000706060_100015922095 [0,1,0,0,0,0|1,0,2]=4 7050 B13R0.336 C#CCCCCNCCCCCCO 2230a_100000686447_100010269958 [0,1,0,0,0,0|0,0,2]=3 7051 B13R0.336 C#CCCCCNCCCCCCO 2230a_100000706060_100000766143 [0,1,0,0,0,0|0,0,2]=3 7052 B13R0.336 C#CCCCCNCCCCCCO 34a_100000686447_100010269958 [0,1,0,0,0,0|0,0,2]=3 7053 B13R0.336 C#CCCCCNCCCCCCO 34a_100000706060_100000766143 [0,1,0,0,0,0|0,0,2]=3 7054 B13R0.336 C#CCCCCNCCCCCOC 2230a_100000747528_100010269958 [0,1,0,0,0,0|1,0,2]=4 7055 B13R0.336 C#CCCCCNCCCCCOC 34a_100000747528_100010269958 [0,1,0,0,0,0|1,0,2]=4 7056 B13R0.336 C#CCCCCNCCCOCCC 2230a_100011217757_100010269958 [0,1,0,0,0,0|2,0,1]=4 7057 B13R0.336 C#CCCCCNCCCOCCC 34a_100011217757_100010269958 [0,1,0,0,0,0|2,0,1]=4 7058 B13R0.336 C#CCCCCNCCOCCCC 2230a_100000706060_100000743108 [0,1,0,0,0,0|2,0,1]=4 7059 B13R0.336 C#CCCCCNCCOCCCC 34a_100000706060_100000743108 [0,1,0,0,0,0|2,0,1]=4 7060 B13R0.336 C#CCCCCNCCSCCCC 2230a_100025743550_100010269958 [0,1,0,0,0,0|2,0,1]=4 7061 B13R0.336 C#CCCCCOCCCCCCBr 34a_100011215345_100010269958 [0,1,0,0,0,0|1,0,2]=4 7062 B13R0.336 C#CCCCCOCCCCCCBr 7a_100011215345_100010269958 [0,1,0,0,0,0|1,0,2]=4 7063 B13R0.336 C#CCCCCOCCCCCCC 34a_100000210272_100010269958 [0,1,0,0,0,0|1,0,1]=3 7064 B13R0.336 C#CCCCCOCCCCCCC 34a_100000766709_100000210614 [0,1,0,0,0,0|1,0,1]=3 7065 B13R0.336 C#CCCCCOCCCCCCC 7a_100000210272_100010269958 [0,1,0,0,0,0|1,0,1]=3 7066 B13R0.336 C#CCCCCOCCCCCCC 7a_100000766709_100000210614 [0,1,0,0,0,0|1,0,1]=3 7067 B13R0.336 C#CCCCCOCCCCCCCl 34a_100000766143_100010269958 [0,1,0,0,0,0|1,0,2]=4 7068 B13R0.336 C#CCCCCOCCCCCCCl 7a_100000766143_100010269958 [0,1,0,0,0,0|1,0,2]=4 7069 B13R0.336 C#CCCCCOCCCCCCF 34a_100000732779_100010269958 [0,1,0,0,0,0|1,0,2]=4 7070 B13R0.336 C#CCCCCOCCCCCCF 34a_100000766709_100015922095 [0,1,0,0,0,0|1,0,2]=4 7071 B13R0.336 C#CCCCCOCCCCCCF 7a_100000732779_100010269958 [0,1,0,0,0,0|1,0,2]=4 7072 B13R0.336 C#CCCCCOCCCCCCF 7a_100000766709_100015922095 [0,1,0,0,0,0|1,0,2]=4 7073 B13R0.336 C#CCCCCOCCCCCCN 34a_100000686447_100010269958 [0,1,0,0,0,0|1,0,2]=4 7074 B13R0.336 C#CCCCCOCCCCCCO 34a_100000766709_100000766143 [0,1,0,0,0,0|0,0,2]=3 7075 B13R0.336 C#CCCCCOCCCCCCO 7a_100000766709_100000766143 [0,1,0,0,0,0|0,0,2]=3 7076 B13R0.336 C#CCCCCOCCCCCNC 34a_100000722520_100010269958 [0,1,0,0,0,0|2,0,1]=4 7077 B13R0.336 C#CCCCCOCCOCCCC 34a_100000210238_100010269958 [0,1,0,0,0,0|2,0,1]=4 7078 B13R0.336 C#CCCCCOCCOCCCC 34a_100000766709_100000743108 [0,1,0,0,0,0|2,0,1]=4 7079 B13R0.336 C#CCCCCOCCOCCCC 7a_100000210238_100010269958 [0,1,0,0,0,0|2,0,1]=4 7080 B13R0.336 C#CCCCCOCCOCCCC 7a_100000766709_100000743108 [0,1,0,0,0,0|2,0,1]=4 7081 B13R0.336 C#CCCCCOCCSCCCC 34a_200000230436_100010269958 [0,1,0,0,0,0|2,0,1]=4 7082 B13R0.336 C#CCCCCOCCSCCCC 7a_200000230436_100010269958 [0,1,0,0,0,0|2,0,1]=4 7083 B13R0.336 C#CCCCCSCCCCCCC 62a_100000210614_100010269958 [0,1,0,0,0,0|1,0,1]=3 7084 B13R0.336 C#CCCCCSCCCCCCC 62a_100010269958_100000210316 [0,1,0,0,0,0|1,0,1]=3 7085 B13R0.336 C#CCCCCSCCCCCCF 62a_100010269958_100015922095 [0,1,0,0,0,0|1,0,2]=4 7086 B13R0.336 C#CCCCCSCCCCCCF 62a_100015922095_100010269958 [0,1,0,0,0,0|1,0,2]=4 7087 B13R0.336 C#CCCCCSCCCCCCO 62a_100000766143_100010269958 [0,1,0,0,0,0|0,0,2]=3 7088 B13R0.336 C#CCCCCSCCCCCCO 62a_100010269958_100000766143 [0,1,0,0,0,0|0,0,2]=3 7089 B13R0.336 C#CCCCCSCCOCCCC 62a_100000743108_100010269958 [0,1,0,0,0,0|2,0,1]=4 7090 B13R0.336 C#CCCCCSCCOCCCC 62a_100010269958_100000743108 [0,1,0,0,0,0|2,0,1]=4 7091 B13R0.336 C#CCCCNCCCCCCCC 2230a_100000229939_100000731252 [0,1,0,0,0,0|1,0,1]=3 7092 B13R0.336 C#CCCCNCCCCCCCC 34a_100000229939_100000695029 [0,1,0,0,0,0|1,0,1]=3 7093 B13R0.336 C#CCCCNCCCCCCCC 34a_100000718082_100000210759 [0,1,0,0,0,0|1,0,1]=3 7094 B13R0.336 C#CCCCNCCCCCCCO 2230a_100011996573_100000731252 [0,1,0,0,0,0|0,0,2]=3 7095 B13R0.336 C#CCCCNCCCCCCCO 34a_100000718082_100000760002 [0,1,0,0,0,0|0,0,2]=3 7096 B13R0.336 C#CCCCNCCCCCCCO 34a_100011996573_100000695029 [0,1,0,0,0,0|0,0,2]=3 7097 B13R0.336 C#CCCCNCCCCCCOC 34a_100000718082_100011998445 [0,1,0,0,0,0|1,0,2]=4 7098 B13R0.336 C#CCCCNCCCOCCCC 2230a_200000211371_100000731252 [0,1,0,0,0,0|2,0,1]=4 7099 B13R0.336 C#CCCCNCCCOCCCC 34a_200000211371_100000695029 [0,1,0,0,0,0|2,0,1]=4 7100 B13R0.336 C#CCCCNCCCOCCCO 2230a_100011310245_100000731252 [0,1,0,0,0,0|1,0,2]=4 7101 B13R0.336 C#CCCCNCCCOCCCO 34a_100011310245_100000695029 [0,1,0,0,0,0|1,0,2]=4 7102 B13R0.336 C#CCCCOCCCCCCCBr 34a_100000760002_100000695029 [0,1,0,0,0,0|1,0,2]=4 7103 B13R0.336 C#CCCCOCCCCCCCBr 7a_100000760002_100011215417 [0,1,0,0,0,0|1,0,2]=4 7104 B13R0.336 C#CCCCOCCCCCCCC 34a_100000210232_100000695029 [0,1,0,0,0,0|1,0,1]=3 7105 B13R0.336 C#CCCCOCCCCCCCC 34a_100000215630_100000210759 [0,1,0,0,0,0|1,0,1]=3 7106 B13R0.336 C#CCCCOCCCCCCCC 7a_100000210232_100011215417 [0,1,0,0,0,0|1,0,1]=3 7107 B13R0.336 C#CCCCOCCCCCCCC 7a_100000215630_100000210759 [0,1,0,0,0,0|1,0,1]=3 7108 B13R0.336 C#CCCCOCCCCCCCN 34a_100011996573_100000695029 [0,1,0,0,0,0|1,0,2]=4 7109 B13R0.336 C#CCCCOCCCCCCCO 34a_100000215630_100000760002 [0,1,0,0,0,0|0,0,2]=3 7110 B13R0.336 C#CCCCOCCCCCCCO 7a_100000215630_100000760002 [0,1,0,0,0,0|0,0,2]=3 7111 B13R0.336 C#CCCCOCCCCCCOC 34a_100000215630_100011998445 [0,1,0,0,0,0|1,0,2]=4 7112 B13R0.336 C#CCCCOCCCCCCOC 34a_200012092642_100000695029 [0,1,0,0,0,0|1,0,2]=4 7113 B13R0.336 C#CCCCOCCCCCCOC 7a_100000215630_100011998445 [0,1,0,0,0,0|1,0,2]=4 7114 B13R0.336 C#CCCCOCCCCCCOC 7a_200012092642_100011215417 [0,1,0,0,0,0|1,0,2]=4 7115 B13R0.336 C#CCCCOCCCOCCCC 34a_200011215613_100000695029 [0,1,0,0,0,0|2,0,1]=4 7116 B13R0.336 C#CCCCOCCCOCCCC 7a_200011215613_100011215417 [0,1,0,0,0,0|2,0,1]=4 7117 B13R0.336 C#CCCCOCCNCCCCC 34a_100000224656_100000695029 [0,1,0,0,0,0|2,0,1]=4 7118 B13R0.336 C#CCCCOCCOCCCCC 34a_100011215259_100000695029 [0,1,0,0,0,0|2,0,1]=4 7119 B13R0.336 C#CCCCOCCOCCCCC 7a_100011215259_100011215417 [0,1,0,0,0,0|2,0,1]=4 7120 B13R0.336 C#CCCCSCCCCCCCC 62a_100000210759_100011215417 [0,1,0,0,0,0|1,0,1]=3 7121 B13R0.336 C#CCCCSCCCCCCCC 62a_100011215417_100000210317 [0,1,0,0,0,0|1,0,1]=3 7122 B13R0.336 C#CCCCSCCCCCCCO 62a_100000760002_100011215417 [0,1,0,0,0,0|0,0,2]=3 7123 B13R0.336 C#CCCCSCCCCCCCO 62a_100011215417_100000760002 [0,1,0,0,0,0|0,0,2]=3 7124 B13R0.336 C#CCCCSCCCCCCOC 62a_100011215417_100011998445 [0,1,0,0,0,0|1,0,2]=4 7125 B13R0.336 C#CCCCSCCCCCCOC 62a_100011998445_100011215417 [0,1,0,0,0,0|1,0,2]=4 7126 B13R0.336 C#CCCNCCCCCCCCC 2230a_100000212291_100000688953 [0,1,0,0,0,0|1,0,1]=3 7127 B13R0.336 C#CCCNCCCCCCCCC 34a_100000212291_100000688953 [0,1,0,0,0,0|1,0,1]=3 7128 B13R0.336 C#CCCNCCCCCCCCC 34a_100000755551_100011214924 [0,1,0,0,0,0|1,0,1]=3 7129 B13R0.336 C#CCCNCCCCCCCCO 2230a_102515433106_100000688953 [0,1,0,0,0,0|0,0,2]=3 7130 B13R0.336 C#CCCNCCCCCCCCO 34a_100000755551_100000033203 [0,1,0,0,0,0|0,0,2]=3 7131 B13R0.336 C#CCCNCCCCCCCCO 34a_102515433106_100000688953 [0,1,0,0,0,0|0,0,2]=3 7132 B13R0.336 C#CCCOCCCCCCCCBr 34a_100009813846_100000688953 [0,1,0,0,0,0|1,0,2]=4 7133 B13R0.336 C#CCCOCCCCCCCCBr 7a_100009813846_100000688953 [0,1,0,0,0,0|1,0,2]=4 7134 B13R0.336 C#CCCOCCCCCCCCC 34a_100000210712_100000688953 [0,1,0,0,0,0|1,0,1]=3 7135 B13R0.336 C#CCCOCCCCCCCCC 34a_100011215631_100011214924 [0,1,0,0,0,0|1,0,1]=3 7136 B13R0.336 C#CCCOCCCCCCCCC 7a_100000210712_100000688953 [0,1,0,0,0,0|1,0,1]=3 7137 B13R0.336 C#CCCOCCCCCCCCCl 34a_100000033203_100000688953 [0,1,0,0,0,0|1,0,2]=4 7138 B13R0.336 C#CCCOCCCCCCCCCl 7a_100000033203_100000688953 [0,1,0,0,0,0|1,0,2]=4 7139 B13R0.336 C#CCCOCCCCCCCCN 34a_102515433106_100000688953 [0,1,0,0,0,0|1,0,2]=4 7140 B13R0.336 C#CCCOCCCCCCCCO 34a_100011215631_100000033203 [0,1,0,0,0,0|0,0,2]=3 7141 B13R0.336 C#CCCOCCCCNCCCC 34a_200011216965_100000688953 [0,1,0,0,0,0|2,0,1]=4 7142 B13R0.336 C#CCCOCCCCOCCCC 34a_200000760531_100000688953 [0,1,0,0,0,0|2,0,1]=4 7143 B13R0.336 C#CCCOCCCCOCCCC 7a_200000760531_100000688953 [0,1,0,0,0,0|2,0,1]=4 7144 B13R0.336 C#CCCOCCOCCCCCC 34a_100000691444_100000688953 [0,1,0,0,0,0|2,0,1]=4 7145 B13R0.336 C#CCCOCCOCCCCCC 7a_100000691444_100000688953 [0,1,0,0,0,0|2,0,1]=4 7146 B13R0.336 C#CCCSCCCCCCCCC 62a_100000688953_100000210670 [0,1,0,0,0,0|1,0,1]=3 7147 B13R0.336 C#CCCSCCCCCCCCO 62a_100000033203_100000688953 [0,1,0,0,0,0|0,0,2]=3 7148 B13R0.336 C#CCCSCCCCCCCCO 62a_100000688953_100000033203 [0,1,0,0,0,0|0,0,2]=3 7149 B13R0.336 C#CCNCCCCCCCCCC 2230a_100000684558_100000038162 [0,1,0,0,0,0|1,0,1]=3 7150 B13R0.336 C#CCNCCCCCCCCCC 34a_100000212058_100000210320 [0,1,0,0,0,0|1,0,1]=3 7151 B13R0.336 C#CCNCCCCCCCCCC 34a_100000684558_100000184674 [0,1,0,0,0,0|1,0,1]=3 7152 B13R0.336 C#CCNCCCCCCCCCO 2230a_100000078944_100000038162 [0,1,0,0,0,0|0,0,2]=3 7153 B13R0.336 C#CCNCCCCCCCCCO 34a_100000078944_100000184674 [0,1,0,0,0,0|0,0,2]=3 7154 B13R0.336 C#CCNCCCCCCCCCO 34a_100000212058_100009813782 [0,1,0,0,0,0|0,0,2]=3 7155 B13R0.336 C#CCOCCCCCCCCCBr 34a_100009813782_100000184674 [0,1,0,0,0,0|1,0,2]=4 7156 B13R0.336 C#CCOCCCCCCCCCBr 7a_100009813782_100000038162 [0,1,0,0,0,0|1,0,2]=4 7157 B13R0.336 C#CCOCCCCCCCCCC 34a_100000210247_100000210320 [0,1,0,0,0,0|1,0,1]=3 7158 B13R0.336 C#CCOCCCCCCCCCC 34a_100000210711_100000184674 [0,1,0,0,0,0|1,0,1]=3 7159 B13R0.336 C#CCOCCCCCCCCCC 7a_100000210711_100000038162 [0,1,0,0,0,0|1,0,1]=3 7160 B13R0.336 C#CCOCCCCCCCCCCl 34a_100009868337_100000184674 [0,1,0,0,0,0|1,0,2]=4 7161 B13R0.336 C#CCOCCCCCCCCCCl 7a_100009868337_100000038162 [0,1,0,0,0,0|1,0,2]=4 7162 B13R0.336 C#CCOCCCCCCCCCN 34a_100000078944_100000184674 [0,1,0,0,0,0|1,0,2]=4 7163 B13R0.336 C#CCOCCCCCCCCCO 34a_100000210247_100009813782 [0,1,0,0,0,0|0,0,2]=3 7164 B13R0.336 C#CCOCCCCCCOCCC 34a_200011021349_100000210303 [0,1,0,0,0,0|2,0,1]=4 7165 B13R0.336 C#CCOCCCCCCOCCC 7a_200011021349_100000210303 [0,1,0,0,0,0|2,0,1]=4 7166 B13R0.336 C#CCOCCCCCCOCCO 34a_200011021349_100000211926 [0,1,0,0,0,0|1,0,2]=4 7167 B13R0.336 C#CCOCCCCCCOCCO 7a_200011021349_100000211926 [0,1,0,0,0,0|1,0,2]=4 7168 B13R0.336 C#CCOCCNCCCCCCC 2230a_100000229938_100010402529 [0,1,0,0,0,0|2,0,1]=4 7169 B13R0.336 C#CCOCCNCCCCCCC 2230a_100000700922_100000210681 [0,1,0,0,0,0|2,0,1]=4 7170 B13R0.336 C#CCOCCNCCCCCCC 34a_100000700922_100000210614 [0,1,0,0,0,0|2,0,1]=4 7171 B13R0.336 C#CCOCCNCCCCCCO 2230a_100000686447_100010402529 [0,1,0,0,0,0|1,0,2]=4 7172 B13R0.336 C#CCOCCNCCCCCCO 2230a_100000700922_100000766143 [0,1,0,0,0,0|1,0,2]=4 7173 B13R0.336 C#CCOCCNCCCCCCO 34a_100000686447_100010402529 [0,1,0,0,0,0|1,0,2]=4 7174 B13R0.336 C#CCOCCNCCCCCCO 34a_100000700922_100000766143 [0,1,0,0,0,0|1,0,2]=4 7175 B13R0.336 C#CCOCCOCCCCCCC 34a_100000054580_100000210614 [0,1,0,0,0,0|2,0,1]=4 7176 B13R0.336 C#CCOCCOCCCCCCC 34a_100000210272_100010402529 [0,1,0,0,0,0|2,0,1]=4 7177 B13R0.336 C#CCOCCOCCCCCCC 7a_100000054580_100000210614 [0,1,0,0,0,0|2,0,1]=4 7178 B13R0.336 C#CCOCCOCCCCCCC 7a_100000210272_100010402529 [0,1,0,0,0,0|2,0,1]=4 7179 B13R0.336 C#CCOCCOCCCCCCO 34a_100000054580_100000766143 [0,1,0,0,0,0|1,0,2]=4 7180 B13R0.336 C#CCOCCOCCCCCCO 7a_100000054580_100000766143 [0,1,0,0,0,0|1,0,2]=4 7181 B13R0.336 C#CCOCCSCCCCCCC 62a_100000210614_100010402529 [0,1,0,0,0,0|2,0,1]=4 7182 B13R0.336 C#CCOCCSCCCCCCC 62a_100010402529_100000210316 [0,1,0,0,0,0|2,0,1]=4 7183 B13R0.336 C#CCOCCSCCCCCCO 62a_100000766143_100010402529 [0,1,0,0,0,0|1,0,2]=4 7184 B13R0.336 C#CCOCCSCCCCCCO 62a_100010402529_100000766143 [0,1,0,0,0,0|1,0,2]=4 7185 B13R0.336 C#CCSCCCCCCCCCC 62a_100000038162_100000210320 [0,1,0,0,0,0|1,0,1]=3 7186 B13R0.336 C#CCSCCCCCCCCCO 62a_100000038162_100009813782 [0,1,0,0,0,0|0,0,2]=3 7187 B13R0.336 C/C=C/CCOCCCCCCCC 34a_100016278192_100000210759 [0,1,0,0,0,0|1,0,2]=4 7188 B13R0.336 C/C=C/CCOCCCCCCCO 34a_100016278192_100000760002 [0,1,0,0,0,0|0,0,2]=3 7189 B13R0.336 C/C=C/CCOCCCCCCOC 34a_100016278192_100011998445 [0,1,0,0,0,0|1,0,2]=4 7190 B13R0.336 C/C=C/CNCCCCCCCCC 34a_100000212291_100102629194 [0,1,0,0,0,0|1,0,2]=4 7191 B13R0.336 C/C=C/CNCCCCCCCCO 34a_102515433106_100102629194 [0,1,0,0,0,0|0,0,2]=3 7192 B13R0.336 C/C=C/COCCCCCCCCBr 34a_100009813846_100102629194 [0,1,0,0,0,0|1,0,2]=4 7193 B13R0.336 C/C=C/COCCCCCCCCBr 7a_100009813846_100102629194 [0,1,0,0,0,0|1,0,2]=4 7194 B13R0.336 C/C=C/COCCCCCCCCC 34a_100000210712_100102629194 [0,1,0,0,0,0|1,0,2]=4 7195 B13R0.336 C/C=C/COCCCCCCCCC 34a_100016270725_100011214924 [0,1,0,0,0,0|1,0,2]=4 7196 B13R0.336 C/C=C/COCCCCCCCCC 7a_100000210712_100102629194 [0,1,0,0,0,0|1,0,2]=4 7197 B13R0.336 C/C=C/COCCCCCCCCCl 34a_100000033203_100102629194 [0,1,0,0,0,0|1,0,2]=4 7198 B13R0.336 C/C=C/COCCCCCCCCCl 7a_100000033203_100102629194 [0,1,0,0,0,0|1,0,2]=4 7199 B13R0.336 C/C=C/COCCCCCCCCN 34a_102515433106_100102629194 [0,1,0,0,0,0|1,0,2]=4 7200 B13R0.336 C/C=C/COCCCCCCCCO 34a_100016270725_100000033203 [0,1,0,0,0,0|0,0,2]=3 7201 B13R0.336 C/C=C/CSCCCCCCCCC 62a_100102629194_100000210670 [0,1,0,0,0,0|1,0,2]=4 7202 B13R0.336 C/C=C/CSCCCCCCCCO 62a_100000033203_100102629194 [0,1,0,0,0,0|0,0,2]=3 7203 B13R0.336 C/C=C/CSCCCCCCCCO 62a_100102629194_100000033203 [0,1,0,0,0,0|0,0,2]=3 7204 B13R0.336 C=CCCCCCCCCCCNC 2230a_106832991635_100011093070 [0,1,0,0,0,0|1,0,1]=3 7205 B13R0.336 C=CCCCCCCCCCCNC 34a_100102657272_100011093070 [0,1,0,0,0,0|1,0,1]=3 7206 B13R0.336 C=CCCCCCCCCCCNC 7a_106832991635_100011093070 [0,1,0,0,0,0|1,0,1]=3 7207 B13R0.336 C=CCCCCCCCCCCOC 34a_100138415774_100011093070 [0,1,0,0,0,0|0,0,2]=3 7208 B13R0.336 C=CCCCCCCCCCCSC 62a_100011093070_200000210301 [0,1,0,0,0,0|1,0,1]=3 7209 B13R0.336 C=CCCCCCCCCCCSC 62a_200000210301_100011093070 [0,1,0,0,0,0|1,0,1]=3 7210 B13R0.336 C=CCCCCCCCCCCS[13CH3] 62a_100011093070_200025704644 [0,1,0,0,0,0|1,0,1]=3 7211 B13R0.336 C=CCCCCCCCCCCS[13CH3] 62a_200025704644_100011093070 [0,1,0,0,0,0|1,0,1]=3 7212 B13R0.336 C=CCCCCCCCCCNCC 2230a_100000081888_100000210202 [0,1,0,0,0,0|1,0,1]=3 7213 B13R0.336 C=CCCCCCCCCCNCC 2230a_100015525214_100009814027 [0,1,0,0,0,0|1,0,1]=3 7214 B13R0.336 C=CCCCCCCCCCNCC 34a_100000081888_100000210202 [0,1,0,0,0,0|1,0,1]=3 7215 B13R0.336 C=CCCCCCCCCCNCF 34a_100000081888_100015361967 [0,1,0,0,0,0|1,0,2]=4 7216 B13R0.336 C=CCCCCCCCCCOCC 34a_100000038209_100000210202 [0,1,0,0,0,0|1,0,1]=3 7217 B13R0.336 C=CCCCCCCCCCOCC 34a_100121572206_100009814027 [0,1,0,0,0,0|1,0,1]=3 7218 B13R0.336 C=CCCCCCCCCCOCC 7a_100000038209_100000210202 [0,1,0,0,0,0|1,0,1]=3 7219 B13R0.336 C=CCCCCCCCCCOCF 34a_100000038209_100015361967 [0,1,0,0,0,0|1,0,2]=4 7220 B13R0.336 C=CCCCCCCCCCOCF 7a_100000038209_100015361967 [0,1,0,0,0,0|1,0,2]=4 7221 B13R0.336 C=CCCCCCCCCCSCC 62a_100000210202_100009814027 [0,1,0,0,0,0|1,0,1]=3 7222 B13R0.336 C=CCCCCCCCCCSCC 62a_100009814027_100000210202 [0,1,0,0,0,0|1,0,1]=3 7223 B13R0.336 C=CCCCCCCCCCSCF 62a_100009814027_100015361967 [0,1,0,0,0,0|1,0,2]=4 7224 B13R0.336 C=CCCCCCCCCCSCF 62a_100015361967_100009814027 [0,1,0,0,0,0|1,0,2]=4 7225 B13R0.336 C=CCCCCCCCCNCCF 34a_100000724931_100011933949 [0,1,0,0,0,0|1,0,2]=4 7226 B13R0.336 C=CCCCCCCCCNCCO 2230a_100016997473_100011933949 [0,1,0,0,0,0|0,0,2]=3 7227 B13R0.336 C=CCCCCCCCCNCCO 34a_100016990907_100011933949 [0,1,0,0,0,0|0,0,2]=3 7228 B13R0.336 C=CCCCCCCCCOCCBr 34a_100000211926_100011933949 [0,1,0,0,0,0|1,0,2]=4 7229 B13R0.336 C=CCCCCCCCCOCCC 34a_100000210258_100011933949 [0,1,0,0,0,0|1,0,1]=3 7230 B13R0.336 C=CCCCCCCCCOCCC 34a_100011215194_100000210303 [0,1,0,0,0,0|1,0,1]=3 7231 B13R0.336 C=CCCCCCCCCOCCC 7a_100011215194_100000210303 [0,1,0,0,0,0|1,0,1]=3 7232 B13R0.336 C=CCCCCCCCCOCCF 34a_100011215194_100011217306 [0,1,0,0,0,0|1,0,2]=4 7233 B13R0.336 C=CCCCCCCCCOCCF 7a_100011215194_100011217306 [0,1,0,0,0,0|1,0,2]=4 7234 B13R0.336 C=CCCCCCCCCOCCN 34a_100000210304_100011933949 [0,1,0,0,0,0|1,0,2]=4 7235 B13R0.336 C=CCCCCCCCCOCCO 34a_100011215194_100000211926 [0,1,0,0,0,0|0,0,2]=3 7236 B13R0.336 C=CCCCCCCCCOCCO 7a_100011215194_100000211926 [0,1,0,0,0,0|0,0,2]=3 7237 B13R0.336 C=CCCCCCCCCOCSC 34a_100011215194_100011218213 [0,1,0,0,0,0|2,0,1]=4 7238 B13R0.336 C=CCCCCCCCCSCCC 62a_100000210303_100011933949 [0,1,0,0,0,0|1,0,1]=3 7239 B13R0.336 C=CCCCCCCCCSCCC 62a_100011933949_100000210303 [0,1,0,0,0,0|1,0,1]=3 7240 B13R0.336 C=CCCCCCCCCSCCF 62a_100011217306_100011933949 [0,1,0,0,0,0|1,0,2]=4 7241 B13R0.336 C=CCCCCCCCCSCCF 62a_100011933949_100011217306 [0,1,0,0,0,0|1,0,2]=4 7242 B13R0.336 C=CCCCCCCCCSCCO 62a_100000211926_100011933949 [0,1,0,0,0,0|0,0,2]=3 7243 B13R0.336 C=CCCCCCCCCSCCO 62a_100011933949_100000211926 [0,1,0,0,0,0|0,0,2]=3 7244 B13R0.336 C=CCCCCCCCCSCOC 62a_100000766300_100011933949 [0,1,0,0,0,0|1,0,2]=4 7245 B13R0.336 C=CCCCCCCCCSCOC 62a_100011933949_100000766300 [0,1,0,0,0,0|1,0,2]=4 7246 B13R0.336 C=CCCCCCCCCSCSC 62a_100011218213_100011933949 [0,1,0,0,0,0|2,0,1]=4 7247 B13R0.336 C=CCCCCCCCCSCSC 62a_100011933949_100011218213 [0,1,0,0,0,0|2,0,1]=4 7248 B13R0.336 C=CCCCCCCCNCCCC 2230a_100000102301_100012355270 [0,1,0,0,0,0|1,0,1]=3 7249 B13R0.336 C=CCCCCCCCNCCCC 7a_106832991798_100012355270 [0,1,0,0,0,0|1,0,1]=3 7250 B13R0.336 C=CCCCCCCCNCCCF 2230a_100015189416_100012355270 [0,1,0,0,0,0|1,0,2]=4 7251 B13R0.336 C=CCCCCCCCNCCCF 34a_100015189416_100012355270 [0,1,0,0,0,0|1,0,2]=4 7252 B13R0.336 C=CCCCCCCCNCCOC 2230a_100000209980_100012355270 [0,1,0,0,0,0|1,0,2]=4 7253 B13R0.336 C=CCCCCCCCNCCSC 2230a_100020590264_100012355270 [0,1,0,0,0,0|2,0,1]=4 7254 B13R0.336 C=CCCCCCCCOCCCBr 34a_100011217188_100012355270 [0,1,0,0,0,0|1,0,2]=4 7255 B13R0.336 C=CCCCCCCCOCCCC 34a_100000210227_100012355270 [0,1,0,0,0,0|1,0,1]=3 7256 B13R0.336 C=CCCCCCCCOCCCC 34a_100000730831_100000210210 [0,1,0,0,0,0|1,0,1]=3 7257 B13R0.336 C=CCCCCCCCOCCCC 7a_100000210227_100012355270 [0,1,0,0,0,0|1,0,1]=3 7258 B13R0.336 C=CCCCCCCCOCCCC 7a_100000730831_100000210211 [0,1,0,0,0,0|1,0,1]=3 7259 B13R0.336 C=CCCCCCCCOCCCCl 34a_100000230001_100012355270 [0,1,0,0,0,0|1,0,2]=4 7260 B13R0.336 C=CCCCCCCCOCCCF 34a_100000730831_100011934791 [0,1,0,0,0,0|1,0,2]=4 7261 B13R0.336 C=CCCCCCCCOCCCF 34a_100000759539_100012355270 [0,1,0,0,0,0|1,0,2]=4 7262 B13R0.336 C=CCCCCCCCOCCCF 7a_100000730831_100011934791 [0,1,0,0,0,0|1,0,2]=4 7263 B13R0.336 C=CCCCCCCCOCCCN 34a_100000182051_100012355270 [0,1,0,0,0,0|1,0,2]=4 7264 B13R0.336 C=CCCCCCCCOCCCO 34a_100000730831_100000230001 [0,1,0,0,0,0|0,0,2]=3 7265 B13R0.336 C=CCCCCCCCOCCCO 7a_100000730831_100011215043 [0,1,0,0,0,0|0,0,2]=3 7266 B13R0.336 C=CCCCCCCCOCCOC 34a_100000210237_100012355270 [0,1,0,0,0,0|1,0,2]=4 7267 B13R0.336 C=CCCCCCCCOCCOC 34a_100000730831_100011201679 [0,1,0,0,0,0|1,0,2]=4 7268 B13R0.336 C=CCCCCCCCOCCOC 7a_100000730831_100000233755 [0,1,0,0,0,0|1,0,2]=4 7269 B13R0.336 C=CCCCCCCCOCCON 34a_100000700252_100012355270 [0,1,0,0,0,0|1,0,2]=4 7270 B13R0.336 C=CCCCCCCCOCCSC 34a_100000230434_100012355270 [0,1,0,0,0,0|2,0,1]=4 7271 B13R0.336 C=CCCCCCCCOCCSC 34a_100000730831_100000212216 [0,1,0,0,0,0|2,0,1]=4 7272 B13R0.336 C=CCCCCCCCOCCSC 7a_100000230434_100012355270 [0,1,0,0,0,0|2,0,1]=4 7273 B13R0.336 C=CCCCCCCCOCCSC 7a_100000730831_100000212216 [0,1,0,0,0,0|2,0,1]=4 7274 B13R0.336 C=CCCCCCCCSCCCC 62a_100000210211_100012355270 [0,1,0,0,0,0|1,0,1]=3 7275 B13R0.336 C=CCCCCCCCSCCCC 62a_100012355270_100000210210 [0,1,0,0,0,0|1,0,1]=3 7276 B13R0.336 C=CCCCCCCCSCCCF 62a_100011934791_100012355270 [0,1,0,0,0,0|1,0,2]=4 7277 B13R0.336 C=CCCCCCCCSCCCF 62a_100012355270_100011934791 [0,1,0,0,0,0|1,0,2]=4 7278 B13R0.336 C=CCCCCCCCSCCCO 62a_100011215043_100012355270 [0,1,0,0,0,0|0,0,2]=3 7279 B13R0.336 C=CCCCCCCCSCCCO 62a_100012355270_100011215043 [0,1,0,0,0,0|0,0,2]=3 7280 B13R0.336 C=CCCCCCCCSCCOC 62a_100000233755_100012355270 [0,1,0,0,0,0|1,0,2]=4 7281 B13R0.336 C=CCCCCCCCSCCOC 62a_100012355270_100000233755 [0,1,0,0,0,0|1,0,2]=4 7282 B13R0.336 C=CCCCCCCCSCCSC 62a_100000212216_100012355270 [0,1,0,0,0,0|2,0,1]=4 7283 B13R0.336 C=CCCCCCCCSCCSC 62a_100012355270_100000751147 [0,1,0,0,0,0|2,0,1]=4 7284 B13R0.336 C=CCCCCCCCSCOCC 62a_100000739092_100012355270 [0,1,0,0,0,0|2,0,1]=4 7285 B13R0.336 C=CCCCCCCCSCOCC 62a_100012355270_100000739092 [0,1,0,0,0,0|2,0,1]=4 7286 B13R0.336 C=CCCCCCCNCCCCC 2230a_100000209983_100011215473 [0,1,0,0,0,0|1,0,1]=3 7287 B13R0.336 C=CCCCCCCNCCCCO 2230a_100000750430_100011215473 [0,1,0,0,0,0|0,0,2]=3 7288 B13R0.336 C=CCCCCCCNCCCCO 34a_100000750430_100011215473 [0,1,0,0,0,0|0,0,2]=3 7289 B13R0.336 C=CCCCCCCNCCCOC 34a_100150723488_100011215473 [0,1,0,0,0,0|1,0,2]=4 7290 B13R0.336 C=CCCCCCCNCCCSC 2230a_100000749238_100011215473 [0,1,0,0,0,0|2,0,1]=4 7291 B13R0.336 C=CCCCCCCNCCOCC 2230a_102516460346_100011215473 [0,1,0,0,0,0|2,0,1]=4 7292 B13R0.336 C=CCCCCCCNCCOCC 34a_102516460346_100011215473 [0,1,0,0,0,0|2,0,1]=4 7293 B13R0.336 C=CCCCCCCNCCSCC 2230a_100000106463_100011215473 [0,1,0,0,0,0|2,0,1]=4 7294 B13R0.336 C=CCCCCCCOCCCCBr 34a_100011216708_100011215473 [0,1,0,0,0,0|1,0,2]=4 7295 B13R0.336 C=CCCCCCCOCCCCC 34a_100000210253_100011215473 [0,1,0,0,0,0|1,0,1]=3 7296 B13R0.336 C=CCCCCCCOCCCCC 34a_200011216477_100000718602 [0,1,0,0,0,0|1,0,1]=3 7297 B13R0.336 C=CCCCCCCOCCCCC 7a_100000210253_100011215473 [0,1,0,0,0,0|1,0,1]=3 7298 B13R0.336 C=CCCCCCCOCCCCC 7a_200011216477_100000210326 [0,1,0,0,0,0|1,0,1]=3 7299 B13R0.336 C=CCCCCCCOCCCCCl 34a_100000210776_100011215473 [0,1,0,0,0,0|1,0,2]=4 7300 B13R0.336 C=CCCCCCCOCCCCCl 7a_100000210776_100011215473 [0,1,0,0,0,0|1,0,2]=4 7301 B13R0.336 C=CCCCCCCOCCCCF 34a_100011995726_100011215473 [0,1,0,0,0,0|1,0,2]=4 7302 B13R0.336 C=CCCCCCCOCCCCF 34a_200011216477_100000729493 [0,1,0,0,0,0|1,0,2]=4 7303 B13R0.336 C=CCCCCCCOCCCCF 7a_100011995726_100011215473 [0,1,0,0,0,0|1,0,2]=4 7304 B13R0.336 C=CCCCCCCOCCCCF 7a_200011216477_100000729493 [0,1,0,0,0,0|1,0,2]=4 7305 B13R0.336 C=CCCCCCCOCCCCI 34a_200012148704_100011215473 [0,1,0,0,0,0|1,0,2]=4 7306 B13R0.336 C=CCCCCCCOCCCCN 34a_100000750430_100011215473 [0,1,0,0,0,0|1,0,2]=4 7307 B13R0.336 C=CCCCCCCOCCCCO 34a_200011216477_100011216708 [0,1,0,0,0,0|0,0,2]=3 7308 B13R0.336 C=CCCCCCCOCCCCO 7a_200011216477_100000210776 [0,1,0,0,0,0|0,0,2]=3 7309 B13R0.336 C=CCCCCCCOCCCNC 34a_100000213112_100011215473 [0,1,0,0,0,0|2,0,1]=4 7310 B13R0.336 C=CCCCCCCOCCCOC 34a_100000740835_100011215473 [0,1,0,0,0,0|1,0,2]=4 7311 B13R0.336 C=CCCCCCCOCCCOC 34a_200011216477_100000740836 [0,1,0,0,0,0|1,0,2]=4 7312 B13R0.336 C=CCCCCCCOCCCOC 7a_200011216477_100000740836 [0,1,0,0,0,0|1,0,2]=4 7313 B13R0.336 C=CCCCCCCOCCCSC 34a_100000690336_100011215473 [0,1,0,0,0,0|2,0,1]=4 7314 B13R0.336 C=CCCCCCCOCCCSC 7a_100000690336_100011215473 [0,1,0,0,0,0|2,0,1]=4 7315 B13R0.336 C=CCCCCCCOCCOCC 34a_100000210136_100011215473 [0,1,0,0,0,0|2,0,1]=4 7316 B13R0.336 C=CCCCCCCOCCOCC 34a_200011216477_100000210147 [0,1,0,0,0,0|2,0,1]=4 7317 B13R0.336 C=CCCCCCCOCCOCC 7a_100000210136_100011215473 [0,1,0,0,0,0|2,0,1]=4 7318 B13R0.336 C=CCCCCCCOCCOCC 7a_200011216477_100011215890 [0,1,0,0,0,0|2,0,1]=4 7319 B13R0.336 C=CCCCCCCOCCSCC 34a_100000212035_100011215473 [0,1,0,0,0,0|2,0,1]=4 7320 B13R0.336 C=CCCCCCCOCCSCC 34a_200011216477_100000757381 [0,1,0,0,0,0|2,0,1]=4 7321 B13R0.336 C=CCCCCCCOCCSCC 7a_100000212035_100011215473 [0,1,0,0,0,0|2,0,1]=4 7322 B13R0.336 C=CCCCCCCOCCSCC 7a_200011216477_100000757381 [0,1,0,0,0,0|2,0,1]=4 7323 B13R0.336 C=CCCCCCCSCCCCC 62a_100000210326_100011215473 [0,1,0,0,0,0|1,0,1]=3 7324 B13R0.336 C=CCCCCCCSCCCCC 62a_100011215473_100000210326 [0,1,0,0,0,0|1,0,1]=3 7325 B13R0.336 C=CCCCCCCSCCCCF 62a_100000729493_100011215473 [0,1,0,0,0,0|1,0,2]=4 7326 B13R0.336 C=CCCCCCCSCCCCF 62a_100011215473_100000729493 [0,1,0,0,0,0|1,0,2]=4 7327 B13R0.336 C=CCCCCCCSCCCCO 62a_100000210776_100011215473 [0,1,0,0,0,0|0,0,2]=3 7328 B13R0.336 C=CCCCCCCSCCCCO 62a_100011215473_100000210776 [0,1,0,0,0,0|0,0,2]=3 7329 B13R0.336 C=CCCCCCCSCCCOC 62a_100000709357_100011215473 [0,1,0,0,0,0|1,0,2]=4 7330 B13R0.336 C=CCCCCCCSCCCOC 62a_100011215473_100000709357 [0,1,0,0,0,0|1,0,2]=4 7331 B13R0.336 C=CCCCCCCSCCOCC 62a_100000210147_100011215473 [0,1,0,0,0,0|2,0,1]=4 7332 B13R0.336 C=CCCCCCCSCCOCC 62a_100011215473_100011215890 [0,1,0,0,0,0|2,0,1]=4 7333 B13R0.336 C=CCCCCCCSCCSCC 62a_100000757381_100011215473 [0,1,0,0,0,0|2,0,1]=4 7334 B13R0.336 C=CCCCCCCSCCSCC 62a_100011215473_100000757381 [0,1,0,0,0,0|2,0,1]=4 7335 B13R0.336 C=CCCCCCNCCCCCC 2230a_100000210581_100000700193 [0,1,0,0,0,0|1,0,1]=3 7336 B13R0.336 C=CCCCCCNCCCCCO 2230a_100000762737_100000700193 [0,1,0,0,0,0|0,0,2]=3 7337 B13R0.336 C=CCCCCCNCCCCCO 34a_100000762737_100000700193 [0,1,0,0,0,0|0,0,2]=3 7338 B13R0.336 C=CCCCCCNCCCOCC 2230a_100000210961_100000700193 [0,1,0,0,0,0|2,0,1]=4 7339 B13R0.336 C=CCCCCCNCCCOCC 34a_100000210961_100000700193 [0,1,0,0,0,0|2,0,1]=4 7340 B13R0.336 C=CCCCCCNCCOCCC 2230a_100161115042_100000700193 [0,1,0,0,0,0|2,0,1]=4 7341 B13R0.336 C=CCCCCCNCCOCCC 34a_100161115042_100000700193 [0,1,0,0,0,0|2,0,1]=4 7342 B13R0.336 C=CCCCCCNCCOCCO 2230a_100000211614_100000700193 [0,1,0,0,0,0|1,0,2]=4 7343 B13R0.336 C=CCCCCCNCCOCCO 34a_100000211614_100000700193 [0,1,0,0,0,0|1,0,2]=4 7344 B13R0.336 C=CCCCCCNCCSCCC 2230a_100020603323_100000700193 [0,1,0,0,0,0|2,0,1]=4 7345 B13R0.336 C=CCCCCCNCCSCCO 2230a_100011219999_100000700193 [0,1,0,0,0,0|1,0,2]=4 7346 B13R0.336 C=CCCCCCOCCCCCBr 34a_100000746331_100000700193 [0,1,0,0,0,0|1,0,2]=4 7347 B13R0.336 C=CCCCCCOCCCCCBr 7a_100000746331_100000700193 [0,1,0,0,0,0|1,0,2]=4 7348 B13R0.336 C=CCCCCCOCCCCCC 34a_100000210259_100000700193 [0,1,0,0,0,0|1,0,1]=3 7349 B13R0.336 C=CCCCCCOCCCCCC 34a_100011216702_100000210314 [0,1,0,0,0,0|1,0,1]=3 7350 B13R0.336 C=CCCCCCOCCCCCC 7a_100000210259_100000700193 [0,1,0,0,0,0|1,0,1]=3 7351 B13R0.336 C=CCCCCCOCCCCCC 7a_100011216702_100000210314 [0,1,0,0,0,0|1,0,1]=3 7352 B13R0.336 C=CCCCCCOCCCCCCl 34a_100000746330_100000700193 [0,1,0,0,0,0|1,0,2]=4 7353 B13R0.336 C=CCCCCCOCCCCCCl 7a_100000746330_100000700193 [0,1,0,0,0,0|1,0,2]=4 7354 B13R0.336 C=CCCCCCOCCCCCF 34a_100011216702_100000729378 [0,1,0,0,0,0|1,0,2]=4 7355 B13R0.336 C=CCCCCCOCCCCCF 7a_100011216702_100000729378 [0,1,0,0,0,0|1,0,2]=4 7356 B13R0.336 C=CCCCCCOCCCCCI 34a_200012148887_100000700193 [0,1,0,0,0,0|1,0,2]=4 7357 B13R0.336 C=CCCCCCOCCCCCI 7a_200012148887_100000700193 [0,1,0,0,0,0|1,0,2]=4 7358 B13R0.336 C=CCCCCCOCCCCCN 34a_100000762737_100000700193 [0,1,0,0,0,0|1,0,2]=4 7359 B13R0.336 C=CCCCCCOCCCCCO 34a_100011216702_100000746330 [0,1,0,0,0,0|0,0,2]=3 7360 B13R0.336 C=CCCCCCOCCCCCO 7a_100011216702_100000746330 [0,1,0,0,0,0|0,0,2]=3 7361 B13R0.336 C=CCCCCCOCCCCOC 34a_100000740925_100000700193 [0,1,0,0,0,0|1,0,2]=4 7362 B13R0.336 C=CCCCCCOCCCCOC 34a_100011216702_100000755781 [0,1,0,0,0,0|1,0,2]=4 7363 B13R0.336 C=CCCCCCOCCCCOC 7a_100011216702_100000730899 [0,1,0,0,0,0|1,0,2]=4 7364 B13R0.336 C=CCCCCCOCCCCSC 34a_100011217163_100000700193 [0,1,0,0,0,0|2,0,1]=4 7365 B13R0.336 C=CCCCCCOCCCCSC 7a_100011217163_100000700193 [0,1,0,0,0,0|2,0,1]=4 7366 B13R0.336 C=CCCCCCOCCCOCC 34a_100000757476_100000700193 [0,1,0,0,0,0|2,0,1]=4 7367 B13R0.336 C=CCCCCCOCCCOCC 34a_100011216702_100012232248 [0,1,0,0,0,0|2,0,1]=4 7368 B13R0.336 C=CCCCCCOCCCOCC 7a_100000757476_100000700193 [0,1,0,0,0,0|2,0,1]=4 7369 B13R0.336 C=CCCCCCOCCCOCC 7a_100011216702_100012232248 [0,1,0,0,0,0|2,0,1]=4 7370 B13R0.336 C=CCCCCCOCCCSCC 34a_100011216438_100000700193 [0,1,0,0,0,0|2,0,1]=4 7371 B13R0.336 C=CCCCCCOCCCSCC 7a_100011216438_100000700193 [0,1,0,0,0,0|2,0,1]=4 7372 B13R0.336 C=CCCCCCOCCOCCC 34a_100000752267_100000700193 [0,1,0,0,0,0|2,0,1]=4 7373 B13R0.336 C=CCCCCCOCCOCCC 34a_100011216702_100011215938 [0,1,0,0,0,0|2,0,1]=4 7374 B13R0.336 C=CCCCCCOCCOCCC 7a_100000752267_100000700193 [0,1,0,0,0,0|2,0,1]=4 7375 B13R0.336 C=CCCCCCOCCOCCC 7a_100011216702_100011215938 [0,1,0,0,0,0|2,0,1]=4 7376 B13R0.336 C=CCCCCCOCCOCCO 34a_100011216702_100000692535 [0,1,0,0,0,0|1,0,2]=4 7377 B13R0.336 C=CCCCCCOCCOCCO 7a_100011216702_100011215305 [0,1,0,0,0,0|1,0,2]=4 7378 B13R0.336 C=CCCCCCOCCSCCC 34a_200000230433_100000700193 [0,1,0,0,0,0|2,0,1]=4 7379 B13R0.336 C=CCCCCCOCCSCCC 7a_200000230433_100000700193 [0,1,0,0,0,0|2,0,1]=4 7380 B13R0.336 C=CCCCCCOCOCCCC 34a_100011216702_100011995733 [0,1,0,0,0,0|2,0,1]=4 7381 B13R0.336 C=CCCCCCSCCCCCC 62a_100000210314_100000700193 [0,1,0,0,0,0|1,0,1]=3 7382 B13R0.336 C=CCCCCCSCCCCCC 62a_100000700193_100000210757 [0,1,0,0,0,0|1,0,1]=3 7383 B13R0.336 C=CCCCCCSCCCCCF 62a_100000700193_100000729378 [0,1,0,0,0,0|1,0,2]=4 7384 B13R0.336 C=CCCCCCSCCCCCF 62a_100000729378_100000700193 [0,1,0,0,0,0|1,0,2]=4 7385 B13R0.336 C=CCCCCCSCCCCCO 62a_100000700193_100000746330 [0,1,0,0,0,0|0,0,2]=3 7386 B13R0.336 C=CCCCCCSCCCCCO 62a_100000746330_100000700193 [0,1,0,0,0,0|0,0,2]=3 7387 B13R0.336 C=CCCCCCSCCCCOC 62a_100000700193_100000730899 [0,1,0,0,0,0|1,0,2]=4 7388 B13R0.336 C=CCCCCCSCCCCOC 62a_100000730899_100000700193 [0,1,0,0,0,0|1,0,2]=4 7389 B13R0.336 C=CCCCCCSCCCOCC 62a_100000700193_100012232248 [0,1,0,0,0,0|2,0,1]=4 7390 B13R0.336 C=CCCCCCSCCCOCC 62a_100012232248_100000700193 [0,1,0,0,0,0|2,0,1]=4 7391 B13R0.336 C=CCCCCCSCCOCCC 62a_100000700193_100011215938 [0,1,0,0,0,0|2,0,1]=4 7392 B13R0.336 C=CCCCCCSCCOCCC 62a_100011215938_100000700193 [0,1,0,0,0,0|2,0,1]=4 7393 B13R0.336 C=CCCCCCSCCOCCO 62a_100000700193_100011215305 [0,1,0,0,0,0|1,0,2]=4 7394 B13R0.336 C=CCCCCCSCCOCCO 62a_100011215305_100000700193 [0,1,0,0,0,0|1,0,2]=4 7395 B13R0.336 C=CCCCCCSCOCCCC 62a_100000700193_100011995733 [0,1,0,0,0,0|2,0,1]=4 7396 B13R0.336 C=CCCCCCSCOCCCC 62a_100011995733_100000700193 [0,1,0,0,0,0|2,0,1]=4 7397 B13R0.336 C=CCCCCNCCCCCCC 2230a_100000229938_100011215482 [0,1,0,0,0,0|1,0,1]=3 7398 B13R0.336 C=CCCCCNCCCCCCC 2230a_100000703577_100000210681 [0,1,0,0,0,0|1,0,1]=3 7399 B13R0.336 C=CCCCCNCCCCCCC 34a_100000703577_100000210614 [0,1,0,0,0,0|1,0,1]=3 7400 B13R0.336 C=CCCCCNCCCCCCF 2230a_100000703577_100015922095 [0,1,0,0,0,0|1,0,2]=4 7401 B13R0.336 C=CCCCCNCCCCCCF 34a_100000703577_100015922095 [0,1,0,0,0,0|1,0,2]=4 7402 B13R0.336 C=CCCCCNCCCCCCO 2230a_100000686447_100011215482 [0,1,0,0,0,0|0,0,2]=3 7403 B13R0.336 C=CCCCCNCCCCCCO 2230a_100000703577_100000766143 [0,1,0,0,0,0|0,0,2]=3 7404 B13R0.336 C=CCCCCNCCCCCCO 34a_100000686447_100011215482 [0,1,0,0,0,0|0,0,2]=3 7405 B13R0.336 C=CCCCCNCCCCCCO 34a_100000703577_100000766143 [0,1,0,0,0,0|0,0,2]=3 7406 B13R0.336 C=CCCCCNCCCCCOC 2230a_100000747528_100011215482 [0,1,0,0,0,0|1,0,2]=4 7407 B13R0.336 C=CCCCCNCCCCCOC 34a_100000747528_100011215482 [0,1,0,0,0,0|1,0,2]=4 7408 B13R0.336 C=CCCCCNCCCOCCC 2230a_100011217757_100011215482 [0,1,0,0,0,0|2,0,1]=4 7409 B13R0.336 C=CCCCCNCCCOCCC 34a_100011217757_100011215482 [0,1,0,0,0,0|2,0,1]=4 7410 B13R0.336 C=CCCCCNCCOCCCC 2230a_100000703577_100000743108 [0,1,0,0,0,0|2,0,1]=4 7411 B13R0.336 C=CCCCCNCCOCCCC 34a_100000703577_100000743108 [0,1,0,0,0,0|2,0,1]=4 7412 B13R0.336 C=CCCCCNCCSCCCC 2230a_100025743550_100011215482 [0,1,0,0,0,0|2,0,1]=4 7413 B13R0.336 C=CCCCCOCCCCCCBr 34a_100011215345_100011215482 [0,1,0,0,0,0|1,0,2]=4 7414 B13R0.336 C=CCCCCOCCCCCCBr 7a_100011215345_100011215482 [0,1,0,0,0,0|1,0,2]=4 7415 B13R0.336 C=CCCCCOCCCCCCC 34a_100000210272_100011215482 [0,1,0,0,0,0|1,0,1]=3 7416 B13R0.336 C=CCCCCOCCCCCCC 34a_100000766645_100000210614 [0,1,0,0,0,0|1,0,1]=3 7417 B13R0.336 C=CCCCCOCCCCCCC 7a_100000210272_100011215482 [0,1,0,0,0,0|1,0,1]=3 7418 B13R0.336 C=CCCCCOCCCCCCC 7a_100000766645_100000210614 [0,1,0,0,0,0|1,0,1]=3 7419 B13R0.336 C=CCCCCOCCCCCCCl 34a_100000766143_100011215482 [0,1,0,0,0,0|1,0,2]=4 7420 B13R0.336 C=CCCCCOCCCCCCCl 7a_100000766143_100011215482 [0,1,0,0,0,0|1,0,2]=4 7421 B13R0.336 C=CCCCCOCCCCCCF 34a_100000732779_100011215482 [0,1,0,0,0,0|1,0,2]=4 7422 B13R0.336 C=CCCCCOCCCCCCF 34a_100000766645_100015922095 [0,1,0,0,0,0|1,0,2]=4 7423 B13R0.336 C=CCCCCOCCCCCCF 7a_100000732779_100011215482 [0,1,0,0,0,0|1,0,2]=4 7424 B13R0.336 C=CCCCCOCCCCCCF 7a_100000766645_100015922095 [0,1,0,0,0,0|1,0,2]=4 7425 B13R0.336 C=CCCCCOCCCCCCN 34a_100000686447_100011215482 [0,1,0,0,0,0|1,0,2]=4 7426 B13R0.336 C=CCCCCOCCCCCCO 34a_100000766645_100000766143 [0,1,0,0,0,0|0,0,2]=3 7427 B13R0.336 C=CCCCCOCCCCCCO 7a_100000766645_100000766143 [0,1,0,0,0,0|0,0,2]=3 7428 B13R0.336 C=CCCCCOCCCCCNC 34a_100000722520_100011215482 [0,1,0,0,0,0|2,0,1]=4 7429 B13R0.336 C=CCCCCOCCOCCCC 34a_100000210238_100011215482 [0,1,0,0,0,0|2,0,1]=4 7430 B13R0.336 C=CCCCCOCCOCCCC 34a_100000766645_100000743108 [0,1,0,0,0,0|2,0,1]=4 7431 B13R0.336 C=CCCCCOCCOCCCC 7a_100000210238_100011215482 [0,1,0,0,0,0|2,0,1]=4 7432 B13R0.336 C=CCCCCOCCOCCCC 7a_100000766645_100000743108 [0,1,0,0,0,0|2,0,1]=4 7433 B13R0.336 C=CCCCCOCCSCCCC 34a_200000230436_100011215482 [0,1,0,0,0,0|2,0,1]=4 7434 B13R0.336 C=CCCCCOCCSCCCC 7a_200000230436_100011215482 [0,1,0,0,0,0|2,0,1]=4 7435 B13R0.336 C=CCCCCSCCCCCCC 62a_100000210614_100011215482 [0,1,0,0,0,0|1,0,1]=3 7436 B13R0.336 C=CCCCCSCCCCCCC 62a_100011215482_100000210316 [0,1,0,0,0,0|1,0,1]=3 7437 B13R0.336 C=CCCCCSCCCCCCF 62a_100011215482_100015922095 [0,1,0,0,0,0|1,0,2]=4 7438 B13R0.336 C=CCCCCSCCCCCCF 62a_100015922095_100011215482 [0,1,0,0,0,0|1,0,2]=4 7439 B13R0.336 C=CCCCCSCCCCCCO 62a_100000766143_100011215482 [0,1,0,0,0,0|0,0,2]=3 7440 B13R0.336 C=CCCCCSCCCCCCO 62a_100011215482_100000766143 [0,1,0,0,0,0|0,0,2]=3 7441 B13R0.336 C=CCCCCSCCOCCCC 62a_100000743108_100011215482 [0,1,0,0,0,0|2,0,1]=4 7442 B13R0.336 C=CCCCCSCCOCCCC 62a_100011215482_100000743108 [0,1,0,0,0,0|2,0,1]=4 7443 B13R0.336 C=CCCCNCCCCCCCC 2230a_100000229939_100011713584 [0,1,0,0,0,0|1,0,1]=3 7444 B13R0.336 C=CCCCNCCCCCCCC 2230a_100000700776_100000210759 [0,1,0,0,0,0|1,0,1]=3 7445 B13R0.336 C=CCCCNCCCCCCCC 34a_100000229939_100000757094 [0,1,0,0,0,0|1,0,1]=3 7446 B13R0.336 C=CCCCNCCCCCCCC 34a_100000700776_100000210759 [0,1,0,0,0,0|1,0,1]=3 7447 B13R0.336 C=CCCCNCCCCCCCO 2230a_100000700776_100000760002 [0,1,0,0,0,0|0,0,2]=3 7448 B13R0.336 C=CCCCNCCCCCCCO 2230a_100011996573_100011713584 [0,1,0,0,0,0|0,0,2]=3 7449 B13R0.336 C=CCCCNCCCCCCCO 34a_100000700776_100000760002 [0,1,0,0,0,0|0,0,2]=3 7450 B13R0.336 C=CCCCNCCCCCCCO 34a_100011996573_100000757094 [0,1,0,0,0,0|0,0,2]=3 7451 B13R0.336 C=CCCCNCCCCCCOC 2230a_100000700776_100011998445 [0,1,0,0,0,0|1,0,2]=4 7452 B13R0.336 C=CCCCNCCCCCCOC 34a_100000700776_100011998445 [0,1,0,0,0,0|1,0,2]=4 7453 B13R0.336 C=CCCCNCCCOCCCC 2230a_200000211371_100011713584 [0,1,0,0,0,0|2,0,1]=4 7454 B13R0.336 C=CCCCNCCCOCCCC 34a_200000211371_100000757094 [0,1,0,0,0,0|2,0,1]=4 7455 B13R0.336 C=CCCCNCCCOCCCO 2230a_100011310245_100011713584 [0,1,0,0,0,0|1,0,2]=4 7456 B13R0.336 C=CCCCNCCCOCCCO 34a_100011310245_100000757094 [0,1,0,0,0,0|1,0,2]=4 7457 B13R0.336 C=CCCCOCCCCCCCBr 34a_100000760002_100000757094 [0,1,0,0,0,0|1,0,2]=4 7458 B13R0.336 C=CCCCOCCCCCCCBr 7a_100000760002_100000757094 [0,1,0,0,0,0|1,0,2]=4 7459 B13R0.336 C=CCCCOCCCCCCCC 34a_100000210232_100000757094 [0,1,0,0,0,0|1,0,1]=3 7460 B13R0.336 C=CCCCOCCCCCCCC 34a_100000758997_100000210759 [0,1,0,0,0,0|1,0,1]=3 7461 B13R0.336 C=CCCCOCCCCCCCC 7a_100000210232_100000757094 [0,1,0,0,0,0|1,0,1]=3 7462 B13R0.336 C=CCCCOCCCCCCCC 7a_100000758997_100000210759 [0,1,0,0,0,0|1,0,1]=3 7463 B13R0.336 C=CCCCOCCCCCCCN 34a_100011996573_100000757094 [0,1,0,0,0,0|1,0,2]=4 7464 B13R0.336 C=CCCCOCCCCCCCO 34a_100000758997_100000760002 [0,1,0,0,0,0|0,0,2]=3 7465 B13R0.336 C=CCCCOCCCCCCCO 7a_100000758997_100000760002 [0,1,0,0,0,0|0,0,2]=3 7466 B13R0.336 C=CCCCOCCCCCCOC 34a_100000758997_100011998445 [0,1,0,0,0,0|1,0,2]=4 7467 B13R0.336 C=CCCCOCCCCCCOC 34a_200012092642_100000757094 [0,1,0,0,0,0|1,0,2]=4 7468 B13R0.336 C=CCCCOCCCCCCOC 7a_100000758997_100011998445 [0,1,0,0,0,0|1,0,2]=4 7469 B13R0.336 C=CCCCOCCCCCCOC 7a_200012092642_100000757094 [0,1,0,0,0,0|1,0,2]=4 7470 B13R0.336 C=CCCCOCCCOCCCC 34a_200011215613_100000757094 [0,1,0,0,0,0|2,0,1]=4 7471 B13R0.336 C=CCCCOCCCOCCCC 7a_200011215613_100000757094 [0,1,0,0,0,0|2,0,1]=4 7472 B13R0.336 C=CCCCOCCNCCCCC 34a_100000224656_100000757094 [0,1,0,0,0,0|2,0,1]=4 7473 B13R0.336 C=CCCCOCCOCCCCC 34a_100011215259_100000757094 [0,1,0,0,0,0|2,0,1]=4 7474 B13R0.336 C=CCCCOCCOCCCCC 7a_100011215259_100000757094 [0,1,0,0,0,0|2,0,1]=4 7475 B13R0.336 C=CCCCSCCCCCCCC 62a_100000210759_100000757094 [0,1,0,0,0,0|1,0,1]=3 7476 B13R0.336 C=CCCCSCCCCCCCC 62a_100011713584_100000210317 [0,1,0,0,0,0|1,0,1]=3 7477 B13R0.336 C=CCCCSCCCCCCCO 62a_100000760002_100000757094 [0,1,0,0,0,0|0,0,2]=3 7478 B13R0.336 C=CCCCSCCCCCCCO 62a_100011713584_100000760002 [0,1,0,0,0,0|0,0,2]=3 7479 B13R0.336 C=CCCCSCCCCCCOC 62a_100011713584_100011998445 [0,1,0,0,0,0|1,0,2]=4 7480 B13R0.336 C=CCCCSCCCCCCOC 62a_100011998445_100000757094 [0,1,0,0,0,0|1,0,2]=4 7481 B13R0.336 C=CCCNCCCCCCCCC 2230a_100000212291_100000754431 [0,1,0,0,0,0|1,0,1]=3 7482 B13R0.336 C=CCCNCCCCCCCCC 2230a_100015191253_100011214924 [0,1,0,0,0,0|1,0,1]=3 7483 B13R0.336 C=CCCNCCCCCCCCC 34a_100000212291_100000754431 [0,1,0,0,0,0|1,0,1]=3 7484 B13R0.336 C=CCCNCCCCCCCCO 2230a_100015191253_100000033203 [0,1,0,0,0,0|0,0,2]=3 7485 B13R0.336 C=CCCNCCCCCCCCO 2230a_102515433106_100000754431 [0,1,0,0,0,0|0,0,2]=3 7486 B13R0.336 C=CCCNCCCCCCCCO 34a_102515433106_100000754431 [0,1,0,0,0,0|0,0,2]=3 7487 B13R0.336 C=CCCOCCCCCCCCBr 34a_100009813846_100000754431 [0,1,0,0,0,0|1,0,2]=4 7488 B13R0.336 C=CCCOCCCCCCCCBr 7a_100009813846_100000754431 [0,1,0,0,0,0|1,0,2]=4 7489 B13R0.336 C=CCCOCCCCCCCCC 34a_100000210712_100000754431 [0,1,0,0,0,0|1,0,1]=3 7490 B13R0.336 C=CCCOCCCCCCCCC 34a_100011205117_100011214924 [0,1,0,0,0,0|1,0,1]=3 7491 B13R0.336 C=CCCOCCCCCCCCC 7a_100000210712_100000754431 [0,1,0,0,0,0|1,0,1]=3 7492 B13R0.336 C=CCCOCCCCCCCCCl 34a_100000033203_100000754431 [0,1,0,0,0,0|1,0,2]=4 7493 B13R0.336 C=CCCOCCCCCCCCCl 7a_100000033203_100000754431 [0,1,0,0,0,0|1,0,2]=4 7494 B13R0.336 C=CCCOCCCCCCCCN 34a_102515433106_100000754431 [0,1,0,0,0,0|1,0,2]=4 7495 B13R0.336 C=CCCOCCCCCCCCO 34a_100011205117_100000033203 [0,1,0,0,0,0|0,0,2]=3 7496 B13R0.336 C=CCCOCCCCNCCCC 34a_200011216965_100000754431 [0,1,0,0,0,0|2,0,1]=4 7497 B13R0.336 C=CCCOCCCCOCCCC 34a_200000760531_100000754431 [0,1,0,0,0,0|2,0,1]=4 7498 B13R0.336 C=CCCOCCCCOCCCC 7a_200000760531_100000754431 [0,1,0,0,0,0|2,0,1]=4 7499 B13R0.336 C=CCCOCCOCCCCCC 34a_100000691444_100000754431 [0,1,0,0,0,0|2,0,1]=4 7500 B13R0.336 C=CCCOCCOCCCCCC 7a_100000691444_100000754431 [0,1,0,0,0,0|2,0,1]=4 7501 B13R0.336 C=CCCSCCCCCCCCC 62a_100000754431_100000210670 [0,1,0,0,0,0|1,0,1]=3 7502 B13R0.336 C=CCCSCCCCCCCCO 62a_100000033203_100000754431 [0,1,0,0,0,0|0,0,2]=3 7503 B13R0.336 C=CCCSCCCCCCCCO 62a_100000754431_100000033203 [0,1,0,0,0,0|0,0,2]=3 7504 B13R0.336 C=CCNCCCCCCCCCC 2230a_100000684558_100000210623 [0,1,0,0,0,0|1,0,1]=3 7505 B13R0.336 C=CCNCCCCCCCCCC 2230a_100020586998_100000210320 [0,1,0,0,0,0|1,0,1]=3 7506 B13R0.336 C=CCNCCCCCCCCCC 34a_100000684558_100015514636 [0,1,0,0,0,0|1,0,1]=3 7507 B13R0.336 C=CCNCCCCCCCCCO 2230a_100000078944_100000210623 [0,1,0,0,0,0|0,0,2]=3 7508 B13R0.336 C=CCNCCCCCCCCCO 2230a_100020586998_100009813782 [0,1,0,0,0,0|0,0,2]=3 7509 B13R0.336 C=CCNCCCCCCCCCO 34a_100000078944_100015514636 [0,1,0,0,0,0|0,0,2]=3 7510 B13R0.336 C=CCOCCCCCCCCCBr 34a_100009813782_100015514636 [0,1,0,0,0,0|1,0,2]=4 7511 B13R0.336 C=CCOCCCCCCCCCBr 7a_100009813782_100015514636 [0,1,0,0,0,0|1,0,2]=4 7512 B13R0.336 C=CCOCCCCCCCCCC 34a_100000210711_100015514636 [0,1,0,0,0,0|1,0,1]=3 7513 B13R0.336 C=CCOCCCCCCCCCC 34a_200000210373_100000210320 [0,1,0,0,0,0|1,0,1]=3 7514 B13R0.336 C=CCOCCCCCCCCCC 7a_100000210711_100015514636 [0,1,0,0,0,0|1,0,1]=3 7515 B13R0.336 C=CCOCCCCCCCCCCl 34a_100009868337_100015514636 [0,1,0,0,0,0|1,0,2]=4 7516 B13R0.336 C=CCOCCCCCCCCCCl 7a_100009868337_100015514636 [0,1,0,0,0,0|1,0,2]=4 7517 B13R0.336 C=CCOCCCCCCCCCN 34a_100000078944_100015514636 [0,1,0,0,0,0|1,0,2]=4 7518 B13R0.336 C=CCOCCCCCCCCCO 34a_200000210373_100009813782 [0,1,0,0,0,0|0,0,2]=3 7519 B13R0.336 C=CCOCCOCCCCCCC 34a_100000037705_100000210614 [0,1,0,0,0,0|2,0,1]=4 7520 B13R0.336 C=CCOCCOCCCCCCC 7a_100000037705_100000210614 [0,1,0,0,0,0|2,0,1]=4 7521 B13R0.336 C=CCOCCOCCCCCCO 34a_100000037705_100000766143 [0,1,0,0,0,0|1,0,2]=4 7522 B13R0.336 C=CCOCCOCCCCCCO 7a_100000037705_100000766143 [0,1,0,0,0,0|1,0,2]=4 7523 B13R0.336 C=CCSCCCCCCCCCC 62a_100000210623_100000210320 [0,1,0,0,0,0|1,0,1]=3 7524 B13R0.336 C=CCSCCCCCCCCCO 62a_100000210623_100009813782 [0,1,0,0,0,0|0,0,2]=3 7525 B13R0.336 C=CCSCCCCCCCCCO 62a_100009813782_100000210623 [0,1,0,0,0,0|0,0,2]=3 7526 B13R0.336 C=COCCCCOCCCCCC 34a_100000031558_100000210314 [0,1,0,0,0,0|2,0,1]=4 7527 B13R0.336 C=COCCCCOCCCCCC 7a_100000031558_100000210314 [0,1,0,0,0,0|2,0,1]=4 7528 B13R0.336 C=COCCCCOCCCCCO 34a_100000031558_100000746330 [0,1,0,0,0,0|1,0,2]=4 7529 B13R0.336 C=COCCCCOCCCCCO 7a_100000031558_100000746330 [0,1,0,0,0,0|1,0,2]=4 7530 B13R0.336 C=COCCCNCCCCCCC 2230a_100000210767_100000210681 [0,1,0,0,0,0|2,0,1]=4 7531 B13R0.336 C=COCCCNCCCCCCC 34a_100000210767_100000210614 [0,1,0,0,0,0|2,0,1]=4 7532 B13R0.336 C=COCCCNCCCCCCO 2230a_100000210767_100000766143 [0,1,0,0,0,0|1,0,2]=4 7533 B13R0.336 C=COCCCNCCCCCCO 34a_100000210767_100000766143 [0,1,0,0,0,0|1,0,2]=4 7534 B13R0.336 C=COCCNCCCCCCCC 2230a_100000229939_100000039644 [0,1,0,0,0,0|2,0,1]=4 7535 B13R0.336 C=COCCNCCCCCCCC 34a_100000229939_100000039644 [0,1,0,0,0,0|2,0,1]=4 7536 B13R0.336 C=COCCNCCCCCCCO 2230a_100011996573_100000039644 [0,1,0,0,0,0|1,0,2]=4 7537 B13R0.336 C=COCCNCCCCCCCO 34a_100011996573_100000039644 [0,1,0,0,0,0|1,0,2]=4 7538 B13R0.336 C=COCCOCCCCCCCC 34a_100000033082_100000210759 [0,1,0,0,0,0|2,0,1]=4 7539 B13R0.336 C=COCCOCCCCCCCC 34a_100000210232_100000039644 [0,1,0,0,0,0|2,0,1]=4 7540 B13R0.336 C=COCCOCCCCCCCC 7a_100000210232_100000039644 [0,1,0,0,0,0|2,0,1]=4 7541 B13R0.336 C=COCCOCCCCCCCO 34a_100000033082_100000760002 [0,1,0,0,0,0|1,0,2]=4 7542 B13R0.336 C=COCCSCCCCCCCC 62a_100000039644_100000210317 [0,1,0,0,0,0|2,0,1]=4 7543 B13R0.336 C=COCCSCCCCCCCC 62a_100000210759_100000039644 [0,1,0,0,0,0|2,0,1]=4 7544 B13R0.336 C=COCCSCCCCCCCO 62a_100000039644_100000760002 [0,1,0,0,0,0|1,0,2]=4 7545 B13R0.336 C=COCCSCCCCCCCO 62a_100000760002_100000039644 [0,1,0,0,0,0|1,0,2]=4 7546 B13R0.336 CC#CCCOCCCCCCCC 34a_100000750427_100000210759 [0,1,0,0,0,0|1,0,2]=4 7547 B13R0.336 CC#CCCOCCCCCCCO 34a_100000750427_100000760002 [0,1,0,0,0,0|0,0,2]=3 7548 B13R0.336 CC#CCCOCCCCCCOC 34a_100000750427_100011998445 [0,1,0,0,0,0|1,0,2]=4 7549 B13R0.336 CC#CCNCCCCCCCCC 2230a_100000212291_100000748600 [0,1,0,0,0,0|1,0,2]=4 7550 B13R0.336 CC#CCNCCCCCCCCC 2230a_100000685387_100011214924 [0,1,0,0,0,0|1,0,2]=4 7551 B13R0.336 CC#CCNCCCCCCCCC 34a_100000212291_100000748600 [0,1,0,0,0,0|1,0,2]=4 7552 B13R0.336 CC#CCNCCCCCCCCC 34a_100000685387_100011214924 [0,1,0,0,0,0|1,0,2]=4 7553 B13R0.336 CC#CCNCCCCCCCCO 2230a_100000685387_100000033203 [0,1,0,0,0,0|0,0,2]=3 7554 B13R0.336 CC#CCNCCCCCCCCO 2230a_102515433106_100000748600 [0,1,0,0,0,0|0,0,2]=3 7555 B13R0.336 CC#CCNCCCCCCCCO 34a_100000685387_100000033203 [0,1,0,0,0,0|0,0,2]=3 7556 B13R0.336 CC#CCNCCCCCCCCO 34a_102515433106_100000748600 [0,1,0,0,0,0|0,0,2]=3 7557 B13R0.336 CC#CCOCCCCCCCCBr 34a_100009813846_100000748600 [0,1,0,0,0,0|1,0,2]=4 7558 B13R0.336 CC#CCOCCCCCCCCBr 7a_100009813846_100000748600 [0,1,0,0,0,0|1,0,2]=4 7559 B13R0.336 CC#CCOCCCCCCCCC 34a_100000210712_100000748600 [0,1,0,0,0,0|1,0,2]=4 7560 B13R0.336 CC#CCOCCCCCCCCC 34a_100000761923_100011214924 [0,1,0,0,0,0|1,0,2]=4 7561 B13R0.336 CC#CCOCCCCCCCCC 7a_100000210712_100000748600 [0,1,0,0,0,0|1,0,2]=4 7562 B13R0.336 CC#CCOCCCCCCCCCl 34a_100000033203_100000748600 [0,1,0,0,0,0|1,0,2]=4 7563 B13R0.336 CC#CCOCCCCCCCCCl 7a_100000033203_100000748600 [0,1,0,0,0,0|1,0,2]=4 7564 B13R0.336 CC#CCOCCCCCCCCN 34a_102515433106_100000748600 [0,1,0,0,0,0|1,0,2]=4 7565 B13R0.336 CC#CCOCCCCCCCCO 34a_100000761923_100000033203 [0,1,0,0,0,0|0,0,2]=3 7566 B13R0.336 CC#CCSCCCCCCCCC 62a_100000748600_100000210670 [0,1,0,0,0,0|1,0,2]=4 7567 B13R0.336 CC#CCSCCCCCCCCO 62a_100000033203_100000748600 [0,1,0,0,0,0|0,0,2]=3 7568 B13R0.336 CC#CCSCCCCCCCCO 62a_100000748600_100000033203 [0,1,0,0,0,0|0,0,2]=3 7569 B13R0.336 CC/C=C/CCCOCCCCCC 34a_100016287902_100000210314 [0,1,0,0,0,0|1,0,2]=4 7570 B13R0.336 CC/C=C/CCCOCCCCCC 7a_100016287902_100000210314 [0,1,0,0,0,0|1,0,2]=4 7571 B13R0.336 CC/C=C/CCCOCCCCCF 34a_100016287902_100000729378 [0,1,0,0,0,0|1,0,2]=4 7572 B13R0.336 CC/C=C/CCCOCCCCCF 7a_100016287902_100000729378 [0,1,0,0,0,0|1,0,2]=4 7573 B13R0.336 CC/C=C/CCCOCCCCCO 34a_100016287902_100000746330 [0,1,0,0,0,0|0,0,2]=3 7574 B13R0.336 CC/C=C/CCCOCCCCCO 7a_100016287902_100000746330 [0,1,0,0,0,0|0,0,2]=3 7575 B13R0.336 CC/C=C/CCCOCCCCOC 34a_100016287902_100000755781 [0,1,0,0,0,0|1,0,2]=4 7576 B13R0.336 CC/C=C/CCCOCCCCOC 7a_100016287902_100000730899 [0,1,0,0,0,0|1,0,2]=4 7577 B13R0.336 CC/C=C/CCCOCCOCCO 34a_100016287902_100000692535 [0,1,0,0,0,0|1,0,2]=4 7578 B13R0.336 CC/C=C/CCCOCCOCCO 7a_100016287902_100011215305 [0,1,0,0,0,0|1,0,2]=4 7579 B13R0.336 CC/C=C\CCCCCCCNCC 269862a_100015525214_200025770492 [0,1,0,0,0,0|1,0,2]=4 7580 B13R0.336 CC/C=C\CCCCCNCCCC 269862a_100000102301_100016288537 [0,1,0,0,0,0|1,0,2]=4 7581 B13R0.336 CC/C=C\CCCCCNCCCF 269862a_100015189416_100016288537 [0,1,0,0,0,0|1,0,2]=4 7582 B13R0.336 CC/C=C\CCCCCNCCCO 269862a_100000182051_100016288537 [0,1,0,0,0,0|0,0,2]=3 7583 B13R0.336 CC/C=C\CCCCCNCCOC 269862a_100000209980_100016288537 [0,1,0,0,0,0|1,0,2]=4 7584 B13R0.336 CC/C=C\CCCCCOCCCC 34a_100016268722_100000210210 [0,1,0,0,0,0|1,0,2]=4 7585 B13R0.336 CC/C=C\CCCCCOCCCC 7a_100016268722_100000210211 [0,1,0,0,0,0|1,0,2]=4 7586 B13R0.336 CC/C=C\CCCCCOCCCF 34a_100016268722_100011934791 [0,1,0,0,0,0|1,0,2]=4 7587 B13R0.336 CC/C=C\CCCCCOCCCF 7a_100016268722_100011934791 [0,1,0,0,0,0|1,0,2]=4 7588 B13R0.336 CC/C=C\CCCCCOCCCO 34a_100016268722_100000230001 [0,1,0,0,0,0|0,0,2]=3 7589 B13R0.336 CC/C=C\CCCCCOCCCO 7a_100016268722_100011215043 [0,1,0,0,0,0|0,0,2]=3 7590 B13R0.336 CC/C=C\CCCCCOCCOC 34a_100016268722_100011201679 [0,1,0,0,0,0|1,0,2]=4 7591 B13R0.336 CC/C=C\CCCCCOCCOC 7a_100016268722_100000233755 [0,1,0,0,0,0|1,0,2]=4 7592 B13R0.336 CC/C=C\CCCCOCCCCC 34a_100016287862_100000718602 [0,1,0,0,0,0|1,0,2]=4 7593 B13R0.336 CC/C=C\CCCCOCCCCC 7a_100016287862_100000210326 [0,1,0,0,0,0|1,0,2]=4 7594 B13R0.336 CC/C=C\CCCCOCCCCF 34a_100016287862_100000729493 [0,1,0,0,0,0|1,0,2]=4 7595 B13R0.336 CC/C=C\CCCCOCCCCF 7a_100016287862_100000729493 [0,1,0,0,0,0|1,0,2]=4 7596 B13R0.336 CC/C=C\CCCCOCCCCO 34a_100016287862_100011216708 [0,1,0,0,0,0|0,0,2]=3 7597 B13R0.336 CC/C=C\CCCCOCCCCO 7a_100016287862_100000210776 [0,1,0,0,0,0|0,0,2]=3 7598 B13R0.336 CC/C=C\CCCCOCCCOC 34a_100016287862_100000740836 [0,1,0,0,0,0|1,0,2]=4 7599 B13R0.336 CC/C=C\CCCCOCCCOC 7a_100016287862_100000740836 [0,1,0,0,0,0|1,0,2]=4 7600 B13R0.336 CC/C=C\CCNCCCCCCC 2230a_100000229938_100015370543 [0,1,0,0,0,0|1,0,2]=4 7601 B13R0.336 CC/C=C\CCNCCCCCCO 2230a_100000686447_100015370543 [0,1,0,0,0,0|0,0,2]=3 7602 B13R0.336 CC/C=C\CCNCCCCCCO 34a_100000686447_100015370543 [0,1,0,0,0,0|0,0,2]=3 7603 B13R0.336 CC/C=C\CCNCCCCCOC 2230a_100000747528_100015370543 [0,1,0,0,0,0|1,0,2]=4 7604 B13R0.336 CC/C=C\CCNCCCCCOC 34a_100000747528_100015370543 [0,1,0,0,0,0|1,0,2]=4 7605 B13R0.336 CC/C=C\CCOCCCCCCBr 34a_100011215345_100015370543 [0,1,0,0,0,0|1,0,2]=4 7606 B13R0.336 CC/C=C\CCOCCCCCCBr 7a_100011215345_100015370543 [0,1,0,0,0,0|1,0,2]=4 7607 B13R0.336 CC/C=C\CCOCCCCCCC 34a_100000210272_100015370543 [0,1,0,0,0,0|1,0,2]=4 7608 B13R0.336 CC/C=C\CCOCCCCCCC 34a_100016288707_100000210614 [0,1,0,0,0,0|1,0,2]=4 7609 B13R0.336 CC/C=C\CCOCCCCCCC 7a_100000210272_100015370543 [0,1,0,0,0,0|1,0,2]=4 7610 B13R0.336 CC/C=C\CCOCCCCCCC 7a_100016288707_100000210614 [0,1,0,0,0,0|1,0,2]=4 7611 B13R0.336 CC/C=C\CCOCCCCCCCl 34a_100000766143_100015370543 [0,1,0,0,0,0|1,0,2]=4 7612 B13R0.336 CC/C=C\CCOCCCCCCCl 7a_100000766143_100015370543 [0,1,0,0,0,0|1,0,2]=4 7613 B13R0.336 CC/C=C\CCOCCCCCCF 34a_100000732779_100015370543 [0,1,0,0,0,0|1,0,2]=4 7614 B13R0.336 CC/C=C\CCOCCCCCCF 34a_100016288707_100015922095 [0,1,0,0,0,0|1,0,2]=4 7615 B13R0.336 CC/C=C\CCOCCCCCCF 7a_100000732779_100015370543 [0,1,0,0,0,0|1,0,2]=4 7616 B13R0.336 CC/C=C\CCOCCCCCCF 7a_100016288707_100015922095 [0,1,0,0,0,0|1,0,2]=4 7617 B13R0.336 CC/C=C\CCOCCCCCCN 34a_100000686447_100015370543 [0,1,0,0,0,0|1,0,2]=4 7618 B13R0.336 CC/C=C\CCOCCCCCCO 34a_100016288707_100000766143 [0,1,0,0,0,0|0,0,2]=3 7619 B13R0.336 CC/C=C\CCOCCCCCCO 7a_100016288707_100000766143 [0,1,0,0,0,0|0,0,2]=3 7620 B13R0.336 CC/C=C\CCSCCCCCCC 62a_100000210614_100015370543 [0,1,0,0,0,0|1,0,2]=4 7621 B13R0.336 CC/C=C\CCSCCCCCCC 62a_100015370543_100000210316 [0,1,0,0,0,0|1,0,2]=4 7622 B13R0.336 CC/C=C\CCSCCCCCCF 62a_100015370543_100015922095 [0,1,0,0,0,0|1,0,2]=4 7623 B13R0.336 CC/C=C\CCSCCCCCCF 62a_100015922095_100015370543 [0,1,0,0,0,0|1,0,2]=4 7624 B13R0.336 CC/C=C\CCSCCCCCCO 62a_100000766143_100015370543 [0,1,0,0,0,0|0,0,2]=3 7625 B13R0.336 CC/C=C\CCSCCCCCCO 62a_100015370543_100000766143 [0,1,0,0,0,0|0,0,2]=3 7626 B13R0.336 CC/C=C\CNCCCCCCCC 2230a_100000229939_100103147603 [0,1,0,0,0,0|1,0,2]=4 7627 B13R0.336 CC/C=C\CNCCCCCCCC 34a_100000229939_100103147603 [0,1,0,0,0,0|1,0,2]=4 7628 B13R0.336 CC/C=C\CNCCCCCCCO 2230a_100011996573_100103147603 [0,1,0,0,0,0|0,0,2]=3 7629 B13R0.336 CC/C=C\CNCCCCCCCO 34a_100011996573_100103147603 [0,1,0,0,0,0|0,0,2]=3 7630 B13R0.336 CC/C=C\CNCCCOCCCO 2230a_100011310245_100103147603 [0,1,0,0,0,0|1,0,2]=4 7631 B13R0.336 CC/C=C\CNCCCOCCCO 34a_100011310245_100103147603 [0,1,0,0,0,0|1,0,2]=4 7632 B13R0.336 CC/C=C\COCCCCCCCBr 34a_100000760002_100103147603 [0,1,0,0,0,0|1,0,2]=4 7633 B13R0.336 CC/C=C\COCCCCCCCBr 7a_100000760002_100103147603 [0,1,0,0,0,0|1,0,2]=4 7634 B13R0.336 CC/C=C\COCCCCCCCC 34a_100000210232_100103147603 [0,1,0,0,0,0|1,0,2]=4 7635 B13R0.336 CC/C=C\COCCCCCCCC 34a_100016268518_100000210759 [0,1,0,0,0,0|1,0,2]=4 7636 B13R0.336 CC/C=C\COCCCCCCCC 7a_100000210232_100103147603 [0,1,0,0,0,0|1,0,2]=4 7637 B13R0.336 CC/C=C\COCCCCCCCN 34a_100011996573_100103147603 [0,1,0,0,0,0|1,0,2]=4 7638 B13R0.336 CC/C=C\COCCCCCCCO 34a_100016268518_100000760002 [0,1,0,0,0,0|0,0,2]=3 7639 B13R0.336 CC/C=C\COCCCCCCOC 34a_100016268518_100011998445 [0,1,0,0,0,0|1,0,2]=4 7640 B13R0.336 CC/C=C\COCCCCCCOC 34a_200012092642_100103147603 [0,1,0,0,0,0|1,0,2]=4 7641 B13R0.336 CC/C=C\COCCCCCCOC 7a_200012092642_100103147603 [0,1,0,0,0,0|1,0,2]=4 7642 B13R0.336 CC/C=C\CSCCCCCCCC 62a_100000210759_100103147603 [0,1,0,0,0,0|1,0,2]=4 7643 B13R0.336 CC/C=C\CSCCCCCCCC 62a_100103147603_100000210317 [0,1,0,0,0,0|1,0,2]=4 7644 B13R0.336 CC/C=C\CSCCCCCCCO 62a_100000760002_100103147603 [0,1,0,0,0,0|0,0,2]=3 7645 B13R0.336 CC/C=C\CSCCCCCCCO 62a_100103147603_100000760002 [0,1,0,0,0,0|0,0,2]=3 7646 B13R0.336 CC/C=C\CSCCCCCCOC 62a_100011998445_100103147603 [0,1,0,0,0,0|1,0,2]=4 7647 B13R0.336 CC/C=C\CSCCCCCCOC 62a_100103147603_100011998445 [0,1,0,0,0,0|1,0,2]=4 7648 B13R0.336 CC=C=CCCOCCCCCCO 34a_100011020354_100000766143 [0,1,0,0,0,0|0,0,3]=4 7649 B13R0.336 CC=CCCCOCCCCCCC 34a_100020645299_100000210614 [0,1,0,0,0,0|1,0,2]=4 7650 B13R0.336 CC=CCCCOCCCCCCF 34a_100020645299_100015922095 [0,1,0,0,0,0|1,0,2]=4 7651 B13R0.336 CC=CCCCOCCCCCCO 34a_100020645299_100000766143 [0,1,0,0,0,0|0,0,2]=3 7652 B13R0.336 CC=CCNCCCCCCCCC 2230a_100000212291_100000070051 [0,1,0,0,0,0|1,0,2]=4 7653 B13R0.336 CC=CCNCCCCCCCCC 34a_100000212291_100000070051 [0,1,0,0,0,0|1,0,2]=4 7654 B13R0.336 CC=CCNCCCCCCCCO 2230a_102515433106_100000070051 [0,1,0,0,0,0|0,0,2]=3 7655 B13R0.336 CC=CCNCCCCCCCCO 34a_102515433106_100000070051 [0,1,0,0,0,0|0,0,2]=3 7656 B13R0.336 CC=CCOCCCCCCCCBr 34a_100009813846_100000070051 [0,1,0,0,0,0|1,0,2]=4 7657 B13R0.336 CC=CCOCCCCCCCCBr 7a_100009813846_100000070051 [0,1,0,0,0,0|1,0,2]=4 7658 B13R0.336 CC=CCOCCCCCCCCC 34a_100000210712_100000070051 [0,1,0,0,0,0|1,0,2]=4 7659 B13R0.336 CC=CCOCCCCCCCCC 7a_100000210712_100000070051 [0,1,0,0,0,0|1,0,2]=4 7660 B13R0.336 CC=CCOCCCCCCCCCl 34a_100000033203_100000070051 [0,1,0,0,0,0|1,0,2]=4 7661 B13R0.336 CC=CCOCCCCCCCCCl 7a_100000033203_100000070051 [0,1,0,0,0,0|1,0,2]=4 7662 B13R0.336 CC=CCOCCCCCCCCN 34a_102515433106_100000070051 [0,1,0,0,0,0|1,0,2]=4 7663 B13R0.336 CC=CCSCCCCCCCCC 62a_100000070051_100000210670 [0,1,0,0,0,0|1,0,2]=4 7664 B13R0.336 CC=CCSCCCCCCCCO 62a_100000033203_100000070051 [0,1,0,0,0,0|0,0,2]=3 7665 B13R0.336 CC=CCSCCCCCCCCO 62a_100000070051_100000033203 [0,1,0,0,0,0|0,0,2]=3 7666 B13R0.336 CCC#CCCCCCCCCOC 34a_200000031908_200000210301 [0,1,0,0,0,0|0,0,2]=3 7667 B13R0.336 CCC#CCCCCCCCCOC 7a_200000031908_200000210301 [0,1,0,0,0,0|0,0,2]=3 7668 B13R0.336 CCC#CCCCCCCCCO[13CH3] 34a_200000031908_200025704644 [0,1,0,0,0,0|0,0,2]=3 7669 B13R0.336 CCC#CCCCCCCCCO[13CH3] 7a_200000031908_200025704644 [0,1,0,0,0,0|0,0,2]=3 7670 B13R0.336 CCC#CCCCCCCNCCF 34a_100000724931_200000036426 [0,1,0,0,0,0|1,0,2]=4 7671 B13R0.336 CCC#CCCCCCCNCCO 2230a_100016997473_200000036426 [0,1,0,0,0,0|0,0,2]=3 7672 B13R0.336 CCC#CCCCCCCNCCO 34a_100016990907_200000036426 [0,1,0,0,0,0|0,0,2]=3 7673 B13R0.336 CCC#CCCCCCCOCCBr 34a_100000211926_200000036426 [0,1,0,0,0,0|1,0,2]=4 7674 B13R0.336 CCC#CCCCCCCOCCC 34a_100000210258_200000036426 [0,1,0,0,0,0|1,0,2]=4 7675 B13R0.336 CCC#CCCCCCCOCCN 34a_100000210304_200000036426 [0,1,0,0,0,0|1,0,2]=4 7676 B13R0.336 CCC#CCCCCCCSCCC 62a_100000210303_200000036426 [0,1,0,0,0,0|1,0,2]=4 7677 B13R0.336 CCC#CCCCCCCSCCC 62a_200000036426_100000210303 [0,1,0,0,0,0|1,0,2]=4 7678 B13R0.336 CCC#CCCCCCCSCCF 62a_100011217306_200000036426 [0,1,0,0,0,0|1,0,2]=4 7679 B13R0.336 CCC#CCCCCCCSCCF 62a_200000036426_100011217306 [0,1,0,0,0,0|1,0,2]=4 7680 B13R0.336 CCC#CCCCCCCSCCO 62a_100000211926_200000036426 [0,1,0,0,0,0|0,0,2]=3 7681 B13R0.336 CCC#CCCCCCCSCCO 62a_200000036426_100000211926 [0,1,0,0,0,0|0,0,2]=3 7682 B13R0.336 CCC#CCCCCCCSCOC 62a_100000766300_200000036426 [0,1,0,0,0,0|1,0,2]=4 7683 B13R0.336 CCC#CCCCCCCSCOC 62a_200000036426_100000766300 [0,1,0,0,0,0|1,0,2]=4 7684 B13R0.336 CCC#CCCOCCCCCCC 34a_100000036655_100000210614 [0,1,0,0,0,0|1,0,2]=4 7685 B13R0.336 CCC#CCCOCCCCCCC 7a_100000036655_100000210614 [0,1,0,0,0,0|1,0,2]=4 7686 B13R0.336 CCC#CCCOCCCCCCF 34a_100000036655_100015922095 [0,1,0,0,0,0|1,0,2]=4 7687 B13R0.336 CCC#CCCOCCCCCCF 7a_100000036655_100015922095 [0,1,0,0,0,0|1,0,2]=4 7688 B13R0.336 CCC#CCCOCCCCCCO 34a_100000036655_100000766143 [0,1,0,0,0,0|0,0,2]=3 7689 B13R0.336 CCC#CCCOCCCCCCO 7a_100000036655_100000766143 [0,1,0,0,0,0|0,0,2]=3 7690 B13R0.336 CCC#CCNCCCCCCCC 2230a_100000229939_100009813939 [0,1,0,0,0,0|1,0,2]=4 7691 B13R0.336 CCC#CCNCCCCCCCC 34a_100000229939_100009813939 [0,1,0,0,0,0|1,0,2]=4 7692 B13R0.336 CCC#CCNCCCCCCCO 2230a_100011996573_100009813939 [0,1,0,0,0,0|0,0,2]=3 7693 B13R0.336 CCC#CCNCCCCCCCO 34a_100011996573_100009813939 [0,1,0,0,0,0|0,0,2]=3 7694 B13R0.336 CCC#CCNCCCOCCCO 2230a_100011310245_100009813939 [0,1,0,0,0,0|1,0,2]=4 7695 B13R0.336 CCC#CCNCCCOCCCO 34a_100011310245_100009813939 [0,1,0,0,0,0|1,0,2]=4 7696 B13R0.336 CCC#CCOCCCCCCCBr 34a_100000760002_100009813939 [0,1,0,0,0,0|1,0,2]=4 7697 B13R0.336 CCC#CCOCCCCCCCBr 7a_100000760002_100009813939 [0,1,0,0,0,0|1,0,2]=4 7698 B13R0.336 CCC#CCOCCCCCCCC 34a_100000032950_100000210759 [0,1,0,0,0,0|1,0,2]=4 7699 B13R0.336 CCC#CCOCCCCCCCC 34a_100000210232_100009813939 [0,1,0,0,0,0|1,0,2]=4 7700 B13R0.336 CCC#CCOCCCCCCCC 7a_100000210232_100009813939 [0,1,0,0,0,0|1,0,2]=4 7701 B13R0.336 CCC#CCOCCCCCCCN 34a_100011996573_100009813939 [0,1,0,0,0,0|1,0,2]=4 7702 B13R0.336 CCC#CCOCCCCCCCO 34a_100000032950_100000760002 [0,1,0,0,0,0|0,0,2]=3 7703 B13R0.336 CCC#CCOCCCCCCOC 34a_100000032950_100011998445 [0,1,0,0,0,0|1,0,2]=4 7704 B13R0.336 CCC#CCOCCCCCCOC 34a_200012092642_100009813939 [0,1,0,0,0,0|1,0,2]=4 7705 B13R0.336 CCC#CCOCCCCCCOC 7a_200012092642_100009813939 [0,1,0,0,0,0|1,0,2]=4 7706 B13R0.336 CCC#CCSCCCCCCCC 62a_100000210759_100009813939 [0,1,0,0,0,0|1,0,2]=4 7707 B13R0.336 CCC#CCSCCCCCCCC 62a_100009813939_100000210317 [0,1,0,0,0,0|1,0,2]=4 7708 B13R0.336 CCC#CCSCCCCCCCO 62a_100000760002_100009813939 [0,1,0,0,0,0|0,0,2]=3 7709 B13R0.336 CCC#CCSCCCCCCCO 62a_100009813939_100000760002 [0,1,0,0,0,0|0,0,2]=3 7710 B13R0.336 CCC#CCSCCCCCCOC 62a_100009813939_100011998445 [0,1,0,0,0,0|1,0,2]=4 7711 B13R0.336 CCC#CCSCCCCCCOC 62a_100011998445_100009813939 [0,1,0,0,0,0|1,0,2]=4 7712 B13R0.336 CCC/C=C/COCCCCCCC 34a_100016278788_100000210614 [0,1,0,0,0,0|1,0,2]=4 7713 B13R0.336 CCC/C=C/COCCCCCCC 7a_100016278788_100000210614 [0,1,0,0,0,0|1,0,2]=4 7714 B13R0.336 CCC/C=C/COCCCCCCF 34a_100016278788_100015922095 [0,1,0,0,0,0|1,0,2]=4 7715 B13R0.336 CCC/C=C/COCCCCCCF 7a_100016278788_100015922095 [0,1,0,0,0,0|1,0,2]=4 7716 B13R0.336 CCC/C=C/COCCCCCCO 34a_100016278788_100000766143 [0,1,0,0,0,0|0,0,2]=3 7717 B13R0.336 CCC/C=C/COCCCCCCO 7a_100016278788_100000766143 [0,1,0,0,0,0|0,0,2]=3 7718 B13R0.336 CCCC#CCCOCCCCCC 34a_100000042726_100000210314 [0,1,0,0,0,0|1,0,2]=4 7719 B13R0.336 CCCC#CCCOCCCCCC 7a_100000042726_100000210314 [0,1,0,0,0,0|1,0,2]=4 7720 B13R0.336 CCCC#CCCOCCCCCF 34a_100000042726_100000729378 [0,1,0,0,0,0|1,0,2]=4 7721 B13R0.336 CCCC#CCCOCCCCCF 7a_100000042726_100000729378 [0,1,0,0,0,0|1,0,2]=4 7722 B13R0.336 CCCC#CCCOCCCCCO 34a_100000042726_100000746330 [0,1,0,0,0,0|0,0,2]=3 7723 B13R0.336 CCCC#CCCOCCCCCO 7a_100000042726_100000746330 [0,1,0,0,0,0|0,0,2]=3 7724 B13R0.336 CCCC#CCCOCCCCOC 34a_100000042726_100000755781 [0,1,0,0,0,0|1,0,2]=4 7725 B13R0.336 CCCC#CCCOCCCCOC 7a_100000042726_100000730899 [0,1,0,0,0,0|1,0,2]=4 7726 B13R0.336 CCCC#CCCOCCOCCO 34a_100000042726_100000692535 [0,1,0,0,0,0|1,0,2]=4 7727 B13R0.336 CCCC#CCCOCCOCCO 7a_100000042726_100011215305 [0,1,0,0,0,0|1,0,2]=4 7728 B13R0.336 CCCC#CCOCCCCCCC 34a_100000034806_100000210614 [0,1,0,0,0,0|1,0,2]=4 7729 B13R0.336 CCCC#CCOCCCCCCC 7a_100000034806_100000210614 [0,1,0,0,0,0|1,0,2]=4 7730 B13R0.336 CCCC#CCOCCCCCCF 34a_100000034806_100015922095 [0,1,0,0,0,0|1,0,2]=4 7731 B13R0.336 CCCC#CCOCCCCCCF 7a_100000034806_100015922095 [0,1,0,0,0,0|1,0,2]=4 7732 B13R0.336 CCCC#CCOCCCCCCO 34a_100000034806_100000766143 [0,1,0,0,0,0|0,0,2]=3 7733 B13R0.336 CCCC#CCOCCCCCCO 7a_100000034806_100000766143 [0,1,0,0,0,0|0,0,2]=3 7734 B13R0.336 CCCC/C=C/CCCCOCCC 34a_200020645093_100000210303 [0,1,0,0,0,0|1,0,2]=4 7735 B13R0.336 CCCC/C=C/CCCCOCCC 7a_200020645093_100000210303 [0,1,0,0,0,0|1,0,2]=4 7736 B13R0.336 CCCC/C=C/CCCCOCCF 34a_200020645093_100011217306 [0,1,0,0,0,0|1,0,2]=4 7737 B13R0.336 CCCC/C=C/CCCCOCCF 7a_200020645093_100011217306 [0,1,0,0,0,0|1,0,2]=4 7738 B13R0.336 CCCC/C=C/CCCCOCCO 34a_200020645093_100000211926 [0,1,0,0,0,0|0,0,2]=3 7739 B13R0.336 CCCC/C=C/CCCCOCCO 7a_200020645093_100000211926 [0,1,0,0,0,0|0,0,2]=3 7740 B13R0.336 CCCC/C=C/COCCCCCC 34a_200016272032_100000210314 [0,1,0,0,0,0|1,0,2]=4 7741 B13R0.336 CCCC/C=C/COCCCCCC 7a_200016272032_100000210314 [0,1,0,0,0,0|1,0,2]=4 7742 B13R0.336 CCCC/C=C/COCCCCCF 34a_200016272032_100000729378 [0,1,0,0,0,0|1,0,2]=4 7743 B13R0.336 CCCC/C=C/COCCCCCF 7a_200016272032_100000729378 [0,1,0,0,0,0|1,0,2]=4 7744 B13R0.336 CCCC/C=C/COCCCCCO 34a_200016272032_100000746330 [0,1,0,0,0,0|0,0,2]=3 7745 B13R0.336 CCCC/C=C/COCCCCCO 7a_200016272032_100000746330 [0,1,0,0,0,0|0,0,2]=3 7746 B13R0.336 CCCC/C=C/COCCCCOC 34a_200016272032_100000755781 [0,1,0,0,0,0|1,0,2]=4 7747 B13R0.336 CCCC/C=C/COCCCCOC 7a_200016272032_100000730899 [0,1,0,0,0,0|1,0,2]=4 7748 B13R0.336 CCCC/C=C/COCCOCCO 34a_200016272032_100000692535 [0,1,0,0,0,0|1,0,2]=4 7749 B13R0.336 CCCC/C=C/COCCOCCO 7a_200016272032_100011215305 [0,1,0,0,0,0|1,0,2]=4 7750 B13R0.336 CCCC/C=C\CCOCCCCC 34a_200016286491_100000718602 [0,1,0,0,0,0|1,0,2]=4 7751 B13R0.336 CCCC/C=C\CCOCCCCC 7a_200016286491_100000210326 [0,1,0,0,0,0|1,0,2]=4 7752 B13R0.336 CCCC/C=C\CCOCCCCF 34a_200016286491_100000729493 [0,1,0,0,0,0|1,0,2]=4 7753 B13R0.336 CCCC/C=C\CCOCCCCF 7a_200016286491_100000729493 [0,1,0,0,0,0|1,0,2]=4 7754 B13R0.336 CCCC/C=C\CCOCCCCO 34a_200016286491_100011216708 [0,1,0,0,0,0|0,0,2]=3 7755 B13R0.336 CCCC/C=C\CCOCCCCO 7a_200016286491_100000210776 [0,1,0,0,0,0|0,0,2]=3 7756 B13R0.336 CCCC/C=C\CCOCCCOC 34a_200016286491_100000740836 [0,1,0,0,0,0|1,0,2]=4 7757 B13R0.336 CCCC/C=C\CCOCCCOC 7a_200016286491_100000740836 [0,1,0,0,0,0|1,0,2]=4 7758 B13R0.336 CCCCC#CCCCCCCNC 2230a_106832991635_200000043322 [0,1,0,0,0,0|1,0,2]=4 7759 B13R0.336 CCCCC#CCCCCCCNC 34a_100102657272_200000043322 [0,1,0,0,0,0|1,0,2]=4 7760 B13R0.336 CCCCC#CCCCCCCNC 7a_106832991635_200000043322 [0,1,0,0,0,0|1,0,2]=4 7761 B13R0.336 CCCCC#CCCCCCCOC 34a_100138415774_200000043322 [0,1,0,0,0,0|0,0,2]=3 7762 B13R0.336 CCCCC#CCCCCCCSC 62a_200000043322_200000210301 [0,1,0,0,0,0|0,1,2]=4 7763 B13R0.336 CCCCC#CCCCCCCSC 62a_200000210301_200000043322 [0,1,0,0,0,0|0,1,2]=4 7764 B13R0.336 CCCCC#CCCCCCCS[13CH3] 62a_200000043322_200025704644 [0,1,0,0,0,0|0,1,2]=4 7765 B13R0.336 CCCCC#CCCCCCCS[13CH3] 62a_200025704644_200000043322 [0,1,0,0,0,0|0,1,2]=4 7766 B13R0.336 CCCCC#CCCCCOCCC 34a_200000066234_100000210303 [0,1,0,0,0,0|1,0,2]=4 7767 B13R0.336 CCCCC#CCCCCOCCC 7a_200000066234_100000210303 [0,1,0,0,0,0|1,0,2]=4 7768 B13R0.336 CCCCC#CCCCCOCCF 34a_200000066234_100011217306 [0,1,0,0,0,0|1,0,2]=4 7769 B13R0.336 CCCCC#CCCCCOCCF 7a_200000066234_100011217306 [0,1,0,0,0,0|1,0,2]=4 7770 B13R0.336 CCCCC#CCCCCOCCO 34a_200000066234_100000211926 [0,1,0,0,0,0|0,0,2]=3 7771 B13R0.336 CCCCC#CCCCCOCCO 7a_200000066234_100000211926 [0,1,0,0,0,0|0,0,2]=3 7772 B13R0.336 CCCCC#CCCCNCCCC 2230a_100000102301_200000047210 [0,1,0,0,0,0|1,0,2]=4 7773 B13R0.336 CCCCC#CCCCNCCCC 7a_106832991798_200000047210 [0,1,0,0,0,0|1,0,2]=4 7774 B13R0.336 CCCCC#CCCCNCCCF 2230a_100015189416_200000047210 [0,1,0,0,0,0|1,0,2]=4 7775 B13R0.336 CCCCC#CCCCNCCCF 34a_100015189416_200000047210 [0,1,0,0,0,0|1,0,2]=4 7776 B13R0.336 CCCCC#CCCCNCCOC 2230a_100000209980_200000047210 [0,1,0,0,0,0|1,0,2]=4 7777 B13R0.336 CCCCC#CCCCOCCCBr 34a_100011217188_200000047210 [0,1,0,0,0,0|1,0,2]=4 7778 B13R0.336 CCCCC#CCCCOCCCC 34a_100000210227_200000047210 [0,1,0,0,0,0|1,0,2]=4 7779 B13R0.336 CCCCC#CCCCOCCCC 7a_100000210227_200000047210 [0,1,0,0,0,0|1,0,2]=4 7780 B13R0.336 CCCCC#CCCCOCCCCl 34a_100000230001_200000047210 [0,1,0,0,0,0|1,0,2]=4 7781 B13R0.336 CCCCC#CCCCOCCCF 34a_100000759539_200000047210 [0,1,0,0,0,0|1,0,2]=4 7782 B13R0.336 CCCCC#CCCCOCCCN 34a_100000182051_200000047210 [0,1,0,0,0,0|1,0,2]=4 7783 B13R0.336 CCCCC#CCCCOCCOC 34a_100000210237_200000047210 [0,1,0,0,0,0|1,0,2]=4 7784 B13R0.336 CCCCC#CCCCOCCON 34a_100000700252_200000047210 [0,1,0,0,0,0|1,0,2]=4 7785 B13R0.336 CCCCC#CCCCSCCCC 62a_100000210211_200000047210 [0,1,0,0,0,0|1,0,2]=4 7786 B13R0.336 CCCCC#CCCCSCCCC 62a_200000047210_100000210210 [0,1,0,0,0,0|1,0,2]=4 7787 B13R0.336 CCCCC#CCCCSCCCF 62a_100011934791_200000047210 [0,1,0,0,0,0|1,0,2]=4 7788 B13R0.336 CCCCC#CCCCSCCCF 62a_200000047210_100011934791 [0,1,0,0,0,0|1,0,2]=4 7789 B13R0.336 CCCCC#CCCCSCCCO 62a_100011215043_200000047210 [0,1,0,0,0,0|0,0,2]=3 7790 B13R0.336 CCCCC#CCCCSCCCO 62a_200000047210_100011215043 [0,1,0,0,0,0|0,0,2]=3 7791 B13R0.336 CCCCC#CCCCSCCOC 62a_100000233755_200000047210 [0,1,0,0,0,0|1,0,2]=4 7792 B13R0.336 CCCCC#CCCCSCCOC 62a_200000047210_100000233755 [0,1,0,0,0,0|1,0,2]=4 7793 B13R0.336 CCCCC#CCCOCCCCC 34a_100000037610_100000718602 [0,1,0,0,0,0|1,0,2]=4 7794 B13R0.336 CCCCC#CCCOCCCCC 7a_100000037610_100000210326 [0,1,0,0,0,0|1,0,2]=4 7795 B13R0.336 CCCCC#CCCOCCCCF 34a_100000037610_100000729493 [0,1,0,0,0,0|1,0,2]=4 7796 B13R0.336 CCCCC#CCCOCCCCF 7a_100000037610_100000729493 [0,1,0,0,0,0|1,0,2]=4 7797 B13R0.336 CCCCC#CCCOCCCCO 34a_100000037610_100011216708 [0,1,0,0,0,0|0,0,2]=3 7798 B13R0.336 CCCCC#CCCOCCCCO 7a_100000037610_100000210776 [0,1,0,0,0,0|0,0,2]=3 7799 B13R0.336 CCCCC#CCCOCCCOC 34a_100000037610_100000740836 [0,1,0,0,0,0|1,0,2]=4 7800 B13R0.336 CCCCC#CCCOCCCOC 7a_100000037610_100000740836 [0,1,0,0,0,0|1,0,2]=4 7801 B13R0.336 CCCCC#CCOCCCCCC 34a_200000034558_100000210314 [0,1,0,0,0,0|1,0,2]=4 7802 B13R0.336 CCCCC#CCOCCCCCC 7a_200000034558_100000210314 [0,1,0,0,0,0|1,0,2]=4 7803 B13R0.336 CCCCC#CCOCCCCCF 34a_200000034558_100000729378 [0,1,0,0,0,0|1,0,2]=4 7804 B13R0.336 CCCCC#CCOCCCCCF 7a_200000034558_100000729378 [0,1,0,0,0,0|1,0,2]=4 7805 B13R0.336 CCCCC#CCOCCCCCO 34a_200000034558_100000746330 [0,1,0,0,0,0|0,0,2]=3 7806 B13R0.336 CCCCC#CCOCCCCCO 7a_200000034558_100000746330 [0,1,0,0,0,0|0,0,2]=3 7807 B13R0.336 CCCCC#CCOCCCCOC 34a_200000034558_100000755781 [0,1,0,0,0,0|1,0,2]=4 7808 B13R0.336 CCCCC#CCOCCCCOC 7a_200000034558_100000730899 [0,1,0,0,0,0|1,0,2]=4 7809 B13R0.336 CCCCC#CCOCCOCCO 34a_200000034558_100000692535 [0,1,0,0,0,0|1,0,2]=4 7810 B13R0.336 CCCCC#CCOCCOCCO 7a_200000034558_100011215305 [0,1,0,0,0,0|1,0,2]=4 7811 B13R0.336 CCCCC/C=C/COCCCCC 34a_100016258190_100000718602 [0,1,0,0,0,0|1,0,2]=4 7812 B13R0.336 CCCCC/C=C/COCCCCC 7a_100016258190_100000210326 [0,1,0,0,0,0|1,0,2]=4 7813 B13R0.336 CCCCC/C=C/COCCCCF 34a_100016258190_100000729493 [0,1,0,0,0,0|1,0,2]=4 7814 B13R0.336 CCCCC/C=C/COCCCCF 7a_100016258190_100000729493 [0,1,0,0,0,0|1,0,2]=4 7815 B13R0.336 CCCCC/C=C/COCCCCO 34a_100016258190_100011216708 [0,1,0,0,0,0|0,0,2]=3 7816 B13R0.336 CCCCC/C=C/COCCCCO 7a_100016258190_100000210776 [0,1,0,0,0,0|0,0,2]=3 7817 B13R0.336 CCCCC/C=C/COCCCOC 34a_100016258190_100000740836 [0,1,0,0,0,0|1,0,2]=4 7818 B13R0.336 CCCCC/C=C/COCCCOC 7a_100016258190_100000740836 [0,1,0,0,0,0|1,0,2]=4 7819 B13R0.336 CCCCC/C=C\CCCOCCC 34a_100020655193_100000210303 [0,1,0,0,0,0|1,0,2]=4 7820 B13R0.336 CCCCC/C=C\CCCOCCC 7a_100020655193_100000210303 [0,1,0,0,0,0|1,0,2]=4 7821 B13R0.336 CCCCC/C=C\CCCOCCF 34a_100020655193_100011217306 [0,1,0,0,0,0|1,0,2]=4 7822 B13R0.336 CCCCC/C=C\CCCOCCF 7a_100020655193_100011217306 [0,1,0,0,0,0|1,0,2]=4 7823 B13R0.336 CCCCC/C=C\CCCOCCO 34a_100020655193_100000211926 [0,1,0,0,0,0|0,0,2]=3 7824 B13R0.336 CCCCC/C=C\CCCOCCO 7a_100020655193_100000211926 [0,1,0,0,0,0|0,0,2]=3 7825 B13R0.336 CCCCC/C=C\CCOCCCC 34a_100016277358_100000210210 [0,1,0,0,0,0|1,0,2]=4 7826 B13R0.336 CCCCC/C=C\CCOCCCC 7a_100016277358_100000210211 [0,1,0,0,0,0|1,0,2]=4 7827 B13R0.336 CCCCC/C=C\CCOCCCF 34a_100016277358_100011934791 [0,1,0,0,0,0|1,0,2]=4 7828 B13R0.336 CCCCC/C=C\CCOCCCF 7a_100016277358_100011934791 [0,1,0,0,0,0|1,0,2]=4 7829 B13R0.336 CCCCC/C=C\CCOCCCO 34a_100016277358_100000230001 [0,1,0,0,0,0|0,0,2]=3 7830 B13R0.336 CCCCC/C=C\CCOCCCO 7a_100016277358_100011215043 [0,1,0,0,0,0|0,0,2]=3 7831 B13R0.336 CCCCC/C=C\CCOCCOC 34a_100016277358_100011201679 [0,1,0,0,0,0|1,0,2]=4 7832 B13R0.336 CCCCC/C=C\CCOCCOC 7a_100016277358_100000233755 [0,1,0,0,0,0|1,0,2]=4 7833 B13R0.336 CCCCCC#CCCOCCCC 34a_200000042877_100000210210 [0,1,0,0,0,0|1,0,2]=4 7834 B13R0.336 CCCCCC#CCCOCCCC 7a_200000042877_100000210211 [0,1,0,0,0,0|1,0,2]=4 7835 B13R0.336 CCCCCC#CCCOCCCF 34a_200000042877_100011934791 [0,1,0,0,0,0|1,0,2]=4 7836 B13R0.336 CCCCCC#CCCOCCCF 7a_200000042877_100011934791 [0,1,0,0,0,0|1,0,2]=4 7837 B13R0.336 CCCCCC#CCCOCCCO 34a_200000042877_100000230001 [0,1,0,0,0,0|0,0,2]=3 7838 B13R0.336 CCCCCC#CCCOCCCO 7a_200000042877_100011215043 [0,1,0,0,0,0|0,0,2]=3 7839 B13R0.336 CCCCCC#CCCOCCOC 34a_200000042877_100011201679 [0,1,0,0,0,0|1,0,2]=4 7840 B13R0.336 CCCCCC#CCCOCCOC 7a_200000042877_100000233755 [0,1,0,0,0,0|1,0,2]=4 7841 B13R0.336 CCCCCC#CCNCCCCC 2230a_100000209983_100009816472 [0,1,0,0,0,0|1,0,2]=4 7842 B13R0.336 CCCCCC#CCNCCCCO 2230a_100000750430_100009816472 [0,1,0,0,0,0|0,0,2]=3 7843 B13R0.336 CCCCCC#CCNCCCCO 34a_100000750430_100009816472 [0,1,0,0,0,0|0,0,2]=3 7844 B13R0.336 CCCCCC#CCNCCCOC 34a_100150723488_100009816472 [0,1,0,0,0,0|1,0,2]=4 7845 B13R0.336 CCCCCC#CCOCCCCBr 34a_100011216708_100009816472 [0,1,0,0,0,0|1,0,2]=4 7846 B13R0.336 CCCCCC#CCOCCCCC 34a_100000210253_100009816472 [0,1,0,0,0,0|1,0,2]=4 7847 B13R0.336 CCCCCC#CCOCCCCC 34a_200000033628_100000718602 [0,1,0,0,0,0|1,0,2]=4 7848 B13R0.336 CCCCCC#CCOCCCCC 7a_100000210253_100009816472 [0,1,0,0,0,0|1,0,2]=4 7849 B13R0.336 CCCCCC#CCOCCCCC 7a_200000033628_100000210326 [0,1,0,0,0,0|1,0,2]=4 7850 B13R0.336 CCCCCC#CCOCCCCCl 34a_100000210776_100009816472 [0,1,0,0,0,0|1,0,2]=4 7851 B13R0.336 CCCCCC#CCOCCCCCl 7a_100000210776_100009816472 [0,1,0,0,0,0|1,0,2]=4 7852 B13R0.336 CCCCCC#CCOCCCCF 34a_100011995726_100009816472 [0,1,0,0,0,0|1,0,2]=4 7853 B13R0.336 CCCCCC#CCOCCCCF 34a_200000033628_100000729493 [0,1,0,0,0,0|1,0,2]=4 7854 B13R0.336 CCCCCC#CCOCCCCF 7a_100011995726_100009816472 [0,1,0,0,0,0|1,0,2]=4 7855 B13R0.336 CCCCCC#CCOCCCCF 7a_200000033628_100000729493 [0,1,0,0,0,0|1,0,2]=4 7856 B13R0.336 CCCCCC#CCOCCCCI 34a_200012148704_100009816472 [0,1,0,0,0,0|1,0,2]=4 7857 B13R0.336 CCCCCC#CCOCCCCN 34a_100000750430_100009816472 [0,1,0,0,0,0|1,0,2]=4 7858 B13R0.336 CCCCCC#CCOCCCCO 34a_200000033628_100011216708 [0,1,0,0,0,0|0,0,2]=3 7859 B13R0.336 CCCCCC#CCOCCCCO 7a_200000033628_100000210776 [0,1,0,0,0,0|0,0,2]=3 7860 B13R0.336 CCCCCC#CCOCCCOC 34a_100000740835_100009816472 [0,1,0,0,0,0|1,0,2]=4 7861 B13R0.336 CCCCCC#CCOCCCOC 34a_200000033628_100000740836 [0,1,0,0,0,0|1,0,2]=4 7862 B13R0.336 CCCCCC#CCOCCCOC 7a_200000033628_100000740836 [0,1,0,0,0,0|1,0,2]=4 7863 B13R0.336 CCCCCC#CCSCCCCC 62a_100000210326_100009816472 [0,1,0,0,0,0|1,0,2]=4 7864 B13R0.336 CCCCCC#CCSCCCCC 62a_100009816472_100000210326 [0,1,0,0,0,0|1,0,2]=4 7865 B13R0.336 CCCCCC#CCSCCCCF 62a_100000729493_100009816472 [0,1,0,0,0,0|1,0,2]=4 7866 B13R0.336 CCCCCC#CCSCCCCF 62a_100009816472_100000729493 [0,1,0,0,0,0|1,0,2]=4 7867 B13R0.336 CCCCCC#CCSCCCCO 62a_100000210776_100009816472 [0,1,0,0,0,0|0,0,2]=3 7868 B13R0.336 CCCCCC#CCSCCCCO 62a_100009816472_100000210776 [0,1,0,0,0,0|0,0,2]=3 7869 B13R0.336 CCCCCC#CCSCCCOC 62a_100000709357_100009816472 [0,1,0,0,0,0|1,0,2]=4 7870 B13R0.336 CCCCCC#CCSCCCOC 62a_100009816472_100000709357 [0,1,0,0,0,0|1,0,2]=4 7871 B13R0.336 CCCCCC/C=C/COCCCC 34a_200016276170_100000210210 [0,1,0,0,0,0|1,0,2]=4 7872 B13R0.336 CCCCCC/C=C/COCCCC 7a_200016276170_100000210211 [0,1,0,0,0,0|1,0,2]=4 7873 B13R0.336 CCCCCC/C=C/COCCCF 34a_200016276170_100011934791 [0,1,0,0,0,0|1,0,2]=4 7874 B13R0.336 CCCCCC/C=C/COCCCF 7a_200016276170_100011934791 [0,1,0,0,0,0|1,0,2]=4 7875 B13R0.336 CCCCCC/C=C/COCCCO 34a_200016276170_100000230001 [0,1,0,0,0,0|0,0,2]=3 7876 B13R0.336 CCCCCC/C=C/COCCCO 7a_200016276170_100011215043 [0,1,0,0,0,0|0,0,2]=3 7877 B13R0.336 CCCCCC/C=C/COCCOC 34a_200016276170_100011201679 [0,1,0,0,0,0|1,0,2]=4 7878 B13R0.336 CCCCCC/C=C/COCCOC 7a_200016276170_100000233755 [0,1,0,0,0,0|1,0,2]=4 7879 B13R0.336 CCCCCCC#CCCOCCC 34a_200000033163_100000210303 [0,1,0,0,0,0|1,0,2]=4 7880 B13R0.336 CCCCCCC#CCCOCCC 7a_200000033163_100000210303 [0,1,0,0,0,0|1,0,2]=4 7881 B13R0.336 CCCCCCC#CCCOCCF 34a_200000033163_100011217306 [0,1,0,0,0,0|1,0,2]=4 7882 B13R0.336 CCCCCCC#CCCOCCF 7a_200000033163_100011217306 [0,1,0,0,0,0|1,0,2]=4 7883 B13R0.336 CCCCCCC#CCCOCCO 34a_200000033163_100000211926 [0,1,0,0,0,0|0,0,2]=3 7884 B13R0.336 CCCCCCC#CCCOCCO 7a_200000033163_100000211926 [0,1,0,0,0,0|0,0,2]=3 7885 B13R0.336 CCCCCCC#CCOCCCC 34a_200000037284_100000210210 [0,1,0,0,0,0|1,0,2]=4 7886 B13R0.336 CCCCCCC#CCOCCCC 7a_200000037284_100000210211 [0,1,0,0,0,0|1,0,2]=4 7887 B13R0.336 CCCCCCC#CCOCCCF 34a_200000037284_100011934791 [0,1,0,0,0,0|1,0,2]=4 7888 B13R0.336 CCCCCCC#CCOCCCF 7a_200000037284_100011934791 [0,1,0,0,0,0|1,0,2]=4 7889 B13R0.336 CCCCCCC#CCOCCCO 34a_200000037284_100000230001 [0,1,0,0,0,0|0,0,2]=3 7890 B13R0.336 CCCCCCC#CCOCCCO 7a_200000037284_100011215043 [0,1,0,0,0,0|0,0,2]=3 7891 B13R0.336 CCCCCCC#CCOCCOC 34a_200000037284_100011201679 [0,1,0,0,0,0|1,0,2]=4 7892 B13R0.336 CCCCCCC#CCOCCOC 7a_200000037284_100000233755 [0,1,0,0,0,0|1,0,2]=4 7893 B13R0.336 CCCCCCC=NNCCCCC 4a_100000694160_100000234349 [0,1,0,0,0,0|2,0,1]=4 7894 B13R0.336 CCCCCCCC#CCOCCC 34a_200000061759_100000210303 [0,1,0,0,0,0|1,0,2]=4 7895 B13R0.336 CCCCCCCC#CCOCCC 7a_200000061759_100000210303 [0,1,0,0,0,0|1,0,2]=4 7896 B13R0.336 CCCCCCCC#CCOCCF 34a_200000061759_100011217306 [0,1,0,0,0,0|1,0,2]=4 7897 B13R0.336 CCCCCCCC#CCOCCF 7a_200000061759_100011217306 [0,1,0,0,0,0|1,0,2]=4 7898 B13R0.336 CCCCCCCC#CCOCCO 34a_200000061759_100000211926 [0,1,0,0,0,0|0,0,2]=3 7899 B13R0.336 CCCCCCCC#CCOCCO 7a_200000061759_100000211926 [0,1,0,0,0,0|0,0,2]=3 7900 B13R0.336 CCCCCCCC/C=C/COCC 34a_200020667288_100000210202 [0,1,0,0,0,0|1,0,2]=4 7901 B13R0.336 CCCCCCCC/C=C/COCC 7a_200020667288_100000210202 [0,1,0,0,0,0|1,0,2]=4 7902 B13R0.336 CCCCCCCC/C=C/COCF 34a_200020667288_100015361967 [0,1,0,0,0,0|1,0,2]=4 7903 B13R0.336 CCCCCCCC/C=C/COCF 7a_200020667288_100015361967 [0,1,0,0,0,0|1,0,2]=4 7904 B13R0.336 CCCCCCCC=NNCCCC 4a_100025702795_100000210592 [0,1,0,0,0,0|2,0,1]=4 7905 B13R0.336 CCCCCCCCC/C=C/COC 34a_100015232335_200000210301 [0,1,0,0,0,0|0,0,2]=3 7906 B13R0.336 CCCCCCCCC/C=C/COC 7a_100015232335_200000210301 [0,1,0,0,0,0|0,0,2]=3 7907 B13R0.336 CCCCCCCCC/C=C/CO[13CH3] 34a_100015232335_200025704644 [0,1,0,0,0,0|0,0,2]=3 7908 B13R0.336 CCCCCCCCC/C=C/CO[13CH3] 7a_100015232335_200025704644 [0,1,0,0,0,0|0,0,2]=3 7909 B13R0.336 CCCCCCCCC=NNCCC 4a_100000740057_100011218696 [0,1,0,0,0,0|2,0,1]=4 7910 B13R0.336 CCCCCCCCC=NNCCO 4a_100000210001_100011218696 [0,1,0,0,0,0|1,0,1]=3 7911 B13R0.336 CCCCCCCCCC=NNCC 4a_100000756455_100000210895 [0,1,0,0,0,0|2,0,1]=4 7912 B13R0.336 CCCCCCCCCCCCNC 2230a_100000210451_200000210301 [0,1,0,0,0,0|1,0,0]=2 7913 B13R0.336 CCCCCCCCCCCCNC 2230a_106832991635_100011215052 [0,1,0,0,0,0|1,0,0]=2 7914 B13R0.336 CCCCCCCCCCCCNC 270004a_106832991635_100011218549 [0,1,0,0,0,0|1,0,0]=2 7915 B13R0.336 CCCCCCCCCCCCNC 34a_100000210451_200000210301 [0,1,0,0,0,0|1,0,0]=2 7916 B13R0.336 CCCCCCCCCCCCNC 34a_100102657272_100000759014 [0,1,0,0,0,0|1,0,0]=2 7917 B13R0.336 CCCCCCCCCCCCNC 7a_106832991635_100000759014 [0,1,0,0,0,0|1,0,0]=2 7918 B13R0.336 CCCCCCCCCCCCN[13CH3] 2230a_100000210451_200025704644 [0,1,0,0,0,0|1,0,0]=2 7919 B13R0.336 CCCCCCCCCCCCN[13CH3] 34a_100000210451_200025704644 [0,1,0,0,0,0|1,0,0]=2 7920 B13R0.336 CCCCCCCCCCCCOC 34a_100000210810_200000210301 [0,1,0,0,0,0|0,0,0]=1 7921 B13R0.336 CCCCCCCCCCCCOC 34a_100138415774_100000759014 [0,1,0,0,0,0|0,0,0]=1 7922 B13R0.336 CCCCCCCCCCCCOC 7a_100000210810_200000210301 [0,1,0,0,0,0|0,0,0]=1 7923 B13R0.336 CCCCCCCCCCCCO[13CH3] 34a_100000210810_200025704644 [0,1,0,0,0,0|0,0,0]=1 7924 B13R0.336 CCCCCCCCCCCCO[13CH3] 7a_100000210810_200025704644 [0,1,0,0,0,0|0,0,0]=1 7925 B13R0.336 CCCCCCCCCCCCSC 62a_200000210301_100000759014 [0,1,0,0,0,0|0,1,0]=2 7926 B13R0.336 CCCCCCCCCCCCS[13CH3] 62a_200025704644_100000759014 [0,1,0,0,0,0|0,1,0]=2 7927 B13R0.336 CCCCCCCCCCCNCC 2230a_100015525214_100011215454 [0,1,0,0,0,0|1,0,0]=2 7928 B13R0.336 CCCCCCCCCCCNCC 2230a_200011215754_100000210202 [0,1,0,0,0,0|1,0,0]=2 7929 B13R0.336 CCCCCCCCCCCNCC 34a_200011215754_100000210202 [0,1,0,0,0,0|1,0,0]=2 7930 B13R0.336 CCCCCCCCCCCNCF 34a_200011215754_100015361967 [0,1,0,0,0,0|1,0,0]=2 7931 B13R0.336 CCCCCCCCCCCOCC 34a_100000210809_100000210202 [0,1,0,0,0,0|1,0,0]=2 7932 B13R0.336 CCCCCCCCCCCOCC 34a_100121572206_100011215454 [0,1,0,0,0,0|1,0,0]=2 7933 B13R0.336 CCCCCCCCCCCOCC 7a_100000210809_100000210202 [0,1,0,0,0,0|1,0,0]=2 7934 B13R0.336 CCCCCCCCCCCOCF 34a_100000210809_100015361967 [0,1,0,0,0,0|1,0,0]=2 7935 B13R0.336 CCCCCCCCCCCOCF 7a_100000210809_100015361967 [0,1,0,0,0,0|1,0,0]=2 7936 B13R0.336 CCCCCCCCCCCSCC 62a_100000210202_100011215454 [0,1,0,0,0,0|1,0,0]=2 7937 B13R0.336 CCCCCCCCCCCSCF 62a_100015361967_100011215454 [0,1,0,0,0,0|1,0,0]=2 7938 B13R0.336 CCCCCCCCCCNCC#N 2230a_100000684558_100011215382 [0,1,0,0,0,0|1,0,1]=3 7939 B13R0.336 CCCCCCCCCCNCC=O 2230a_100000684558_200015260668 [0,1,0,0,0,0|0,0,2]=3 7940 B13R0.336 CCCCCCCCCCNCC=O 34a_100000684558_200009817547 [0,1,0,0,0,0|0,0,2]=3 7941 B13R0.336 CCCCCCCCCCNCCC 2230a_100000684558_100000210303 [0,1,0,0,0,0|1,0,0]=2 7942 B13R0.336 CCCCCCCCCCNCCC 34a_100000684558_100000210303 [0,1,0,0,0,0|1,0,0]=2 7943 B13R0.336 CCCCCCCCCCNCCF 2230a_100000684558_100011217306 [0,1,0,0,0,0|1,0,0]=2 7944 B13R0.336 CCCCCCCCCCNCCF 34a_100000684558_100011217306 [0,1,0,0,0,0|1,0,0]=2 7945 B13R0.336 CCCCCCCCCCNCCF 34a_100000724931_100000210320 [0,1,0,0,0,0|1,0,0]=2 7946 B13R0.336 CCCCCCCCCCNCCO 2230a_100000684558_100000211926 [0,1,0,0,0,0|0,0,0]=1 7947 B13R0.336 CCCCCCCCCCNCCO 2230a_100016997473_100000210320 [0,1,0,0,0,0|0,0,0]=1 7948 B13R0.336 CCCCCCCCCCNCCO 34a_100000684558_100000211926 [0,1,0,0,0,0|0,0,0]=1 7949 B13R0.336 CCCCCCCCCCNCCO 34a_100016990907_100000210320 [0,1,0,0,0,0|0,0,0]=1 7950 B13R0.336 CCCCCCCCCCNCOC 2230a_100000684558_100000766300 [0,1,0,0,0,0|1,0,0]=2 7951 B13R0.336 CCCCCCCCCCNCSC 2230a_100000684558_100011218213 [0,1,0,0,0,0|1,1,0]=3 7952 B13R0.336 CCCCCCCCCCNCSC 34a_100000684558_100011218213 [0,1,0,0,0,0|1,1,0]=3 7953 B13R0.336 CCCCCCCCCCOCC#N 7a_100000210711_100011215382 [0,1,0,0,0,0|1,0,1]=3 7954 B13R0.336 CCCCCCCCCCOCC=O 34a_100000210711_200009817547 [0,1,0,0,0,0|0,0,2]=3 7955 B13R0.336 CCCCCCCCCCOCC=O 7a_100000210711_200015260668 [0,1,0,0,0,0|0,0,2]=3 7956 B13R0.336 CCCCCCCCCCOCCBr 34a_100000211926_100000210320 [0,1,0,0,0,0|1,0,0]=2 7957 B13R0.336 CCCCCCCCCCOCCC 34a_100000210258_100000210320 [0,1,0,0,0,0|1,0,0]=2 7958 B13R0.336 CCCCCCCCCCOCCC 34a_100000210711_100000210303 [0,1,0,0,0,0|1,0,0]=2 7959 B13R0.336 CCCCCCCCCCOCCC 7a_100000210711_100000210303 [0,1,0,0,0,0|1,0,0]=2 7960 B13R0.336 CCCCCCCCCCOCCF 34a_100000210711_100011217306 [0,1,0,0,0,0|1,0,0]=2 7961 B13R0.336 CCCCCCCCCCOCCF 7a_100000210711_100011217306 [0,1,0,0,0,0|1,0,0]=2 7962 B13R0.336 CCCCCCCCCCOCCN 34a_100000210304_100000210320 [0,1,0,0,0,0|1,0,0]=2 7963 B13R0.336 CCCCCCCCCCOCCO 34a_100000210711_100000211926 [0,1,0,0,0,0|0,0,0]=1 7964 B13R0.336 CCCCCCCCCCOCCO 7a_100000210711_100000211926 [0,1,0,0,0,0|0,0,0]=1 7965 B13R0.336 CCCCCCCCCCOCSC 34a_100000210711_100011218213 [0,1,0,0,0,0|1,1,0]=3 7966 B13R0.336 CCCCCCCCCCSCC#N 62a_100011215382_100000210320 [0,1,0,0,0,0|1,0,1]=3 7967 B13R0.336 CCCCCCCCCCSCC=O 62a_200015260668_100000210320 [0,1,0,0,0,0|0,0,2]=3 7968 B13R0.336 CCCCCCCCCCSCCC 62a_100000210303_100000210320 [0,1,0,0,0,0|1,0,0]=2 7969 B13R0.336 CCCCCCCCCCSCCF 62a_100011217306_100000210320 [0,1,0,0,0,0|1,0,0]=2 7970 B13R0.336 CCCCCCCCCCSCCO 62a_100000211926_100000210320 [0,1,0,0,0,0|0,0,0]=1 7971 B13R0.336 CCCCCCCCCCSCOC 62a_100000766300_100000210320 [0,1,0,0,0,0|1,0,0]=2 7972 B13R0.336 CCCCCCCCCCSCSC 62a_100011218213_100000210320 [0,1,0,0,0,0|1,1,0]=3 7973 B13R0.336 CCCCCCCCCNCCC#N 2230a_100000212291_100011215226 [0,1,0,0,0,0|1,0,1]=3 7974 B13R0.336 CCCCCCCCCNCCCC 2230a_100000102301_100011214924 [0,1,0,0,0,0|1,0,0]=2 7975 B13R0.336 CCCCCCCCCNCCCC 2230a_100000212291_100000210211 [0,1,0,0,0,0|1,0,0]=2 7976 B13R0.336 CCCCCCCCCNCCCC 34a_100000212291_100000210210 [0,1,0,0,0,0|1,0,0]=2 7977 B13R0.336 CCCCCCCCCNCCCC 7a_106832991798_100000210328 [0,1,0,0,0,0|1,0,0]=2 7978 B13R0.336 CCCCCCCCCNCCCF 2230a_100000212291_100011934791 [0,1,0,0,0,0|1,0,0]=2 7979 B13R0.336 CCCCCCCCCNCCCF 2230a_100015189416_100011214924 [0,1,0,0,0,0|1,0,0]=2 7980 B13R0.336 CCCCCCCCCNCCCF 34a_100000212291_100011934791 [0,1,0,0,0,0|1,0,0]=2 7981 B13R0.336 CCCCCCCCCNCCCF 34a_100015189416_100011214924 [0,1,0,0,0,0|1,0,0]=2 7982 B13R0.336 CCCCCCCCCNCCCO 2230a_100000212291_100000230001 [0,1,0,0,0,0|0,0,0]=1 7983 B13R0.336 CCCCCCCCCNCCCO 34a_100000212291_100000230001 [0,1,0,0,0,0|0,0,0]=1 7984 B13R0.336 CCCCCCCCCNCCOC 2230a_100000209980_100011214924 [0,1,0,0,0,0|1,0,0]=2 7985 B13R0.336 CCCCCCCCCNCCOC 2230a_100000212291_100011201679 [0,1,0,0,0,0|1,0,0]=2 7986 B13R0.336 CCCCCCCCCNCCOC 34a_100000212291_100011201679 [0,1,0,0,0,0|1,0,0]=2 7987 B13R0.336 CCCCCCCCCNCCSC 2230a_100000212291_100000751147 [0,1,0,0,0,0|1,1,0]=3 7988 B13R0.336 CCCCCCCCCNCCSC 2230a_100020590264_100011214924 [0,1,0,0,0,0|1,1,0]=3 7989 B13R0.336 CCCCCCCCCNCCSC 34a_100000212291_100000212216 [0,1,0,0,0,0|1,1,0]=3 7990 B13R0.336 CCCCCCCCCOCCC#N 7a_100000210712_100000184422 [0,1,0,0,0,0|1,0,1]=3 7991 B13R0.336 CCCCCCCCCOCCCBr 34a_100011217188_100011214924 [0,1,0,0,0,0|1,0,0]=2 7992 B13R0.336 CCCCCCCCCOCCCC 34a_100000210227_100011214924 [0,1,0,0,0,0|1,0,0]=2 7993 B13R0.336 CCCCCCCCCOCCCC 34a_100000210712_100000210210 [0,1,0,0,0,0|1,0,0]=2 7994 B13R0.336 CCCCCCCCCOCCCC 7a_100000210227_100000210328 [0,1,0,0,0,0|1,0,0]=2 7995 B13R0.336 CCCCCCCCCOCCCC 7a_100000210712_100000210211 [0,1,0,0,0,0|1,0,0]=2 7996 B13R0.336 CCCCCCCCCOCCCCl 34a_100000230001_100011214924 [0,1,0,0,0,0|1,0,0]=2 7997 B13R0.336 CCCCCCCCCOCCCF 34a_100000210712_100011934791 [0,1,0,0,0,0|1,0,0]=2 7998 B13R0.336 CCCCCCCCCOCCCF 34a_100000759539_100011214924 [0,1,0,0,0,0|1,0,0]=2 7999 B13R0.336 CCCCCCCCCOCCCF 7a_100000210712_100011934791 [0,1,0,0,0,0|1,0,0]=2 8000 B13R0.336 CCCCCCCCCOCCCN 34a_100000182051_100011214924 [0,1,0,0,0,0|1,0,0]=2 8001 B13R0.336 CCCCCCCCCOCCCO 34a_100000210712_100000230001 [0,1,0,0,0,0|0,0,0]=1 8002 B13R0.336 CCCCCCCCCOCCCO 7a_100000210712_100011215043 [0,1,0,0,0,0|0,0,0]=1 8003 B13R0.336 CCCCCCCCCOCCOC 34a_100000210237_100011214924 [0,1,0,0,0,0|1,0,0]=2 8004 B13R0.336 CCCCCCCCCOCCOC 34a_100000210712_100011201679 [0,1,0,0,0,0|1,0,0]=2 8005 B13R0.336 CCCCCCCCCOCCOC 7a_100000210712_100000233755 [0,1,0,0,0,0|1,0,0]=2 8006 B13R0.336 CCCCCCCCCOCCON 34a_100000700252_100011214924 [0,1,0,0,0,0|1,0,0]=2 8007 B13R0.336 CCCCCCCCCOCCSC 34a_100000210712_100000212216 [0,1,0,0,0,0|1,1,0]=3 8008 B13R0.336 CCCCCCCCCOCCSC 34a_100000230434_100011214924 [0,1,0,0,0,0|1,1,0]=3 8009 B13R0.336 CCCCCCCCCOCCSC 7a_100000210712_100000212216 [0,1,0,0,0,0|1,1,0]=3 8010 B13R0.336 CCCCCCCCCOCCSC 7a_100000230434_100000210328 [0,1,0,0,0,0|1,1,0]=3 8011 B13R0.336 CCCCCCCCCSCCC#N 62a_100011215226_100000210670 [0,1,0,0,0,0|1,0,1]=3 8012 B13R0.336 CCCCCCCCCSCCCC 62a_100000210211_100000210670 [0,1,0,0,0,0|1,0,0]=2 8013 B13R0.336 CCCCCCCCCSCCCF 62a_100011934791_100000210670 [0,1,0,0,0,0|1,0,0]=2 8014 B13R0.336 CCCCCCCCCSCCCO 62a_100011215043_100000210670 [0,1,0,0,0,0|0,0,0]=1 8015 B13R0.336 CCCCCCCCCSCCOC 62a_100000233755_100000210670 [0,1,0,0,0,0|1,0,0]=2 8016 B13R0.336 CCCCCCCCCSCCSC 62a_100000212216_100000210670 [0,1,0,0,0,0|1,1,0]=3 8017 B13R0.336 CCCCCCCCCSCOCC 62a_100000739092_100000210670 [0,1,0,0,0,0|2,0,0]=3 8018 B13R0.336 CCCCCCCCCSCSC#N 62a_100000211825_100000210670 [0,1,0,0,0,0|2,0,1]=4 8019 B13R0.336 CCCCCCCCNCC#CCO 2230a_100000229939_200000047223 [0,1,0,0,0,0|0,0,2]=3 8020 B13R0.336 CCCCCCCCNCC#CCO 34a_100000229939_200000047223 [0,1,0,0,0,0|0,0,2]=3 8021 B13R0.336 CCCCCCCCNCCCC#N 2230a_100000229939_100000687738 [0,1,0,0,0,0|1,0,1]=3 8022 B13R0.336 CCCCCCCCNCCCC=O 2230a_100000229939_200011292268 [0,1,0,0,0,0|0,0,2]=3 8023 B13R0.336 CCCCCCCCNCCCCC 2230a_100000209983_100000210759 [0,1,0,0,0,0|1,0,0]=2 8024 B13R0.336 CCCCCCCCNCCCCC 2230a_100000229939_100000210326 [0,1,0,0,0,0|1,0,0]=2 8025 B13R0.336 CCCCCCCCNCCCCC 34a_100000229939_100000718602 [0,1,0,0,0,0|1,0,0]=2 8026 B13R0.336 CCCCCCCCNCCCCF 2230a_100000229939_100000729493 [0,1,0,0,0,0|1,0,0]=2 8027 B13R0.336 CCCCCCCCNCCCCF 34a_100000229939_100000729493 [0,1,0,0,0,0|1,0,0]=2 8028 B13R0.336 CCCCCCCCNCCCCO 2230a_100000229939_100000210776 [0,1,0,0,0,0|0,0,0]=1 8029 B13R0.336 CCCCCCCCNCCCCO 2230a_100000750430_100000210759 [0,1,0,0,0,0|0,0,0]=1 8030 B13R0.336 CCCCCCCCNCCCCO 34a_100000229939_100011216708 [0,1,0,0,0,0|0,0,0]=1 8031 B13R0.336 CCCCCCCCNCCCCO 34a_100000750430_100000210759 [0,1,0,0,0,0|0,0,0]=1 8032 B13R0.336 CCCCCCCCNCCCOC 2230a_100000229939_100000740836 [0,1,0,0,0,0|1,0,0]=2 8033 B13R0.336 CCCCCCCCNCCCOC 34a_100000229939_100000740836 [0,1,0,0,0,0|1,0,0]=2 8034 B13R0.336 CCCCCCCCNCCCOC 34a_100150723488_100000210759 [0,1,0,0,0,0|1,0,0]=2 8035 B13R0.336 CCCCCCCCNCCCSC 2230a_100000749238_100000210759 [0,1,0,0,0,0|1,1,0]=3 8036 B13R0.336 CCCCCCCCNCCOCC 2230a_100000229939_100011215890 [0,1,0,0,0,0|2,0,0]=3 8037 B13R0.336 CCCCCCCCNCCOCC 2230a_102516460346_100000210759 [0,1,0,0,0,0|2,0,0]=3 8038 B13R0.336 CCCCCCCCNCCOCC 34a_100000229939_100000210147 [0,1,0,0,0,0|2,0,0]=3 8039 B13R0.336 CCCCCCCCNCCOCC 34a_102516460346_100000210759 [0,1,0,0,0,0|2,0,0]=3 8040 B13R0.336 CCCCCCCCNCCSCC 2230a_100000106463_100000210759 [0,1,0,0,0,0|2,0,0]=3 8041 B13R0.336 CCCCCCCCNCCSCC 2230a_100000229939_100000757381 [0,1,0,0,0,0|2,0,0]=3 8042 B13R0.336 CCCCCCCCNCCSCC 34a_100000229939_100000757381 [0,1,0,0,0,0|2,0,0]=3 8043 B13R0.336 CCCCCCCCOCC#CCCl 34a_200000047223_100000210759 [0,1,0,0,0,0|1,0,2]=4 8044 B13R0.336 CCCCCCCCOCC#CCO 34a_100000210232_200000047223 [0,1,0,0,0,0|0,0,2]=3 8045 B13R0.336 CCCCCCCCOCC#CCO 7a_100000210232_200000047223 [0,1,0,0,0,0|0,0,2]=3 8046 B13R0.336 CCCCCCCCOCCCC#N 7a_100000210232_100000687738 [0,1,0,0,0,0|1,0,1]=3 8047 B13R0.336 CCCCCCCCOCCCC=O 7a_100000210232_200011292268 [0,1,0,0,0,0|0,0,2]=3 8048 B13R0.336 CCCCCCCCOCCCCBr 34a_100011216708_100000210759 [0,1,0,0,0,0|1,0,0]=2 8049 B13R0.336 CCCCCCCCOCCCCC 34a_100000210232_100000718602 [0,1,0,0,0,0|1,0,0]=2 8050 B13R0.336 CCCCCCCCOCCCCC 34a_100000210253_100000210759 [0,1,0,0,0,0|1,0,0]=2 8051 B13R0.336 CCCCCCCCOCCCCC 7a_100000210232_100000210326 [0,1,0,0,0,0|1,0,0]=2 8052 B13R0.336 CCCCCCCCOCCCCC 7a_100000210253_100000210759 [0,1,0,0,0,0|1,0,0]=2 8053 B13R0.336 CCCCCCCCOCCCCCl 34a_100000210776_100000210759 [0,1,0,0,0,0|1,0,0]=2 8054 B13R0.336 CCCCCCCCOCCCCCl 7a_100000210776_100000210759 [0,1,0,0,0,0|1,0,0]=2 8055 B13R0.336 CCCCCCCCOCCCCF 34a_100000210232_100000729493 [0,1,0,0,0,0|1,0,0]=2 8056 B13R0.336 CCCCCCCCOCCCCF 34a_100011995726_100000210759 [0,1,0,0,0,0|1,0,0]=2 8057 B13R0.336 CCCCCCCCOCCCCF 7a_100000210232_100000729493 [0,1,0,0,0,0|1,0,0]=2 8058 B13R0.336 CCCCCCCCOCCCCF 7a_100011995726_100000210759 [0,1,0,0,0,0|1,0,0]=2 8059 B13R0.336 CCCCCCCCOCCCCI 34a_200012148704_100000210759 [0,1,0,0,0,0|1,0,0]=2 8060 B13R0.336 CCCCCCCCOCCCCN 34a_100000750430_100000210759 [0,1,0,0,0,0|1,0,0]=2 8061 B13R0.336 CCCCCCCCOCCCCO 34a_100000210232_100011216708 [0,1,0,0,0,0|0,0,0]=1 8062 B13R0.336 CCCCCCCCOCCCCO 7a_100000210232_100000210776 [0,1,0,0,0,0|0,0,0]=1 8063 B13R0.336 CCCCCCCCOCCCNC 34a_100000213112_100000210759 [0,1,0,0,0,0|2,0,0]=3 8064 B13R0.336 CCCCCCCCOCCCOC 34a_100000210232_100000740836 [0,1,0,0,0,0|1,0,0]=2 8065 B13R0.336 CCCCCCCCOCCCOC 34a_100000740835_100000210759 [0,1,0,0,0,0|1,0,0]=2 8066 B13R0.336 CCCCCCCCOCCCOC 7a_100000210232_100000740836 [0,1,0,0,0,0|1,0,0]=2 8067 B13R0.336 CCCCCCCCOCCCSC 34a_100000690336_100000210759 [0,1,0,0,0,0|1,1,0]=3 8068 B13R0.336 CCCCCCCCOCCCSC 7a_100000690336_100000210759 [0,1,0,0,0,0|1,1,0]=3 8069 B13R0.336 CCCCCCCCOCCOCC 34a_100000210136_100000210759 [0,1,0,0,0,0|2,0,0]=3 8070 B13R0.336 CCCCCCCCOCCOCC 34a_100000210232_100000210147 [0,1,0,0,0,0|2,0,0]=3 8071 B13R0.336 CCCCCCCCOCCOCC 7a_100000210136_100000210759 [0,1,0,0,0,0|2,0,0]=3 8072 B13R0.336 CCCCCCCCOCCOCC 7a_100000210232_100011215890 [0,1,0,0,0,0|2,0,0]=3 8073 B13R0.336 CCCCCCCCOCCSCC 34a_100000210232_100000757381 [0,1,0,0,0,0|2,0,0]=3 8074 B13R0.336 CCCCCCCCOCCSCC 34a_100000212035_100000210759 [0,1,0,0,0,0|2,0,0]=3 8075 B13R0.336 CCCCCCCCOCCSCC 7a_100000210232_100000757381 [0,1,0,0,0,0|2,0,0]=3 8076 B13R0.336 CCCCCCCCOCCSCC 7a_100000212035_100000210759 [0,1,0,0,0,0|2,0,0]=3 8077 B13R0.336 CCCCCCCCSCC#CCO 62a_100000210759_200000047223 [0,1,0,0,0,0|0,0,2]=3 8078 B13R0.336 CCCCCCCCSCC#CCO 62a_200000047223_100000210317 [0,1,0,0,0,0|0,0,2]=3 8079 B13R0.336 CCCCCCCCSCCCC#N 62a_100000210759_100000687738 [0,1,0,0,0,0|1,0,1]=3 8080 B13R0.336 CCCCCCCCSCCCC#N 62a_100000687738_100000210317 [0,1,0,0,0,0|1,0,1]=3 8081 B13R0.336 CCCCCCCCSCCCC=O 62a_100000210759_200011292268 [0,1,0,0,0,0|0,0,2]=3 8082 B13R0.336 CCCCCCCCSCCCC=O 62a_200011292268_100000210317 [0,1,0,0,0,0|0,0,2]=3 8083 B13R0.336 CCCCCCCCSCCCCC 62a_100000210326_100000210317 [0,1,0,0,0,0|1,0,0]=2 8084 B13R0.336 CCCCCCCCSCCCCC 62a_100000210759_100000210326 [0,1,0,0,0,0|1,0,0]=2 8085 B13R0.336 CCCCCCCCSCCCCF 62a_100000210759_100000729493 [0,1,0,0,0,0|1,0,0]=2 8086 B13R0.336 CCCCCCCCSCCCCF 62a_100000729493_100000210317 [0,1,0,0,0,0|1,0,0]=2 8087 B13R0.336 CCCCCCCCSCCCCO 62a_100000210759_100000210776 [0,1,0,0,0,0|0,0,0]=1 8088 B13R0.336 CCCCCCCCSCCCCO 62a_100000210776_100000210317 [0,1,0,0,0,0|0,0,0]=1 8089 B13R0.336 CCCCCCCCSCCCOC 62a_100000210759_100000709357 [0,1,0,0,0,0|1,0,0]=2 8090 B13R0.336 CCCCCCCCSCCCOC 62a_100000709357_100000210317 [0,1,0,0,0,0|1,0,0]=2 8091 B13R0.336 CCCCCCCCSCCOCC 62a_100000210147_100000210317 [0,1,0,0,0,0|2,0,0]=3 8092 B13R0.336 CCCCCCCCSCCOCC 62a_100000210759_100011215890 [0,1,0,0,0,0|2,0,0]=3 8093 B13R0.336 CCCCCCCCSCCSC#N 62a_100000034367_100000210317 [0,1,0,0,0,0|2,0,1]=4 8094 B13R0.336 CCCCCCCCSCCSC#N 62a_100000210759_100000034367 [0,1,0,0,0,0|2,0,1]=4 8095 B13R0.336 CCCCCCCCSCCSCC 62a_100000210759_100000757381 [0,1,0,0,0,0|2,0,0]=3 8096 B13R0.336 CCCCCCCCSCCSCC 62a_100000757381_100000210317 [0,1,0,0,0,0|2,0,0]=3 8097 B13R0.336 CCCCCCCNCCCCC#N 2230a_100000229938_100000211819 [0,1,0,0,0,0|1,0,1]=3 8098 B13R0.336 CCCCCCCNCCCCC=O 2230a_100000229938_100000139335 [0,1,0,0,0,0|0,0,2]=3 8099 B13R0.336 CCCCCCCNCCCCCC 2230a_100000210581_100000210681 [0,1,0,0,0,0|1,0,0]=2 8100 B13R0.336 CCCCCCCNCCCCCC 2230a_100000229938_100000210314 [0,1,0,0,0,0|1,0,0]=2 8101 B13R0.336 CCCCCCCNCCCCCF 2230a_100000229938_100000729378 [0,1,0,0,0,0|1,0,0]=2 8102 B13R0.336 CCCCCCCNCCCCCO 2230a_100000229938_100000746330 [0,1,0,0,0,0|0,0,0]=1 8103 B13R0.336 CCCCCCCNCCCCCO 2230a_100000762737_100000210681 [0,1,0,0,0,0|0,0,0]=1 8104 B13R0.336 CCCCCCCNCCCCCO 34a_100000762737_100000210614 [0,1,0,0,0,0|0,0,0]=1 8105 B13R0.336 CCCCCCCNCCCCOC 2230a_100000229938_100000730899 [0,1,0,0,0,0|1,0,0]=2 8106 B13R0.336 CCCCCCCNCCCN=[N+]=[N-] 2230a_100000744732_100000210681 [0,1,0,0,0,0|3,0,0]=4 8107 B13R0.336 CCCCCCCNCCCOCC 2230a_100000210961_100000210681 [0,1,0,0,0,0|2,0,0]=3 8108 B13R0.336 CCCCCCCNCCCOCC 2230a_100000229938_100012232248 [0,1,0,0,0,0|2,0,0]=3 8109 B13R0.336 CCCCCCCNCCCOCC 34a_100000210961_100000210614 [0,1,0,0,0,0|2,0,0]=3 8110 B13R0.336 CCCCCCCNCCOCC#N 2230a_100000229938_200000047693 [0,1,0,0,0,0|2,0,1]=4 8111 B13R0.336 CCCCCCCNCCOCCC 2230a_100000229938_100011215938 [0,1,0,0,0,0|2,0,0]=3 8112 B13R0.336 CCCCCCCNCCOCCC 2230a_100161115042_100000210681 [0,1,0,0,0,0|2,0,0]=3 8113 B13R0.336 CCCCCCCNCCOCCC 34a_100161115042_100000210614 [0,1,0,0,0,0|2,0,0]=3 8114 B13R0.336 CCCCCCCNCCOCCO 2230a_100000211614_100000210681 [0,1,0,0,0,0|1,0,0]=2 8115 B13R0.336 CCCCCCCNCCOCCO 2230a_100000229938_100011215305 [0,1,0,0,0,0|1,0,0]=2 8116 B13R0.336 CCCCCCCNCCOCCO 34a_100000211614_100000210614 [0,1,0,0,0,0|1,0,0]=2 8117 B13R0.336 CCCCCCCNCCSCCC 2230a_100020603323_100000210681 [0,1,0,0,0,0|2,0,0]=3 8118 B13R0.336 CCCCCCCNCCSCCO 2230a_100011219999_100000210681 [0,1,0,0,0,0|1,0,0]=2 8119 B13R0.336 CCCCCCCNCOCCCC 2230a_100000229938_100011995733 [0,1,0,0,0,0|2,0,0]=3 8120 B13R0.336 CCCCCCCNCOCCOC 2230a_100000229938_100000231047 [0,1,0,0,0,0|2,0,0]=3 8121 B13R0.336 CCCCCCCOCCCCC#N 7a_100000210272_100000211819 [0,1,0,0,0,0|1,0,1]=3 8122 B13R0.336 CCCCCCCOCCCCC=O 7a_100000210272_100000139335 [0,1,0,0,0,0|0,0,2]=3 8123 B13R0.336 CCCCCCCOCCCCCBr 34a_100000746331_100000210614 [0,1,0,0,0,0|1,0,0]=2 8124 B13R0.336 CCCCCCCOCCCCCBr 7a_100000746331_100000210614 [0,1,0,0,0,0|1,0,0]=2 8125 B13R0.336 CCCCCCCOCCCCCC 34a_100000210259_100000210614 [0,1,0,0,0,0|1,0,0]=2 8126 B13R0.336 CCCCCCCOCCCCCC 34a_100000210272_100000210314 [0,1,0,0,0,0|1,0,0]=2 8127 B13R0.336 CCCCCCCOCCCCCC 7a_100000210259_100000210614 [0,1,0,0,0,0|1,0,0]=2 8128 B13R0.336 CCCCCCCOCCCCCC 7a_100000210272_100000210314 [0,1,0,0,0,0|1,0,0]=2 8129 B13R0.336 CCCCCCCOCCCCCCl 34a_100000746330_100000210614 [0,1,0,0,0,0|1,0,0]=2 8130 B13R0.336 CCCCCCCOCCCCCCl 7a_100000746330_100000210614 [0,1,0,0,0,0|1,0,0]=2 8131 B13R0.336 CCCCCCCOCCCCCF 34a_100000210272_100000729378 [0,1,0,0,0,0|1,0,0]=2 8132 B13R0.336 CCCCCCCOCCCCCF 7a_100000210272_100000729378 [0,1,0,0,0,0|1,0,0]=2 8133 B13R0.336 CCCCCCCOCCCCCI 34a_200012148887_100000210614 [0,1,0,0,0,0|1,0,0]=2 8134 B13R0.336 CCCCCCCOCCCCCI 7a_200012148887_100000210614 [0,1,0,0,0,0|1,0,0]=2 8135 B13R0.336 CCCCCCCOCCCCCN 34a_100000762737_100000210614 [0,1,0,0,0,0|1,0,0]=2 8136 B13R0.336 CCCCCCCOCCCCCO 34a_100000210272_100000746330 [0,1,0,0,0,0|0,0,0]=1 8137 B13R0.336 CCCCCCCOCCCCCO 7a_100000210272_100000746330 [0,1,0,0,0,0|0,0,0]=1 8138 B13R0.336 CCCCCCCOCCCCOC 34a_100000210272_100000755781 [0,1,0,0,0,0|1,0,0]=2 8139 B13R0.336 CCCCCCCOCCCCOC 34a_100000740925_100000210614 [0,1,0,0,0,0|1,0,0]=2 8140 B13R0.336 CCCCCCCOCCCCOC 7a_100000210272_100000730899 [0,1,0,0,0,0|1,0,0]=2 8141 B13R0.336 CCCCCCCOCCCCSC 34a_100011217163_100000210614 [0,1,0,0,0,0|1,1,0]=3 8142 B13R0.336 CCCCCCCOCCCCSC 7a_100011217163_100000210614 [0,1,0,0,0,0|1,1,0]=3 8143 B13R0.336 CCCCCCCOCCCOCC 34a_100000210272_100012232248 [0,1,0,0,0,0|2,0,0]=3 8144 B13R0.336 CCCCCCCOCCCOCC 34a_100000757476_100000210614 [0,1,0,0,0,0|2,0,0]=3 8145 B13R0.336 CCCCCCCOCCCOCC 7a_100000210272_100012232248 [0,1,0,0,0,0|2,0,0]=3 8146 B13R0.336 CCCCCCCOCCCOCC 7a_100000757476_100000210614 [0,1,0,0,0,0|2,0,0]=3 8147 B13R0.336 CCCCCCCOCCCSCC 34a_100011216438_100000210614 [0,1,0,0,0,0|2,0,0]=3 8148 B13R0.336 CCCCCCCOCCCSCC 7a_100011216438_100000210614 [0,1,0,0,0,0|2,0,0]=3 8149 B13R0.336 CCCCCCCOCCOCC#N 7a_100000210272_200000047693 [0,1,0,0,0,0|2,0,1]=4 8150 B13R0.336 CCCCCCCOCCOCCBr 34a_100000692535_100000210614 [0,1,0,0,0,0|2,0,0]=3 8151 B13R0.336 CCCCCCCOCCOCCBr 7a_100000692535_100000210614 [0,1,0,0,0,0|2,0,0]=3 8152 B13R0.336 CCCCCCCOCCOCCC 34a_100000210272_100011215938 [0,1,0,0,0,0|2,0,0]=3 8153 B13R0.336 CCCCCCCOCCOCCC 34a_100000752267_100000210614 [0,1,0,0,0,0|2,0,0]=3 8154 B13R0.336 CCCCCCCOCCOCCC 7a_100000210272_100011215938 [0,1,0,0,0,0|2,0,0]=3 8155 B13R0.336 CCCCCCCOCCOCCC 7a_100000752267_100000210614 [0,1,0,0,0,0|2,0,0]=3 8156 B13R0.336 CCCCCCCOCCOCCCl 34a_100011215305_100000210614 [0,1,0,0,0,0|2,0,0]=3 8157 B13R0.336 CCCCCCCOCCOCCCl 7a_100011215305_100000210614 [0,1,0,0,0,0|2,0,0]=3 8158 B13R0.336 CCCCCCCOCCOCCF 34a_200015357709_100000210614 [0,1,0,0,0,0|2,0,0]=3 8159 B13R0.336 CCCCCCCOCCOCCF 7a_200015357709_100000210614 [0,1,0,0,0,0|2,0,0]=3 8160 B13R0.336 CCCCCCCOCCOCCI 34a_100012149058_100000210614 [0,1,0,0,0,0|2,0,0]=3 8161 B13R0.336 CCCCCCCOCCOCCI 7a_100012149058_100000210614 [0,1,0,0,0,0|2,0,0]=3 8162 B13R0.336 CCCCCCCOCCOCCN 34a_100000211614_100000210614 [0,1,0,0,0,0|2,0,0]=3 8163 B13R0.336 CCCCCCCOCCOCCO 34a_100000210272_100000692535 [0,1,0,0,0,0|1,0,0]=2 8164 B13R0.336 CCCCCCCOCCOCCO 7a_100000210272_100011215305 [0,1,0,0,0,0|1,0,0]=2 8165 B13R0.336 CCCCCCCOCCSCCC 34a_200000230433_100000210614 [0,1,0,0,0,0|2,0,0]=3 8166 B13R0.336 CCCCCCCOCCSCCC 7a_200000230433_100000210614 [0,1,0,0,0,0|2,0,0]=3 8167 B13R0.336 CCCCCCCOCOCCCC 34a_100000210272_100011995733 [0,1,0,0,0,0|2,0,0]=3 8168 B13R0.336 CCCCCCCSCCCCC#N 62a_100000210614_100000211819 [0,1,0,0,0,0|1,0,1]=3 8169 B13R0.336 CCCCCCCSCCCCC#N 62a_100011219923_100000210316 [0,1,0,0,0,0|1,0,1]=3 8170 B13R0.336 CCCCCCCSCCCCC=O 62a_100000139335_100000210316 [0,1,0,0,0,0|0,0,2]=3 8171 B13R0.336 CCCCCCCSCCCCC=O 62a_100000210614_100000139335 [0,1,0,0,0,0|0,0,2]=3 8172 B13R0.336 CCCCCCCSCCCCCC 62a_100000210314_100000210316 [0,1,0,0,0,0|1,0,0]=2 8173 B13R0.336 CCCCCCCSCCCCCC 62a_100000210614_100000210757 [0,1,0,0,0,0|1,0,0]=2 8174 B13R0.336 CCCCCCCSCCCCCF 62a_100000210614_100000729378 [0,1,0,0,0,0|1,0,0]=2 8175 B13R0.336 CCCCCCCSCCCCCF 62a_100000729378_100000210316 [0,1,0,0,0,0|1,0,0]=2 8176 B13R0.336 CCCCCCCSCCCCCO 62a_100000210614_100000746330 [0,1,0,0,0,0|0,0,0]=1 8177 B13R0.336 CCCCCCCSCCCCCO 62a_100000746330_100000210316 [0,1,0,0,0,0|0,0,0]=1 8178 B13R0.336 CCCCCCCSCCCCOC 62a_100000210614_100000730899 [0,1,0,0,0,0|1,0,0]=2 8179 B13R0.336 CCCCCCCSCCCCOC 62a_100000730899_100000210316 [0,1,0,0,0,0|1,0,0]=2 8180 B13R0.336 CCCCCCCSCCCOCC 62a_100000210614_100012232248 [0,1,0,0,0,0|2,0,0]=3 8181 B13R0.336 CCCCCCCSCCCOCC 62a_100012232248_100000210316 [0,1,0,0,0,0|2,0,0]=3 8182 B13R0.336 CCCCCCCSCCOCC#N 62a_100000210614_200000047693 [0,1,0,0,0,0|2,0,1]=4 8183 B13R0.336 CCCCCCCSCCOCC#N 62a_200000047693_100000210316 [0,1,0,0,0,0|2,0,1]=4 8184 B13R0.336 CCCCCCCSCCOCCC 62a_100000210614_100011215938 [0,1,0,0,0,0|2,0,0]=3 8185 B13R0.336 CCCCCCCSCCOCCC 62a_100011215938_100000210316 [0,1,0,0,0,0|2,0,0]=3 8186 B13R0.336 CCCCCCCSCCOCCO 62a_100000210614_100011215305 [0,1,0,0,0,0|1,0,0]=2 8187 B13R0.336 CCCCCCCSCCOCCO 62a_100011215305_100000210316 [0,1,0,0,0,0|1,0,0]=2 8188 B13R0.336 CCCCCCCSCOCCCC 62a_100000210614_100011995733 [0,1,0,0,0,0|2,0,0]=3 8189 B13R0.336 CCCCCCCSCOCCCC 62a_100011995733_100000210316 [0,1,0,0,0,0|2,0,0]=3 8190 B13R0.336 CCCCCCCSCOCCOC 62a_100000210614_100000231047 [0,1,0,0,0,0|2,0,0]=3 8191 B13R0.336 CCCCCCCSCOCCOC 62a_100000231047_100000210316 [0,1,0,0,0,0|2,0,0]=3 8192 B13R0.336 CCCCCCNCCCCCC#N 2230a_100000210581_100009813376 [0,1,0,0,0,0|1,0,1]=3 8193 B13R0.336 CCCCCCNCCCCCC=O 2230a_100000210581_100000139337 [0,1,0,0,0,0|0,0,2]=3 8194 B13R0.336 CCCCCCNCCCCCCF 2230a_100000210581_100015922095 [0,1,0,0,0,0|1,0,0]=2 8195 B13R0.336 CCCCCCNCCCCCCO 2230a_100000210581_100000766143 [0,1,0,0,0,0|0,0,0]=1 8196 B13R0.336 CCCCCCNCCCCCCO 2230a_100000686447_100000210314 [0,1,0,0,0,0|0,0,0]=1 8197 B13R0.336 CCCCCCNCCCCCCO 34a_100000686447_100000210314 [0,1,0,0,0,0|0,0,0]=1 8198 B13R0.336 CCCCCCNCCCCCOC 2230a_100000747528_100000210314 [0,1,0,0,0,0|1,0,0]=2 8199 B13R0.336 CCCCCCNCCCCCOC 34a_100000747528_100000210314 [0,1,0,0,0,0|1,0,0]=2 8200 B13R0.336 CCCCCCNCCCCN=[N+]=[N-] 2230a_100000101370_100000210314 [0,1,0,0,0,0|3,0,0]=4 8201 B13R0.336 CCCCCCNCCCOCCC 2230a_100011217757_100000210314 [0,1,0,0,0,0|2,0,0]=3 8202 B13R0.336 CCCCCCNCCCOCCC 34a_100011217757_100000210314 [0,1,0,0,0,0|2,0,0]=3 8203 B13R0.336 CCCCCCNCCOCCCC 2230a_100000210581_100000743108 [0,1,0,0,0,0|2,0,0]=3 8204 B13R0.336 CCCCCCNCCOCCOC 2230a_100000210581_100000695917 [0,1,0,0,0,0|2,0,0]=3 8205 B13R0.336 CCCCCCNCCOCCOC 2230a_100000745349_100000210314 [0,1,0,0,0,0|2,0,0]=3 8206 B13R0.336 CCCCCCNCCOCCOC 34a_100000745349_100000210314 [0,1,0,0,0,0|2,0,0]=3 8207 B13R0.336 CCCCCCNCCSCCCC 2230a_100025743550_100000210314 [0,1,0,0,0,0|2,0,0]=3 8208 B13R0.336 CCCCCCOCCCCCC#N 7a_100000210259_100009813376 [0,1,0,0,0,0|1,0,1]=3 8209 B13R0.336 CCCCCCOCCCCCC=O 7a_100000210259_100000139337 [0,1,0,0,0,0|0,0,2]=3 8210 B13R0.336 CCCCCCOCCCCCCBr 34a_100011215345_100000210314 [0,1,0,0,0,0|1,0,0]=2 8211 B13R0.336 CCCCCCOCCCCCCBr 7a_100011215345_100000210314 [0,1,0,0,0,0|1,0,0]=2 8212 B13R0.336 CCCCCCOCCCCCCCl 34a_100000766143_100000210314 [0,1,0,0,0,0|1,0,0]=2 8213 B13R0.336 CCCCCCOCCCCCCCl 7a_100000766143_100000210314 [0,1,0,0,0,0|1,0,0]=2 8214 B13R0.336 CCCCCCOCCCCCCF 34a_100000210259_100015922095 [0,1,0,0,0,0|1,0,0]=2 8215 B13R0.336 CCCCCCOCCCCCCF 34a_100000732779_100000210314 [0,1,0,0,0,0|1,0,0]=2 8216 B13R0.336 CCCCCCOCCCCCCF 7a_100000210259_100015922095 [0,1,0,0,0,0|1,0,0]=2 8217 B13R0.336 CCCCCCOCCCCCCF 7a_100000732779_100000210314 [0,1,0,0,0,0|1,0,0]=2 8218 B13R0.336 CCCCCCOCCCCCCN 34a_100000686447_100000210314 [0,1,0,0,0,0|1,0,0]=2 8219 B13R0.336 CCCCCCOCCCCCCO 34a_100000210259_100000766143 [0,1,0,0,0,0|0,0,0]=1 8220 B13R0.336 CCCCCCOCCCCCCO 7a_100000210259_100000766143 [0,1,0,0,0,0|0,0,0]=1 8221 B13R0.336 CCCCCCOCCCCCNC 34a_100000722520_100000210314 [0,1,0,0,0,0|2,0,0]=3 8222 B13R0.336 CCCCCCOCCOCCC#N 7a_100000691444_100000184422 [0,1,0,0,0,0|2,0,1]=4 8223 B13R0.336 CCCCCCOCCOCCCC 34a_100000210238_100000210314 [0,1,0,0,0,0|2,0,0]=3 8224 B13R0.336 CCCCCCOCCOCCCC 34a_100000210259_100000743108 [0,1,0,0,0,0|2,0,0]=3 8225 B13R0.336 CCCCCCOCCOCCCC 34a_100000691444_100000210210 [0,1,0,0,0,0|2,0,0]=3 8226 B13R0.336 CCCCCCOCCOCCCC 7a_100000210238_100000210314 [0,1,0,0,0,0|2,0,0]=3 8227 B13R0.336 CCCCCCOCCOCCCC 7a_100000210259_100000743108 [0,1,0,0,0,0|2,0,0]=3 8228 B13R0.336 CCCCCCOCCOCCCC 7a_100000691444_100000210211 [0,1,0,0,0,0|2,0,0]=3 8229 B13R0.336 CCCCCCOCCOCCCF 34a_100000691444_100011934791 [0,1,0,0,0,0|2,0,0]=3 8230 B13R0.336 CCCCCCOCCOCCCF 7a_100000691444_100011934791 [0,1,0,0,0,0|2,0,0]=3 8231 B13R0.336 CCCCCCOCCOCCCO 34a_100000691444_100000230001 [0,1,0,0,0,0|1,0,0]=2 8232 B13R0.336 CCCCCCOCCOCCCO 7a_100000691444_100011215043 [0,1,0,0,0,0|1,0,0]=2 8233 B13R0.336 CCCCCCOCCOCCNC 34a_100000228057_100000210314 [0,1,0,0,0,0|3,0,0]=4 8234 B13R0.336 CCCCCCOCCOCCOC 34a_100000032842_200000210301 [0,1,0,0,0,0|2,0,0]=3 8235 B13R0.336 CCCCCCOCCOCCOC 34a_100000210259_100000695917 [0,1,0,0,0,0|2,0,0]=3 8236 B13R0.336 CCCCCCOCCOCCOC 34a_100000691444_100011201679 [0,1,0,0,0,0|2,0,0]=3 8237 B13R0.336 CCCCCCOCCOCCOC 34a_100011215163_100000210314 [0,1,0,0,0,0|2,0,0]=3 8238 B13R0.336 CCCCCCOCCOCCOC 7a_100000032842_200000210301 [0,1,0,0,0,0|2,0,0]=3 8239 B13R0.336 CCCCCCOCCOCCOC 7a_100000210259_100000695917 [0,1,0,0,0,0|2,0,0]=3 8240 B13R0.336 CCCCCCOCCOCCOC 7a_100000691444_100000233755 [0,1,0,0,0,0|2,0,0]=3 8241 B13R0.336 CCCCCCOCCOCCOC 7a_100011215163_100000210314 [0,1,0,0,0,0|2,0,0]=3 8242 B13R0.336 CCCCCCOCCOCCO[13CH3] 34a_100000032842_200025704644 [0,1,0,0,0,0|2,0,0]=3 8243 B13R0.336 CCCCCCOCCOCCO[13CH3] 7a_100000032842_200025704644 [0,1,0,0,0,0|2,0,0]=3 8244 B13R0.336 CCCCCCOCCOCCSC 34a_100000691444_100000212216 [0,1,0,0,0,0|2,1,0]=4 8245 B13R0.336 CCCCCCOCCOCCSC 7a_100000691444_100000212216 [0,1,0,0,0,0|2,1,0]=4 8246 B13R0.336 CCCCCCOCCSCCCC 34a_200000230436_100000210314 [0,1,0,0,0,0|2,0,0]=3 8247 B13R0.336 CCCCCCOCCSCCCC 7a_200000230436_100000210314 [0,1,0,0,0,0|2,0,0]=3 8248 B13R0.336 CCCCCCSCCCCCC#N 62a_100000210314_100009813376 [0,1,0,0,0,0|1,0,1]=3 8249 B13R0.336 CCCCCCSCCCCCC#N 62a_100009813376_100000210757 [0,1,0,0,0,0|1,0,1]=3 8250 B13R0.336 CCCCCCSCCCCCC=O 62a_100000139337_100000210757 [0,1,0,0,0,0|0,0,2]=3 8251 B13R0.336 CCCCCCSCCCCCC=O 62a_100000210314_100000139337 [0,1,0,0,0,0|0,0,2]=3 8252 B13R0.336 CCCCCCSCCCCCCF 62a_100000210314_100015922095 [0,1,0,0,0,0|1,0,0]=2 8253 B13R0.336 CCCCCCSCCCCCCF 62a_100015922095_100000210757 [0,1,0,0,0,0|1,0,0]=2 8254 B13R0.336 CCCCCCSCCCCCCO 62a_100000210314_100000766143 [0,1,0,0,0,0|0,0,0]=1 8255 B13R0.336 CCCCCCSCCCCCCO 62a_100000766143_100000210757 [0,1,0,0,0,0|0,0,0]=1 8256 B13R0.336 CCCCCCSCCOCCCC 62a_100000210314_100000743108 [0,1,0,0,0,0|2,0,0]=3 8257 B13R0.336 CCCCCCSCCOCCCC 62a_100000743108_100000210757 [0,1,0,0,0,0|2,0,0]=3 8258 B13R0.336 CCCCCCSCCOCCOC 62a_100000210314_100000695917 [0,1,0,0,0,0|2,0,0]=3 8259 B13R0.336 CCCCCCSCCOCCOC 62a_100000695917_100000210757 [0,1,0,0,0,0|2,0,0]=3 8260 B13R0.336 CCCCCNCCCCCCC#N 2230a_100000209983_100009813337 [0,1,0,0,0,0|1,0,1]=3 8261 B13R0.336 CCCCCNCCCCCCCO 2230a_100000209983_100000760002 [0,1,0,0,0,0|0,0,0]=1 8262 B13R0.336 CCCCCNCCCCCCCO 2230a_100011996573_100000210326 [0,1,0,0,0,0|0,0,0]=1 8263 B13R0.336 CCCCCNCCCCCCCO 34a_100011996573_100000718602 [0,1,0,0,0,0|0,0,0]=1 8264 B13R0.336 CCCCCNCCCCCCOC 2230a_100000209983_100011998445 [0,1,0,0,0,0|1,0,0]=2 8265 B13R0.336 CCCCCNCCCOCCCC 2230a_200000211371_100000210326 [0,1,0,0,0,0|2,0,0]=3 8266 B13R0.336 CCCCCNCCCOCCCC 34a_200000211371_100000718602 [0,1,0,0,0,0|2,0,0]=3 8267 B13R0.336 CCCCCNCCCOCCCO 2230a_100011310245_100000210326 [0,1,0,0,0,0|1,0,0]=2 8268 B13R0.336 CCCCCNCCCOCCCO 34a_100011310245_100000718602 [0,1,0,0,0,0|1,0,0]=2 8269 B13R0.336 CCCCCNCCCOCCOC 2230a_100000206027_100000210326 [0,1,0,0,0,0|2,0,0]=3 8270 B13R0.336 CCCCCNCCCOCCOC 2230a_100000209983_100011216529 [0,1,0,0,0,0|2,0,0]=3 8271 B13R0.336 CCCCCNCCCOCCOC 34a_100000206027_100000718602 [0,1,0,0,0,0|2,0,0]=3 8272 B13R0.336 CCCCCNCCOCC#CCO 34a_100000224656_200000047223 [0,1,0,0,0,0|1,0,2]=4 8273 B13R0.336 CCCCCNCCOCCCCC 34a_100000224656_100000718602 [0,1,0,0,0,0|2,0,0]=3 8274 B13R0.336 CCCCCNCCOCCCCF 34a_100000224656_100000729493 [0,1,0,0,0,0|2,0,0]=3 8275 B13R0.336 CCCCCNCCOCCCCO 34a_100000224656_100011216708 [0,1,0,0,0,0|1,0,0]=2 8276 B13R0.336 CCCCCNCCOCCCOC 34a_100000224656_100000740836 [0,1,0,0,0,0|2,0,0]=3 8277 B13R0.336 CCCCCNCCOCCOCC 2230a_100000209983_100011211534 [0,1,0,0,0,0|3,0,0]=4 8278 B13R0.336 CCCCCNCCOCCOCC 2230a_100102712874_100000210326 [0,1,0,0,0,0|3,0,0]=4 8279 B13R0.336 CCCCCNCCOCCOCC 34a_100000224656_100000210147 [0,1,0,0,0,0|3,0,0]=4 8280 B13R0.336 CCCCCNCCOCCOCC 34a_100102712874_100000718602 [0,1,0,0,0,0|3,0,0]=4 8281 B13R0.336 CCCCCNCCOCCSCC 34a_100000224656_100000757381 [0,1,0,0,0,0|3,0,0]=4 8282 B13R0.336 CCCCCOCCCCCCC#N 7a_100000210253_100009813337 [0,1,0,0,0,0|1,0,1]=3 8283 B13R0.336 CCCCCOCCCCCCCBr 34a_100000760002_100000718602 [0,1,0,0,0,0|1,0,0]=2 8284 B13R0.336 CCCCCOCCCCCCCBr 7a_100000760002_100000210326 [0,1,0,0,0,0|1,0,0]=2 8285 B13R0.336 CCCCCOCCCCCCCN 34a_100011996573_100000718602 [0,1,0,0,0,0|1,0,0]=2 8286 B13R0.336 CCCCCOCCCCCCCO 34a_100000210253_100000760002 [0,1,0,0,0,0|0,0,0]=1 8287 B13R0.336 CCCCCOCCCCCCCO 7a_100000210253_100000760002 [0,1,0,0,0,0|0,0,0]=1 8288 B13R0.336 CCCCCOCCCCCCOC 34a_100000210253_100011998445 [0,1,0,0,0,0|1,0,0]=2 8289 B13R0.336 CCCCCOCCCCCCOC 34a_200012092642_100000718602 [0,1,0,0,0,0|1,0,0]=2 8290 B13R0.336 CCCCCOCCCCCCOC 7a_100000210253_100011998445 [0,1,0,0,0,0|1,0,0]=2 8291 B13R0.336 CCCCCOCCCCCCOC 7a_200012092642_100000210326 [0,1,0,0,0,0|1,0,0]=2 8292 B13R0.336 CCCCCOCCCOCCCC 34a_200011215613_100000718602 [0,1,0,0,0,0|2,0,0]=3 8293 B13R0.336 CCCCCOCCCOCCCC 7a_200011215613_100000210326 [0,1,0,0,0,0|2,0,0]=3 8294 B13R0.336 CCCCCOCCCOCCCN 34a_100011310245_100000718602 [0,1,0,0,0,0|2,0,0]=3 8295 B13R0.336 CCCCCOCCCOCCOC 34a_100000210253_100011216529 [0,1,0,0,0,0|2,0,0]=3 8296 B13R0.336 CCCCCOCCCOCCOC 7a_100000210253_100011216529 [0,1,0,0,0,0|2,0,0]=3 8297 B13R0.336 CCCCCOCCOCC#CCO 34a_100011215259_200000047223 [0,1,0,0,0,0|1,0,2]=4 8298 B13R0.336 CCCCCOCCOCC#CCO 7a_100011215259_200000047223 [0,1,0,0,0,0|1,0,2]=4 8299 B13R0.336 CCCCCOCCOCCCC#N 7a_100011215259_100000687738 [0,1,0,0,0,0|2,0,1]=4 8300 B13R0.336 CCCCCOCCOCCCC=O 7a_100011215259_200011292268 [0,1,0,0,0,0|1,0,2]=4 8301 B13R0.336 CCCCCOCCOCCCCC 34a_100011215259_100000718602 [0,1,0,0,0,0|2,0,0]=3 8302 B13R0.336 CCCCCOCCOCCCCC 7a_100011215259_100000210326 [0,1,0,0,0,0|2,0,0]=3 8303 B13R0.336 CCCCCOCCOCCCCF 34a_100011215259_100000729493 [0,1,0,0,0,0|2,0,0]=3 8304 B13R0.336 CCCCCOCCOCCCCF 7a_100011215259_100000729493 [0,1,0,0,0,0|2,0,0]=3 8305 B13R0.336 CCCCCOCCOCCCCO 34a_100011215259_100011216708 [0,1,0,0,0,0|1,0,0]=2 8306 B13R0.336 CCCCCOCCOCCCCO 7a_100011215259_100000210776 [0,1,0,0,0,0|1,0,0]=2 8307 B13R0.336 CCCCCOCCOCCCOC 34a_100011215259_100000740836 [0,1,0,0,0,0|2,0,0]=3 8308 B13R0.336 CCCCCOCCOCCCOC 7a_100011215259_100000740836 [0,1,0,0,0,0|2,0,0]=3 8309 B13R0.336 CCCCCOCCOCCOCC 34a_100000210240_100000718602 [0,1,0,0,0,0|3,0,0]=4 8310 B13R0.336 CCCCCOCCOCCOCC 34a_100000210253_100011211534 [0,1,0,0,0,0|3,0,0]=4 8311 B13R0.336 CCCCCOCCOCCOCC 34a_100011215259_100000210147 [0,1,0,0,0,0|3,0,0]=4 8312 B13R0.336 CCCCCOCCOCCOCC 7a_100000210240_100000210326 [0,1,0,0,0,0|3,0,0]=4 8313 B13R0.336 CCCCCOCCOCCOCC 7a_100000210253_100011211534 [0,1,0,0,0,0|3,0,0]=4 8314 B13R0.336 CCCCCOCCOCCOCC 7a_100011215259_100011215890 [0,1,0,0,0,0|3,0,0]=4 8315 B13R0.336 CCCCCOCCOCCSCC 34a_100011215259_100000757381 [0,1,0,0,0,0|3,0,0]=4 8316 B13R0.336 CCCCCOCCOCCSCC 7a_100011215259_100000757381 [0,1,0,0,0,0|3,0,0]=4 8317 B13R0.336 CCCCCSCCCCCCC#N 62a_100000210326_100009813337 [0,1,0,0,0,0|1,0,1]=3 8318 B13R0.336 CCCCCSCCCCCCC#N 62a_100009813337_100000210326 [0,1,0,0,0,0|1,0,1]=3 8319 B13R0.336 CCCCCSCCCCCCCO 62a_100000210326_100000760002 [0,1,0,0,0,0|0,0,0]=1 8320 B13R0.336 CCCCCSCCCCCCCO 62a_100000760002_100000210326 [0,1,0,0,0,0|0,0,0]=1 8321 B13R0.336 CCCCCSCCCCCCOC 62a_100000210326_100011998445 [0,1,0,0,0,0|1,0,0]=2 8322 B13R0.336 CCCCCSCCCCCCOC 62a_100011998445_100000210326 [0,1,0,0,0,0|1,0,0]=2 8323 B13R0.336 CCCCCSCCCOCCOC 62a_100000210326_100011216529 [0,1,0,0,0,0|2,0,0]=3 8324 B13R0.336 CCCCCSCCCOCCOC 62a_100011216529_100000210326 [0,1,0,0,0,0|2,0,0]=3 8325 B13R0.336 CCCCCSCCOCCOCC 62a_100000210326_100011211534 [0,1,0,0,0,0|3,0,0]=4 8326 B13R0.336 CCCCCSCCOCCOCC 62a_100011211534_100000210326 [0,1,0,0,0,0|3,0,0]=4 8327 B13R0.336 CCCCNCCCCCCCCO 2230a_100000102301_100000033203 [0,1,0,0,0,0|0,0,0]=1 8328 B13R0.336 CCCCNCCCCCCCCO 2230a_102515433106_100000210211 [0,1,0,0,0,0|0,0,0]=1 8329 B13R0.336 CCCCNCCCCCCCCO 34a_102515433106_100000210210 [0,1,0,0,0,0|0,0,0]=1 8330 B13R0.336 CCCCNCCCCCCCCO 7a_106832991798_100000033203 [0,1,0,0,0,0|0,0,0]=1 8331 B13R0.336 CCCCNCCCCCCN=[N+]=[N-] 2230a_200000049180_100000210211 [0,1,0,0,0,0|3,0,0]=4 8332 B13R0.336 CCCCNCCCCOCCCC 34a_200011216965_100000210210 [0,1,0,0,0,0|2,0,0]=3 8333 B13R0.336 CCCCNCCCCOCCCF 34a_200011216965_100011934791 [0,1,0,0,0,0|2,0,0]=3 8334 B13R0.336 CCCCNCCCCOCCCO 34a_200011216965_100000230001 [0,1,0,0,0,0|1,0,0]=2 8335 B13R0.336 CCCCNCCCCOCCOC 34a_200011216965_100011201679 [0,1,0,0,0,0|2,0,0]=3 8336 B13R0.336 CCCCNCCCCOCCSC 34a_200011216965_100000212216 [0,1,0,0,0,0|2,1,0]=4 8337 B13R0.336 CCCCNCCOCCOCCC 2230a_200011904461_100000210211 [0,1,0,0,0,0|3,0,0]=4 8338 B13R0.336 CCCCNCCOCCOCCC 34a_200011904461_100000210210 [0,1,0,0,0,0|3,0,0]=4 8339 B13R0.336 CCCCNCCOCCOCCO 2230a_100000102301_100000032323 [0,1,0,0,0,0|2,0,0]=3 8340 B13R0.336 CCCCNCCOCCOCCO 2230a_100011998139_100000210211 [0,1,0,0,0,0|2,0,0]=3 8341 B13R0.336 CCCCNCCOCCOCCO 34a_100011998139_100000210210 [0,1,0,0,0,0|2,0,0]=3 8342 B13R0.336 CCCCNCCOCCOCCO 7a_106832991798_100000032323 [0,1,0,0,0,0|2,0,0]=3 8343 B13R0.336 CCCCOCCCCCCCCBr 34a_100009813846_100000210210 [0,1,0,0,0,0|1,0,0]=2 8344 B13R0.336 CCCCOCCCCCCCCBr 7a_100009813846_100000210211 [0,1,0,0,0,0|1,0,0]=2 8345 B13R0.336 CCCCOCCCCCCCCCl 34a_100000033203_100000210210 [0,1,0,0,0,0|1,0,0]=2 8346 B13R0.336 CCCCOCCCCCCCCCl 7a_100000033203_100000210211 [0,1,0,0,0,0|1,0,0]=2 8347 B13R0.336 CCCCOCCCCCCCCN 34a_102515433106_100000210210 [0,1,0,0,0,0|1,0,0]=2 8348 B13R0.336 CCCCOCCCCCCCCO 34a_100000210227_100000033203 [0,1,0,0,0,0|0,0,0]=1 8349 B13R0.336 CCCCOCCCCCCCCO 7a_100000210227_100000033203 [0,1,0,0,0,0|0,0,0]=1 8350 B13R0.336 CCCCOCCCCCNCCN 34a_103619048469_100000210210 [0,1,0,0,0,0|2,0,0]=3 8351 B13R0.336 CCCCOCCCCOCCC#N 7a_200000760531_100000184422 [0,1,0,0,0,0|2,0,1]=4 8352 B13R0.336 CCCCOCCCCOCCCC 34a_200000760531_100000210210 [0,1,0,0,0,0|2,0,0]=3 8353 B13R0.336 CCCCOCCCCOCCCC 7a_200000760531_100000210211 [0,1,0,0,0,0|2,0,0]=3 8354 B13R0.336 CCCCOCCCCOCCCF 34a_200000760531_100011934791 [0,1,0,0,0,0|2,0,0]=3 8355 B13R0.336 CCCCOCCCCOCCCF 7a_200000760531_100011934791 [0,1,0,0,0,0|2,0,0]=3 8356 B13R0.336 CCCCOCCCCOCCCO 34a_200000760531_100000230001 [0,1,0,0,0,0|1,0,0]=2 8357 B13R0.336 CCCCOCCCCOCCCO 7a_200000760531_100011215043 [0,1,0,0,0,0|1,0,0]=2 8358 B13R0.336 CCCCOCCCCOCCOC 34a_200000760531_100011201679 [0,1,0,0,0,0|2,0,0]=3 8359 B13R0.336 CCCCOCCCCOCCOC 7a_200000760531_100000233755 [0,1,0,0,0,0|2,0,0]=3 8360 B13R0.336 CCCCOCCCCOCCSC 34a_200000760531_100000212216 [0,1,0,0,0,0|2,1,0]=4 8361 B13R0.336 CCCCOCCCCOCCSC 7a_200000760531_100000212216 [0,1,0,0,0,0|2,1,0]=4 8362 B13R0.336 CCCCOCCCNCC#CCO 2230a_200000211371_200000047223 [0,1,0,0,0,0|1,0,2]=4 8363 B13R0.336 CCCCOCCCNCC#CCO 34a_200000211371_200000047223 [0,1,0,0,0,0|1,0,2]=4 8364 B13R0.336 CCCCOCCCNCCCC#N 2230a_200000211371_100000687738 [0,1,0,0,0,0|2,0,1]=4 8365 B13R0.336 CCCCOCCCNCCCC=O 2230a_200000211371_200011292268 [0,1,0,0,0,0|1,0,2]=4 8366 B13R0.336 CCCCOCCCNCCCCF 2230a_200000211371_100000729493 [0,1,0,0,0,0|2,0,0]=3 8367 B13R0.336 CCCCOCCCNCCCCF 34a_200000211371_100000729493 [0,1,0,0,0,0|2,0,0]=3 8368 B13R0.336 CCCCOCCCNCCCCO 2230a_200000211371_100000210776 [0,1,0,0,0,0|1,0,0]=2 8369 B13R0.336 CCCCOCCCNCCCCO 34a_200000211371_100011216708 [0,1,0,0,0,0|1,0,0]=2 8370 B13R0.336 CCCCOCCCNCCCOC 2230a_200000211371_100000740836 [0,1,0,0,0,0|2,0,0]=3 8371 B13R0.336 CCCCOCCCNCCCOC 34a_200000211371_100000740836 [0,1,0,0,0,0|2,0,0]=3 8372 B13R0.336 CCCCOCCCNCCOCC 2230a_200000211371_100011215890 [0,1,0,0,0,0|3,0,0]=4 8373 B13R0.336 CCCCOCCCNCCOCC 34a_200000211371_100000210147 [0,1,0,0,0,0|3,0,0]=4 8374 B13R0.336 CCCCOCCCNCCSCC 2230a_200000211371_100000757381 [0,1,0,0,0,0|3,0,0]=4 8375 B13R0.336 CCCCOCCCNCCSCC 34a_200000211371_100000757381 [0,1,0,0,0,0|3,0,0]=4 8376 B13R0.336 CCCCOCCCOCC#CCO 34a_200011215613_200000047223 [0,1,0,0,0,0|1,0,2]=4 8377 B13R0.336 CCCCOCCCOCC#CCO 7a_200011215613_200000047223 [0,1,0,0,0,0|1,0,2]=4 8378 B13R0.336 CCCCOCCCOCCCC#N 7a_200011215613_100000687738 [0,1,0,0,0,0|2,0,1]=4 8379 B13R0.336 CCCCOCCCOCCCC=O 7a_200011215613_200011292268 [0,1,0,0,0,0|1,0,2]=4 8380 B13R0.336 CCCCOCCCOCCCCF 34a_200011215613_100000729493 [0,1,0,0,0,0|2,0,0]=3 8381 B13R0.336 CCCCOCCCOCCCCF 7a_200011215613_100000729493 [0,1,0,0,0,0|2,0,0]=3 8382 B13R0.336 CCCCOCCCOCCCCO 34a_200011215613_100011216708 [0,1,0,0,0,0|1,0,0]=2 8383 B13R0.336 CCCCOCCCOCCCCO 7a_200011215613_100000210776 [0,1,0,0,0,0|1,0,0]=2 8384 B13R0.336 CCCCOCCCOCCCOC 34a_200011215475_100000210210 [0,1,0,0,0,0|2,0,0]=3 8385 B13R0.336 CCCCOCCCOCCCOC 34a_200011215613_100000740836 [0,1,0,0,0,0|2,0,0]=3 8386 B13R0.336 CCCCOCCCOCCCOC 7a_200011215475_100000210211 [0,1,0,0,0,0|2,0,0]=3 8387 B13R0.336 CCCCOCCCOCCCOC 7a_200011215613_100000740836 [0,1,0,0,0,0|2,0,0]=3 8388 B13R0.336 CCCCOCCCOCCOCC 34a_200011215613_100000210147 [0,1,0,0,0,0|3,0,0]=4 8389 B13R0.336 CCCCOCCCOCCOCC 7a_200011215613_100011215890 [0,1,0,0,0,0|3,0,0]=4 8390 B13R0.336 CCCCOCCCOCCSCC 34a_200011215613_100000757381 [0,1,0,0,0,0|3,0,0]=4 8391 B13R0.336 CCCCOCCCOCCSCC 7a_200011215613_100000757381 [0,1,0,0,0,0|3,0,0]=4 8392 B13R0.336 CCCCOCCNCCCCCO 2230a_100000762737_100000743108 [0,1,0,0,0,0|1,0,0]=2 8393 B13R0.336 CCCCOCCNCCCCCO 34a_100000762737_100000743108 [0,1,0,0,0,0|1,0,0]=2 8394 B13R0.336 CCCCOCCNCCCOCC 2230a_100000210961_100000743108 [0,1,0,0,0,0|3,0,0]=4 8395 B13R0.336 CCCCOCCNCCCOCC 34a_100000210961_100000743108 [0,1,0,0,0,0|3,0,0]=4 8396 B13R0.336 CCCCOCCNCCOCCC 2230a_100161115042_100000743108 [0,1,0,0,0,0|3,0,0]=4 8397 B13R0.336 CCCCOCCNCCOCCC 34a_100161115042_100000743108 [0,1,0,0,0,0|3,0,0]=4 8398 B13R0.336 CCCCOCCNCCOCCO 2230a_100000211614_100000743108 [0,1,0,0,0,0|2,0,0]=3 8399 B13R0.336 CCCCOCCNCCOCCO 34a_100000211614_100000743108 [0,1,0,0,0,0|2,0,0]=3 8400 B13R0.336 CCCCOCCNCCSCCC 2230a_100020603323_100000743108 [0,1,0,0,0,0|3,0,0]=4 8401 B13R0.336 CCCCOCCNCCSCCO 2230a_100011219999_100000743108 [0,1,0,0,0,0|2,0,0]=3 8402 B13R0.336 CCCCOCCOCCCCC#N 7a_100000210238_100000211819 [0,1,0,0,0,0|2,0,1]=4 8403 B13R0.336 CCCCOCCOCCCCC=O 7a_100000210238_100000139335 [0,1,0,0,0,0|1,0,2]=4 8404 B13R0.336 CCCCOCCOCCCCCBr 34a_100000746331_100000743108 [0,1,0,0,0,0|2,0,0]=3 8405 B13R0.336 CCCCOCCOCCCCCBr 7a_100000746331_100000743108 [0,1,0,0,0,0|2,0,0]=3 8406 B13R0.336 CCCCOCCOCCCCCCl 34a_100000746330_100000743108 [0,1,0,0,0,0|2,0,0]=3 8407 B13R0.336 CCCCOCCOCCCCCCl 7a_100000746330_100000743108 [0,1,0,0,0,0|2,0,0]=3 8408 B13R0.336 CCCCOCCOCCCCCF 34a_100000210238_100000729378 [0,1,0,0,0,0|2,0,0]=3 8409 B13R0.336 CCCCOCCOCCCCCF 7a_100000210238_100000729378 [0,1,0,0,0,0|2,0,0]=3 8410 B13R0.336 CCCCOCCOCCCCCI 34a_200012148887_100000743108 [0,1,0,0,0,0|2,0,0]=3 8411 B13R0.336 CCCCOCCOCCCCCI 7a_200012148887_100000743108 [0,1,0,0,0,0|2,0,0]=3 8412 B13R0.336 CCCCOCCOCCCCCN 34a_100000762737_100000743108 [0,1,0,0,0,0|2,0,0]=3 8413 B13R0.336 CCCCOCCOCCCCCO 34a_100000210238_100000746330 [0,1,0,0,0,0|1,0,0]=2 8414 B13R0.336 CCCCOCCOCCCCCO 7a_100000210238_100000746330 [0,1,0,0,0,0|1,0,0]=2 8415 B13R0.336 CCCCOCCOCCCCOC 34a_100000210238_100000755781 [0,1,0,0,0,0|2,0,0]=3 8416 B13R0.336 CCCCOCCOCCCCOC 34a_100000740925_100000743108 [0,1,0,0,0,0|2,0,0]=3 8417 B13R0.336 CCCCOCCOCCCCOC 7a_100000210238_100000730899 [0,1,0,0,0,0|2,0,0]=3 8418 B13R0.336 CCCCOCCOCCCCSC 34a_100011217163_100000743108 [0,1,0,0,0,0|2,1,0]=4 8419 B13R0.336 CCCCOCCOCCCCSC 7a_100011217163_100000743108 [0,1,0,0,0,0|2,1,0]=4 8420 B13R0.336 CCCCOCCOCCCOCC 34a_100000210238_100012232248 [0,1,0,0,0,0|3,0,0]=4 8421 B13R0.336 CCCCOCCOCCCOCC 34a_100000757476_100000743108 [0,1,0,0,0,0|3,0,0]=4 8422 B13R0.336 CCCCOCCOCCCOCC 7a_100000210238_100012232248 [0,1,0,0,0,0|3,0,0]=4 8423 B13R0.336 CCCCOCCOCCCOCC 7a_100000757476_100000743108 [0,1,0,0,0,0|3,0,0]=4 8424 B13R0.336 CCCCOCCOCCCSCC 34a_100011216438_100000743108 [0,1,0,0,0,0|3,0,0]=4 8425 B13R0.336 CCCCOCCOCCCSCC 7a_100011216438_100000743108 [0,1,0,0,0,0|3,0,0]=4 8426 B13R0.336 CCCCOCCOCCOCCBr 34a_100000692535_100000743108 [0,1,0,0,0,0|3,0,0]=4 8427 B13R0.336 CCCCOCCOCCOCCBr 34a_100010132937_100000210210 [0,1,0,0,0,0|3,0,0]=4 8428 B13R0.336 CCCCOCCOCCOCCBr 7a_100000692535_100000743108 [0,1,0,0,0,0|3,0,0]=4 8429 B13R0.336 CCCCOCCOCCOCCBr 7a_100010132937_100000210211 [0,1,0,0,0,0|3,0,0]=4 8430 B13R0.336 CCCCOCCOCCOCCC 34a_100000210238_100011215938 [0,1,0,0,0,0|3,0,0]=4 8431 B13R0.336 CCCCOCCOCCOCCC 34a_100000752267_100000743108 [0,1,0,0,0,0|3,0,0]=4 8432 B13R0.336 CCCCOCCOCCOCCC 34a_100011215186_100000210303 [0,1,0,0,0,0|3,0,0]=4 8433 B13R0.336 CCCCOCCOCCOCCC 7a_100000210238_100011215938 [0,1,0,0,0,0|3,0,0]=4 8434 B13R0.336 CCCCOCCOCCOCCC 7a_100000752267_100000743108 [0,1,0,0,0,0|3,0,0]=4 8435 B13R0.336 CCCCOCCOCCOCCC 7a_100011215186_100000210303 [0,1,0,0,0,0|3,0,0]=4 8436 B13R0.336 CCCCOCCOCCOCCCl 34a_100000032323_100000210210 [0,1,0,0,0,0|3,0,0]=4 8437 B13R0.336 CCCCOCCOCCOCCCl 34a_100011215305_100000743108 [0,1,0,0,0,0|3,0,0]=4 8438 B13R0.336 CCCCOCCOCCOCCCl 7a_100000032323_100000210211 [0,1,0,0,0,0|3,0,0]=4 8439 B13R0.336 CCCCOCCOCCOCCCl 7a_100011215305_100000743108 [0,1,0,0,0,0|3,0,0]=4 8440 B13R0.336 CCCCOCCOCCOCCF 34a_100011215186_100011217306 [0,1,0,0,0,0|3,0,0]=4 8441 B13R0.336 CCCCOCCOCCOCCF 34a_200015357709_100000743108 [0,1,0,0,0,0|3,0,0]=4 8442 B13R0.336 CCCCOCCOCCOCCF 7a_100011215186_100011217306 [0,1,0,0,0,0|3,0,0]=4 8443 B13R0.336 CCCCOCCOCCOCCF 7a_200015357709_100000743108 [0,1,0,0,0,0|3,0,0]=4 8444 B13R0.336 CCCCOCCOCCOCCI 34a_100012149058_100000743108 [0,1,0,0,0,0|3,0,0]=4 8445 B13R0.336 CCCCOCCOCCOCCI 7a_100012149058_100000743108 [0,1,0,0,0,0|3,0,0]=4 8446 B13R0.336 CCCCOCCOCCOCCN 34a_100000211614_100000743108 [0,1,0,0,0,0|3,0,0]=4 8447 B13R0.336 CCCCOCCOCCOCCN 34a_100011998139_100000210210 [0,1,0,0,0,0|3,0,0]=4 8448 B13R0.336 CCCCOCCOCCOCCO 34a_100000210227_100000032323 [0,1,0,0,0,0|2,0,0]=3 8449 B13R0.336 CCCCOCCOCCOCCO 34a_100000210238_100000692535 [0,1,0,0,0,0|2,0,0]=3 8450 B13R0.336 CCCCOCCOCCOCCO 34a_100011215186_100000211926 [0,1,0,0,0,0|2,0,0]=3 8451 B13R0.336 CCCCOCCOCCOCCO 7a_100000210227_100000032323 [0,1,0,0,0,0|2,0,0]=3 8452 B13R0.336 CCCCOCCOCCOCCO 7a_100000210238_100011215305 [0,1,0,0,0,0|2,0,0]=3 8453 B13R0.336 CCCCOCCOCCOCCO 7a_100011215186_100000211926 [0,1,0,0,0,0|2,0,0]=3 8454 B13R0.336 CCCCOCCOCCSCCC 34a_200000230433_100000743108 [0,1,0,0,0,0|3,0,0]=4 8455 B13R0.336 CCCCOCCOCCSCCC 7a_200000230433_100000743108 [0,1,0,0,0,0|3,0,0]=4 8456 B13R0.336 CCCCOCCOCOCCCC 34a_100000210238_100011995733 [0,1,0,0,0,0|3,0,0]=4 8457 B13R0.336 CCCCOCCSCCCCC#N 62a_100000743108_100000211819 [0,1,0,0,0,0|2,0,1]=4 8458 B13R0.336 CCCCOCCSCCCCC#N 62a_100011219923_100000743108 [0,1,0,0,0,0|2,0,1]=4 8459 B13R0.336 CCCCOCCSCCCCC=O 62a_100000139335_100000743108 [0,1,0,0,0,0|1,0,2]=4 8460 B13R0.336 CCCCOCCSCCCCC=O 62a_100000743108_100000139335 [0,1,0,0,0,0|1,0,2]=4 8461 B13R0.336 CCCCOCCSCCCCCF 62a_100000729378_100000743108 [0,1,0,0,0,0|2,0,0]=3 8462 B13R0.336 CCCCOCCSCCCCCF 62a_100000743108_100000729378 [0,1,0,0,0,0|2,0,0]=3 8463 B13R0.336 CCCCOCCSCCCCCO 62a_100000743108_100000746330 [0,1,0,0,0,0|1,0,0]=2 8464 B13R0.336 CCCCOCCSCCCCCO 62a_100000746330_100000743108 [0,1,0,0,0,0|1,0,0]=2 8465 B13R0.336 CCCCOCCSCCCCOC 62a_100000730899_100000743108 [0,1,0,0,0,0|2,0,0]=3 8466 B13R0.336 CCCCOCCSCCCCOC 62a_100000743108_100000730899 [0,1,0,0,0,0|2,0,0]=3 8467 B13R0.336 CCCCOCCSCCCOCC 62a_100000743108_100012232248 [0,1,0,0,0,0|3,0,0]=4 8468 B13R0.336 CCCCOCCSCCCOCC 62a_100012232248_100000743108 [0,1,0,0,0,0|3,0,0]=4 8469 B13R0.336 CCCCOCCSCCOCCC 62a_100000743108_100011215938 [0,1,0,0,0,0|3,0,0]=4 8470 B13R0.336 CCCCOCCSCCOCCC 62a_100011215938_100000743108 [0,1,0,0,0,0|3,0,0]=4 8471 B13R0.336 CCCCOCCSCCOCCO 62a_100000743108_100011215305 [0,1,0,0,0,0|2,0,0]=3 8472 B13R0.336 CCCCOCCSCCOCCO 62a_100011215305_100000743108 [0,1,0,0,0,0|2,0,0]=3 8473 B13R0.336 CCCCOCCSCOCCCC 62a_100000743108_100011995733 [0,1,0,0,0,0|3,0,0]=4 8474 B13R0.336 CCCCOCCSCOCCCC 62a_100011995733_100000743108 [0,1,0,0,0,0|3,0,0]=4 8475 B13R0.336 CCCCOCCSCOCCOC 62a_100000231047_100000743108 [0,1,0,0,0,0|3,0,0]=4 8476 B13R0.336 CCCCOCCSCOCCOC 62a_100000743108_100000231047 [0,1,0,0,0,0|3,0,0]=4 8477 B13R0.336 CCCCOCNCCCCCCO 2230a_100000686447_100011995733 [0,1,0,0,0,0|1,0,0]=2 8478 B13R0.336 CCCCOCNCCCCCCO 34a_100000686447_100011995733 [0,1,0,0,0,0|1,0,0]=2 8479 B13R0.336 CCCCOCNCCCCCOC 2230a_100000747528_100011995733 [0,1,0,0,0,0|2,0,0]=3 8480 B13R0.336 CCCCOCNCCCCCOC 34a_100000747528_100011995733 [0,1,0,0,0,0|2,0,0]=3 8481 B13R0.336 CCCCOCNCCCOCCC 2230a_100011217757_100011995733 [0,1,0,0,0,0|3,0,0]=4 8482 B13R0.336 CCCCOCNCCCOCCC 34a_100011217757_100011995733 [0,1,0,0,0,0|3,0,0]=4 8483 B13R0.336 CCCCOCNCCOCCOC 2230a_100000745349_100011995733 [0,1,0,0,0,0|3,0,0]=4 8484 B13R0.336 CCCCOCNCCOCCOC 34a_100000745349_100011995733 [0,1,0,0,0,0|3,0,0]=4 8485 B13R0.336 CCCCOCNCCSCCCC 2230a_100025743550_100011995733 [0,1,0,0,0,0|3,0,0]=4 8486 B13R0.336 CCCCOCOCCCCCCBr 34a_100011215345_100011995733 [0,1,0,0,0,0|2,0,0]=3 8487 B13R0.336 CCCCOCOCCCCCCCl 34a_100000766143_100011995733 [0,1,0,0,0,0|2,0,0]=3 8488 B13R0.336 CCCCOCOCCCCCCF 34a_100000732779_100011995733 [0,1,0,0,0,0|2,0,0]=3 8489 B13R0.336 CCCCOCOCCCCCCN 34a_100000686447_100011995733 [0,1,0,0,0,0|2,0,0]=3 8490 B13R0.336 CCCCOCOCCCCCNC 34a_100000722520_100011995733 [0,1,0,0,0,0|3,0,0]=4 8491 B13R0.336 CCCCOCOCCOCCOC 34a_100011215163_100011995733 [0,1,0,0,0,0|3,0,0]=4 8492 B13R0.336 CCCCOCOCCSCCCC 34a_200000230436_100011995733 [0,1,0,0,0,0|3,0,0]=4 8493 B13R0.336 CCCCOCSCCCCCC#N 62a_100009813376_100011995733 [0,1,0,0,0,0|2,0,1]=4 8494 B13R0.336 CCCCOCSCCCCCC#N 62a_100011995733_100009813376 [0,1,0,0,0,0|2,0,1]=4 8495 B13R0.336 CCCCOCSCCCCCC=O 62a_100000139337_100011995733 [0,1,0,0,0,0|1,0,2]=4 8496 B13R0.336 CCCCOCSCCCCCC=O 62a_100011995733_100000139337 [0,1,0,0,0,0|1,0,2]=4 8497 B13R0.336 CCCCOCSCCCCCCF 62a_100011995733_100015922095 [0,1,0,0,0,0|2,0,0]=3 8498 B13R0.336 CCCCOCSCCCCCCF 62a_100015922095_100011995733 [0,1,0,0,0,0|2,0,0]=3 8499 B13R0.336 CCCCOCSCCCCCCO 62a_100000766143_100011995733 [0,1,0,0,0,0|1,0,0]=2 8500 B13R0.336 CCCCOCSCCCCCCO 62a_100011995733_100000766143 [0,1,0,0,0,0|1,0,0]=2 8501 B13R0.336 CCCCOCSCCOCCOC 62a_100000695917_100011995733 [0,1,0,0,0,0|3,0,0]=4 8502 B13R0.336 CCCCOCSCCOCCOC 62a_100011995733_100000695917 [0,1,0,0,0,0|3,0,0]=4 8503 B13R0.336 CCCCSCCCCCCCCO 62a_100000033203_100000210210 [0,1,0,0,0,0|0,0,0]=1 8504 B13R0.336 CCCCSCCCCCCCCO 62a_100000210211_100000033203 [0,1,0,0,0,0|0,0,0]=1 8505 B13R0.336 CCCCSCCNCCCCC#N 2230a_100025743550_100000211819 [0,1,0,0,0,0|2,0,1]=4 8506 B13R0.336 CCCCSCCNCCCCC=O 2230a_100025743550_100000139335 [0,1,0,0,0,0|1,0,2]=4 8507 B13R0.336 CCCCSCCNCCCCCF 2230a_100025743550_100000729378 [0,1,0,0,0,0|2,0,0]=3 8508 B13R0.336 CCCCSCCNCCCCCO 2230a_100025743550_100000746330 [0,1,0,0,0,0|1,0,0]=2 8509 B13R0.336 CCCCSCCNCCCCOC 2230a_100025743550_100000730899 [0,1,0,0,0,0|2,0,0]=3 8510 B13R0.336 CCCCSCCNCCCOCC 2230a_100025743550_100012232248 [0,1,0,0,0,0|3,0,0]=4 8511 B13R0.336 CCCCSCCNCCOCCC 2230a_100025743550_100011215938 [0,1,0,0,0,0|3,0,0]=4 8512 B13R0.336 CCCCSCCNCCOCCO 2230a_100025743550_100011215305 [0,1,0,0,0,0|2,0,0]=3 8513 B13R0.336 CCCCSCCNCOCCOC 2230a_100025743550_100000231047 [0,1,0,0,0,0|3,0,0]=4 8514 B13R0.336 CCCCSCCOCCCCC#N 7a_200000230436_100000211819 [0,1,0,0,0,0|2,0,1]=4 8515 B13R0.336 CCCCSCCOCCCCC=O 7a_200000230436_100000139335 [0,1,0,0,0,0|1,0,2]=4 8516 B13R0.336 CCCCSCCOCCCCCF 34a_200000230436_100000729378 [0,1,0,0,0,0|2,0,0]=3 8517 B13R0.336 CCCCSCCOCCCCCF 7a_200000230436_100000729378 [0,1,0,0,0,0|2,0,0]=3 8518 B13R0.336 CCCCSCCOCCCCCO 34a_200000230436_100000746330 [0,1,0,0,0,0|1,0,0]=2 8519 B13R0.336 CCCCSCCOCCCCCO 7a_200000230436_100000746330 [0,1,0,0,0,0|1,0,0]=2 8520 B13R0.336 CCCCSCCOCCCCOC 34a_200000230436_100000755781 [0,1,0,0,0,0|2,0,0]=3 8521 B13R0.336 CCCCSCCOCCCCOC 7a_200000230436_100000730899 [0,1,0,0,0,0|2,0,0]=3 8522 B13R0.336 CCCCSCCOCCCOCC 34a_200000230436_100012232248 [0,1,0,0,0,0|3,0,0]=4 8523 B13R0.336 CCCCSCCOCCCOCC 7a_200000230436_100012232248 [0,1,0,0,0,0|3,0,0]=4 8524 B13R0.336 CCCCSCCOCCOCCC 34a_200000230436_100011215938 [0,1,0,0,0,0|3,0,0]=4 8525 B13R0.336 CCCCSCCOCCOCCC 7a_200000230436_100011215938 [0,1,0,0,0,0|3,0,0]=4 8526 B13R0.336 CCCCSCCOCCOCCO 34a_200000230436_100000692535 [0,1,0,0,0,0|2,0,0]=3 8527 B13R0.336 CCCCSCCOCCOCCO 62a_100000032323_100000210210 [0,1,0,0,0,0|2,0,0]=3 8528 B13R0.336 CCCCSCCOCCOCCO 62a_100000210211_100000032323 [0,1,0,0,0,0|2,0,0]=3 8529 B13R0.336 CCCCSCCOCCOCCO 7a_200000230436_100011215305 [0,1,0,0,0,0|2,0,0]=3 8530 B13R0.336 CCCNCCCCCCCCCO 2230a_100000078944_100000210303 [0,1,0,0,0,0|0,0,0]=1 8531 B13R0.336 CCCNCCCCCCCCCO 34a_100000078944_100000210303 [0,1,0,0,0,0|0,0,0]=1 8532 B13R0.336 CCCNCCCOCCOCCO 2230a_100011996194_100000210303 [0,1,0,0,0,0|2,0,0]=3 8533 B13R0.336 CCCNCCCOCCOCCO 34a_100011996194_100000210303 [0,1,0,0,0,0|2,0,0]=3 8534 B13R0.336 CCCNCCOCCOCCOC 2230a_100012028300_100000210303 [0,1,0,0,0,0|3,0,0]=4 8535 B13R0.336 CCCNCCOCCOCCOC 34a_100012028300_100000210303 [0,1,0,0,0,0|3,0,0]=4 8536 B13R0.336 CCCOCCCCCCCCCBr 34a_100009813782_100000210303 [0,1,0,0,0,0|1,0,0]=2 8537 B13R0.336 CCCOCCCCCCCCCBr 7a_100009813782_100000210303 [0,1,0,0,0,0|1,0,0]=2 8538 B13R0.336 CCCOCCCCCCCCCCl 34a_100009868337_100000210303 [0,1,0,0,0,0|1,0,0]=2 8539 B13R0.336 CCCOCCCCCCCCCCl 7a_100009868337_100000210303 [0,1,0,0,0,0|1,0,0]=2 8540 B13R0.336 CCCOCCCCCCCCCN 34a_100000078944_100000210303 [0,1,0,0,0,0|1,0,0]=2 8541 B13R0.336 CCCOCCCCCCCCCO 34a_100000210258_100009813782 [0,1,0,0,0,0|0,0,0]=1 8542 B13R0.336 CCCOCCCNCCCCC#N 2230a_100011217757_100000211819 [0,1,0,0,0,0|2,0,1]=4 8543 B13R0.336 CCCOCCCNCCCCC=O 2230a_100011217757_100000139335 [0,1,0,0,0,0|1,0,2]=4 8544 B13R0.336 CCCOCCCNCCCCCF 2230a_100011217757_100000729378 [0,1,0,0,0,0|2,0,0]=3 8545 B13R0.336 CCCOCCCNCCCCCF 34a_100011217757_100000729378 [0,1,0,0,0,0|2,0,0]=3 8546 B13R0.336 CCCOCCCNCCCCCO 2230a_100011217757_100000746330 [0,1,0,0,0,0|1,0,0]=2 8547 B13R0.336 CCCOCCCNCCCCCO 34a_100011217757_100000746330 [0,1,0,0,0,0|1,0,0]=2 8548 B13R0.336 CCCOCCCNCCCCOC 2230a_100011217757_100000730899 [0,1,0,0,0,0|2,0,0]=3 8549 B13R0.336 CCCOCCCNCCCCOC 34a_100011217757_100000755781 [0,1,0,0,0,0|2,0,0]=3 8550 B13R0.336 CCCOCCCNCCCOCC 2230a_100011217757_100012232248 [0,1,0,0,0,0|3,0,0]=4 8551 B13R0.336 CCCOCCCNCCCOCC 34a_100011217757_100012232248 [0,1,0,0,0,0|3,0,0]=4 8552 B13R0.336 CCCOCCCNCCOCCC 2230a_100011217757_100011215938 [0,1,0,0,0,0|3,0,0]=4 8553 B13R0.336 CCCOCCCNCCOCCC 34a_100011217757_100011215938 [0,1,0,0,0,0|3,0,0]=4 8554 B13R0.336 CCCOCCCNCCOCCO 2230a_100011217757_100011215305 [0,1,0,0,0,0|2,0,0]=3 8555 B13R0.336 CCCOCCCNCCOCCO 34a_100011217757_100000692535 [0,1,0,0,0,0|2,0,0]=3 8556 B13R0.336 CCCOCCCNCOCCOC 2230a_100011217757_100000231047 [0,1,0,0,0,0|3,0,0]=4 8557 B13R0.336 CCCOCCNCCCCCC#N 2230a_100161115042_100009813376 [0,1,0,0,0,0|2,0,1]=4 8558 B13R0.336 CCCOCCNCCCCCC=O 2230a_100161115042_100000139337 [0,1,0,0,0,0|1,0,2]=4 8559 B13R0.336 CCCOCCNCCCCCCF 2230a_100161115042_100015922095 [0,1,0,0,0,0|2,0,0]=3 8560 B13R0.336 CCCOCCNCCCCCCF 34a_100161115042_100015922095 [0,1,0,0,0,0|2,0,0]=3 8561 B13R0.336 CCCOCCNCCCCCCO 2230a_100000686447_100011215938 [0,1,0,0,0,0|1,0,0]=2 8562 B13R0.336 CCCOCCNCCCCCCO 2230a_100161115042_100000766143 [0,1,0,0,0,0|1,0,0]=2 8563 B13R0.336 CCCOCCNCCCCCCO 34a_100000686447_100011215938 [0,1,0,0,0,0|1,0,0]=2 8564 B13R0.336 CCCOCCNCCCCCCO 34a_100161115042_100000766143 [0,1,0,0,0,0|1,0,0]=2 8565 B13R0.336 CCCOCCNCCCCCOC 2230a_100000747528_100011215938 [0,1,0,0,0,0|2,0,0]=3 8566 B13R0.336 CCCOCCNCCCCCOC 34a_100000747528_100011215938 [0,1,0,0,0,0|2,0,0]=3 8567 B13R0.336 CCCOCCNCCOCCOC 2230a_100000745349_100011215938 [0,1,0,0,0,0|3,0,0]=4 8568 B13R0.336 CCCOCCNCCOCCOC 2230a_100161115042_100000695917 [0,1,0,0,0,0|3,0,0]=4 8569 B13R0.336 CCCOCCNCCOCCOC 34a_100000745349_100011215938 [0,1,0,0,0,0|3,0,0]=4 8570 B13R0.336 CCCOCCNCCOCCOC 34a_100161115042_100000695917 [0,1,0,0,0,0|3,0,0]=4 8571 B13R0.336 CCCOCCOCCCCCC#N 7a_100000752267_100009813376 [0,1,0,0,0,0|2,0,1]=4 8572 B13R0.336 CCCOCCOCCCCCC=O 7a_100000752267_100000139337 [0,1,0,0,0,0|1,0,2]=4 8573 B13R0.336 CCCOCCOCCCCCCBr 34a_100011215345_100011215938 [0,1,0,0,0,0|2,0,0]=3 8574 B13R0.336 CCCOCCOCCCCCCBr 7a_100011215345_100011215938 [0,1,0,0,0,0|2,0,0]=3 8575 B13R0.336 CCCOCCOCCCCCCCl 34a_100000766143_100011215938 [0,1,0,0,0,0|2,0,0]=3 8576 B13R0.336 CCCOCCOCCCCCCCl 7a_100000766143_100011215938 [0,1,0,0,0,0|2,0,0]=3 8577 B13R0.336 CCCOCCOCCCCCCF 34a_100000732779_100011215938 [0,1,0,0,0,0|2,0,0]=3 8578 B13R0.336 CCCOCCOCCCCCCF 34a_100000752267_100015922095 [0,1,0,0,0,0|2,0,0]=3 8579 B13R0.336 CCCOCCOCCCCCCF 7a_100000732779_100011215938 [0,1,0,0,0,0|2,0,0]=3 8580 B13R0.336 CCCOCCOCCCCCCF 7a_100000752267_100015922095 [0,1,0,0,0,0|2,0,0]=3 8581 B13R0.336 CCCOCCOCCCCCCN 34a_100000686447_100011215938 [0,1,0,0,0,0|2,0,0]=3 8582 B13R0.336 CCCOCCOCCCCCCO 34a_100000752267_100000766143 [0,1,0,0,0,0|1,0,0]=2 8583 B13R0.336 CCCOCCOCCCCCCO 7a_100000752267_100000766143 [0,1,0,0,0,0|1,0,0]=2 8584 B13R0.336 CCCOCCOCCCCCNC 34a_100000722520_100011215938 [0,1,0,0,0,0|3,0,0]=4 8585 B13R0.336 CCCOCCOCCNCCCF 2230a_200011904461_100011934791 [0,1,0,0,0,0|3,0,0]=4 8586 B13R0.336 CCCOCCOCCNCCCF 34a_200011904461_100011934791 [0,1,0,0,0,0|3,0,0]=4 8587 B13R0.336 CCCOCCOCCNCCCO 2230a_200011904461_100000230001 [0,1,0,0,0,0|2,0,0]=3 8588 B13R0.336 CCCOCCOCCNCCCO 34a_200011904461_100000230001 [0,1,0,0,0,0|2,0,0]=3 8589 B13R0.336 CCCOCCOCCNCCOC 2230a_200011904461_100011201679 [0,1,0,0,0,0|3,0,0]=4 8590 B13R0.336 CCCOCCOCCNCCOC 34a_200011904461_100011201679 [0,1,0,0,0,0|3,0,0]=4 8591 B13R0.336 CCCOCCOCCOCCCN 34a_100011996194_100000210303 [0,1,0,0,0,0|3,0,0]=4 8592 B13R0.336 CCCOCCOCCOCCOC 34a_100000210258_100013367474 [0,1,0,0,0,0|3,0,0]=4 8593 B13R0.336 CCCOCCOCCOCCOC 34a_100000688194_100000210303 [0,1,0,0,0,0|3,0,0]=4 8594 B13R0.336 CCCOCCOCCOCCOC 34a_100000752267_100000695917 [0,1,0,0,0,0|3,0,0]=4 8595 B13R0.336 CCCOCCOCCOCCOC 34a_100011215163_100011215938 [0,1,0,0,0,0|3,0,0]=4 8596 B13R0.336 CCCOCCOCCOCCOC 7a_100000688194_100000210303 [0,1,0,0,0,0|3,0,0]=4 8597 B13R0.336 CCCOCCOCCOCCOC 7a_100000752267_100000695917 [0,1,0,0,0,0|3,0,0]=4 8598 B13R0.336 CCCOCCOCCOCCOC 7a_100011215163_100011215938 [0,1,0,0,0,0|3,0,0]=4 8599 B13R0.336 CCCOCCSCCCCCC#N 62a_100009813376_100011215938 [0,1,0,0,0,0|2,0,1]=4 8600 B13R0.336 CCCOCCSCCCCCC#N 62a_100011215938_100009813376 [0,1,0,0,0,0|2,0,1]=4 8601 B13R0.336 CCCOCCSCCCCCC=O 62a_100000139337_100011215938 [0,1,0,0,0,0|1,0,2]=4 8602 B13R0.336 CCCOCCSCCCCCC=O 62a_100011215938_100000139337 [0,1,0,0,0,0|1,0,2]=4 8603 B13R0.336 CCCOCCSCCCCCCF 62a_100011215938_100015922095 [0,1,0,0,0,0|2,0,0]=3 8604 B13R0.336 CCCOCCSCCCCCCF 62a_100015922095_100011215938 [0,1,0,0,0,0|2,0,0]=3 8605 B13R0.336 CCCOCCSCCCCCCO 62a_100000766143_100011215938 [0,1,0,0,0,0|1,0,0]=2 8606 B13R0.336 CCCOCCSCCCCCCO 62a_100011215938_100000766143 [0,1,0,0,0,0|1,0,0]=2 8607 B13R0.336 CCCOCCSCCOCCOC 62a_100000695917_100011215938 [0,1,0,0,0,0|3,0,0]=4 8608 B13R0.336 CCCOCCSCCOCCOC 62a_100011215938_100000695917 [0,1,0,0,0,0|3,0,0]=4 8609 B13R0.336 CCCSCCCCCCCCCO 62a_100000210303_100009813782 [0,1,0,0,0,0|0,0,0]=1 8610 B13R0.336 CCCSCCCCCCCCCO 62a_100009813782_100000210303 [0,1,0,0,0,0|0,0,0]=1 8611 B13R0.336 CCCSCCNCCCCCC#N 2230a_100020603323_100009813376 [0,1,0,0,0,0|2,0,1]=4 8612 B13R0.336 CCCSCCNCCCCCC=O 2230a_100020603323_100000139337 [0,1,0,0,0,0|1,0,2]=4 8613 B13R0.336 CCCSCCNCCCCCCF 2230a_100020603323_100015922095 [0,1,0,0,0,0|2,0,0]=3 8614 B13R0.336 CCCSCCNCCCCCCO 2230a_100020603323_100000766143 [0,1,0,0,0,0|1,0,0]=2 8615 B13R0.336 CCCSCCNCCOCCOC 2230a_100020603323_100000695917 [0,1,0,0,0,0|3,0,0]=4 8616 B13R0.336 CCCSCCOCCCCCC#N 7a_200000230433_100009813376 [0,1,0,0,0,0|2,0,1]=4 8617 B13R0.336 CCCSCCOCCCCCC=O 7a_200000230433_100000139337 [0,1,0,0,0,0|1,0,2]=4 8618 B13R0.336 CCCSCCOCCCCCCF 34a_200000230433_100015922095 [0,1,0,0,0,0|2,0,0]=3 8619 B13R0.336 CCCSCCOCCCCCCF 7a_200000230433_100015922095 [0,1,0,0,0,0|2,0,0]=3 8620 B13R0.336 CCCSCCOCCCCCCO 34a_200000230433_100000766143 [0,1,0,0,0,0|1,0,0]=2 8621 B13R0.336 CCCSCCOCCCCCCO 7a_200000230433_100000766143 [0,1,0,0,0,0|1,0,0]=2 8622 B13R0.336 CCCSCCOCCOCCOC 34a_200000230433_100000695917 [0,1,0,0,0,0|3,0,0]=4 8623 B13R0.336 CCCSCCOCCOCCOC 62a_100000210303_100013367474 [0,1,0,0,0,0|3,0,0]=4 8624 B13R0.336 CCCSCCOCCOCCOC 62a_100013367474_100000210303 [0,1,0,0,0,0|3,0,0]=4 8625 B13R0.336 CCCSCCOCCOCCOC 7a_200000230433_100000695917 [0,1,0,0,0,0|3,0,0]=4 8626 B13R0.336 CCNCCCCCCCCCCO 2230a_100000066964_100000210202 [0,1,0,0,0,0|0,0,0]=1 8627 B13R0.336 CCNCCCCCCCCCCO 2230a_100015525214_100009813290 [0,1,0,0,0,0|0,0,0]=1 8628 B13R0.336 CCNCCCCCCCCCCO 34a_100000066964_100000210202 [0,1,0,0,0,0|0,0,0]=1 8629 B13R0.336 CCOCCCCCCCCCCBr 34a_100009813290_100000210202 [0,1,0,0,0,0|1,0,0]=2 8630 B13R0.336 CCOCCCCCCCCCCBr 7a_100009813290_100000210202 [0,1,0,0,0,0|1,0,0]=2 8631 B13R0.336 CCOCCCCCCCCCCCl 34a_200000033068_100000210202 [0,1,0,0,0,0|1,0,0]=2 8632 B13R0.336 CCOCCCCCCCCCCCl 7a_200000033068_100000210202 [0,1,0,0,0,0|1,0,0]=2 8633 B13R0.336 CCOCCCCCCCCCCN 34a_100000066964_100000210202 [0,1,0,0,0,0|1,0,0]=2 8634 B13R0.336 CCOCCCCCCCCCCO 34a_100121572206_100009813290 [0,1,0,0,0,0|0,0,0]=1 8635 B13R0.336 CCOCCCCCCCCCOC 34a_100009875440_200000210301 [0,1,0,0,0,0|1,0,0]=2 8636 B13R0.336 CCOCCCCCCCCCOC 7a_100009875440_200000210301 [0,1,0,0,0,0|1,0,0]=2 8637 B13R0.336 CCOCCCCCCCCCO[13CH3] 34a_100009875440_200025704644 [0,1,0,0,0,0|1,0,0]=2 8638 B13R0.336 CCOCCCCCCCCCO[13CH3] 7a_100009875440_200025704644 [0,1,0,0,0,0|1,0,0]=2 8639 B13R0.336 CCOCCCNCCCCCC#N 2230a_100000210961_100009813376 [0,1,0,0,0,0|2,0,1]=4 8640 B13R0.336 CCOCCCNCCCCCC=O 2230a_100000210961_100000139337 [0,1,0,0,0,0|1,0,2]=4 8641 B13R0.336 CCOCCCNCCCCCCF 2230a_100000210961_100015922095 [0,1,0,0,0,0|2,0,0]=3 8642 B13R0.336 CCOCCCNCCCCCCF 34a_100000210961_100015922095 [0,1,0,0,0,0|2,0,0]=3 8643 B13R0.336 CCOCCCNCCCCCCO 2230a_100000210961_100000766143 [0,1,0,0,0,0|1,0,0]=2 8644 B13R0.336 CCOCCCNCCCCCCO 2230a_100000686447_100012232248 [0,1,0,0,0,0|1,0,0]=2 8645 B13R0.336 CCOCCCNCCCCCCO 34a_100000210961_100000766143 [0,1,0,0,0,0|1,0,0]=2 8646 B13R0.336 CCOCCCNCCCCCCO 34a_100000686447_100012232248 [0,1,0,0,0,0|1,0,0]=2 8647 B13R0.336 CCOCCCNCCCCCOC 2230a_100000747528_100012232248 [0,1,0,0,0,0|2,0,0]=3 8648 B13R0.336 CCOCCCNCCCCCOC 34a_100000747528_100012232248 [0,1,0,0,0,0|2,0,0]=3 8649 B13R0.336 CCOCCCNCCOCCOC 2230a_100000210961_100000695917 [0,1,0,0,0,0|3,0,0]=4 8650 B13R0.336 CCOCCCNCCOCCOC 2230a_100000745349_100012232248 [0,1,0,0,0,0|3,0,0]=4 8651 B13R0.336 CCOCCCNCCOCCOC 34a_100000210961_100000695917 [0,1,0,0,0,0|3,0,0]=4 8652 B13R0.336 CCOCCCNCCOCCOC 34a_100000745349_100012232248 [0,1,0,0,0,0|3,0,0]=4 8653 B13R0.336 CCOCCCOCCCCCC#N 7a_100000757476_100009813376 [0,1,0,0,0,0|2,0,1]=4 8654 B13R0.336 CCOCCCOCCCCCC=O 7a_100000757476_100000139337 [0,1,0,0,0,0|1,0,2]=4 8655 B13R0.336 CCOCCCOCCCCCCBr 34a_100011215345_100012232248 [0,1,0,0,0,0|2,0,0]=3 8656 B13R0.336 CCOCCCOCCCCCCBr 7a_100011215345_100012232248 [0,1,0,0,0,0|2,0,0]=3 8657 B13R0.336 CCOCCCOCCCCCCCl 34a_100000766143_100012232248 [0,1,0,0,0,0|2,0,0]=3 8658 B13R0.336 CCOCCCOCCCCCCCl 7a_100000766143_100012232248 [0,1,0,0,0,0|2,0,0]=3 8659 B13R0.336 CCOCCCOCCCCCCF 34a_100000732779_100012232248 [0,1,0,0,0,0|2,0,0]=3 8660 B13R0.336 CCOCCCOCCCCCCF 34a_100000757476_100015922095 [0,1,0,0,0,0|2,0,0]=3 8661 B13R0.336 CCOCCCOCCCCCCF 7a_100000732779_100012232248 [0,1,0,0,0,0|2,0,0]=3 8662 B13R0.336 CCOCCCOCCCCCCF 7a_100000757476_100015922095 [0,1,0,0,0,0|2,0,0]=3 8663 B13R0.336 CCOCCCOCCCCCCN 34a_100000686447_100012232248 [0,1,0,0,0,0|2,0,0]=3 8664 B13R0.336 CCOCCCOCCCCCCO 34a_100000757476_100000766143 [0,1,0,0,0,0|1,0,0]=2 8665 B13R0.336 CCOCCCOCCCCCCO 7a_100000757476_100000766143 [0,1,0,0,0,0|1,0,0]=2 8666 B13R0.336 CCOCCCOCCCCCNC 34a_100000722520_100012232248 [0,1,0,0,0,0|3,0,0]=4 8667 B13R0.336 CCOCCCOCCOCCOC 34a_100000757476_100000695917 [0,1,0,0,0,0|3,0,0]=4 8668 B13R0.336 CCOCCCOCCOCCOC 34a_100011215163_100012232248 [0,1,0,0,0,0|3,0,0]=4 8669 B13R0.336 CCOCCCOCCOCCOC 7a_100000757476_100000695917 [0,1,0,0,0,0|3,0,0]=4 8670 B13R0.336 CCOCCCOCCOCCOC 7a_100011215163_100012232248 [0,1,0,0,0,0|3,0,0]=4 8671 B13R0.336 CCOCCCSCCCCCC#N 62a_100009813376_100012232248 [0,1,0,0,0,0|2,0,1]=4 8672 B13R0.336 CCOCCCSCCCCCC#N 62a_100012232248_100009813376 [0,1,0,0,0,0|2,0,1]=4 8673 B13R0.336 CCOCCCSCCCCCC=O 62a_100000139337_100012232248 [0,1,0,0,0,0|1,0,2]=4 8674 B13R0.336 CCOCCCSCCCCCC=O 62a_100012232248_100000139337 [0,1,0,0,0,0|1,0,2]=4 8675 B13R0.336 CCOCCCSCCCCCCF 62a_100012232248_100015922095 [0,1,0,0,0,0|2,0,0]=3 8676 B13R0.336 CCOCCCSCCCCCCF 62a_100015922095_100012232248 [0,1,0,0,0,0|2,0,0]=3 8677 B13R0.336 CCOCCCSCCCCCCO 62a_100000766143_100012232248 [0,1,0,0,0,0|1,0,0]=2 8678 B13R0.336 CCOCCCSCCCCCCO 62a_100012232248_100000766143 [0,1,0,0,0,0|1,0,0]=2 8679 B13R0.336 CCOCCCSCCOCCOC 62a_100000695917_100012232248 [0,1,0,0,0,0|3,0,0]=4 8680 B13R0.336 CCOCCCSCCOCCOC 62a_100012232248_100000695917 [0,1,0,0,0,0|3,0,0]=4 8681 B13R0.336 CCOCCNCCCCCCC#N 2230a_102516460346_100009813337 [0,1,0,0,0,0|2,0,1]=4 8682 B13R0.336 CCOCCNCCCCCCCO 2230a_100011996573_100011215890 [0,1,0,0,0,0|1,0,0]=2 8683 B13R0.336 CCOCCNCCCCCCCO 2230a_102516460346_100000760002 [0,1,0,0,0,0|1,0,0]=2 8684 B13R0.336 CCOCCNCCCCCCCO 34a_100011996573_100000210147 [0,1,0,0,0,0|1,0,0]=2 8685 B13R0.336 CCOCCNCCCCCCCO 34a_102516460346_100000760002 [0,1,0,0,0,0|1,0,0]=2 8686 B13R0.336 CCOCCNCCCCCCOC 2230a_102516460346_100011998445 [0,1,0,0,0,0|2,0,0]=3 8687 B13R0.336 CCOCCNCCCCCCOC 34a_102516460346_100011998445 [0,1,0,0,0,0|2,0,0]=3 8688 B13R0.336 CCOCCNCCCOCCCO 2230a_100011310245_100011215890 [0,1,0,0,0,0|2,0,0]=3 8689 B13R0.336 CCOCCNCCCOCCCO 34a_100011310245_100000210147 [0,1,0,0,0,0|2,0,0]=3 8690 B13R0.336 CCOCCNCCCOCCOC 2230a_100000206027_100011215890 [0,1,0,0,0,0|3,0,0]=4 8691 B13R0.336 CCOCCNCCCOCCOC 2230a_102516460346_100011216529 [0,1,0,0,0,0|3,0,0]=4 8692 B13R0.336 CCOCCNCCCOCCOC 34a_100000206027_100000210147 [0,1,0,0,0,0|3,0,0]=4 8693 B13R0.336 CCOCCNCCCOCCOC 34a_102516460346_100011216529 [0,1,0,0,0,0|3,0,0]=4 8694 B13R0.336 CCOCCOCCCCCCC#N 7a_100000210136_100009813337 [0,1,0,0,0,0|2,0,1]=4 8695 B13R0.336 CCOCCOCCCCCCCBr 34a_100000760002_100000210147 [0,1,0,0,0,0|2,0,0]=3 8696 B13R0.336 CCOCCOCCCCCCCBr 7a_100000760002_100011215890 [0,1,0,0,0,0|2,0,0]=3 8697 B13R0.336 CCOCCOCCCCCCCN 34a_100011996573_100000210147 [0,1,0,0,0,0|2,0,0]=3 8698 B13R0.336 CCOCCOCCCCCCCO 34a_100000210136_100000760002 [0,1,0,0,0,0|1,0,0]=2 8699 B13R0.336 CCOCCOCCCCCCCO 7a_100000210136_100000760002 [0,1,0,0,0,0|1,0,0]=2 8700 B13R0.336 CCOCCOCCCCCCOC 34a_100000210136_100011998445 [0,1,0,0,0,0|2,0,0]=3 8701 B13R0.336 CCOCCOCCCCCCOC 34a_200012092642_100000210147 [0,1,0,0,0,0|2,0,0]=3 8702 B13R0.336 CCOCCOCCCCCCOC 7a_100000210136_100011998445 [0,1,0,0,0,0|2,0,0]=3 8703 B13R0.336 CCOCCOCCCCCCOC 7a_200012092642_100011215890 [0,1,0,0,0,0|2,0,0]=3 8704 B13R0.336 CCOCCOCCCOCCCN 34a_100011310245_100000210147 [0,1,0,0,0,0|3,0,0]=4 8705 B13R0.336 CCOCCOCCCOCCOC 34a_100000210136_100011216529 [0,1,0,0,0,0|3,0,0]=4 8706 B13R0.336 CCOCCOCCCOCCOC 7a_100000210136_100011216529 [0,1,0,0,0,0|3,0,0]=4 8707 B13R0.336 CCOCCOCCNCCCCF 2230a_100102712874_100000729493 [0,1,0,0,0,0|3,0,0]=4 8708 B13R0.336 CCOCCOCCNCCCCF 34a_100102712874_100000729493 [0,1,0,0,0,0|3,0,0]=4 8709 B13R0.336 CCOCCOCCNCCCCO 2230a_100000750430_100011211534 [0,1,0,0,0,0|2,0,0]=3 8710 B13R0.336 CCOCCOCCNCCCCO 2230a_100102712874_100000210776 [0,1,0,0,0,0|2,0,0]=3 8711 B13R0.336 CCOCCOCCNCCCCO 34a_100000750430_100011211534 [0,1,0,0,0,0|2,0,0]=3 8712 B13R0.336 CCOCCOCCNCCCCO 34a_100102712874_100011216708 [0,1,0,0,0,0|2,0,0]=3 8713 B13R0.336 CCOCCOCCNCCCOC 2230a_100102712874_100000740836 [0,1,0,0,0,0|3,0,0]=4 8714 B13R0.336 CCOCCOCCNCCCOC 34a_100102712874_100000740836 [0,1,0,0,0,0|3,0,0]=4 8715 B13R0.336 CCOCCOCCNCCCOC 34a_100150723488_100011211534 [0,1,0,0,0,0|3,0,0]=4 8716 B13R0.336 CCOCCOCCOCCCCBr 34a_100011216708_100011211534 [0,1,0,0,0,0|3,0,0]=4 8717 B13R0.336 CCOCCOCCOCCCCCl 34a_100000210776_100011211534 [0,1,0,0,0,0|3,0,0]=4 8718 B13R0.336 CCOCCOCCOCCCCCl 7a_100000210776_100011211534 [0,1,0,0,0,0|3,0,0]=4 8719 B13R0.336 CCOCCOCCOCCCCF 34a_100000210240_100000729493 [0,1,0,0,0,0|3,0,0]=4 8720 B13R0.336 CCOCCOCCOCCCCF 34a_100011995726_100011211534 [0,1,0,0,0,0|3,0,0]=4 8721 B13R0.336 CCOCCOCCOCCCCF 7a_100000210240_100000729493 [0,1,0,0,0,0|3,0,0]=4 8722 B13R0.336 CCOCCOCCOCCCCF 7a_100011995726_100011211534 [0,1,0,0,0,0|3,0,0]=4 8723 B13R0.336 CCOCCOCCOCCCCI 34a_200012148704_100011211534 [0,1,0,0,0,0|3,0,0]=4 8724 B13R0.336 CCOCCOCCOCCCCN 34a_100000750430_100011211534 [0,1,0,0,0,0|3,0,0]=4 8725 B13R0.336 CCOCCOCCOCCCCO 34a_100000210240_100011216708 [0,1,0,0,0,0|2,0,0]=3 8726 B13R0.336 CCOCCOCCOCCCCO 7a_100000210240_100000210776 [0,1,0,0,0,0|2,0,0]=3 8727 B13R0.336 CCOCCOCCOCCCOC 34a_100000210240_100000740836 [0,1,0,0,0,0|3,0,0]=4 8728 B13R0.336 CCOCCOCCOCCCOC 34a_100000740835_100011211534 [0,1,0,0,0,0|3,0,0]=4 8729 B13R0.336 CCOCCOCCOCCCOC 7a_100000210240_100000740836 [0,1,0,0,0,0|3,0,0]=4 8730 B13R0.336 CCOCCOCCSCCCCF 62a_100000729493_100011211534 [0,1,0,0,0,0|3,0,0]=4 8731 B13R0.336 CCOCCOCCSCCCCF 62a_100011211534_100000729493 [0,1,0,0,0,0|3,0,0]=4 8732 B13R0.336 CCOCCOCCSCCCCO 62a_100000210776_100011211534 [0,1,0,0,0,0|2,0,0]=3 8733 B13R0.336 CCOCCOCCSCCCCO 62a_100011211534_100000210776 [0,1,0,0,0,0|2,0,0]=3 8734 B13R0.336 CCOCCOCCSCCCOC 62a_100000709357_100011211534 [0,1,0,0,0,0|3,0,0]=4 8735 B13R0.336 CCOCCOCCSCCCOC 62a_100011211534_100000709357 [0,1,0,0,0,0|3,0,0]=4 8736 B13R0.336 CCOCCSCCCCCCC#N 62a_100000210147_100009813337 [0,1,0,0,0,0|2,0,1]=4 8737 B13R0.336 CCOCCSCCCCCCC#N 62a_100009813337_100011215890 [0,1,0,0,0,0|2,0,1]=4 8738 B13R0.336 CCOCCSCCCCCCCO 62a_100000210147_100000760002 [0,1,0,0,0,0|1,0,0]=2 8739 B13R0.336 CCOCCSCCCCCCCO 62a_100000760002_100011215890 [0,1,0,0,0,0|1,0,0]=2 8740 B13R0.336 CCOCCSCCCCCCOC 62a_100000210147_100011998445 [0,1,0,0,0,0|2,0,0]=3 8741 B13R0.336 CCOCCSCCCCCCOC 62a_100011998445_100011215890 [0,1,0,0,0,0|2,0,0]=3 8742 B13R0.336 CCOCCSCCCOCCOC 62a_100000210147_100011216529 [0,1,0,0,0,0|3,0,0]=4 8743 B13R0.336 CCOCCSCCCOCCOC 62a_100011216529_100011215890 [0,1,0,0,0,0|3,0,0]=4 8744 B13R0.336 CCOCSCCCCCCCCO 62a_100000033203_100000739092 [0,1,0,0,0,0|1,0,0]=2 8745 B13R0.336 CCOCSCCCCCCCCO 62a_100000739092_100000033203 [0,1,0,0,0,0|1,0,0]=2 8746 B13R0.336 CCOCSCCOCCOCCO 62a_100000032323_100000739092 [0,1,0,0,0,0|3,0,0]=4 8747 B13R0.336 CCOCSCCOCCOCCO 62a_100000739092_100000032323 [0,1,0,0,0,0|3,0,0]=4 8748 B13R0.336 CCSCCCCCCCCCCO 62a_100000210202_200000033068 [0,1,0,0,0,0|0,0,0]=1 8749 B13R0.336 CCSCCCCCCCCCCO 62a_100009813290_100000210202 [0,1,0,0,0,0|0,0,0]=1 8750 B13R0.336 CCSCCCOCCCCCC#N 7a_100011216438_100009813376 [0,1,0,0,0,0|2,0,1]=4 8751 B13R0.336 CCSCCCOCCCCCC=O 7a_100011216438_100000139337 [0,1,0,0,0,0|1,0,2]=4 8752 B13R0.336 CCSCCCOCCCCCCF 34a_100011216438_100015922095 [0,1,0,0,0,0|2,0,0]=3 8753 B13R0.336 CCSCCCOCCCCCCF 7a_100011216438_100015922095 [0,1,0,0,0,0|2,0,0]=3 8754 B13R0.336 CCSCCCOCCCCCCO 34a_100011216438_100000766143 [0,1,0,0,0,0|1,0,0]=2 8755 B13R0.336 CCSCCCOCCCCCCO 7a_100011216438_100000766143 [0,1,0,0,0,0|1,0,0]=2 8756 B13R0.336 CCSCCCOCCOCCOC 34a_100011216438_100000695917 [0,1,0,0,0,0|3,0,0]=4 8757 B13R0.336 CCSCCCOCCOCCOC 7a_100011216438_100000695917 [0,1,0,0,0,0|3,0,0]=4 8758 B13R0.336 CCSCCNCCCCCCC#N 2230a_100000106463_100009813337 [0,1,0,0,0,0|2,0,1]=4 8759 B13R0.336 CCSCCNCCCCCCCO 2230a_100000106463_100000760002 [0,1,0,0,0,0|1,0,0]=2 8760 B13R0.336 CCSCCNCCCCCCCO 2230a_100011996573_100000757381 [0,1,0,0,0,0|1,0,0]=2 8761 B13R0.336 CCSCCNCCCCCCCO 34a_100011996573_100000757381 [0,1,0,0,0,0|1,0,0]=2 8762 B13R0.336 CCSCCNCCCCCCOC 2230a_100000106463_100011998445 [0,1,0,0,0,0|2,0,0]=3 8763 B13R0.336 CCSCCNCCCOCCCO 2230a_100011310245_100000757381 [0,1,0,0,0,0|2,0,0]=3 8764 B13R0.336 CCSCCNCCCOCCCO 34a_100011310245_100000757381 [0,1,0,0,0,0|2,0,0]=3 8765 B13R0.336 CCSCCNCCCOCCOC 2230a_100000106463_100011216529 [0,1,0,0,0,0|3,0,0]=4 8766 B13R0.336 CCSCCNCCCOCCOC 2230a_100000206027_100000757381 [0,1,0,0,0,0|3,0,0]=4 8767 B13R0.336 CCSCCNCCCOCCOC 34a_100000206027_100000757381 [0,1,0,0,0,0|3,0,0]=4 8768 B13R0.336 CCSCCOCCCCCCC#N 7a_100000212035_100009813337 [0,1,0,0,0,0|2,0,1]=4 8769 B13R0.336 CCSCCOCCCCCCCBr 34a_100000760002_100000757381 [0,1,0,0,0,0|2,0,0]=3 8770 B13R0.336 CCSCCOCCCCCCCBr 7a_100000760002_100000757381 [0,1,0,0,0,0|2,0,0]=3 8771 B13R0.336 CCSCCOCCCCCCCN 34a_100011996573_100000757381 [0,1,0,0,0,0|2,0,0]=3 8772 B13R0.336 CCSCCOCCCCCCCO 34a_100000212035_100000760002 [0,1,0,0,0,0|1,0,0]=2 8773 B13R0.336 CCSCCOCCCCCCCO 7a_100000212035_100000760002 [0,1,0,0,0,0|1,0,0]=2 8774 B13R0.336 CCSCCOCCCCCCOC 34a_100000212035_100011998445 [0,1,0,0,0,0|2,0,0]=3 8775 B13R0.336 CCSCCOCCCCCCOC 34a_200012092642_100000757381 [0,1,0,0,0,0|2,0,0]=3 8776 B13R0.336 CCSCCOCCCCCCOC 7a_100000212035_100011998445 [0,1,0,0,0,0|2,0,0]=3 8777 B13R0.336 CCSCCOCCCCCCOC 7a_200012092642_100000757381 [0,1,0,0,0,0|2,0,0]=3 8778 B13R0.336 CCSCCOCCCOCCCN 34a_100011310245_100000757381 [0,1,0,0,0,0|3,0,0]=4 8779 B13R0.336 CCSCCOCCCOCCOC 34a_100000212035_100011216529 [0,1,0,0,0,0|3,0,0]=4 8780 B13R0.336 CCSCCOCCCOCCOC 7a_100000212035_100011216529 [0,1,0,0,0,0|3,0,0]=4 8781 B13R0.336 CCSCCSCCCCCCC#N 62a_100000757381_100009813337 [0,1,0,0,0,0|2,0,1]=4 8782 B13R0.336 CCSCCSCCCCCCC#N 62a_100009813337_100000757381 [0,1,0,0,0,0|2,0,1]=4 8783 B13R0.336 CCSCCSCCCCCCCO 62a_100000757381_100000760002 [0,1,0,0,0,0|1,0,0]=2 8784 B13R0.336 CCSCCSCCCCCCCO 62a_100000760002_100000757381 [0,1,0,0,0,0|1,0,0]=2 8785 B13R0.336 CCSCCSCCCCCCOC 62a_100000757381_100011998445 [0,1,0,0,0,0|2,0,0]=3 8786 B13R0.336 CCSCCSCCCCCCOC 62a_100011998445_100000757381 [0,1,0,0,0,0|2,0,0]=3 8787 B13R0.336 CCSCCSCCCOCCOC 62a_100000757381_100011216529 [0,1,0,0,0,0|3,0,0]=4 8788 B13R0.336 CCSCCSCCCOCCOC 62a_100011216529_100000757381 [0,1,0,0,0,0|3,0,0]=4 8789 B13R0.336 CNCCCCCCCCCCCO 2230a_106832991635_100009812471 [0,1,0,0,0,0|0,0,0]=1 8790 B13R0.336 CNCCCCCCCCCCCO 34a_100102657272_100009812471 [0,1,0,0,0,0|0,0,0]=1 8791 B13R0.336 CNCCCCCCCCCCCO 7a_106832991635_100009812471 [0,1,0,0,0,0|0,0,0]=1 8792 B13R0.336 CNCCCCCOCCCCCF 34a_100000722520_100000729378 [0,1,0,0,0,0|2,0,0]=3 8793 B13R0.336 CNCCCCCOCCCCCO 34a_100000722520_100000746330 [0,1,0,0,0,0|1,0,0]=2 8794 B13R0.336 CNCCCCCOCCCCOC 34a_100000722520_100000755781 [0,1,0,0,0,0|2,0,0]=3 8795 B13R0.336 CNCCCCCOCCOCCO 34a_100000722520_100000692535 [0,1,0,0,0,0|2,0,0]=3 8796 B13R0.336 CNCCCOCCCCCCCO 34a_100000213112_100000760002 [0,1,0,0,0,0|1,0,0]=2 8797 B13R0.336 CNCCCOCCCCCCOC 34a_100000213112_100011998445 [0,1,0,0,0,0|2,0,0]=3 8798 B13R0.336 CNCCCOCCCOCCOC 34a_100000213112_100011216529 [0,1,0,0,0,0|3,0,0]=4 8799 B13R0.336 CNCCOCCOCCCCCF 34a_100000228057_100000729378 [0,1,0,0,0,0|3,0,0]=4 8800 B13R0.336 CNCCOCCOCCCCCO 34a_100000228057_100000746330 [0,1,0,0,0,0|2,0,0]=3 8801 B13R0.336 CNCCOCCOCCCCOC 34a_100000228057_100000755781 [0,1,0,0,0,0|3,0,0]=4 8802 B13R0.336 CNCCOCCOCCOCCO 2230a_103437854208_200000210301 [0,1,0,0,0,0|3,0,0]=4 8803 B13R0.336 CNCCOCCOCCOCCO 2230a_106832991635_100010166562 [0,1,0,0,0,0|3,0,0]=4 8804 B13R0.336 CNCCOCCOCCOCCO 34a_100000228057_100000692535 [0,1,0,0,0,0|3,0,0]=4 8805 B13R0.336 CNCCOCCOCCOCCO 34a_100102657272_100010166562 [0,1,0,0,0,0|3,0,0]=4 8806 B13R0.336 CNCCOCCOCCOCCO 34a_103437854208_200000210301 [0,1,0,0,0,0|3,0,0]=4 8807 B13R0.336 CNCCOCCOCCOCCO 34a_200014138305_100000211926 [0,1,0,0,0,0|3,0,0]=4 8808 B13R0.336 CNCCOCCOCCOCCO 7a_106832991635_100010166562 [0,1,0,0,0,0|3,0,0]=4 8809 B13R0.336 COCCCCCCCCCCCBr 34a_100009812471_200000210301 [0,1,0,0,0,0|1,0,0]=2 8810 B13R0.336 COCCCCCCCCCCCBr 7a_100009812471_200000210301 [0,1,0,0,0,0|1,0,0]=2 8811 B13R0.336 COCCCCCCCCCCCO 34a_100138415774_100009812471 [0,1,0,0,0,0|0,0,0]=1 8812 B13R0.336 COCCCCCCNCCCCO 2230a_100000750430_100011998445 [0,1,0,0,0,0|1,0,0]=2 8813 B13R0.336 COCCCCCCNCCCCO 34a_100000750430_100011998445 [0,1,0,0,0,0|1,0,0]=2 8814 B13R0.336 COCCCCCCNCCCOC 34a_100150723488_100011998445 [0,1,0,0,0,0|2,0,0]=3 8815 B13R0.336 COCCCCCCNCCCSC 2230a_100000749238_100011998445 [0,1,0,0,0,0|2,0,0]=3 8816 B13R0.336 COCCCCCCOCC#CCO 34a_200012092642_200000047223 [0,1,0,0,0,0|1,0,2]=4 8817 B13R0.336 COCCCCCCOCC#CCO 7a_200012092642_200000047223 [0,1,0,0,0,0|1,0,2]=4 8818 B13R0.336 COCCCCCCOCCCC#N 7a_200012092642_100000687738 [0,1,0,0,0,0|2,0,1]=4 8819 B13R0.336 COCCCCCCOCCCC=O 7a_200012092642_200011292268 [0,1,0,0,0,0|1,0,2]=4 8820 B13R0.336 COCCCCCCOCCCCBr 34a_100011216708_100011998445 [0,1,0,0,0,0|2,0,0]=3 8821 B13R0.336 COCCCCCCOCCCCCl 34a_100000210776_100011998445 [0,1,0,0,0,0|2,0,0]=3 8822 B13R0.336 COCCCCCCOCCCCCl 7a_100000210776_100011998445 [0,1,0,0,0,0|2,0,0]=3 8823 B13R0.336 COCCCCCCOCCCCF 34a_100011995726_100011998445 [0,1,0,0,0,0|2,0,0]=3 8824 B13R0.336 COCCCCCCOCCCCF 34a_200012092642_100000729493 [0,1,0,0,0,0|2,0,0]=3 8825 B13R0.336 COCCCCCCOCCCCF 7a_100011995726_100011998445 [0,1,0,0,0,0|2,0,0]=3 8826 B13R0.336 COCCCCCCOCCCCF 7a_200012092642_100000729493 [0,1,0,0,0,0|2,0,0]=3 8827 B13R0.336 COCCCCCCOCCCCI 34a_200012148704_100011998445 [0,1,0,0,0,0|2,0,0]=3 8828 B13R0.336 COCCCCCCOCCCCN 34a_100000750430_100011998445 [0,1,0,0,0,0|2,0,0]=3 8829 B13R0.336 COCCCCCCOCCCCO 34a_200012092642_100011216708 [0,1,0,0,0,0|1,0,0]=2 8830 B13R0.336 COCCCCCCOCCCCO 7a_200012092642_100000210776 [0,1,0,0,0,0|1,0,0]=2 8831 B13R0.336 COCCCCCCOCCCOC 34a_100000740835_100011998445 [0,1,0,0,0,0|2,0,0]=3 8832 B13R0.336 COCCCCCCOCCCOC 34a_200012092642_100000740836 [0,1,0,0,0,0|2,0,0]=3 8833 B13R0.336 COCCCCCCOCCCOC 7a_200012092642_100000740836 [0,1,0,0,0,0|2,0,0]=3 8834 B13R0.336 COCCCCCCOCCCSC 34a_100000690336_100011998445 [0,1,0,0,0,0|2,0,0]=3 8835 B13R0.336 COCCCCCCOCCCSC 7a_100000690336_100011998445 [0,1,0,0,0,0|2,0,0]=3 8836 B13R0.336 COCCCCCCSCC#CCO 62a_100011998445_200000047223 [0,1,0,0,0,0|1,0,2]=4 8837 B13R0.336 COCCCCCCSCC#CCO 62a_200000047223_100011998445 [0,1,0,0,0,0|1,0,2]=4 8838 B13R0.336 COCCCCCCSCCCC#N 62a_100000687738_100011998445 [0,1,0,0,0,0|2,0,1]=4 8839 B13R0.336 COCCCCCCSCCCC#N 62a_100011998445_100000687738 [0,1,0,0,0,0|2,0,1]=4 8840 B13R0.336 COCCCCCCSCCCC=O 62a_100011998445_200011292268 [0,1,0,0,0,0|1,0,2]=4 8841 B13R0.336 COCCCCCCSCCCC=O 62a_200011292268_100011998445 [0,1,0,0,0,0|1,0,2]=4 8842 B13R0.336 COCCCCCCSCCCCF 62a_100000729493_100011998445 [0,1,0,0,0,0|2,0,0]=3 8843 B13R0.336 COCCCCCCSCCCCF 62a_100011998445_100000729493 [0,1,0,0,0,0|2,0,0]=3 8844 B13R0.336 COCCCCCCSCCCCO 62a_100000210776_100011998445 [0,1,0,0,0,0|1,0,0]=2 8845 B13R0.336 COCCCCCCSCCCCO 62a_100011998445_100000210776 [0,1,0,0,0,0|1,0,0]=2 8846 B13R0.336 COCCCCCCSCCCOC 62a_100000709357_100011998445 [0,1,0,0,0,0|2,0,0]=3 8847 B13R0.336 COCCCCCCSCCCOC 62a_100011998445_100000709357 [0,1,0,0,0,0|2,0,0]=3 8848 B13R0.336 COCCCCCNCCCCC#N 2230a_100000747528_100000211819 [0,1,0,0,0,0|2,0,1]=4 8849 B13R0.336 COCCCCCNCCCCC=O 2230a_100000747528_100000139335 [0,1,0,0,0,0|1,0,2]=4 8850 B13R0.336 COCCCCCNCCCCCF 2230a_100000747528_100000729378 [0,1,0,0,0,0|2,0,0]=3 8851 B13R0.336 COCCCCCNCCCCCF 34a_100000747528_100000729378 [0,1,0,0,0,0|2,0,0]=3 8852 B13R0.336 COCCCCCNCCCCCO 2230a_100000747528_100000746330 [0,1,0,0,0,0|1,0,0]=2 8853 B13R0.336 COCCCCCNCCCCCO 34a_100000747528_100000746330 [0,1,0,0,0,0|1,0,0]=2 8854 B13R0.336 COCCCCCNCCCCOC 2230a_100000747528_100000730899 [0,1,0,0,0,0|2,0,0]=3 8855 B13R0.336 COCCCCCNCCCCOC 34a_100000747528_100000755781 [0,1,0,0,0,0|2,0,0]=3 8856 B13R0.336 COCCCCCNCCOCCO 2230a_100000747528_100011215305 [0,1,0,0,0,0|2,0,0]=3 8857 B13R0.336 COCCCCCNCCOCCO 34a_100000747528_100000692535 [0,1,0,0,0,0|2,0,0]=3 8858 B13R0.336 COCCCCCNCOCCOC 2230a_100000747528_100000231047 [0,1,0,0,0,0|3,0,0]=4 8859 B13R0.336 COCCCCNCCCCCCO 2230a_100000686447_100000730899 [0,1,0,0,0,0|1,0,0]=2 8860 B13R0.336 COCCCCNCCCCCCO 34a_100000686447_100000755781 [0,1,0,0,0,0|1,0,0]=2 8861 B13R0.336 COCCCCNCCOCCOC 2230a_100000745349_100000730899 [0,1,0,0,0,0|3,0,0]=4 8862 B13R0.336 COCCCCNCCOCCOC 34a_100000745349_100000755781 [0,1,0,0,0,0|3,0,0]=4 8863 B13R0.336 COCCCCOCCCCCCBr 34a_100011215345_100000755781 [0,1,0,0,0,0|2,0,0]=3 8864 B13R0.336 COCCCCOCCCCCCBr 7a_100011215345_100000730899 [0,1,0,0,0,0|2,0,0]=3 8865 B13R0.336 COCCCCOCCCCCCCl 34a_100000766143_100000755781 [0,1,0,0,0,0|2,0,0]=3 8866 B13R0.336 COCCCCOCCCCCCCl 7a_100000766143_100000730899 [0,1,0,0,0,0|2,0,0]=3 8867 B13R0.336 COCCCCOCCCCCCF 34a_100000732779_100000755781 [0,1,0,0,0,0|2,0,0]=3 8868 B13R0.336 COCCCCOCCCCCCF 34a_100000740925_100015922095 [0,1,0,0,0,0|2,0,0]=3 8869 B13R0.336 COCCCCOCCCCCCF 7a_100000732779_100000730899 [0,1,0,0,0,0|2,0,0]=3 8870 B13R0.336 COCCCCOCCCCCCN 34a_100000686447_100000755781 [0,1,0,0,0,0|2,0,0]=3 8871 B13R0.336 COCCCCOCCCCCCO 34a_100000740925_100000766143 [0,1,0,0,0,0|1,0,0]=2 8872 B13R0.336 COCCCCOCCOCCOC 34a_100000740925_100000695917 [0,1,0,0,0,0|3,0,0]=4 8873 B13R0.336 COCCCCOCCOCCOC 34a_100011215163_100000755781 [0,1,0,0,0,0|3,0,0]=4 8874 B13R0.336 COCCCCOCCOCCOC 7a_100011215163_100000730899 [0,1,0,0,0,0|3,0,0]=4 8875 B13R0.336 COCCCCSCCCCCC#N 62a_100000730899_100009813376 [0,1,0,0,0,0|2,0,1]=4 8876 B13R0.336 COCCCCSCCCCCC#N 62a_100009813376_100000730899 [0,1,0,0,0,0|2,0,1]=4 8877 B13R0.336 COCCCCSCCCCCC=O 62a_100000139337_100000730899 [0,1,0,0,0,0|1,0,2]=4 8878 B13R0.336 COCCCCSCCCCCC=O 62a_100000730899_100000139337 [0,1,0,0,0,0|1,0,2]=4 8879 B13R0.336 COCCCCSCCCCCCF 62a_100000730899_100015922095 [0,1,0,0,0,0|2,0,0]=3 8880 B13R0.336 COCCCCSCCCCCCF 62a_100015922095_100000730899 [0,1,0,0,0,0|2,0,0]=3 8881 B13R0.336 COCCCCSCCCCCCO 62a_100000730899_100000766143 [0,1,0,0,0,0|1,0,0]=2 8882 B13R0.336 COCCCCSCCCCCCO 62a_100000766143_100000730899 [0,1,0,0,0,0|1,0,0]=2 8883 B13R0.336 COCCCCSCCOCCOC 62a_100000695917_100000730899 [0,1,0,0,0,0|3,0,0]=4 8884 B13R0.336 COCCCCSCCOCCOC 62a_100000730899_100000695917 [0,1,0,0,0,0|3,0,0]=4 8885 B13R0.336 COCCCNCCCCCCCO 2230a_100011996573_100000740836 [0,1,0,0,0,0|1,0,0]=2 8886 B13R0.336 COCCCNCCCCCCCO 34a_100011996573_100000740836 [0,1,0,0,0,0|1,0,0]=2 8887 B13R0.336 COCCCNCCCCCCCO 34a_100150723488_100000760002 [0,1,0,0,0,0|1,0,0]=2 8888 B13R0.336 COCCCNCCCOCCCO 2230a_100011310245_100000740836 [0,1,0,0,0,0|2,0,0]=3 8889 B13R0.336 COCCCNCCCOCCCO 34a_100011310245_100000740836 [0,1,0,0,0,0|2,0,0]=3 8890 B13R0.336 COCCCNCCCOCCOC 2230a_100000206027_100000740836 [0,1,0,0,0,0|3,0,0]=4 8891 B13R0.336 COCCCNCCCOCCOC 34a_100000206027_100000740836 [0,1,0,0,0,0|3,0,0]=4 8892 B13R0.336 COCCCNCCCOCCOC 34a_100150723488_100011216529 [0,1,0,0,0,0|3,0,0]=4 8893 B13R0.336 COCCCOCCCCCCCBr 34a_100000760002_100000740836 [0,1,0,0,0,0|2,0,0]=3 8894 B13R0.336 COCCCOCCCCCCCBr 7a_100000760002_100000740836 [0,1,0,0,0,0|2,0,0]=3 8895 B13R0.336 COCCCOCCCCCCCN 34a_100011996573_100000740836 [0,1,0,0,0,0|2,0,0]=3 8896 B13R0.336 COCCCOCCCCCCCO 34a_100000740835_100000760002 [0,1,0,0,0,0|1,0,0]=2 8897 B13R0.336 COCCCOCCCOCCCF 34a_200011215475_100011934791 [0,1,0,0,0,0|3,0,0]=4 8898 B13R0.336 COCCCOCCCOCCCF 7a_200011215475_100011934791 [0,1,0,0,0,0|3,0,0]=4 8899 B13R0.336 COCCCOCCCOCCCN 34a_100011310245_100000740836 [0,1,0,0,0,0|3,0,0]=4 8900 B13R0.336 COCCCOCCCOCCCO 34a_200011215475_100000230001 [0,1,0,0,0,0|2,0,0]=3 8901 B13R0.336 COCCCOCCCOCCCO 7a_200011215475_100011215043 [0,1,0,0,0,0|2,0,0]=3 8902 B13R0.336 COCCCOCCCOCCOC 34a_100000740835_100011216529 [0,1,0,0,0,0|3,0,0]=4 8903 B13R0.336 COCCCOCCCOCCOC 34a_200011215475_100011201679 [0,1,0,0,0,0|3,0,0]=4 8904 B13R0.336 COCCCOCCCOCCOC 7a_200011215475_100000233755 [0,1,0,0,0,0|3,0,0]=4 8905 B13R0.336 COCCCOCCCOCCSC 34a_200011215475_100000212216 [0,1,0,0,0,0|3,0,0]=4 8906 B13R0.336 COCCCOCCCOCCSC 7a_200011215475_100000212216 [0,1,0,0,0,0|3,0,0]=4 8907 B13R0.336 COCCCSCCCCCCC#N 62a_100000709357_100009813337 [0,1,0,0,0,0|2,0,1]=4 8908 B13R0.336 COCCCSCCCCCCC#N 62a_100009813337_100000709357 [0,1,0,0,0,0|2,0,1]=4 8909 B13R0.336 COCCCSCCCCCCCO 62a_100000709357_100000760002 [0,1,0,0,0,0|1,0,0]=2 8910 B13R0.336 COCCCSCCCCCCCO 62a_100000760002_100000709357 [0,1,0,0,0,0|1,0,0]=2 8911 B13R0.336 COCCCSCCCOCCOC 62a_100000709357_100011216529 [0,1,0,0,0,0|3,0,0]=4 8912 B13R0.336 COCCCSCCCOCCOC 62a_100011216529_100000709357 [0,1,0,0,0,0|3,0,0]=4 8913 B13R0.336 COCCNCCCCCCCCO 2230a_100000209980_100000033203 [0,1,0,0,0,0|1,0,0]=2 8914 B13R0.336 COCCNCCCCCCCCO 2230a_102515433106_100011201679 [0,1,0,0,0,0|1,0,0]=2 8915 B13R0.336 COCCNCCCCCCCCO 34a_102515433106_100011201679 [0,1,0,0,0,0|1,0,0]=2 8916 B13R0.336 COCCNCCOCCOCCO 2230a_100000209980_100000032323 [0,1,0,0,0,0|3,0,0]=4 8917 B13R0.336 COCCNCCOCCOCCO 2230a_100011998139_100011201679 [0,1,0,0,0,0|3,0,0]=4 8918 B13R0.336 COCCNCCOCCOCCO 34a_100011998139_100011201679 [0,1,0,0,0,0|3,0,0]=4 8919 B13R0.336 COCCOCCCCCCCCBr 34a_100009813846_100011201679 [0,1,0,0,0,0|2,0,0]=3 8920 B13R0.336 COCCOCCCCCCCCBr 7a_100009813846_100000233755 [0,1,0,0,0,0|2,0,0]=3 8921 B13R0.336 COCCOCCCCCCCCCl 34a_100000033203_100011201679 [0,1,0,0,0,0|2,0,0]=3 8922 B13R0.336 COCCOCCCCCCCCCl 7a_100000033203_100000233755 [0,1,0,0,0,0|2,0,0]=3 8923 B13R0.336 COCCOCCCCCCCCN 34a_102515433106_100011201679 [0,1,0,0,0,0|2,0,0]=3 8924 B13R0.336 COCCOCCCCCCCCO 34a_100000210237_100000033203 [0,1,0,0,0,0|1,0,0]=2 8925 B13R0.336 COCCOCCCCCNCCN 34a_103619048469_100011201679 [0,1,0,0,0,0|3,0,0]=4 8926 B13R0.336 COCCOCCCNCCCCF 2230a_100000206027_100000729493 [0,1,0,0,0,0|3,0,0]=4 8927 B13R0.336 COCCOCCCNCCCCF 34a_100000206027_100000729493 [0,1,0,0,0,0|3,0,0]=4 8928 B13R0.336 COCCOCCCNCCCCO 2230a_100000206027_100000210776 [0,1,0,0,0,0|2,0,0]=3 8929 B13R0.336 COCCOCCCNCCCCO 2230a_100000750430_100011216529 [0,1,0,0,0,0|2,0,0]=3 8930 B13R0.336 COCCOCCCNCCCCO 34a_100000206027_100011216708 [0,1,0,0,0,0|2,0,0]=3 8931 B13R0.336 COCCOCCCNCCCCO 34a_100000750430_100011216529 [0,1,0,0,0,0|2,0,0]=3 8932 B13R0.336 COCCOCCCNCCCSC 2230a_100000749238_100011216529 [0,1,0,0,0,0|3,0,0]=4 8933 B13R0.336 COCCOCCCOCCCCBr 34a_100011216708_100011216529 [0,1,0,0,0,0|3,0,0]=4 8934 B13R0.336 COCCOCCCOCCCCCl 34a_100000210776_100011216529 [0,1,0,0,0,0|3,0,0]=4 8935 B13R0.336 COCCOCCCOCCCCCl 7a_100000210776_100011216529 [0,1,0,0,0,0|3,0,0]=4 8936 B13R0.336 COCCOCCCOCCCCF 34a_100011995726_100011216529 [0,1,0,0,0,0|3,0,0]=4 8937 B13R0.336 COCCOCCCOCCCCF 7a_100011995726_100011216529 [0,1,0,0,0,0|3,0,0]=4 8938 B13R0.336 COCCOCCCOCCCCI 34a_200012148704_100011216529 [0,1,0,0,0,0|3,0,0]=4 8939 B13R0.336 COCCOCCCOCCCCN 34a_100000750430_100011216529 [0,1,0,0,0,0|3,0,0]=4 8940 B13R0.336 COCCOCCCOCCCSC 34a_100000690336_100011216529 [0,1,0,0,0,0|3,0,0]=4 8941 B13R0.336 COCCOCCCOCCCSC 7a_100000690336_100011216529 [0,1,0,0,0,0|3,0,0]=4 8942 B13R0.336 COCCOCCCSCCCCF 62a_100000729493_100011216529 [0,1,0,0,0,0|3,0,0]=4 8943 B13R0.336 COCCOCCCSCCCCF 62a_100011216529_100000729493 [0,1,0,0,0,0|3,0,0]=4 8944 B13R0.336 COCCOCCCSCCCCO 62a_100000210776_100011216529 [0,1,0,0,0,0|2,0,0]=3 8945 B13R0.336 COCCOCCCSCCCCO 62a_100011216529_100000210776 [0,1,0,0,0,0|2,0,0]=3 8946 B13R0.336 COCCOCCNCCCCCF 2230a_100000745349_100000729378 [0,1,0,0,0,0|3,0,0]=4 8947 B13R0.336 COCCOCCNCCCCCF 34a_100000745349_100000729378 [0,1,0,0,0,0|3,0,0]=4 8948 B13R0.336 COCCOCCNCCCCCO 2230a_100000745349_100000746330 [0,1,0,0,0,0|2,0,0]=3 8949 B13R0.336 COCCOCCNCCCCCO 2230a_100000762737_100000695917 [0,1,0,0,0,0|2,0,0]=3 8950 B13R0.336 COCCOCCNCCCCCO 34a_100000745349_100000746330 [0,1,0,0,0,0|2,0,0]=3 8951 B13R0.336 COCCOCCNCCCCCO 34a_100000762737_100000695917 [0,1,0,0,0,0|2,0,0]=3 8952 B13R0.336 COCCOCCNCCOCCO 2230a_100000211614_100000695917 [0,1,0,0,0,0|3,0,0]=4 8953 B13R0.336 COCCOCCNCCOCCO 2230a_100000745349_100011215305 [0,1,0,0,0,0|3,0,0]=4 8954 B13R0.336 COCCOCCNCCOCCO 34a_100000211614_100000695917 [0,1,0,0,0,0|3,0,0]=4 8955 B13R0.336 COCCOCCNCCOCCO 34a_100000745349_100000692535 [0,1,0,0,0,0|3,0,0]=4 8956 B13R0.336 COCCOCCNCCSCCO 2230a_100011219999_100000695917 [0,1,0,0,0,0|3,0,0]=4 8957 B13R0.336 COCCOCCOCCCCCBr 34a_100000746331_100000695917 [0,1,0,0,0,0|3,0,0]=4 8958 B13R0.336 COCCOCCOCCCCCBr 7a_100000746331_100000695917 [0,1,0,0,0,0|3,0,0]=4 8959 B13R0.336 COCCOCCOCCCCCCl 34a_100000746330_100000695917 [0,1,0,0,0,0|3,0,0]=4 8960 B13R0.336 COCCOCCOCCCCCCl 7a_100000746330_100000695917 [0,1,0,0,0,0|3,0,0]=4 8961 B13R0.336 COCCOCCOCCCCCF 34a_100011215163_100000729378 [0,1,0,0,0,0|3,0,0]=4 8962 B13R0.336 COCCOCCOCCCCCF 7a_100011215163_100000729378 [0,1,0,0,0,0|3,0,0]=4 8963 B13R0.336 COCCOCCOCCCCCI 34a_200012148887_100000695917 [0,1,0,0,0,0|3,0,0]=4 8964 B13R0.336 COCCOCCOCCCCCI 7a_200012148887_100000695917 [0,1,0,0,0,0|3,0,0]=4 8965 B13R0.336 COCCOCCOCCCCCN 34a_100000762737_100000695917 [0,1,0,0,0,0|3,0,0]=4 8966 B13R0.336 COCCOCCOCCCCCO 34a_100011215163_100000746330 [0,1,0,0,0,0|2,0,0]=3 8967 B13R0.336 COCCOCCOCCCCCO 7a_100011215163_100000746330 [0,1,0,0,0,0|2,0,0]=3 8968 B13R0.336 COCCOCCOCCCCSC 34a_100011217163_100000695917 [0,1,0,0,0,0|3,0,0]=4 8969 B13R0.336 COCCOCCOCCCCSC 7a_100011217163_100000695917 [0,1,0,0,0,0|3,0,0]=4 8970 B13R0.336 COCCOCCOCCNCCO 2230a_100012028300_100000211926 [0,1,0,0,0,0|3,0,0]=4 8971 B13R0.336 COCCOCCOCCNCCO 2230a_100016997473_100013367474 [0,1,0,0,0,0|3,0,0]=4 8972 B13R0.336 COCCOCCOCCNCCO 34a_100012028300_100000211926 [0,1,0,0,0,0|3,0,0]=4 8973 B13R0.336 COCCOCCOCCNCCO 34a_100016990907_100013367474 [0,1,0,0,0,0|3,0,0]=4 8974 B13R0.336 COCCOCCOCCOCCO 34a_100000210237_100000032323 [0,1,0,0,0,0|3,0,0]=4 8975 B13R0.336 COCCOCCOCCOCCO 34a_100000688194_100000211926 [0,1,0,0,0,0|3,0,0]=4 8976 B13R0.336 COCCOCCOCCOCCO 34a_100011215163_100000692535 [0,1,0,0,0,0|3,0,0]=4 8977 B13R0.336 COCCOCCOCCOCCO 34a_100138415774_100010166562 [0,1,0,0,0,0|3,0,0]=4 8978 B13R0.336 COCCOCCOCCOCCO 7a_100000688194_100000211926 [0,1,0,0,0,0|3,0,0]=4 8979 B13R0.336 COCCOCCOCCOCCO 7a_100011215163_100011215305 [0,1,0,0,0,0|3,0,0]=4 8980 B13R0.336 COCCOCCOCCSCCO 62a_100000211926_100013367474 [0,1,0,0,0,0|3,0,0]=4 8981 B13R0.336 COCCOCCOCCSCCO 62a_100013367474_100000211926 [0,1,0,0,0,0|3,0,0]=4 8982 B13R0.336 COCCOCCSCCCCCF 62a_100000695917_100000729378 [0,1,0,0,0,0|3,0,0]=4 8983 B13R0.336 COCCOCCSCCCCCF 62a_100000729378_100000695917 [0,1,0,0,0,0|3,0,0]=4 8984 B13R0.336 COCCOCCSCCCCCO 62a_100000695917_100000746330 [0,1,0,0,0,0|2,0,0]=3 8985 B13R0.336 COCCOCCSCCCCCO 62a_100000746330_100000695917 [0,1,0,0,0,0|2,0,0]=3 8986 B13R0.336 COCCOCCSCCOCCO 62a_100000695917_100011215305 [0,1,0,0,0,0|3,0,0]=4 8987 B13R0.336 COCCOCCSCCOCCO 62a_100011215305_100000695917 [0,1,0,0,0,0|3,0,0]=4 8988 B13R0.336 COCCOCNCCCCCCO 2230a_100000686447_100000231047 [0,1,0,0,0,0|2,0,0]=3 8989 B13R0.336 COCCOCSCCCCCCF 62a_100000231047_100015922095 [0,1,0,0,0,0|3,0,0]=4 8990 B13R0.336 COCCOCSCCCCCCF 62a_100015922095_100000231047 [0,1,0,0,0,0|3,0,0]=4 8991 B13R0.336 COCCOCSCCCCCCO 62a_100000231047_100000766143 [0,1,0,0,0,0|2,0,0]=3 8992 B13R0.336 COCCOCSCCCCCCO 62a_100000766143_100000231047 [0,1,0,0,0,0|2,0,0]=3 8993 B13R0.336 COCCSCCCCCCCCO 62a_100000033203_100000233755 [0,1,0,0,0,0|1,0,0]=2 8994 B13R0.336 COCCSCCCCCCCCO 62a_100000233755_100000033203 [0,1,0,0,0,0|1,0,0]=2 8995 B13R0.336 COCCSCCOCCOCCO 62a_100000032323_100000233755 [0,1,0,0,0,0|3,0,0]=4 8996 B13R0.336 COCCSCCOCCOCCO 62a_100000233755_100000032323 [0,1,0,0,0,0|3,0,0]=4 8997 B13R0.336 COCNCCCCCCCCCO 2230a_100000078944_100000766300 [0,1,0,0,0,0|1,0,0]=2 8998 B13R0.336 COCNCCCOCCOCCO 2230a_100011996194_100000766300 [0,1,0,0,0,0|3,0,0]=4 8999 B13R0.336 COCSCCCCCCCCCO 62a_100000766300_100009813782 [0,1,0,0,0,0|1,0,0]=2 9000 B13R0.336 COCSCCCCCCCCCO 62a_100009813782_100000766300 [0,1,0,0,0,0|1,0,0]=2 9001 B13R0.336 CSCCCCCCCCCCCO 62a_100009812471_200000210301 [0,1,0,0,0,0|0,0,0]=1 9002 B13R0.336 CSCCCCOCCCCCC#N 7a_100011217163_100009813376 [0,1,0,0,0,0|2,0,1]=4 9003 B13R0.336 CSCCCCOCCCCCC=O 7a_100011217163_100000139337 [0,1,0,0,0,0|1,0,2]=4 9004 B13R0.336 CSCCCCOCCCCCCF 34a_100011217163_100015922095 [0,1,0,0,0,0|2,0,0]=3 9005 B13R0.336 CSCCCCOCCCCCCF 7a_100011217163_100015922095 [0,1,0,0,0,0|2,0,0]=3 9006 B13R0.336 CSCCCCOCCCCCCO 34a_100011217163_100000766143 [0,1,0,0,0,0|1,0,0]=2 9007 B13R0.336 CSCCCCOCCCCCCO 7a_100011217163_100000766143 [0,1,0,0,0,0|1,0,0]=2 9008 B13R0.336 CSCCCNCCCCCCC#N 2230a_100000749238_100009813337 [0,1,0,0,0,0|2,0,1]=4 9009 B13R0.336 CSCCCNCCCCCCCO 2230a_100000749238_100000760002 [0,1,0,0,0,0|1,0,0]=2 9010 B13R0.336 CSCCCOCCCCCCC#N 7a_100000690336_100009813337 [0,1,0,0,0,0|2,0,1]=4 9011 B13R0.336 CSCCCOCCCCCCCO 34a_100000690336_100000760002 [0,1,0,0,0,0|1,0,0]=2 9012 B13R0.336 CSCCCOCCCCCCCO 7a_100000690336_100000760002 [0,1,0,0,0,0|1,0,0]=2 9013 B13R0.336 CSCCNCCCCCCCCO 2230a_100020590264_100000033203 [0,1,0,0,0,0|1,0,0]=2 9014 B13R0.336 CSCCNCCCCCCCCO 2230a_102515433106_100000751147 [0,1,0,0,0,0|1,0,0]=2 9015 B13R0.336 CSCCNCCCCCCCCO 34a_102515433106_100000212216 [0,1,0,0,0,0|1,0,0]=2 9016 B13R0.336 CSCCNCCOCCOCCO 2230a_100011998139_100000751147 [0,1,0,0,0,0|3,0,0]=4 9017 B13R0.336 CSCCNCCOCCOCCO 2230a_100020590264_100000032323 [0,1,0,0,0,0|3,0,0]=4 9018 B13R0.336 CSCCNCCOCCOCCO 34a_100011998139_100000212216 [0,1,0,0,0,0|3,0,0]=4 9019 B13R0.336 CSCCOCCCCCCCCBr 34a_100009813846_100000212216 [0,1,0,0,0,0|2,0,0]=3 9020 B13R0.336 CSCCOCCCCCCCCBr 7a_100009813846_100000212216 [0,1,0,0,0,0|2,0,0]=3 9021 B13R0.336 CSCCOCCCCCCCCCl 34a_100000033203_100000212216 [0,1,0,0,0,0|2,0,0]=3 9022 B13R0.336 CSCCOCCCCCCCCCl 7a_100000033203_100000212216 [0,1,0,0,0,0|2,0,0]=3 9023 B13R0.336 CSCCOCCCCCCCCN 34a_102515433106_100000212216 [0,1,0,0,0,0|2,0,0]=3 9024 B13R0.336 CSCCOCCCCCCCCO 34a_100000230434_100000033203 [0,1,0,0,0,0|1,0,0]=2 9025 B13R0.336 CSCCOCCCCCCCCO 7a_100000230434_100000033203 [0,1,0,0,0,0|1,0,0]=2 9026 B13R0.336 CSCCOCCCCCNCCN 34a_103619048469_100000212216 [0,1,0,0,0,0|3,0,0]=4 9027 B13R0.336 CSCCOCCOCCOCCO 34a_100000230434_100000032323 [0,1,0,0,0,0|3,0,0]=4 9028 B13R0.336 CSCCOCCOCCOCCO 62a_100010166562_200000210301 [0,1,0,0,0,0|3,0,0]=4 9029 B13R0.336 CSCCOCCOCCOCCO 62a_200000210301_100010166562 [0,1,0,0,0,0|3,0,0]=4 9030 B13R0.336 CSCCOCCOCCOCCO 7a_100000230434_100000032323 [0,1,0,0,0,0|3,0,0]=4 9031 B13R0.336 CSCCSCCCCCCCCO 62a_100000033203_100000751147 [0,1,0,0,0,0|1,0,0]=2 9032 B13R0.336 CSCCSCCCCCCCCO 62a_100000212216_100000033203 [0,1,0,0,0,0|1,0,0]=2 9033 B13R0.336 CSCCSCCOCCOCCO 62a_100000032323_100000751147 [0,1,0,0,0,0|3,0,0]=4 9034 B13R0.336 CSCCSCCOCCOCCO 62a_100000212216_100000032323 [0,1,0,0,0,0|3,0,0]=4 9035 B13R0.336 CSCNCCCCCCCCCO 2230a_100000078944_100011218213 [0,1,0,0,0,0|1,0,0]=2 9036 B13R0.336 CSCNCCCCCCCCCO 34a_100000078944_100011218213 [0,1,0,0,0,0|1,0,0]=2 9037 B13R0.336 CSCNCCCOCCOCCO 2230a_100011996194_100011218213 [0,1,0,0,0,0|3,0,0]=4 9038 B13R0.336 CSCNCCCOCCOCCO 34a_100011996194_100011218213 [0,1,0,0,0,0|3,0,0]=4 9039 B13R0.336 CSCOCCCCCCCCCBr 34a_100009813782_100011218213 [0,1,0,0,0,0|2,0,0]=3 9040 B13R0.336 CSCOCCCCCCCCCCl 34a_100009868337_100011218213 [0,1,0,0,0,0|2,0,0]=3 9041 B13R0.336 CSCOCCCCCCCCCN 34a_100000078944_100011218213 [0,1,0,0,0,0|2,0,0]=3 9042 B13R0.336 CSCSCCCCCCCCCO 62a_100009813782_100011218213 [0,1,0,0,0,0|1,0,0]=2 9043 B13R0.336 CSCSCCCCCCCCCO 62a_100011218213_100009813782 [0,1,0,0,0,0|1,0,0]=2 9044 B13R0.336 FCCCCCCOCCCCCBr 34a_100000746331_100015922095 [0,1,0,0,0,0|2,0,0]=3 9045 B13R0.336 FCCCCCCOCCCCCBr 7a_100000746331_100015922095 [0,1,0,0,0,0|2,0,0]=3 9046 B13R0.336 FCCCCCCOCCCCCCl 34a_100000746330_100015922095 [0,1,0,0,0,0|2,0,0]=3 9047 B13R0.336 FCCCCCCOCCCCCCl 7a_100000746330_100015922095 [0,1,0,0,0,0|2,0,0]=3 9048 B13R0.336 FCCCCCCOCCCCCF 34a_100000732779_100000729378 [0,1,0,0,0,0|2,0,0]=3 9049 B13R0.336 FCCCCCCOCCCCCF 7a_100000732779_100000729378 [0,1,0,0,0,0|2,0,0]=3 9050 B13R0.336 FCCCCCCOCCCCCI 34a_200012148887_100015922095 [0,1,0,0,0,0|2,0,0]=3 9051 B13R0.336 FCCCCCCOCCCCCI 7a_200012148887_100015922095 [0,1,0,0,0,0|2,0,0]=3 9052 B13R0.336 FCCCCCCOCCOCCBr 34a_100000692535_100015922095 [0,1,0,0,0,0|3,0,0]=4 9053 B13R0.336 FCCCCCCOCCOCCBr 7a_100000692535_100015922095 [0,1,0,0,0,0|3,0,0]=4 9054 B13R0.336 FCCCCCCOCCOCCCl 34a_100011215305_100015922095 [0,1,0,0,0,0|3,0,0]=4 9055 B13R0.336 FCCCCCCOCCOCCCl 7a_100011215305_100015922095 [0,1,0,0,0,0|3,0,0]=4 9056 B13R0.336 FCCCCCCOCCOCCF 34a_200015357709_100015922095 [0,1,0,0,0,0|3,0,0]=4 9057 B13R0.336 FCCCCCCOCCOCCF 7a_200015357709_100015922095 [0,1,0,0,0,0|3,0,0]=4 9058 B13R0.336 FCCCCCCOCCOCCI 34a_100012149058_100015922095 [0,1,0,0,0,0|3,0,0]=4 9059 B13R0.336 FCCCCCCOCCOCCI 7a_100012149058_100015922095 [0,1,0,0,0,0|3,0,0]=4 9060 B13R0.336 FCCCCCCSCCCCCF 62a_100000729378_100015922095 [0,1,0,0,0,0|2,0,0]=3 9061 B13R0.336 FCCCCCCSCCCCCF 62a_100015922095_100000729378 [0,1,0,0,0,0|2,0,0]=3 9062 B13R0.336 FCCCCCOCCCCCCBr 34a_100011215345_100000729378 [0,1,0,0,0,0|2,0,0]=3 9063 B13R0.336 FCCCCCOCCCCCCBr 7a_100011215345_100000729378 [0,1,0,0,0,0|2,0,0]=3 9064 B13R0.336 FCCCCCOCCCCCCCl 34a_100000766143_100000729378 [0,1,0,0,0,0|2,0,0]=3 9065 B13R0.336 FCCCCCOCCCCCCCl 7a_100000766143_100000729378 [0,1,0,0,0,0|2,0,0]=3 9066 B13R0.336 FCCCCOCCCCCCCBr 34a_100000760002_100000729493 [0,1,0,0,0,0|2,0,0]=3 9067 B13R0.336 FCCCCOCCCCCCCBr 7a_100000760002_100000729493 [0,1,0,0,0,0|2,0,0]=3 9068 B13R0.336 FCCCOCCCCCCCCBr 34a_100009813846_100011934791 [0,1,0,0,0,0|2,0,0]=3 9069 B13R0.336 FCCCOCCCCCCCCBr 7a_100009813846_100011934791 [0,1,0,0,0,0|2,0,0]=3 9070 B13R0.336 FCCCOCCCCCCCCCl 34a_100000033203_100011934791 [0,1,0,0,0,0|2,0,0]=3 9071 B13R0.336 FCCCOCCCCCCCCCl 7a_100000033203_100011934791 [0,1,0,0,0,0|2,0,0]=3 9072 B13R0.336 FCCOCCCCCCCCCBr 34a_100009813782_100011217306 [0,1,0,0,0,0|2,0,0]=3 9073 B13R0.336 FCCOCCCCCCCCCBr 7a_100009813782_100011217306 [0,1,0,0,0,0|2,0,0]=3 9074 B13R0.336 FCCOCCCCCCCCCCl 34a_100009868337_100011217306 [0,1,0,0,0,0|2,0,0]=3 9075 B13R0.336 FCCOCCCCCCCCCCl 7a_100009868337_100011217306 [0,1,0,0,0,0|2,0,0]=3 9076 B13R0.336 FCOCCCCCCCCCCBr 34a_100009813290_100015361967 [0,1,0,0,0,0|2,0,0]=3 9077 B13R0.336 FCOCCCCCCCCCCBr 7a_100009813290_100015361967 [0,1,0,0,0,0|2,0,0]=3 9078 B13R0.336 FCOCCCCCCCCCCCl 34a_200000033068_100015361967 [0,1,0,0,0,0|2,0,0]=3 9079 B13R0.336 FCOCCCCCCCCCCCl 7a_200000033068_100015361967 [0,1,0,0,0,0|2,0,0]=3 9080 B13R0.336 N#CCCCCCCNCCCCO 2230a_100000750430_100009813337 [0,1,0,0,0,0|1,0,1]=3 9081 B13R0.336 N#CCCCCCCOCCCCCl 7a_100000210776_100009813337 [0,1,0,0,0,0|2,0,1]=4 9082 B13R0.336 N#CCCCCCCOCCCCF 7a_100011995726_100009813337 [0,1,0,0,0,0|2,0,1]=4 9083 B13R0.336 N#CCCCCCCSCCCCF 62a_100000729493_100009813337 [0,1,0,0,0,0|2,0,1]=4 9084 B13R0.336 N#CCCCCCCSCCCCF 62a_100009813337_100000729493 [0,1,0,0,0,0|2,0,1]=4 9085 B13R0.336 N#CCCCCCCSCCCCO 62a_100000210776_100009813337 [0,1,0,0,0,0|1,0,1]=3 9086 B13R0.336 N#CCCCCCCSCCCCO 62a_100009813337_100000210776 [0,1,0,0,0,0|1,0,1]=3 9087 B13R0.336 N#CCCCCCNCCCCCO 2230a_100000762737_100009813376 [0,1,0,0,0,0|1,0,1]=3 9088 B13R0.336 N#CCCCCCNCCOCCO 2230a_100000211614_100009813376 [0,1,0,0,0,0|2,0,1]=4 9089 B13R0.336 N#CCCCCCNCCSCCO 2230a_100011219999_100009813376 [0,1,0,0,0,0|2,0,1]=4 9090 B13R0.336 N#CCCCCCOCCCCCBr 7a_100000746331_100009813376 [0,1,0,0,0,0|2,0,1]=4 9091 B13R0.336 N#CCCCCCOCCCCCCl 7a_100000746330_100009813376 [0,1,0,0,0,0|2,0,1]=4 9092 B13R0.336 N#CCCCCCOCCCCCI 7a_200012148887_100009813376 [0,1,0,0,0,0|2,0,1]=4 9093 B13R0.336 N#CCCCCCSCCCCCF 62a_100000729378_100009813376 [0,1,0,0,0,0|2,0,1]=4 9094 B13R0.336 N#CCCCCCSCCCCCF 62a_100009813376_100000729378 [0,1,0,0,0,0|2,0,1]=4 9095 B13R0.336 N#CCCCCCSCCCCCO 62a_100000746330_100009813376 [0,1,0,0,0,0|1,0,1]=3 9096 B13R0.336 N#CCCCCCSCCCCCO 62a_100009813376_100000746330 [0,1,0,0,0,0|1,0,1]=3 9097 B13R0.336 N#CCCCCCSCCOCCO 62a_100009813376_100011215305 [0,1,0,0,0,0|2,0,1]=4 9098 B13R0.336 N#CCCCCCSCCOCCO 62a_100011215305_100009813376 [0,1,0,0,0,0|2,0,1]=4 9099 B13R0.336 N#CCCCCNCCCCCCO 2230a_100000686447_100000211819 [0,1,0,0,0,0|1,0,1]=3 9100 B13R0.336 N#CCCCCOCCCCCCBr 7a_100011215345_100000211819 [0,1,0,0,0,0|2,0,1]=4 9101 B13R0.336 N#CCCCCOCCCCCCCl 7a_100000766143_100000211819 [0,1,0,0,0,0|2,0,1]=4 9102 B13R0.336 N#CCCCCOCCCCCCF 7a_100000732779_100000211819 [0,1,0,0,0,0|2,0,1]=4 9103 B13R0.336 N#CCCCCSCCCCCCF 62a_100011219923_100015922095 [0,1,0,0,0,0|2,0,1]=4 9104 B13R0.336 N#CCCCCSCCCCCCF 62a_100015922095_100000211819 [0,1,0,0,0,0|2,0,1]=4 9105 B13R0.336 N#CCCCCSCCCCCCO 62a_100000766143_100000211819 [0,1,0,0,0,0|1,0,1]=3 9106 B13R0.336 N#CCCCCSCCCCCCO 62a_100011219923_100000766143 [0,1,0,0,0,0|1,0,1]=3 9107 B13R0.336 N#CCCCNCCCCCCCO 2230a_100011996573_100000687738 [0,1,0,0,0,0|1,0,1]=3 9108 B13R0.336 N#CCCCNCCCOCCCO 2230a_100011310245_100000687738 [0,1,0,0,0,0|2,0,1]=4 9109 B13R0.336 N#CCCCOCCCCCCCBr 7a_100000760002_100000687738 [0,1,0,0,0,0|2,0,1]=4 9110 B13R0.336 N#CCCCSCCCCCCCO 62a_100000687738_100000760002 [0,1,0,0,0,0|1,0,1]=3 9111 B13R0.336 N#CCCCSCCCCCCCO 62a_100000760002_100000687738 [0,1,0,0,0,0|1,0,1]=3 9112 B13R0.336 N#CCCNCCCCCCCCO 2230a_102515433106_100011215226 [0,1,0,0,0,0|1,0,1]=3 9113 B13R0.336 N#CCCOCCCCCCCCBr 7a_100009813846_100000184422 [0,1,0,0,0,0|2,0,1]=4 9114 B13R0.336 N#CCCOCCCCCCCCCl 7a_100000033203_100000184422 [0,1,0,0,0,0|2,0,1]=4 9115 B13R0.336 N#CCCSCCCCCCCCO 62a_100000033203_100011215226 [0,1,0,0,0,0|1,0,1]=3 9116 B13R0.336 N#CCCSCCCCCCCCO 62a_100011215226_100000033203 [0,1,0,0,0,0|1,0,1]=3 9117 B13R0.336 N#CCNCCCCCCCCCO 2230a_100000078944_100011215382 [0,1,0,0,0,0|1,0,1]=3 9118 B13R0.336 N#CCOCCCCCCCCCBr 7a_100009813782_100011215382 [0,1,0,0,0,0|2,0,1]=4 9119 B13R0.336 N#CCOCCCCCCCCCCl 7a_100009868337_100011215382 [0,1,0,0,0,0|2,0,1]=4 9120 B13R0.336 N#CCOCCNCCCCCCO 2230a_100000686447_200000047693 [0,1,0,0,0,0|2,0,1]=4 9121 B13R0.336 N#CCOCCSCCCCCCO 62a_100000766143_200000047693 [0,1,0,0,0,0|2,0,1]=4 9122 B13R0.336 N#CCOCCSCCCCCCO 62a_200000047693_100000766143 [0,1,0,0,0,0|2,0,1]=4 9123 B13R0.336 N#CCSCCCCCCCCCO 62a_100009813782_100011215382 [0,1,0,0,0,0|1,0,1]=3 9124 B13R0.336 N#CCSCCCCCCCCCO 62a_100011215382_100009813782 [0,1,0,0,0,0|1,0,1]=3 9125 B13R0.336 N#CSCCSCCCCCCCO 62a_100000034367_100000760002 [0,1,0,0,0,0|2,0,1]=4 9126 B13R0.336 N#CSCCSCCCCCCCO 62a_100000760002_100000034367 [0,1,0,0,0,0|2,0,1]=4 9127 B13R0.336 N#CSCSCCCCCCCCO 62a_100000033203_100000211825 [0,1,0,0,0,0|2,0,1]=4 9128 B13R0.336 N#CSCSCCCCCCCCO 62a_100000211825_100000033203 [0,1,0,0,0,0|2,0,1]=4 9129 B13R0.336 NCCCCCCCCCCOCF 34a_100000066964_100015361967 [0,1,0,0,0,0|2,0,0]=3 9130 B13R0.336 NCCCCCCCCCOCC=O 34a_100000078944_200009817547 [0,1,0,0,0,0|1,0,2]=4 9131 B13R0.336 NCCCCCCCCCOCCF 34a_100000078944_100011217306 [0,1,0,0,0,0|2,0,0]=3 9132 B13R0.336 NCCCCCCCCCOCCO 34a_100000078944_100000211926 [0,1,0,0,0,0|1,0,0]=2 9133 B13R0.336 NCCCCCCCCOCCCF 34a_102515433106_100011934791 [0,1,0,0,0,0|2,0,0]=3 9134 B13R0.336 NCCCCCCCCOCCCO 34a_102515433106_100000230001 [0,1,0,0,0,0|1,0,0]=2 9135 B13R0.336 NCCCCCCCOCC#CCO 34a_100011996573_200000047223 [0,1,0,0,0,0|1,0,2]=4 9136 B13R0.336 NCCCCCCCOCCCCF 34a_100011996573_100000729493 [0,1,0,0,0,0|2,0,0]=3 9137 B13R0.336 NCCCCCCCOCCCCO 34a_100011996573_100011216708 [0,1,0,0,0,0|1,0,0]=2 9138 B13R0.336 NCCCCCCOCCCCCF 34a_100000686447_100000729378 [0,1,0,0,0,0|2,0,0]=3 9139 B13R0.336 NCCCCCCOCCCCCO 34a_100000686447_100000746330 [0,1,0,0,0,0|1,0,0]=2 9140 B13R0.336 NCCCCCCOCCOCCO 34a_100000686447_100000692535 [0,1,0,0,0,0|2,0,0]=3 9141 B13R0.336 NCCCCCOCCCCCCF 34a_100000762737_100015922095 [0,1,0,0,0,0|2,0,0]=3 9142 B13R0.336 NCCCCCOCCCCCCO 34a_100000762737_100000766143 [0,1,0,0,0,0|1,0,0]=2 9143 B13R0.336 NCCCCOCCCCCCCO 34a_100000750430_100000760002 [0,1,0,0,0,0|1,0,0]=2 9144 B13R0.336 NCCCOCCCCCCCCO 34a_100000182051_100000033203 [0,1,0,0,0,0|1,0,0]=2 9145 B13R0.336 NCCCOCCCOCCCCF 34a_100011310245_100000729493 [0,1,0,0,0,0|3,0,0]=4 9146 B13R0.336 NCCCOCCCOCCCCO 34a_100011310245_100011216708 [0,1,0,0,0,0|2,0,0]=3 9147 B13R0.336 NCCCOCCOCCOCCO 34a_100000182051_100000032323 [0,1,0,0,0,0|3,0,0]=4 9148 B13R0.336 NCCCOCCOCCOCCO 34a_100011996194_100000211926 [0,1,0,0,0,0|3,0,0]=4 9149 B13R0.336 NCCNCCCCCOCCCF 34a_103619048469_100011934791 [0,1,0,0,0,0|3,0,0]=4 9150 B13R0.336 NCCNCCCCCOCCCO 34a_103619048469_100000230001 [0,1,0,0,0,0|2,0,0]=3 9151 B13R0.336 NCCOCCCCCCCCCO 34a_100000210304_100009813782 [0,1,0,0,0,0|1,0,0]=2 9152 B13R0.336 NCCOCCOCCCCCCF 34a_100000211614_100015922095 [0,1,0,0,0,0|3,0,0]=4 9153 B13R0.336 NCCOCCOCCCCCCO 34a_100000211614_100000766143 [0,1,0,0,0,0|2,0,0]=3 9154 B13R0.336 NCCOCCOCCOCCCO 34a_100011998139_100000230001 [0,1,0,0,0,0|3,0,0]=4 9155 B13R0.336 NOCCOCCCCCCCCO 34a_100000700252_100000033203 [0,1,0,0,0,0|2,0,0]=3 9156 B13R0.336 O=CCCCCCNCCCCCO 2230a_100000762737_100000139337 [0,1,0,0,0,0|1,0,1]=3 9157 B13R0.336 O=CCCCCCNCCOCCO 2230a_100000211614_100000139337 [0,1,0,0,0,0|2,0,1]=4 9158 B13R0.336 O=CCCCCCNCCSCCO 2230a_100011219999_100000139337 [0,1,0,0,0,0|2,0,1]=4 9159 B13R0.336 O=CCCCCCOCCCCCBr 7a_100000746331_100000139337 [0,1,0,0,0,0|1,0,2]=4 9160 B13R0.336 O=CCCCCCOCCCCCCl 7a_100000746330_100000139337 [0,1,0,0,0,0|1,0,2]=4 9161 B13R0.336 O=CCCCCCOCCCCCI 7a_200012148887_100000139337 [0,1,0,0,0,0|1,0,2]=4 9162 B13R0.336 O=CCCCCCSCCCCCF 62a_100000139337_100000729378 [0,1,0,0,0,0|1,0,2]=4 9163 B13R0.336 O=CCCCCCSCCCCCF 62a_100000729378_100000139337 [0,1,0,0,0,0|1,0,2]=4 9164 B13R0.336 O=CCCCCCSCCCCCO 62a_100000139337_100000746330 [0,1,0,0,0,0|1,0,1]=3 9165 B13R0.336 O=CCCCCCSCCCCCO 62a_100000746330_100000139337 [0,1,0,0,0,0|1,0,1]=3 9166 B13R0.336 O=CCCCCCSCCOCCO 62a_100000139337_100011215305 [0,1,0,0,0,0|2,0,1]=4 9167 B13R0.336 O=CCCCCCSCCOCCO 62a_100011215305_100000139337 [0,1,0,0,0,0|2,0,1]=4 9168 B13R0.336 O=CCCCCNCCCCCCO 2230a_100000686447_100000139335 [0,1,0,0,0,0|1,0,1]=3 9169 B13R0.336 O=CCCCCOCCCCCCBr 7a_100011215345_100000139335 [0,1,0,0,0,0|1,0,2]=4 9170 B13R0.336 O=CCCCCOCCCCCCCl 7a_100000766143_100000139335 [0,1,0,0,0,0|1,0,2]=4 9171 B13R0.336 O=CCCCCOCCCCCCF 7a_100000732779_100000139335 [0,1,0,0,0,0|1,0,2]=4 9172 B13R0.336 O=CCCCCSCCCCCCF 62a_100000139335_100015922095 [0,1,0,0,0,0|1,0,2]=4 9173 B13R0.336 O=CCCCCSCCCCCCF 62a_100015922095_100000139335 [0,1,0,0,0,0|1,0,2]=4 9174 B13R0.336 O=CCCCCSCCCCCCO 62a_100000139335_100000766143 [0,1,0,0,0,0|1,0,1]=3 9175 B13R0.336 O=CCCCCSCCCCCCO 62a_100000766143_100000139335 [0,1,0,0,0,0|1,0,1]=3 9176 B13R0.336 O=CCCCNCCCCCCCO 2230a_100011996573_200011292268 [0,1,0,0,0,0|1,0,1]=3 9177 B13R0.336 O=CCCCNCCCOCCCO 2230a_100011310245_200011292268 [0,1,0,0,0,0|2,0,1]=4 9178 B13R0.336 O=CCCCOCCCCCCCBr 7a_100000760002_200011292268 [0,1,0,0,0,0|1,0,2]=4 9179 B13R0.336 O=CCCCSCCCCCCCO 62a_100000760002_200011292268 [0,1,0,0,0,0|1,0,1]=3 9180 B13R0.336 O=CCCCSCCCCCCCO 62a_200011292268_100000760002 [0,1,0,0,0,0|1,0,1]=3 9181 B13R0.336 O=CCNCCCCCCCCCO 2230a_100000078944_200015260668 [0,1,0,0,0,0|1,0,1]=3 9182 B13R0.336 O=CCNCCCCCCCCCO 34a_100000078944_200009817547 [0,1,0,0,0,0|1,0,1]=3 9183 B13R0.336 O=CCOCCCCCCCCCBr 34a_100009813782_200009817547 [0,1,0,0,0,0|1,0,2]=4 9184 B13R0.336 O=CCOCCCCCCCCCBr 7a_100009813782_200015260668 [0,1,0,0,0,0|1,0,2]=4 9185 B13R0.336 O=CCOCCCCCCCCCCl 34a_100009868337_200009817547 [0,1,0,0,0,0|1,0,2]=4 9186 B13R0.336 O=CCOCCCCCCCCCCl 7a_100009868337_200015260668 [0,1,0,0,0,0|1,0,2]=4 9187 B13R0.336 O=CCSCCCCCCCCCO 62a_100009813782_200015260668 [0,1,0,0,0,0|1,0,1]=3 9188 B13R0.336 O=CCSCCCCCCCCCO 62a_200015260668_100009813782 [0,1,0,0,0,0|1,0,1]=3 9189 B13R0.336 OCC#CCNCCCCCCCO 2230a_100011996573_200000047223 [0,1,0,0,0,0|1,0,2]=4 9190 B13R0.336 OCC#CCNCCCCCCCO 34a_100011996573_200000047223 [0,1,0,0,0,0|1,0,2]=4 9191 B13R0.336 OCC#CCOCCCCCCCBr 34a_100000760002_200000047223 [0,1,0,0,0,0|1,0,2]=4 9192 B13R0.336 OCC#CCOCCCCCCCBr 7a_100000760002_200000047223 [0,1,0,0,0,0|1,0,2]=4 9193 B13R0.336 OCC#CCSCCCCCCCO 62a_100000760002_200000047223 [0,1,0,0,0,0|1,0,2]=4 9194 B13R0.336 OCC#CCSCCCCCCCO 62a_200000047223_100000760002 [0,1,0,0,0,0|1,0,2]=4 9195 B13R0.336 OCCCCCCCCCCNCF 34a_100000066964_100015361967 [0,1,0,0,0,0|1,0,0]=2 9196 B13R0.336 OCCCCCCCCCCSCF 62a_100009813290_100015361967 [0,1,0,0,0,0|1,0,0]=2 9197 B13R0.336 OCCCCCCCCCCSCF 62a_100015361967_200000033068 [0,1,0,0,0,0|1,0,0]=2 9198 B13R0.336 OCCCCCCCCCNCCF 2230a_100000078944_100011217306 [0,1,0,0,0,0|1,0,0]=2 9199 B13R0.336 OCCCCCCCCCNCCF 34a_100000078944_100011217306 [0,1,0,0,0,0|1,0,0]=2 9200 B13R0.336 OCCCCCCCCCNCCF 34a_100000724931_100009813782 [0,1,0,0,0,0|1,0,0]=2 9201 B13R0.336 OCCCCCCCCCNCCO 2230a_100000078944_100000211926 [0,1,0,0,0,0|1,0,0]=2 9202 B13R0.336 OCCCCCCCCCNCCO 2230a_100016997473_100009813782 [0,1,0,0,0,0|1,0,0]=2 9203 B13R0.336 OCCCCCCCCCNCCO 34a_100000078944_100000211926 [0,1,0,0,0,0|1,0,0]=2 9204 B13R0.336 OCCCCCCCCCNCCO 34a_100016990907_100009813782 [0,1,0,0,0,0|1,0,0]=2 9205 B13R0.336 OCCCCCCCCCOCCBr 34a_100000211926_100009813782 [0,1,0,0,0,0|1,0,0]=2 9206 B13R0.336 OCCCCCCCCCSCCF 62a_100009813782_100011217306 [0,1,0,0,0,0|1,0,0]=2 9207 B13R0.336 OCCCCCCCCCSCCF 62a_100011217306_100009813782 [0,1,0,0,0,0|1,0,0]=2 9208 B13R0.336 OCCCCCCCCCSCCO 62a_100000211926_100009813782 [0,1,0,0,0,0|1,0,0]=2 9209 B13R0.336 OCCCCCCCCCSCCO 62a_100009813782_100000211926 [0,1,0,0,0,0|1,0,0]=2 9210 B13R0.336 OCCCCCCCCNCCCF 2230a_100015189416_100000033203 [0,1,0,0,0,0|1,0,0]=2 9211 B13R0.336 OCCCCCCCCNCCCF 2230a_102515433106_100011934791 [0,1,0,0,0,0|1,0,0]=2 9212 B13R0.336 OCCCCCCCCNCCCF 34a_100015189416_100000033203 [0,1,0,0,0,0|1,0,0]=2 9213 B13R0.336 OCCCCCCCCNCCCF 34a_102515433106_100011934791 [0,1,0,0,0,0|1,0,0]=2 9214 B13R0.336 OCCCCCCCCNCCCO 2230a_102515433106_100000230001 [0,1,0,0,0,0|1,0,0]=2 9215 B13R0.336 OCCCCCCCCNCCCO 34a_102515433106_100000230001 [0,1,0,0,0,0|1,0,0]=2 9216 B13R0.336 OCCCCCCCCOCCCBr 34a_100011217188_100000033203 [0,1,0,0,0,0|1,0,0]=2 9217 B13R0.336 OCCCCCCCCOCCCCl 34a_100000230001_100000033203 [0,1,0,0,0,0|1,0,0]=2 9218 B13R0.336 OCCCCCCCCOCCCF 34a_100000759539_100000033203 [0,1,0,0,0,0|1,0,0]=2 9219 B13R0.336 OCCCCCCCCSCCCF 62a_100000033203_100011934791 [0,1,0,0,0,0|1,0,0]=2 9220 B13R0.336 OCCCCCCCCSCCCF 62a_100011934791_100000033203 [0,1,0,0,0,0|1,0,0]=2 9221 B13R0.336 OCCCCCCCCSCCCO 62a_100000033203_100011215043 [0,1,0,0,0,0|1,0,0]=2 9222 B13R0.336 OCCCCCCCCSCCCO 62a_100011215043_100000033203 [0,1,0,0,0,0|1,0,0]=2 9223 B13R0.336 OCCCCCCCNCCCCF 2230a_100011996573_100000729493 [0,1,0,0,0,0|1,0,0]=2 9224 B13R0.336 OCCCCCCCNCCCCF 34a_100011996573_100000729493 [0,1,0,0,0,0|1,0,0]=2 9225 B13R0.336 OCCCCCCCNCCCCO 2230a_100000750430_100000760002 [0,1,0,0,0,0|1,0,0]=2 9226 B13R0.336 OCCCCCCCNCCCCO 2230a_100011996573_100000210776 [0,1,0,0,0,0|1,0,0]=2 9227 B13R0.336 OCCCCCCCNCCCCO 34a_100000750430_100000760002 [0,1,0,0,0,0|1,0,0]=2 9228 B13R0.336 OCCCCCCCNCCCCO 34a_100011996573_100011216708 [0,1,0,0,0,0|1,0,0]=2 9229 B13R0.336 OCCCCCCCOCC#CCCl 34a_200000047223_100000760002 [0,1,0,0,0,0|1,0,2]=4 9230 B13R0.336 OCCCCCCCOCCCCBr 34a_100011216708_100000760002 [0,1,0,0,0,0|1,0,0]=2 9231 B13R0.336 OCCCCCCCOCCCCCl 34a_100000210776_100000760002 [0,1,0,0,0,0|1,0,0]=2 9232 B13R0.336 OCCCCCCCOCCCCCl 7a_100000210776_100000760002 [0,1,0,0,0,0|1,0,0]=2 9233 B13R0.336 OCCCCCCCOCCCCF 34a_100011995726_100000760002 [0,1,0,0,0,0|1,0,0]=2 9234 B13R0.336 OCCCCCCCOCCCCF 7a_100011995726_100000760002 [0,1,0,0,0,0|1,0,0]=2 9235 B13R0.336 OCCCCCCCOCCCCI 34a_200012148704_100000760002 [0,1,0,0,0,0|1,0,0]=2 9236 B13R0.336 OCCCCCCCSCCCCF 62a_100000729493_100000760002 [0,1,0,0,0,0|1,0,0]=2 9237 B13R0.336 OCCCCCCCSCCCCF 62a_100000760002_100000729493 [0,1,0,0,0,0|1,0,0]=2 9238 B13R0.336 OCCCCCCCSCCCCO 62a_100000210776_100000760002 [0,1,0,0,0,0|1,0,0]=2 9239 B13R0.336 OCCCCCCCSCCCCO 62a_100000760002_100000210776 [0,1,0,0,0,0|1,0,0]=2 9240 B13R0.336 OCCCCCCNCCCCCF 2230a_100000686447_100000729378 [0,1,0,0,0,0|1,0,0]=2 9241 B13R0.336 OCCCCCCNCCCCCF 34a_100000686447_100000729378 [0,1,0,0,0,0|1,0,0]=2 9242 B13R0.336 OCCCCCCNCCCCCO 2230a_100000686447_100000746330 [0,1,0,0,0,0|1,0,0]=2 9243 B13R0.336 OCCCCCCNCCCCCO 2230a_100000762737_100000766143 [0,1,0,0,0,0|1,0,0]=2 9244 B13R0.336 OCCCCCCNCCCCCO 34a_100000686447_100000746330 [0,1,0,0,0,0|1,0,0]=2 9245 B13R0.336 OCCCCCCNCCCCCO 34a_100000762737_100000766143 [0,1,0,0,0,0|1,0,0]=2 9246 B13R0.336 OCCCCCCNCCOCCO 2230a_100000211614_100000766143 [0,1,0,0,0,0|2,0,0]=3 9247 B13R0.336 OCCCCCCNCCOCCO 2230a_100000686447_100011215305 [0,1,0,0,0,0|2,0,0]=3 9248 B13R0.336 OCCCCCCNCCOCCO 34a_100000211614_100000766143 [0,1,0,0,0,0|2,0,0]=3 9249 B13R0.336 OCCCCCCNCCOCCO 34a_100000686447_100000692535 [0,1,0,0,0,0|2,0,0]=3 9250 B13R0.336 OCCCCCCNCCSCCO 2230a_100011219999_100000766143 [0,1,0,0,0,0|2,0,0]=3 9251 B13R0.336 OCCCCCCOCCCCCBr 34a_100000746331_100000766143 [0,1,0,0,0,0|1,0,0]=2 9252 B13R0.336 OCCCCCCOCCCCCBr 7a_100000746331_100000766143 [0,1,0,0,0,0|1,0,0]=2 9253 B13R0.336 OCCCCCCOCCCCCCl 34a_100000746330_100000766143 [0,1,0,0,0,0|1,0,0]=2 9254 B13R0.336 OCCCCCCOCCCCCCl 7a_100000746330_100000766143 [0,1,0,0,0,0|1,0,0]=2 9255 B13R0.336 OCCCCCCOCCCCCI 34a_200012148887_100000766143 [0,1,0,0,0,0|1,0,0]=2 9256 B13R0.336 OCCCCCCOCCCCCI 7a_200012148887_100000766143 [0,1,0,0,0,0|1,0,0]=2 9257 B13R0.336 OCCCCCCOCCOCCBr 34a_100000692535_100000766143 [0,1,0,0,0,0|2,0,0]=3 9258 B13R0.336 OCCCCCCOCCOCCBr 7a_100000692535_100000766143 [0,1,0,0,0,0|2,0,0]=3 9259 B13R0.336 OCCCCCCOCCOCCCl 34a_100011215305_100000766143 [0,1,0,0,0,0|2,0,0]=3 9260 B13R0.336 OCCCCCCOCCOCCCl 7a_100011215305_100000766143 [0,1,0,0,0,0|2,0,0]=3 9261 B13R0.336 OCCCCCCOCCOCCF 34a_200015357709_100000766143 [0,1,0,0,0,0|2,0,0]=3 9262 B13R0.336 OCCCCCCOCCOCCF 7a_200015357709_100000766143 [0,1,0,0,0,0|2,0,0]=3 9263 B13R0.336 OCCCCCCOCCOCCI 34a_100012149058_100000766143 [0,1,0,0,0,0|2,0,0]=3 9264 B13R0.336 OCCCCCCOCCOCCI 7a_100012149058_100000766143 [0,1,0,0,0,0|2,0,0]=3 9265 B13R0.336 OCCCCCCSCCCCCF 62a_100000729378_100000766143 [0,1,0,0,0,0|1,0,0]=2 9266 B13R0.336 OCCCCCCSCCCCCF 62a_100000766143_100000729378 [0,1,0,0,0,0|1,0,0]=2 9267 B13R0.336 OCCCCCCSCCCCCO 62a_100000746330_100000766143 [0,1,0,0,0,0|1,0,0]=2 9268 B13R0.336 OCCCCCCSCCCCCO 62a_100000766143_100000746330 [0,1,0,0,0,0|1,0,0]=2 9269 B13R0.336 OCCCCCCSCCOCCO 62a_100000766143_100011215305 [0,1,0,0,0,0|2,0,0]=3 9270 B13R0.336 OCCCCCCSCCOCCO 62a_100011215305_100000766143 [0,1,0,0,0,0|2,0,0]=3 9271 B13R0.336 OCCCCCNCCCCCCF 2230a_100000762737_100015922095 [0,1,0,0,0,0|1,0,0]=2 9272 B13R0.336 OCCCCCNCCCCCCF 34a_100000762737_100015922095 [0,1,0,0,0,0|1,0,0]=2 9273 B13R0.336 OCCCCCOCCCCCCBr 34a_100011215345_100000746330 [0,1,0,0,0,0|1,0,0]=2 9274 B13R0.336 OCCCCCOCCCCCCBr 7a_100011215345_100000746330 [0,1,0,0,0,0|1,0,0]=2 9275 B13R0.336 OCCCCCOCCCCCCCl 34a_100000766143_100000746330 [0,1,0,0,0,0|1,0,0]=2 9276 B13R0.336 OCCCCCOCCCCCCCl 7a_100000766143_100000746330 [0,1,0,0,0,0|1,0,0]=2 9277 B13R0.336 OCCCCCOCCCCCCF 34a_100000732779_100000746330 [0,1,0,0,0,0|1,0,0]=2 9278 B13R0.336 OCCCCCOCCCCCCF 7a_100000732779_100000746330 [0,1,0,0,0,0|1,0,0]=2 9279 B13R0.336 OCCCCCSCCCCCCF 62a_100000746330_100015922095 [0,1,0,0,0,0|1,0,0]=2 9280 B13R0.336 OCCCCCSCCCCCCF 62a_100015922095_100000746330 [0,1,0,0,0,0|1,0,0]=2 9281 B13R0.336 OCCCCNCCCOCCCO 2230a_100011310245_100000210776 [0,1,0,0,0,0|2,0,0]=3 9282 B13R0.336 OCCCCNCCCOCCCO 34a_100011310245_100011216708 [0,1,0,0,0,0|2,0,0]=3 9283 B13R0.336 OCCCCOCCCCCCCBr 34a_100000760002_100011216708 [0,1,0,0,0,0|1,0,0]=2 9284 B13R0.336 OCCCCOCCCCCCCBr 7a_100000760002_100000210776 [0,1,0,0,0,0|1,0,0]=2 9285 B13R0.336 OCCCNCCOCCOCCO 2230a_100011998139_100000230001 [0,1,0,0,0,0|3,0,0]=4 9286 B13R0.336 OCCCNCCOCCOCCO 34a_100011998139_100000230001 [0,1,0,0,0,0|3,0,0]=4 9287 B13R0.336 OCCCOCCCCCCCCBr 34a_100009813846_100000230001 [0,1,0,0,0,0|1,0,0]=2 9288 B13R0.336 OCCCOCCCCCCCCBr 7a_100009813846_100011215043 [0,1,0,0,0,0|1,0,0]=2 9289 B13R0.336 OCCCOCCCCCCCCCl 34a_100000033203_100000230001 [0,1,0,0,0,0|1,0,0]=2 9290 B13R0.336 OCCCOCCCCCCCCCl 7a_100000033203_100011215043 [0,1,0,0,0,0|1,0,0]=2 9291 B13R0.336 OCCCOCCCNCCCCF 2230a_100011310245_100000729493 [0,1,0,0,0,0|2,0,0]=3 9292 B13R0.336 OCCCOCCCNCCCCF 34a_100011310245_100000729493 [0,1,0,0,0,0|2,0,0]=3 9293 B13R0.336 OCCCOCCOCCOCCBr 34a_100010132937_100000230001 [0,1,0,0,0,0|3,0,0]=4 9294 B13R0.336 OCCCOCCOCCOCCBr 7a_100010132937_100011215043 [0,1,0,0,0,0|3,0,0]=4 9295 B13R0.336 OCCCOCCOCCOCCCl 34a_100000032323_100000230001 [0,1,0,0,0,0|3,0,0]=4 9296 B13R0.336 OCCCOCCOCCOCCCl 7a_100000032323_100011215043 [0,1,0,0,0,0|3,0,0]=4 9297 B13R0.336 OCCCSCCOCCOCCO 62a_100000032323_100011215043 [0,1,0,0,0,0|3,0,0]=4 9298 B13R0.336 OCCCSCCOCCOCCO 62a_100011215043_100000032323 [0,1,0,0,0,0|3,0,0]=4 9299 B13R0.336 OCCNCCCOCCOCCO 2230a_100011996194_100000211926 [0,1,0,0,0,0|3,0,0]=4 9300 B13R0.336 OCCNCCCOCCOCCO 34a_100011996194_100000211926 [0,1,0,0,0,0|3,0,0]=4 9301 B13R0.336 OCCOCCCCCCCCCBr 34a_100009813782_100000211926 [0,1,0,0,0,0|1,0,0]=2 9302 B13R0.336 OCCOCCCCCCCCCBr 7a_100009813782_100000211926 [0,1,0,0,0,0|1,0,0]=2 9303 B13R0.336 OCCOCCCCCCCCCCl 34a_100009868337_100000211926 [0,1,0,0,0,0|1,0,0]=2 9304 B13R0.336 OCCOCCCCCCCCCCl 7a_100009868337_100000211926 [0,1,0,0,0,0|1,0,0]=2 9305 B13R0.336 OCCOCCNCCCCCCF 2230a_100000211614_100015922095 [0,1,0,0,0,0|2,0,0]=3 9306 B13R0.336 OCCOCCNCCCCCCF 34a_100000211614_100015922095 [0,1,0,0,0,0|2,0,0]=3 9307 B13R0.336 OCCOCCOCCCCCCBr 34a_100011215345_100000692535 [0,1,0,0,0,0|2,0,0]=3 9308 B13R0.336 OCCOCCOCCCCCCBr 7a_100011215345_100011215305 [0,1,0,0,0,0|2,0,0]=3 9309 B13R0.336 OCCOCCOCCCCCCCl 34a_100000766143_100000692535 [0,1,0,0,0,0|2,0,0]=3 9310 B13R0.336 OCCOCCOCCCCCCCl 7a_100000766143_100011215305 [0,1,0,0,0,0|2,0,0]=3 9311 B13R0.336 OCCOCCOCCCCCCF 34a_100000732779_100000692535 [0,1,0,0,0,0|2,0,0]=3 9312 B13R0.336 OCCOCCOCCCCCCF 7a_100000732779_100011215305 [0,1,0,0,0,0|2,0,0]=3 9313 B13R0.336 OCCOCCOCCCNCCF 2230a_100011996194_100011217306 [0,1,0,0,0,0|3,0,0]=4 9314 B13R0.336 OCCOCCOCCCNCCF 34a_100011996194_100011217306 [0,1,0,0,0,0|3,0,0]=4 9315 B13R0.336 OCCOCCOCCNCCCF 2230a_100011998139_100011934791 [0,1,0,0,0,0|3,0,0]=4 9316 B13R0.336 OCCOCCOCCNCCCF 2230a_100015189416_100000032323 [0,1,0,0,0,0|3,0,0]=4 9317 B13R0.336 OCCOCCOCCNCCCF 34a_100011998139_100011934791 [0,1,0,0,0,0|3,0,0]=4 9318 B13R0.336 OCCOCCOCCNCCCF 34a_100015189416_100000032323 [0,1,0,0,0,0|3,0,0]=4 9319 B13R0.336 OCCOCCOCCOCCCBr 34a_100011217188_100000032323 [0,1,0,0,0,0|3,0,0]=4 9320 B13R0.336 OCCOCCOCCOCCCCl 34a_100000230001_100000032323 [0,1,0,0,0,0|3,0,0]=4 9321 B13R0.336 OCCOCCOCCOCCCF 34a_100000759539_100000032323 [0,1,0,0,0,0|3,0,0]=4 9322 B13R0.336 OCCOCCOCCSCCCF 62a_100000032323_100011934791 [0,1,0,0,0,0|3,0,0]=4 9323 B13R0.336 OCCOCCOCCSCCCF 62a_100011934791_100000032323 [0,1,0,0,0,0|3,0,0]=4 9324 B13R0.336 OCCOCCSCCCCCCF 62a_100011215305_100015922095 [0,1,0,0,0,0|2,0,0]=3 9325 B13R0.336 OCCOCCSCCCCCCF 62a_100015922095_100011215305 [0,1,0,0,0,0|2,0,0]=3 9326 B13R0.336 OCCSCCNCCCCCCF 2230a_100011219999_100015922095 [0,1,0,0,0,0|2,0,0]=3 9327 B13R0.336 [13CH3]NCCOCCOCCOCCO 2230a_103437854208_200025704644 [0,1,0,0,0,0|3,0,0]=4 9328 B13R0.336 [13CH3]NCCOCCOCCOCCO 34a_103437854208_200025704644 [0,1,0,0,0,0|3,0,0]=4 9329 B13R0.336 [13CH3]OCCCCCCCCCCCBr 34a_100009812471_200025704644 [0,1,0,0,0,0|1,0,0]=2 9330 B13R0.336 [13CH3]OCCCCCCCCCCCBr 7a_100009812471_200025704644 [0,1,0,0,0,0|1,0,0]=2 9331 B13R0.336 [13CH3]SCCCCCCCCCCCO 62a_100009812471_200025704644 [0,1,0,0,0,0|0,0,0]=1 9332 B13R0.336 [13CH3]SCCOCCOCCOCCO 62a_100010166562_200025704644 [0,1,0,0,0,0|3,0,0]=4 9333 B13R0.336 [13CH3]SCCOCCOCCOCCO 62a_200025704644_100010166562 [0,1,0,0,0,0|3,0,0]=4 9334 B13R0.336 [N-]=[N+]=NCCCCCCNCCCO 2230a_200000049180_100000230001 [0,1,0,0,0,0|3,0,0]=4 9335 B13R0.336 [N-]=[N+]=NCCCCNCCCCCO 2230a_100000101370_100000746330 [0,1,0,0,0,0|3,0,0]=4 9336 B13R0.336 [N-]=[N+]=NCCCNCCCCCCO 2230a_100000744732_100000766143 [0,1,0,0,0,0|3,0,0]=4 9337 B13R0.338 C#CCCCC(=O)CCCCCCC 1458a_100000211969_100000731252 [0,1,0,0,0,0|1,0,2]=4 9338 B13R0.338 C#CCCCC(=O)CCCCCCC 1458a_100000690238_100000210614 [0,1,0,0,0,0|1,0,2]=4 9339 B13R0.338 C#CCCCC(=O)CCCCCCO 1458a_100000690238_100000766143 [0,1,0,0,0,0|0,0,3]=4 9340 B13R0.338 C#CCCCC(=O)CCCCCCO 1458a_100011996774_100000731252 [0,1,0,0,0,0|0,0,3]=4 9341 B13R0.338 C#CCCCCCC(=O)CCCCC 1458a_100000212188_100012094781 [0,1,0,0,0,0|1,0,2]=4 9342 B13R0.338 C#CCCCCCC(=O)CCCCC 1458a_100000694772_100000210326 [0,1,0,0,0,0|1,0,2]=4 9343 B13R0.338 C#CCCCCCC(=O)CCCCO 1458a_100000694772_100000210776 [0,1,0,0,0,0|0,0,3]=4 9344 B13R0.338 C#CCCCCCC(=O)CCCCO 1458a_100000695505_100012094781 [0,1,0,0,0,0|0,0,3]=4 9345 B13R0.338 C#CCCCCCN(C)CCCCC 2230a_100000223495_100012094781 [0,1,0,0,0,0|2,0,1]=4 9346 B13R0.338 C#CCCCCCN(C)CCCCC 269982a_100000223495_100012094781 [0,1,0,0,0,0|2,0,1]=4 9347 B13R0.338 C#CCCCCCN(C)CCCCO 2230a_100000717598_100012094781 [0,1,0,0,0,0|1,0,2]=4 9348 B13R0.338 C#CCCCCCN(C)CCCCO 269982a_100000717598_100012094781 [0,1,0,0,0,0|1,0,2]=4 9349 B13R0.338 C#CCCCCNC(C)CCCCC 2230a_100000211957_100010269958 [0,1,0,0,0,0|2,0,1]=4 9350 B13R0.338 C#CCCCCNC(C)CCCCC 2230a_100000706060_200011218191 [0,1,0,0,0,0|2,0,1]=4 9351 B13R0.338 C#CCCCCNC(C)CCCCC 34a_100000706060_200011218191 [0,1,0,0,0,0|2,0,1]=4 9352 B13R0.338 C#CCCCCOC(C)CCCCC 34a_100000766709_200011218191 [0,1,0,0,0,0|2,0,1]=4 9353 B13R0.338 C#CCCCCOC(C)CCCCC 34a_100011215632_100010269958 [0,1,0,0,0,0|2,0,1]=4 9354 B13R0.338 C#CCCCCOC(C)CCCCC 7a_100000766709_200011218191 [0,1,0,0,0,0|2,0,1]=4 9355 B13R0.338 C#CCCCCOC(C)CCCCC 7a_100011215632_100010269958 [0,1,0,0,0,0|2,0,1]=4 9356 B13R0.338 C#CCCCCSC(C)CCCCC 62a_100010269958_200011218191 [0,1,0,0,0,0|2,0,1]=4 9357 B13R0.338 C#CCCCCSC(C)CCCCC 62a_200011218191_100010269958 [0,1,0,0,0,0|2,0,1]=4 9358 B13R0.338 C#CCCCN(C)CCCCCCC 2230a_100000228206_100000731252 [0,1,0,0,0,0|2,0,1]=4 9359 B13R0.338 C#CCCCN(C)CCCCCCC 269982a_100000228206_100011215417 [0,1,0,0,0,0|2,0,1]=4 9360 B13R0.338 C#CCCNC(C)CCCCCCC 34a_100000755551_200011218727 [0,1,0,0,0,0|2,0,1]=4 9361 B13R0.338 C#CCCOC(C)CCCCCCC 34a_100011215631_200011218727 [0,1,0,0,0,0|2,0,1]=4 9362 B13R0.338 C#CCCOC(C)CCCCCCC 34a_200011215852_100000688953 [0,1,0,0,0,0|2,0,1]=4 9363 B13R0.338 C#CCCOC(C)CCCCCCC 7a_200011215852_100000688953 [0,1,0,0,0,0|2,0,1]=4 9364 B13R0.338 C#CCCSC(C)CCCCCCC 62a_100000688953_200011218727 [0,1,0,0,0,0|2,0,1]=4 9365 B13R0.338 C#CCCSC(C)CCCCCCC 62a_200011218727_100000688953 [0,1,0,0,0,0|2,0,1]=4 9366 B13R0.338 C=CCCCC(=O)CCCCCCC 1458a_100000211969_100000757094 [0,1,0,0,0,0|1,0,2]=4 9367 B13R0.338 C=CCCCC(=O)CCCCCCC 1458a_100000766728_100000210614 [0,1,0,0,0,0|1,0,2]=4 9368 B13R0.338 C=CCCCC(=O)CCCCCCO 1458a_100000766728_100000766143 [0,1,0,0,0,0|0,0,3]=4 9369 B13R0.338 C=CCCCC(=O)CCCCCCO 1458a_100011996774_100000757094 [0,1,0,0,0,0|0,0,3]=4 9370 B13R0.338 C=CCCCCCC(=O)CCCCC 1458a_100000212188_100000700193 [0,1,0,0,0,0|1,0,2]=4 9371 B13R0.338 C=CCCCCCC(=O)CCCCC 1458a_100011934241_100000210326 [0,1,0,0,0,0|1,0,2]=4 9372 B13R0.338 C=CCCCCCC(=O)CCCCO 1458a_100000695505_100000700193 [0,1,0,0,0,0|0,0,3]=4 9373 B13R0.338 C=CCCCCCC(=O)CCCCO 1458a_100011934241_100000210776 [0,1,0,0,0,0|0,0,3]=4 9374 B13R0.338 C=CCCCCCN(C)CCCCC 2230a_100000223495_100000700193 [0,1,0,0,0,0|2,0,1]=4 9375 B13R0.338 C=CCCCCCN(C)CCCCC 269982a_100000223495_100000700193 [0,1,0,0,0,0|2,0,1]=4 9376 B13R0.338 C=CCCCCCN(C)CCCCO 2230a_100000717598_100000700193 [0,1,0,0,0,0|1,0,2]=4 9377 B13R0.338 C=CCCCCCN(C)CCCCO 269982a_100000717598_100000700193 [0,1,0,0,0,0|1,0,2]=4 9378 B13R0.338 C=CCCCCNC(C)CCCCC 2230a_100000211957_100011215482 [0,1,0,0,0,0|2,0,1]=4 9379 B13R0.338 C=CCCCCNC(C)CCCCC 2230a_100000703577_200011218191 [0,1,0,0,0,0|2,0,1]=4 9380 B13R0.338 C=CCCCCNC(C)CCCCC 270004a_100000703577_100000211708 [0,1,0,0,0,0|2,0,1]=4 9381 B13R0.338 C=CCCCCNC(C)CCCCC 34a_100000703577_200011218191 [0,1,0,0,0,0|2,0,1]=4 9382 B13R0.338 C=CCCCCOC(C)CCCCC 34a_100000766645_200011218191 [0,1,0,0,0,0|2,0,1]=4 9383 B13R0.338 C=CCCCCOC(C)CCCCC 34a_100011215632_100011215482 [0,1,0,0,0,0|2,0,1]=4 9384 B13R0.338 C=CCCCCOC(C)CCCCC 7a_100000766645_200011218191 [0,1,0,0,0,0|2,0,1]=4 9385 B13R0.338 C=CCCCCOC(C)CCCCC 7a_100011215632_100011215482 [0,1,0,0,0,0|2,0,1]=4 9386 B13R0.338 C=CCCCCSC(C)CCCCC 62a_100011215482_200011218191 [0,1,0,0,0,0|2,0,1]=4 9387 B13R0.338 C=CCCCCSC(C)CCCCC 62a_200011218191_100011215482 [0,1,0,0,0,0|2,0,1]=4 9388 B13R0.338 C=CCCCN(C)CCCCCCC 2230a_100000228206_100011713584 [0,1,0,0,0,0|2,0,1]=4 9389 B13R0.338 C=CCCCN(C)CCCCCCC 269982a_100000228206_100000757094 [0,1,0,0,0,0|2,0,1]=4 9390 B13R0.338 C=CCCNC(C)CCCCCCC 2230a_100015191253_200011218727 [0,1,0,0,0,0|2,0,1]=4 9391 B13R0.338 C=CCCNC(C)CCCCCCC 270004a_100015191253_100000210596 [0,1,0,0,0,0|2,0,1]=4 9392 B13R0.338 C=CCCOC(C)CCCCCCC 34a_100011205117_200011218727 [0,1,0,0,0,0|2,0,1]=4 9393 B13R0.338 C=CCCOC(C)CCCCCCC 34a_200011215852_100000754431 [0,1,0,0,0,0|2,0,1]=4 9394 B13R0.338 C=CCCOC(C)CCCCCCC 7a_200011215852_100000754431 [0,1,0,0,0,0|2,0,1]=4 9395 B13R0.338 C=CCCSC(C)CCCCCCC 62a_100000754431_200011218727 [0,1,0,0,0,0|2,0,1]=4 9396 B13R0.338 C=CCCSC(C)CCCCCCC 62a_200011218727_100000754431 [0,1,0,0,0,0|2,0,1]=4 9397 B13R0.338 CC(CCCC#N)NCCCCCO 270004a_100000762737_200000032708 [0,1,0,0,0,0|2,0,1]=4 9398 B13R0.338 CC/C=C/CC(=O)CCCCCCO 1458a_100016274230_100000766143 [0,1,0,0,0,0|0,0,3]=4 9399 B13R0.338 CC/C=C\CC(=O)CCCCCCO 1458a_100011996774_100103147603 [0,1,0,0,0,0|0,0,3]=4 9400 B13R0.338 CCC#CCC(=O)CCCCCCO 1458a_100011996774_100009813939 [0,1,0,0,0,0|0,0,3]=4 9401 B13R0.338 CCC#CCC(C)OCCCCCO 34a_200000035118_100000746330 [0,1,0,0,0,0|1,0,2]=4 9402 B13R0.338 CCC#CCC(C)OCCCCCO 7a_200000035118_100000746330 [0,1,0,0,0,0|1,0,2]=4 9403 B13R0.338 CCCC#CC(=O)CCCCCCO 1458a_200011218047_100000766143 [0,1,0,0,0,0|0,0,3]=4 9404 B13R0.338 CCCC/C=C/CC(=O)CCCCO 1458a_200016282684_100000210776 [0,1,0,0,0,0|0,0,3]=4 9405 B13R0.338 CCCC=CC(=O)CCCCCCO 1458a_100000212230_100000766143 [0,1,0,0,0,0|0,0,3]=4 9406 B13R0.338 CCCCCC#CC(=O)CCCCO 1458a_100011215388_100000210776 [0,1,0,0,0,0|0,0,3]=4 9407 B13R0.338 CCCCCC(=O)CCCCCC#N 1458a_100000212188_100009813376 [0,1,0,0,0,0|1,0,2]=4 9408 B13R0.338 CCCCCC(=O)CCCCCCF 1458a_100000212188_100015922095 [0,1,0,0,0,0|1,0,1]=3 9409 B13R0.338 CCCCCC(=O)CCCCCCO 1458a_100000212188_100000766143 [0,1,0,0,0,0|0,0,1]=2 9410 B13R0.338 CCCCCC(=O)CCCCCCO 1458a_100011996774_100000210326 [0,1,0,0,0,0|0,0,1]=2 9411 B13R0.338 CCCCCC(=O)CCCCCOC 1458a_100011935119_100000210326 [0,1,0,0,0,0|2,0,1]=4 9412 B13R0.338 CCCCCC(=O)CCOCCCC 1458a_100000212188_100000743108 [0,1,0,0,0,0|2,0,1]=4 9413 B13R0.338 CCCCCC(=O)CNCCCCO 2230a_100000750430_200012276598 [0,1,0,0,0,0|1,0,1]=3 9414 B13R0.338 CCCCCC(=O)CNCCCCO 34a_100000750430_200012276598 [0,1,0,0,0,0|1,0,1]=3 9415 B13R0.338 CCCCCC(=O)COCCCCBr 34a_100011216708_200012276598 [0,1,0,0,0,0|2,0,1]=4 9416 B13R0.338 CCCCCC(=O)COCCCCCl 34a_100000210776_200012276598 [0,1,0,0,0,0|2,0,1]=4 9417 B13R0.338 CCCCCC(=O)COCCCCCl 7a_100000210776_200012276598 [0,1,0,0,0,0|2,0,1]=4 9418 B13R0.338 CCCCCC(=O)COCCCCF 34a_100011995726_200012276598 [0,1,0,0,0,0|2,0,1]=4 9419 B13R0.338 CCCCCC(=O)COCCCCF 7a_100011995726_200012276598 [0,1,0,0,0,0|2,0,1]=4 9420 B13R0.338 CCCCCC(=O)COCCCCI 34a_200012148704_200012276598 [0,1,0,0,0,0|2,0,1]=4 9421 B13R0.338 CCCCCC(=O)COCCCCN 34a_100000750430_200012276598 [0,1,0,0,0,0|2,0,1]=4 9422 B13R0.338 CCCCCC(=O)CSCCCCF 62a_100000729493_200012276598 [0,1,0,0,0,0|2,0,1]=4 9423 B13R0.338 CCCCCC(=O)CSCCCCF 62a_200012276598_100000729493 [0,1,0,0,0,0|2,0,1]=4 9424 B13R0.338 CCCCCC(=O)CSCCCCO 62a_100000210776_200012276598 [0,1,0,0,0,0|1,0,1]=3 9425 B13R0.338 CCCCCC(=O)CSCCCCO 62a_200012276598_100000210776 [0,1,0,0,0,0|1,0,1]=3 9426 B13R0.338 CCCCCC(=O)NCCCCCO 240690a_100000762737_100000212188 [0,1,0,0,0,0|1,0,1]=3 9427 B13R0.338 CCCCCC(=O)NCCOCCO 240690a_100000211614_100000212188 [0,1,0,0,0,0|2,0,1]=4 9428 B13R0.338 CCCCCC(=O)NCCSCCO 240690a_100011219999_100000212188 [0,1,0,0,0,0|2,0,1]=4 9429 B13R0.338 CCCCCC(=O)NCCSCCO 527a_100011219999_100000212188 [0,1,0,0,0,0|2,0,1]=4 9430 B13R0.338 CCCCCC(C)NCCCCC#N 2230a_100000211957_100000211819 [0,1,0,0,0,0|2,0,1]=4 9431 B13R0.338 CCCCCC(C)NCCCCC#N 270004a_100000751965_100000211708 [0,1,0,0,0,0|2,0,1]=4 9432 B13R0.338 CCCCCC(C)NCCCCC=O 2230a_100000211957_100000139335 [0,1,0,0,0,0|1,0,2]=4 9433 B13R0.338 CCCCCC(C)NCCCCCF 2230a_100000211957_100000729378 [0,1,0,0,0,0|2,0,0]=3 9434 B13R0.338 CCCCCC(C)NCCCCCO 2230a_100000211957_100000746330 [0,1,0,0,0,0|1,0,0]=2 9435 B13R0.338 CCCCCC(C)NCCCCCO 2230a_100000762737_200011218191 [0,1,0,0,0,0|1,0,0]=2 9436 B13R0.338 CCCCCC(C)NCCCCCO 270004a_100000762737_100000211708 [0,1,0,0,0,0|1,0,0]=2 9437 B13R0.338 CCCCCC(C)NCCCCCO 34a_100000762737_200011218191 [0,1,0,0,0,0|1,0,0]=2 9438 B13R0.338 CCCCCC(C)NCCCCOC 2230a_100000211957_100000730899 [0,1,0,0,0,0|3,0,0]=4 9439 B13R0.338 CCCCCC(C)NCCCOCC 2230a_100000210961_200011218191 [0,1,0,0,0,0|3,0,0]=4 9440 B13R0.338 CCCCCC(C)NCCCOCC 2230a_100000211957_100012232248 [0,1,0,0,0,0|3,0,0]=4 9441 B13R0.338 CCCCCC(C)NCCCOCC 270004a_100000210961_100000211708 [0,1,0,0,0,0|3,0,0]=4 9442 B13R0.338 CCCCCC(C)NCCCOCC 34a_100000210961_200011218191 [0,1,0,0,0,0|3,0,0]=4 9443 B13R0.338 CCCCCC(C)NCCOCCC 2230a_100000211957_100011215938 [0,1,0,0,0,0|3,0,0]=4 9444 B13R0.338 CCCCCC(C)NCCOCCC 2230a_100161115042_200011218191 [0,1,0,0,0,0|3,0,0]=4 9445 B13R0.338 CCCCCC(C)NCCOCCC 270004a_100161115042_100000211708 [0,1,0,0,0,0|3,0,0]=4 9446 B13R0.338 CCCCCC(C)NCCOCCC 34a_100161115042_200011218191 [0,1,0,0,0,0|3,0,0]=4 9447 B13R0.338 CCCCCC(C)NCCOCCO 2230a_100000211614_200011218191 [0,1,0,0,0,0|2,0,0]=3 9448 B13R0.338 CCCCCC(C)NCCOCCO 2230a_100000211957_100011215305 [0,1,0,0,0,0|2,0,0]=3 9449 B13R0.338 CCCCCC(C)NCCOCCO 270004a_100000211614_100000211708 [0,1,0,0,0,0|2,0,0]=3 9450 B13R0.338 CCCCCC(C)NCCOCCO 34a_100000211614_200011218191 [0,1,0,0,0,0|2,0,0]=3 9451 B13R0.338 CCCCCC(C)NCCSCCC 2230a_100020603323_200011218191 [0,1,0,0,0,0|3,0,0]=4 9452 B13R0.338 CCCCCC(C)NCCSCCC 270004a_100020603323_100000211708 [0,1,0,0,0,0|3,0,0]=4 9453 B13R0.338 CCCCCC(C)NCCSCCO 2230a_100011219999_200011218191 [0,1,0,0,0,0|2,0,0]=3 9454 B13R0.338 CCCCCC(C)NCCSCCO 270004a_100011219999_100000211708 [0,1,0,0,0,0|2,0,0]=3 9455 B13R0.338 CCCCCC(C)NCOCCCC 2230a_100000211957_100011995733 [0,1,0,0,0,0|3,0,0]=4 9456 B13R0.338 CCCCCC(C)OCCCCC#N 7a_100011215632_100000211819 [0,1,0,0,0,0|2,0,1]=4 9457 B13R0.338 CCCCCC(C)OCCCCC=O 7a_100011215632_100000139335 [0,1,0,0,0,0|1,0,2]=4 9458 B13R0.338 CCCCCC(C)OCCCCCBr 34a_100000746331_200011218191 [0,1,0,0,0,0|2,0,0]=3 9459 B13R0.338 CCCCCC(C)OCCCCCBr 7a_100000746331_200011218191 [0,1,0,0,0,0|2,0,0]=3 9460 B13R0.338 CCCCCC(C)OCCCCCCl 34a_100000746330_200011218191 [0,1,0,0,0,0|2,0,0]=3 9461 B13R0.338 CCCCCC(C)OCCCCCCl 7a_100000746330_200011218191 [0,1,0,0,0,0|2,0,0]=3 9462 B13R0.338 CCCCCC(C)OCCCCCF 34a_100011215632_100000729378 [0,1,0,0,0,0|2,0,0]=3 9463 B13R0.338 CCCCCC(C)OCCCCCF 7a_100011215632_100000729378 [0,1,0,0,0,0|2,0,0]=3 9464 B13R0.338 CCCCCC(C)OCCCCCI 34a_200012148887_200011218191 [0,1,0,0,0,0|2,0,0]=3 9465 B13R0.338 CCCCCC(C)OCCCCCI 7a_200012148887_200011218191 [0,1,0,0,0,0|2,0,0]=3 9466 B13R0.338 CCCCCC(C)OCCCCCN 34a_100000762737_200011218191 [0,1,0,0,0,0|2,0,0]=3 9467 B13R0.338 CCCCCC(C)OCCCCCO 34a_100011215632_100000746330 [0,1,0,0,0,0|1,0,0]=2 9468 B13R0.338 CCCCCC(C)OCCCCCO 7a_100011215632_100000746330 [0,1,0,0,0,0|1,0,0]=2 9469 B13R0.338 CCCCCC(C)OCCCCOC 34a_100000740925_200011218191 [0,1,0,0,0,0|3,0,0]=4 9470 B13R0.338 CCCCCC(C)OCCCCOC 34a_100011215632_100000755781 [0,1,0,0,0,0|3,0,0]=4 9471 B13R0.338 CCCCCC(C)OCCCCOC 7a_100011215632_100000730899 [0,1,0,0,0,0|3,0,0]=4 9472 B13R0.338 CCCCCC(C)OCCCCSC 34a_100011217163_200011218191 [0,1,0,0,0,0|3,0,0]=4 9473 B13R0.338 CCCCCC(C)OCCCCSC 7a_100011217163_200011218191 [0,1,0,0,0,0|3,0,0]=4 9474 B13R0.338 CCCCCC(C)OCCCOCC 34a_100000757476_200011218191 [0,1,0,0,0,0|3,0,0]=4 9475 B13R0.338 CCCCCC(C)OCCCOCC 34a_100011215632_100012232248 [0,1,0,0,0,0|3,0,0]=4 9476 B13R0.338 CCCCCC(C)OCCCOCC 7a_100000757476_200011218191 [0,1,0,0,0,0|3,0,0]=4 9477 B13R0.338 CCCCCC(C)OCCCOCC 7a_100011215632_100012232248 [0,1,0,0,0,0|3,0,0]=4 9478 B13R0.338 CCCCCC(C)OCCCSCC 34a_100011216438_200011218191 [0,1,0,0,0,0|3,0,0]=4 9479 B13R0.338 CCCCCC(C)OCCCSCC 7a_100011216438_200011218191 [0,1,0,0,0,0|3,0,0]=4 9480 B13R0.338 CCCCCC(C)OCCOCCBr 34a_100000692535_200011218191 [0,1,0,0,0,0|3,0,0]=4 9481 B13R0.338 CCCCCC(C)OCCOCCBr 7a_100000692535_200011218191 [0,1,0,0,0,0|3,0,0]=4 9482 B13R0.338 CCCCCC(C)OCCOCCC 34a_100000752267_200011218191 [0,1,0,0,0,0|3,0,0]=4 9483 B13R0.338 CCCCCC(C)OCCOCCC 34a_100011215632_100011215938 [0,1,0,0,0,0|3,0,0]=4 9484 B13R0.338 CCCCCC(C)OCCOCCC 7a_100000752267_200011218191 [0,1,0,0,0,0|3,0,0]=4 9485 B13R0.338 CCCCCC(C)OCCOCCC 7a_100011215632_100011215938 [0,1,0,0,0,0|3,0,0]=4 9486 B13R0.338 CCCCCC(C)OCCOCCCl 34a_100011215305_200011218191 [0,1,0,0,0,0|3,0,0]=4 9487 B13R0.338 CCCCCC(C)OCCOCCCl 7a_100011215305_200011218191 [0,1,0,0,0,0|3,0,0]=4 9488 B13R0.338 CCCCCC(C)OCCOCCF 34a_200015357709_200011218191 [0,1,0,0,0,0|3,0,0]=4 9489 B13R0.338 CCCCCC(C)OCCOCCF 7a_200015357709_200011218191 [0,1,0,0,0,0|3,0,0]=4 9490 B13R0.338 CCCCCC(C)OCCOCCI 34a_100012149058_200011218191 [0,1,0,0,0,0|3,0,0]=4 9491 B13R0.338 CCCCCC(C)OCCOCCI 7a_100012149058_200011218191 [0,1,0,0,0,0|3,0,0]=4 9492 B13R0.338 CCCCCC(C)OCCOCCN 34a_100000211614_200011218191 [0,1,0,0,0,0|3,0,0]=4 9493 B13R0.338 CCCCCC(C)OCCOCCO 34a_100011215632_100000692535 [0,1,0,0,0,0|2,0,0]=3 9494 B13R0.338 CCCCCC(C)OCCOCCO 7a_100011215632_100011215305 [0,1,0,0,0,0|2,0,0]=3 9495 B13R0.338 CCCCCC(C)OCCSCCC 34a_200000230433_200011218191 [0,1,0,0,0,0|3,0,0]=4 9496 B13R0.338 CCCCCC(C)OCCSCCC 7a_200000230433_200011218191 [0,1,0,0,0,0|3,0,0]=4 9497 B13R0.338 CCCCCC(C)OCOCCCC 34a_100011215632_100011995733 [0,1,0,0,0,0|3,0,0]=4 9498 B13R0.338 CCCCCC(C)SCCCCC#N 62a_100011219923_200011218191 [0,1,0,0,0,0|2,0,1]=4 9499 B13R0.338 CCCCCC(C)SCCCCC#N 62a_200011218191_100000211819 [0,1,0,0,0,0|2,0,1]=4 9500 B13R0.338 CCCCCC(C)SCCCCC=O 62a_100000139335_200011218191 [0,1,0,0,0,0|1,0,2]=4 9501 B13R0.338 CCCCCC(C)SCCCCC=O 62a_200011218191_100000139335 [0,1,0,0,0,0|1,0,2]=4 9502 B13R0.338 CCCCCC(C)SCCCCCF 62a_100000729378_200011218191 [0,1,0,0,0,0|2,0,0]=3 9503 B13R0.338 CCCCCC(C)SCCCCCF 62a_200011218191_100000729378 [0,1,0,0,0,0|2,0,0]=3 9504 B13R0.338 CCCCCC(C)SCCCCCO 62a_100000746330_200011218191 [0,1,0,0,0,0|1,0,0]=2 9505 B13R0.338 CCCCCC(C)SCCCCCO 62a_200011218191_100000746330 [0,1,0,0,0,0|1,0,0]=2 9506 B13R0.338 CCCCCC(C)SCCCCOC 62a_100000730899_200011218191 [0,1,0,0,0,0|3,0,0]=4 9507 B13R0.338 CCCCCC(C)SCCCCOC 62a_200011218191_100000730899 [0,1,0,0,0,0|3,0,0]=4 9508 B13R0.338 CCCCCC(C)SCCCOCC 62a_100012232248_200011218191 [0,1,0,0,0,0|3,0,0]=4 9509 B13R0.338 CCCCCC(C)SCCCOCC 62a_200011218191_100012232248 [0,1,0,0,0,0|3,0,0]=4 9510 B13R0.338 CCCCCC(C)SCCOCCC 62a_100011215938_200011218191 [0,1,0,0,0,0|3,0,0]=4 9511 B13R0.338 CCCCCC(C)SCCOCCC 62a_200011218191_100011215938 [0,1,0,0,0,0|3,0,0]=4 9512 B13R0.338 CCCCCC(C)SCCOCCO 62a_100011215305_200011218191 [0,1,0,0,0,0|2,0,0]=3 9513 B13R0.338 CCCCCC(C)SCCOCCO 62a_200011218191_100011215305 [0,1,0,0,0,0|2,0,0]=3 9514 B13R0.338 CCCCCC(C)SCOCCCC 62a_100011995733_200011218191 [0,1,0,0,0,0|3,0,0]=4 9515 B13R0.338 CCCCCC(C)SCOCCCC 62a_200011218191_100011995733 [0,1,0,0,0,0|3,0,0]=4 9516 B13R0.338 CCCCCC=CC(=O)CCCCO 1458a_100016263427_100000210776 [0,1,0,0,0,0|0,0,3]=4 9517 B13R0.338 CCCCCCCC(=NNCCO)C 4a_100000210001_100000210596 [0,1,0,0,0,0|2,0,1]=4 9518 B13R0.338 CCCCCCCC(=O)CC#CCO 1458a_100000211969_200000047223 [0,1,0,0,0,0|0,0,3]=4 9519 B13R0.338 CCCCCCCC(=O)CCCC#N 1458a_100000075515_100000210614 [0,1,0,0,0,0|1,0,2]=4 9520 B13R0.338 CCCCCCCC(=O)CCCC#N 1458a_100000211969_100000211468 [0,1,0,0,0,0|1,0,2]=4 9521 B13R0.338 CCCCCCCC(=O)CCCCC 1458a_100000211969_100000210326 [0,1,0,0,0,0|1,0,1]=3 9522 B13R0.338 CCCCCCCC(=O)CCCCC 1458a_100000212188_100000210614 [0,1,0,0,0,0|1,0,1]=3 9523 B13R0.338 CCCCCCCC(=O)CCCCF 1458a_100000211969_100000729493 [0,1,0,0,0,0|1,0,1]=3 9524 B13R0.338 CCCCCCCC(=O)CCCCO 1458a_100000211969_100000210776 [0,1,0,0,0,0|0,0,1]=2 9525 B13R0.338 CCCCCCCC(=O)CCCCO 1458a_100000695505_100000210614 [0,1,0,0,0,0|0,0,1]=2 9526 B13R0.338 CCCCCCCC(=O)CCCOC 1458a_100000211969_100000740836 [0,1,0,0,0,0|2,0,1]=4 9527 B13R0.338 CCCCCCCC(=O)CCCOC 1458a_100000741012_100000210614 [0,1,0,0,0,0|2,0,1]=4 9528 B13R0.338 CCCCCCCC(=O)CCCSC 1458a_100000173376_100000210614 [0,1,0,0,0,0|2,0,1]=4 9529 B13R0.338 CCCCCCCC(=O)CCOCC 1458a_100000211969_100011215890 [0,1,0,0,0,0|2,0,1]=4 9530 B13R0.338 CCCCCCCC(=O)CCOCC 1458a_100000749530_100000210614 [0,1,0,0,0,0|2,0,1]=4 9531 B13R0.338 CCCCCCCC(=O)CCSCC 1458a_100000211969_100000757381 [0,1,0,0,0,0|2,0,1]=4 9532 B13R0.338 CCCCCCCC(=O)CCSCC 1458a_100000230768_100000210614 [0,1,0,0,0,0|2,0,1]=4 9533 B13R0.338 CCCCCCCC(=O)COCCC 1458a_100000745993_100000210614 [0,1,0,0,0,0|2,0,1]=4 9534 B13R0.338 CCCCCCCC(=O)COCCO 1458a_100000708028_100000210614 [0,1,0,0,0,0|1,0,1]=3 9535 B13R0.338 CCCCCCCC(=O)CSCCC 1458a_100000217233_100000210614 [0,1,0,0,0,0|2,0,1]=4 9536 B13R0.338 CCCCCCCC(=O)NCCCC 11a_100000102301_100000211969 [0,1,0,0,0,0|2,0,1]=4 9537 B13R0.338 CCCCCCCC(=O)NCCCC 1626a_100000102301_100000211969 [0,1,0,0,0,0|2,0,1]=4 9538 B13R0.338 CCCCCCCC(=O)NCCCC 240690a_100000102301_100000211969 [0,1,0,0,0,0|2,0,1]=4 9539 B13R0.338 CCCCCCCC(=O)NCCCC 527a_100000102301_100000211969 [0,1,0,0,0,0|2,0,1]=4 9540 B13R0.338 CCCCCCCC(=O)NCCCF 11a_100015189416_100000211969 [0,1,0,0,0,0|2,0,1]=4 9541 B13R0.338 CCCCCCCC(=O)NCCCF 1626a_100015189416_100000211969 [0,1,0,0,0,0|2,0,1]=4 9542 B13R0.338 CCCCCCCC(=O)NCCCF 240690a_100015189416_100000211969 [0,1,0,0,0,0|2,0,1]=4 9543 B13R0.338 CCCCCCCC(=O)NCCCF 527a_100015189416_100000211969 [0,1,0,0,0,0|2,0,1]=4 9544 B13R0.338 CCCCCCCC(=O)NCCCO 240690a_100000182051_100000211969 [0,1,0,0,0,0|1,0,1]=3 9545 B13R0.338 CCCCCCCC(=O)NCCCO 527a_100000182051_100000211969 [0,1,0,0,0,0|1,0,1]=3 9546 B13R0.338 CCCCCCCC(=O)NNCCO 22a_100000210001_100000211969 [0,1,0,0,0,0|2,0,1]=4 9547 B13R0.338 CCCCCCCC(C)NCCC#N 270004a_100000720768_100000210596 [0,1,0,0,0,0|2,0,1]=4 9548 B13R0.338 CCCCCCCC(C)NCCCC 2230a_100000102301_200011218727 [0,1,0,0,0,0|2,0,0]=3 9549 B13R0.338 CCCCCCCC(C)NCCCC 270004a_100000102301_100000210596 [0,1,0,0,0,0|2,0,0]=3 9550 B13R0.338 CCCCCCCC(C)NCCCC 7a_106832991798_200011218727 [0,1,0,0,0,0|2,0,0]=3 9551 B13R0.338 CCCCCCCC(C)NCCCF 2230a_100015189416_200011218727 [0,1,0,0,0,0|2,0,0]=3 9552 B13R0.338 CCCCCCCC(C)NCCCF 270004a_100015189416_100000210596 [0,1,0,0,0,0|2,0,0]=3 9553 B13R0.338 CCCCCCCC(C)NCCCF 34a_100015189416_200011218727 [0,1,0,0,0,0|2,0,0]=3 9554 B13R0.338 CCCCCCCC(C)NCCCO 270004a_100000182051_100000210596 [0,1,0,0,0,0|1,0,0]=2 9555 B13R0.338 CCCCCCCC(C)NCCOC 2230a_100000209980_200011218727 [0,1,0,0,0,0|3,0,0]=4 9556 B13R0.338 CCCCCCCC(C)NCCOC 270004a_100000209980_100000210596 [0,1,0,0,0,0|3,0,0]=4 9557 B13R0.338 CCCCCCCC(C)NCCSC 2230a_100020590264_200011218727 [0,1,0,0,0,0|3,0,0]=4 9558 B13R0.338 CCCCCCCC(C)NCCSC 270004a_100020590264_100000210596 [0,1,0,0,0,0|3,0,0]=4 9559 B13R0.338 CCCCCCCC(C)OCCC#N 7a_200011215852_100000184422 [0,1,0,0,0,0|2,0,1]=4 9560 B13R0.338 CCCCCCCC(C)OCCCBr 34a_100011217188_200011218727 [0,1,0,0,0,0|2,0,0]=3 9561 B13R0.338 CCCCCCCC(C)OCCCC 34a_100000210227_200011218727 [0,1,0,0,0,0|2,0,0]=3 9562 B13R0.338 CCCCCCCC(C)OCCCC 34a_200011215852_100000210210 [0,1,0,0,0,0|2,0,0]=3 9563 B13R0.338 CCCCCCCC(C)OCCCC 7a_100000210227_200011218727 [0,1,0,0,0,0|2,0,0]=3 9564 B13R0.338 CCCCCCCC(C)OCCCC 7a_200011215852_100000210211 [0,1,0,0,0,0|2,0,0]=3 9565 B13R0.338 CCCCCCCC(C)OCCCCl 34a_100000230001_200011218727 [0,1,0,0,0,0|2,0,0]=3 9566 B13R0.338 CCCCCCCC(C)OCCCF 34a_100000759539_200011218727 [0,1,0,0,0,0|2,0,0]=3 9567 B13R0.338 CCCCCCCC(C)OCCCF 34a_200011215852_100011934791 [0,1,0,0,0,0|2,0,0]=3 9568 B13R0.338 CCCCCCCC(C)OCCCF 7a_200011215852_100011934791 [0,1,0,0,0,0|2,0,0]=3 9569 B13R0.338 CCCCCCCC(C)OCCCN 34a_100000182051_200011218727 [0,1,0,0,0,0|2,0,0]=3 9570 B13R0.338 CCCCCCCC(C)OCCCO 34a_200011215852_100000230001 [0,1,0,0,0,0|1,0,0]=2 9571 B13R0.338 CCCCCCCC(C)OCCCO 7a_200011215852_100011215043 [0,1,0,0,0,0|1,0,0]=2 9572 B13R0.338 CCCCCCCC(C)OCCOC 34a_100000210237_200011218727 [0,1,0,0,0,0|3,0,0]=4 9573 B13R0.338 CCCCCCCC(C)OCCOC 34a_200011215852_100011201679 [0,1,0,0,0,0|3,0,0]=4 9574 B13R0.338 CCCCCCCC(C)OCCOC 7a_200011215852_100000233755 [0,1,0,0,0,0|3,0,0]=4 9575 B13R0.338 CCCCCCCC(C)OCCON 34a_100000700252_200011218727 [0,1,0,0,0,0|3,0,0]=4 9576 B13R0.338 CCCCCCCC(C)OCCSC 34a_100000230434_200011218727 [0,1,0,0,0,0|3,0,0]=4 9577 B13R0.338 CCCCCCCC(C)OCCSC 34a_200011215852_100000212216 [0,1,0,0,0,0|3,0,0]=4 9578 B13R0.338 CCCCCCCC(C)OCCSC 7a_100000230434_200011218727 [0,1,0,0,0,0|3,0,0]=4 9579 B13R0.338 CCCCCCCC(C)OCCSC 7a_200011215852_100000212216 [0,1,0,0,0,0|3,0,0]=4 9580 B13R0.338 CCCCCCCC(C)SCCC#N 62a_100011215226_200011218727 [0,1,0,0,0,0|2,0,1]=4 9581 B13R0.338 CCCCCCCC(C)SCCC#N 62a_200011218727_100011215226 [0,1,0,0,0,0|2,0,1]=4 9582 B13R0.338 CCCCCCCC(C)SCCCC 62a_100000210211_200011218727 [0,1,0,0,0,0|2,0,0]=3 9583 B13R0.338 CCCCCCCC(C)SCCCC 62a_200011218727_100000210210 [0,1,0,0,0,0|2,0,0]=3 9584 B13R0.338 CCCCCCCC(C)SCCCF 62a_100011934791_200011218727 [0,1,0,0,0,0|2,0,0]=3 9585 B13R0.338 CCCCCCCC(C)SCCCF 62a_200011218727_100011934791 [0,1,0,0,0,0|2,0,0]=3 9586 B13R0.338 CCCCCCCC(C)SCCCO 62a_100011215043_200011218727 [0,1,0,0,0,0|1,0,0]=2 9587 B13R0.338 CCCCCCCC(C)SCCCO 62a_200011218727_100011215043 [0,1,0,0,0,0|1,0,0]=2 9588 B13R0.338 CCCCCCCC(C)SCCOC 62a_100000233755_200011218727 [0,1,0,0,0,0|3,0,0]=4 9589 B13R0.338 CCCCCCCC(C)SCCOC 62a_200011218727_100000233755 [0,1,0,0,0,0|3,0,0]=4 9590 B13R0.338 CCCCCCCC(C)SCCSC 62a_100000212216_200011218727 [0,1,0,0,0,0|3,0,0]=4 9591 B13R0.338 CCCCCCCC(C)SCCSC 62a_200011218727_100000751147 [0,1,0,0,0,0|3,0,0]=4 9592 B13R0.338 CCCCCCCC(C)SCOCC 62a_100000739092_200011218727 [0,1,0,0,0,0|3,0,0]=4 9593 B13R0.338 CCCCCCCC(C)SCOCC 62a_200011218727_100000739092 [0,1,0,0,0,0|3,0,0]=4 9594 B13R0.338 CCCCCCCN(C)CC#CCO 2230a_100000228206_200000047223 [0,1,0,0,0,0|1,0,2]=4 9595 B13R0.338 CCCCCCCN(C)CCCC#N 2230a_100000228206_100000687738 [0,1,0,0,0,0|2,0,1]=4 9596 B13R0.338 CCCCCCCN(C)CCCC#N 269982a_100000228206_100000687738 [0,1,0,0,0,0|2,0,1]=4 9597 B13R0.338 CCCCCCCN(C)CCCC=O 2230a_100000228206_200011292268 [0,1,0,0,0,0|1,0,2]=4 9598 B13R0.338 CCCCCCCN(C)CCCC=O 269982a_100000228206_200011292268 [0,1,0,0,0,0|1,0,2]=4 9599 B13R0.338 CCCCCCCN(C)CCCCC 2230a_100000223495_100000210681 [0,1,0,0,0,0|2,0,0]=3 9600 B13R0.338 CCCCCCCN(C)CCCCC 2230a_100000228206_100000210326 [0,1,0,0,0,0|2,0,0]=3 9601 B13R0.338 CCCCCCCN(C)CCCCC 269982a_100000223495_100000210681 [0,1,0,0,0,0|2,0,0]=3 9602 B13R0.338 CCCCCCCN(C)CCCCC 269982a_100000228206_100000210215 [0,1,0,0,0,0|2,0,0]=3 9603 B13R0.338 CCCCCCCN(C)CCCCF 2230a_100000228206_100000729493 [0,1,0,0,0,0|2,0,0]=3 9604 B13R0.338 CCCCCCCN(C)CCCCF 269982a_100000228206_100000729493 [0,1,0,0,0,0|2,0,0]=3 9605 B13R0.338 CCCCCCCN(C)CCCCO 2230a_100000228206_100000210776 [0,1,0,0,0,0|1,0,0]=2 9606 B13R0.338 CCCCCCCN(C)CCCCO 2230a_100000717598_100000210681 [0,1,0,0,0,0|1,0,0]=2 9607 B13R0.338 CCCCCCCN(C)CCCCO 269982a_100000228206_100000210776 [0,1,0,0,0,0|1,0,0]=2 9608 B13R0.338 CCCCCCCN(C)CCCCO 269982a_100000717598_100000210681 [0,1,0,0,0,0|1,0,0]=2 9609 B13R0.338 CCCCCCCN(C)CCCOC 2230a_100000224831_100000210681 [0,1,0,0,0,0|3,0,0]=4 9610 B13R0.338 CCCCCCCN(C)CCCOC 2230a_100000228206_100000740836 [0,1,0,0,0,0|3,0,0]=4 9611 B13R0.338 CCCCCCCN(C)CCCOC 269982a_100000224831_100000210681 [0,1,0,0,0,0|3,0,0]=4 9612 B13R0.338 CCCCCCCN(C)CCCOC 269982a_100000228206_100000740836 [0,1,0,0,0,0|3,0,0]=4 9613 B13R0.338 CCCCCCCN(C)CCOCC 2230a_100000228206_100011215890 [0,1,0,0,0,0|3,0,0]=4 9614 B13R0.338 CCCCCCCN(C)CCOCC 269982a_100000228206_100011215890 [0,1,0,0,0,0|3,0,0]=4 9615 B13R0.338 CCCCCCCN(C)CCSCC 2230a_100000228206_100000757381 [0,1,0,0,0,0|3,0,0]=4 9616 B13R0.338 CCCCCCCN(C)CCSCC 269982a_100000228206_100000757381 [0,1,0,0,0,0|3,0,0]=4 9617 B13R0.338 CCCCCCNC(=O)CCCCC 11a_100000210581_100000212188 [0,1,0,0,0,0|2,0,1]=4 9618 B13R0.338 CCCCCCNC(=O)CCCCC 1626a_100000210581_100000212188 [0,1,0,0,0,0|2,0,1]=4 9619 B13R0.338 CCCCCCNC(=O)CCCCC 240690a_100000210581_100000212188 [0,1,0,0,0,0|2,0,1]=4 9620 B13R0.338 CCCCCCNC(=O)CCCCC 527a_100000210581_100000212188 [0,1,0,0,0,0|2,0,1]=4 9621 B13R0.338 CCCCCCNC(=O)CCCCO 1626a_100000210581_100000695505 [0,1,0,0,0,0|1,0,1]=3 9622 B13R0.338 CCCCCCNC(=O)CNCCO 2230a_100016997473_100000230325 [0,1,0,0,0,0|2,0,1]=4 9623 B13R0.338 CCCCCCNC(=O)CNCCO 34a_100016990907_100000230325 [0,1,0,0,0,0|2,0,1]=4 9624 B13R0.338 CCCCCCNC(=O)COCCO 1626a_100000210581_100000708028 [0,1,0,0,0,0|2,0,1]=4 9625 B13R0.338 CCCCCCNC(=O)COCCO 240690a_100000210581_100000708028 [0,1,0,0,0,0|2,0,1]=4 9626 B13R0.338 CCCCCCNC(=O)CSCCO 62a_100000230325_100000211926 [0,1,0,0,0,0|2,0,1]=4 9627 B13R0.338 CCCCCCNC(=O)NCCCO 2708a_100000210581_100000182051 [0,1,0,0,0,0|2,0,1]=4 9628 B13R0.338 CCCCCCNC(=O)NCCCO 273464a_100000182051_100000210581 [0,1,0,0,0,0|2,0,1]=4 9629 B13R0.338 CCCCCCNC(=O)NCCCO 273464a_100000210581_100000182051 [0,1,0,0,0,0|2,0,1]=4 9630 B13R0.338 CCCCCCNC(=O)NCCCO 512a_100000210581_100000182051 [0,1,0,0,0,0|2,0,1]=4 9631 B13R0.338 CCCCCCNC(C)CCCC#N 270004a_100000210581_200000032708 [0,1,0,0,0,0|2,0,1]=4 9632 B13R0.338 CCCCCCNC(C)CCCCC 2230a_100000210581_200011218191 [0,1,0,0,0,0|2,0,0]=3 9633 B13R0.338 CCCCCCNC(C)CCCCC 2230a_100000211957_100000210314 [0,1,0,0,0,0|2,0,0]=3 9634 B13R0.338 CCCCCCNC(C)CCCCC 270004a_100000210581_100000211708 [0,1,0,0,0,0|2,0,0]=3 9635 B13R0.338 CCCCCCNC(C)CCCSC 270004a_100000210581_100011399439 [0,1,0,0,0,0|3,0,0]=4 9636 B13R0.338 CCCCCCNC(C)CCOCC 270004a_100000210581_200011216536 [0,1,0,0,0,0|3,0,0]=4 9637 B13R0.338 CCCCCCNC(C)CSCCC 270004a_100000210581_100011343953 [0,1,0,0,0,0|3,0,0]=4 9638 B13R0.338 CCCCCCOC(C)CCCCC 34a_100000210259_200011218191 [0,1,0,0,0,0|2,0,0]=3 9639 B13R0.338 CCCCCCOC(C)CCCCC 34a_100011215632_100000210314 [0,1,0,0,0,0|2,0,0]=3 9640 B13R0.338 CCCCCCOC(C)CCCCC 7a_100000210259_200011218191 [0,1,0,0,0,0|2,0,0]=3 9641 B13R0.338 CCCCCCOC(C)CCCCC 7a_100011215632_100000210314 [0,1,0,0,0,0|2,0,0]=3 9642 B13R0.338 CCCCCCOC(C)CCCOC 34a_200011539412_100000210314 [0,1,0,0,0,0|3,0,0]=4 9643 B13R0.338 CCCCCCOC(C)CCCOC 7a_200011539412_100000210314 [0,1,0,0,0,0|3,0,0]=4 9644 B13R0.338 CCCCCCSC(C)CCCCC 62a_100000210314_200011218191 [0,1,0,0,0,0|2,0,0]=3 9645 B13R0.338 CCCCCCSC(C)CCCCC 62a_200011218191_100000210757 [0,1,0,0,0,0|2,0,0]=3 9646 B13R0.338 CCCCCN(C)CCCCCC#N 2230a_100000223495_100009813376 [0,1,0,0,0,0|2,0,1]=4 9647 B13R0.338 CCCCCN(C)CCCCCC#N 269982a_100000223495_100009813376 [0,1,0,0,0,0|2,0,1]=4 9648 B13R0.338 CCCCCN(C)CCCCCC=O 2230a_100000223495_100000139337 [0,1,0,0,0,0|1,0,2]=4 9649 B13R0.338 CCCCCN(C)CCCCCC=O 269982a_100000223495_100000139337 [0,1,0,0,0,0|1,0,2]=4 9650 B13R0.338 CCCCCN(C)CCCCCCF 2230a_100000223495_100015922095 [0,1,0,0,0,0|2,0,0]=3 9651 B13R0.338 CCCCCN(C)CCCCCCF 269982a_100000223495_100015922095 [0,1,0,0,0,0|2,0,0]=3 9652 B13R0.338 CCCCCN(C)CCCCCCO 2230a_100000223495_100000766143 [0,1,0,0,0,0|1,0,0]=2 9653 B13R0.338 CCCCCN(C)CCCCCCO 269982a_100000223495_100000766143 [0,1,0,0,0,0|1,0,0]=2 9654 B13R0.338 CCCCCN(C)CCOCCCC 2230a_100000223495_100000743108 [0,1,0,0,0,0|3,0,0]=4 9655 B13R0.338 CCCCCN(C)CCOCCCC 269982a_100000223495_100000743108 [0,1,0,0,0,0|3,0,0]=4 9656 B13R0.338 CCCCCNCC(=O)CCCCC 2230a_100000209983_200012276598 [0,1,0,0,0,0|2,0,1]=4 9657 B13R0.338 CCCCCOCC(=O)CCCCC 34a_100000210253_200012276598 [0,1,0,0,0,0|2,0,1]=4 9658 B13R0.338 CCCCCOCC(=O)CCCCC 7a_100000210253_200012276598 [0,1,0,0,0,0|2,0,1]=4 9659 B13R0.338 CCCCCOC[C@@H](N)CCCCN 34a_100016993712_100000718602 [0,1,0,0,0,0|2,0,0]=3 9660 B13R0.338 CCCCCSCC(=O)CCCCC 62a_100000210326_200012276598 [0,1,0,0,0,0|2,0,1]=4 9661 B13R0.338 CCCCCSCC(=O)CCCCC 62a_200012276598_100000210326 [0,1,0,0,0,0|2,0,1]=4 9662 B13R0.338 CCCCNC(=O)CCCCCCO 240690a_100000102301_100011996774 [0,1,0,0,0,0|1,0,1]=3 9663 B13R0.338 CCCCNC(=O)CNCCCCO 2230a_100000750430_100000182744 [0,1,0,0,0,0|2,0,1]=4 9664 B13R0.338 CCCCNC(=O)CNCCCCO 34a_100000750430_100000182744 [0,1,0,0,0,0|2,0,1]=4 9665 B13R0.338 CCCCNC(=O)CSCCCCO 62a_100000182744_100000210776 [0,1,0,0,0,0|2,0,1]=4 9666 B13R0.338 CCCCNC(=O)CSCCCCO 62a_100000210776_100000182744 [0,1,0,0,0,0|2,0,1]=4 9667 B13R0.338 CCCCNC(=O)NCCCCCO 2708a_100000102301_100000762737 [0,1,0,0,0,0|2,0,1]=4 9668 B13R0.338 CCCCNC(=O)NCCCCCO 273464a_100000102301_100000762737 [0,1,0,0,0,0|2,0,1]=4 9669 B13R0.338 CCCCNC(=O)NCCCCCO 273464a_100000762737_100000102301 [0,1,0,0,0,0|2,0,1]=4 9670 B13R0.338 CCCCNC(=O)NCCCCCO 512a_100000102301_100000762737 [0,1,0,0,0,0|2,0,1]=4 9671 B13R0.338 CCCCNC(=O)NCCCCCO 512a_100000762737_100000102301 [0,1,0,0,0,0|2,0,1]=4 9672 B13R0.338 CCCCOC(=O)CNCCCCO 2230a_100000750430_100000211628 [0,1,0,0,0,0|2,0,1]=4 9673 B13R0.338 CCCCOC(=O)CNCCCCO 34a_100000750430_100000211628 [0,1,0,0,0,0|2,0,1]=4 9674 B13R0.338 CCCCOC(=O)CSCCCCO 62a_100000210776_100000211628 [0,1,0,0,0,0|2,0,1]=4 9675 B13R0.338 CCCCOC(=O)CSCCCCO 62a_100000211628_100000210776 [0,1,0,0,0,0|2,0,1]=4 9676 B13R0.338 CCCCOCCC(=O)CCCCO 1458a_100000695505_100000743108 [0,1,0,0,0,0|1,0,1]=3 9677 B13R0.338 CCCCOCCC(=O)COCCO 1458a_100000708028_100000743108 [0,1,0,0,0,0|2,0,1]=4 9678 B13R0.338 CCCCOCCN(C)CCCCO 2230a_100000717598_100000743108 [0,1,0,0,0,0|2,0,0]=3 9679 B13R0.338 CCCCOCCN(C)CCCCO 269982a_100000717598_100000743108 [0,1,0,0,0,0|2,0,0]=3 9680 B13R0.338 CCCOCC(=O)CCCCCCF 1458a_100000745993_100015922095 [0,1,0,0,0,0|2,0,1]=4 9681 B13R0.338 CCCOCC(=O)CCCCCCO 1458a_100000745993_100000766143 [0,1,0,0,0,0|1,0,1]=3 9682 B13R0.338 CCCOCC(=O)NCCCCCO 240690a_100000762737_100000745993 [0,1,0,0,0,0|2,0,1]=4 9683 B13R0.338 CCCOCCNC(=O)CCCCO 1626a_100161115042_100000695505 [0,1,0,0,0,0|2,0,1]=4 9684 B13R0.338 CCCSCC(=O)CCCCCCF 1458a_100000217233_100015922095 [0,1,0,0,0,0|2,0,1]=4 9685 B13R0.338 CCCSCC(=O)CCCCCCO 1458a_100000217233_100000766143 [0,1,0,0,0,0|1,0,1]=3 9686 B13R0.338 CCCSCC(=O)NCCCCCO 240690a_100000762737_100000217233 [0,1,0,0,0,0|2,0,1]=4 9687 B13R0.338 CCCSCC(C)NCCCCCO 270004a_100000762737_100011343953 [0,1,0,0,0,0|2,0,0]=3 9688 B13R0.338 CCCSCC(C)NCCOCCO 270004a_100000211614_100011343953 [0,1,0,0,0,0|3,0,0]=4 9689 B13R0.338 CCCSCC(C)NCCSCCO 270004a_100011219999_100011343953 [0,1,0,0,0,0|3,0,0]=4 9690 B13R0.338 CCOCCC(=O)CCCCCCF 1458a_100000749530_100015922095 [0,1,0,0,0,0|2,0,1]=4 9691 B13R0.338 CCOCCC(=O)CCCCCCO 1458a_100000749530_100000766143 [0,1,0,0,0,0|1,0,1]=3 9692 B13R0.338 CCOCCC(=O)CCCCCCO 1458a_100011996774_100011215890 [0,1,0,0,0,0|1,0,1]=3 9693 B13R0.338 CCOCCC(=O)NCCCCCO 240690a_100000762737_100000749530 [0,1,0,0,0,0|2,0,1]=4 9694 B13R0.338 CCOCCC(C)NCCCCCO 270004a_100000762737_200011216536 [0,1,0,0,0,0|2,0,0]=3 9695 B13R0.338 CCOCCC(C)NCCOCCO 270004a_100000211614_200011216536 [0,1,0,0,0,0|3,0,0]=4 9696 B13R0.338 CCOCCC(C)NCCSCCO 270004a_100011219999_200011216536 [0,1,0,0,0,0|3,0,0]=4 9697 B13R0.338 CCOCCCNC(=O)CCCCO 1626a_100000210961_100000695505 [0,1,0,0,0,0|2,0,1]=4 9698 B13R0.338 CCOCCOC[C@@H](N)CCCCN 34a_100016993712_100000210147 [0,1,0,0,0,0|3,0,0]=4 9699 B13R0.338 CCSCCC(=O)CCCCCCF 1458a_100000230768_100015922095 [0,1,0,0,0,0|2,0,1]=4 9700 B13R0.338 CCSCCC(=O)CCCCCCO 1458a_100000230768_100000766143 [0,1,0,0,0,0|1,0,1]=3 9701 B13R0.338 CCSCCC(=O)CCCCCCO 1458a_100011996774_100000757381 [0,1,0,0,0,0|1,0,1]=3 9702 B13R0.338 CCSCCC(=O)NCCCCCO 240690a_100000762737_100000230768 [0,1,0,0,0,0|2,0,1]=4 9703 B13R0.338 CCSCCOC[C@@H](N)CCCCN 34a_100016993712_100000757381 [0,1,0,0,0,0|3,0,0]=4 9704 B13R0.338 CN(CCCCO)CCCCCC#N 2230a_100000717598_100009813376 [0,1,0,0,0,0|2,0,1]=4 9705 B13R0.338 CN(CCCCO)CCCCCC#N 269982a_100000717598_100009813376 [0,1,0,0,0,0|2,0,1]=4 9706 B13R0.338 CN(CCCCO)CCCCCC=O 2230a_100000717598_100000139337 [0,1,0,0,0,0|2,0,1]=4 9707 B13R0.338 CN(CCCCO)CCCCCC=O 269982a_100000717598_100000139337 [0,1,0,0,0,0|2,0,1]=4 9708 B13R0.338 CN(CCCCO)CCCCCCF 2230a_100000717598_100015922095 [0,1,0,0,0,0|2,0,0]=3 9709 B13R0.338 CN(CCCCO)CCCCCCF 269982a_100000717598_100015922095 [0,1,0,0,0,0|2,0,0]=3 9710 B13R0.338 CN(CCCCO)CCCCCCO 2230a_100000717598_100000766143 [0,1,0,0,0,0|2,0,0]=3 9711 B13R0.338 CN(CCCCO)CCCCCCO 269982a_100000717598_100000766143 [0,1,0,0,0,0|2,0,0]=3 9712 B13R0.338 COCCCC(=O)CCCCCCF 1458a_100000741012_100015922095 [0,1,0,0,0,0|2,0,1]=4 9713 B13R0.338 COCCCC(=O)CCCCCCO 1458a_100000741012_100000766143 [0,1,0,0,0,0|1,0,1]=3 9714 B13R0.338 COCCCC(=O)CCCCCCO 1458a_100011996774_100000740836 [0,1,0,0,0,0|1,0,1]=3 9715 B13R0.338 COCCCC(=O)NCCCCCO 240690a_100000762737_100000741012 [0,1,0,0,0,0|2,0,1]=4 9716 B13R0.338 COCCCC(C)OCCCCCF 34a_200011539412_100000729378 [0,1,0,0,0,0|3,0,0]=4 9717 B13R0.338 COCCCC(C)OCCCCCF 7a_200011539412_100000729378 [0,1,0,0,0,0|3,0,0]=4 9718 B13R0.338 COCCCC(C)OCCCCCO 34a_200011539412_100000746330 [0,1,0,0,0,0|2,0,0]=3 9719 B13R0.338 COCCCC(C)OCCCCCO 7a_200011539412_100000746330 [0,1,0,0,0,0|2,0,0]=3 9720 B13R0.338 COCCCC(C)OCCOCCO 34a_200011539412_100000692535 [0,1,0,0,0,0|3,0,0]=4 9721 B13R0.338 COCCCC(C)OCCOCCO 7a_200011539412_100011215305 [0,1,0,0,0,0|3,0,0]=4 9722 B13R0.338 COCCCCCC(=O)CCCCF 1458a_100011935119_100000729493 [0,1,0,0,0,0|2,0,1]=4 9723 B13R0.338 COCCCCCC(=O)CCCCO 1458a_100011935119_100000210776 [0,1,0,0,0,0|1,0,1]=3 9724 B13R0.338 COCCCCCC(=O)NCCCO 240690a_100000182051_100011935119 [0,1,0,0,0,0|2,0,1]=4 9725 B13R0.338 COCCCCCC(=O)NCCCO 527a_100000182051_100011935119 [0,1,0,0,0,0|2,0,1]=4 9726 B13R0.338 COCCCN(C)CCCCCCF 2230a_100000224831_100015922095 [0,1,0,0,0,0|3,0,0]=4 9727 B13R0.338 COCCCN(C)CCCCCCF 269982a_100000224831_100015922095 [0,1,0,0,0,0|3,0,0]=4 9728 B13R0.338 COCCCN(C)CCCCCCO 2230a_100000224831_100000766143 [0,1,0,0,0,0|2,0,0]=3 9729 B13R0.338 COCCCN(C)CCCCCCO 269982a_100000224831_100000766143 [0,1,0,0,0,0|2,0,0]=3 9730 B13R0.338 COCCCOC[C@@H](N)CCCCN 34a_100016993712_100000740836 [0,1,0,0,0,0|3,0,0]=4 9731 B13R0.338 COCCNC(=O)CCCCCCO 240690a_100000209980_100011996774 [0,1,0,0,0,0|2,0,1]=4 9732 B13R0.338 COCCOCCC(=O)CCCCO 1458a_100000695505_100000695917 [0,1,0,0,0,0|2,0,1]=4 9733 B13R0.338 COCCOCCC(=O)CCCCO 1458a_100000745395_100000210776 [0,1,0,0,0,0|2,0,1]=4 9734 B13R0.338 COCCOCCN(C)CCCCO 2230a_100000717598_100000695917 [0,1,0,0,0,0|3,0,0]=4 9735 B13R0.338 COCCOCCN(C)CCCCO 269982a_100000717598_100000695917 [0,1,0,0,0,0|3,0,0]=4 9736 B13R0.338 CSCCCC(=O)CCCCCCF 1458a_100000173376_100015922095 [0,1,0,0,0,0|2,0,1]=4 9737 B13R0.338 CSCCCC(=O)CCCCCCO 1458a_100000173376_100000766143 [0,1,0,0,0,0|1,0,1]=3 9738 B13R0.338 CSCCCC(=O)NCCCCCO 240690a_100000762737_100000173376 [0,1,0,0,0,0|2,0,1]=4 9739 B13R0.338 CSCCCC(C)NCCCCCO 270004a_100000762737_100011399439 [0,1,0,0,0,0|2,0,0]=3 9740 B13R0.338 CSCCCC(C)NCCOCCO 270004a_100000211614_100011399439 [0,1,0,0,0,0|3,0,0]=4 9741 B13R0.338 CSCCCC(C)NCCSCCO 270004a_100011219999_100011399439 [0,1,0,0,0,0|3,0,0]=4 9742 B13R0.338 CSCCNC(=O)CCCCCCO 240690a_100020590264_100011996774 [0,1,0,0,0,0|2,0,1]=4 9743 B13R0.338 N#CCCCC(=O)CCCCCCO 1458a_100000075515_100000766143 [0,1,0,0,0,0|1,0,2]=4 9744 B13R0.338 N#CCCCC(=O)CCCCCCO 1458a_100011996774_100000211468 [0,1,0,0,0,0|1,0,2]=4 9745 B13R0.338 N#CCCCCCC(=O)CCCCO 1458a_100000695505_100009813376 [0,1,0,0,0,0|1,0,2]=4 9746 B13R0.338 NCCCC[C@H](N)COCCCCF 34a_100016993712_100000729493 [0,1,0,0,0,0|3,0,0]=4 9747 B13R0.338 NCCCC[C@H](N)COCCCCO 34a_100016993712_100011216708 [0,1,0,0,0,0|2,0,0]=3 9748 B13R0.338 O=C(CCCCCCF)COCCO 1458a_100000708028_100015922095 [0,1,0,0,0,0|2,0,1]=4 9749 B13R0.338 O=C(CCCCCCO)COCCO 1458a_100000708028_100000766143 [0,1,0,0,0,0|2,0,1]=4 9750 B13R0.338 O=C(CCCCCCO)NCCCF 240690a_100015189416_100011996774 [0,1,0,0,0,0|2,0,1]=4 9751 B13R0.338 O=C(CCCCCCO)NCCCO 240690a_100000182051_100011996774 [0,1,0,0,0,0|2,0,1]=4 9752 B13R0.338 O=C(CCCCF)CCCCCCO 1458a_100011996774_100000729493 [0,1,0,0,0,0|1,0,1]=3 9753 B13R0.338 O=C(CCCCO)CCCCCCF 1458a_100000695505_100015922095 [0,1,0,0,0,0|1,0,1]=3 9754 B13R0.338 O=C(CCCCO)CCCCCCO 1458a_100000695505_100000766143 [0,1,0,0,0,0|1,0,1]=3 9755 B13R0.338 O=C(CCCCO)CCCCCCO 1458a_100011996774_100000210776 [0,1,0,0,0,0|1,0,1]=3 9756 B13R1.28 BrCCCCCOC1CCCCC1 34a_100000746331_100000210327 [0,0,0,1,0,0|2,0,0]=3 9757 B13R1.28 BrCCCCCOC1CCCCC1 7a_100000746331_100000210327 [0,0,0,1,0,0|2,0,0]=3 9758 B13R1.28 BrCCCCCOC1CCCOC1 34a_100000746331_100000693364 [0,0,0,1,0,0|3,0,0]=4 9759 B13R1.28 BrCCCCCOC1CCCOC1 7a_100000746331_100000693364 [0,0,0,1,0,0|3,0,0]=4 9760 B13R1.28 BrCCCCCOC1CCOCC1 7a_100000746331_100000686592 [0,0,0,1,0,0|3,0,0]=4 9761 B13R1.28 BrCCCCCOC1CCSCC1 34a_100000746331_100000069128 [0,0,0,1,0,0|3,0,0]=4 9762 B13R1.28 BrCCCCCOC1CCSCC1 7a_100000746331_100011500858 [0,0,0,1,0,0|3,0,0]=4 9763 B13R1.28 BrCCCCOCC1CCCCC1 34a_100011216708_100000211423 [0,0,0,1,0,0|2,0,0]=3 9764 B13R1.28 BrCCCCOCC1CCCCO1 34a_100011216708_100000211543 [0,0,0,1,0,0|2,0,0]=3 9765 B13R1.28 BrCCCCOCC1CCCOC1 34a_100011216708_100000741521 [0,0,0,1,0,0|3,0,0]=4 9766 B13R1.28 BrCCCCOCC1CCOCC1 34a_100011216708_100000754603 [0,0,0,1,0,0|3,0,0]=4 9767 B13R1.28 BrCCCOCCC1CCCCC1 34a_100011217188_100011209188 [0,0,0,1,0,0|2,0,0]=3 9768 B13R1.28 BrCCCOCCC1CCOCC1 34a_100011217188_100011934994 [0,0,0,1,0,0|3,0,0]=4 9769 B13R1.28 BrCCCOCCC1OCCCO1 34a_100011217188_100000764188 [0,0,0,1,0,0|3,0,0]=4 9770 B13R1.28 BrCCCOCCN1CCCCC1 34a_100011217188_100000739454 [0,0,0,1,0,0|3,0,0]=4 9771 B13R1.28 BrCCCOCOC1CCCCC1 34a_100011217188_100011935260 [0,0,0,1,0,0|3,0,0]=4 9772 B13R1.28 BrCCOCCCC1CCCCC1 34a_100000211926_100011713725 [0,0,0,1,0,0|2,0,0]=3 9773 B13R1.28 BrCCOCCCN1CCCCC1 34a_100000211926_100000690320 [0,0,0,1,0,0|3,0,0]=4 9774 B13R1.28 BrCCOCCOC1CCCCC1 34a_100000211926_100011211530 [0,0,0,1,0,0|3,0,0]=4 9775 B13R1.28 BrCCOCCOC1CCCCC1 34a_100000692535_100000210327 [0,0,0,1,0,0|3,0,0]=4 9776 B13R1.28 BrCCOCCOC1CCCCC1 7a_100000692535_100000210327 [0,0,0,1,0,0|3,0,0]=4 9777 B13R1.28 BrCCOCCOC1CCCCO1 34a_100000211926_100000744793 [0,0,0,1,0,0|3,0,0]=4 9778 B13R1.28 C#CCCCCNC1CCCCC1 2230a_100000182618_100010269958 [0,0,0,1,0,0|2,0,1]=4 9779 B13R1.28 C#CCCCCNC1CCCCC1 34a_100000182618_100010269958 [0,0,0,1,0,0|2,0,1]=4 9780 B13R1.28 C#CCCCCNC1CCCCC1 34a_100000706060_100000210327 [0,0,0,1,0,0|2,0,1]=4 9781 B13R1.28 C#CCCCCOC1CCCCC1 34a_100000210231_100010269958 [0,0,0,1,0,0|2,0,1]=4 9782 B13R1.28 C#CCCCCOC1CCCCC1 34a_100000766709_100000210327 [0,0,0,1,0,0|2,0,1]=4 9783 B13R1.28 C#CCCCCOC1CCCCC1 7a_100000210231_100010269958 [0,0,0,1,0,0|2,0,1]=4 9784 B13R1.28 C#CCCCCOC1CCCCC1 7a_100000766709_100000210327 [0,0,0,1,0,0|2,0,1]=4 9785 B13R1.28 C#CCCCCOC1CCCCO1 34a_100000033831_100010269958 [0,0,0,1,0,0|1,0,2]=4 9786 B13R1.28 C#CCCCCSC1CCCCC1 62a_100000210327_100010269958 [0,0,0,1,0,0|2,0,1]=4 9787 B13R1.28 C#CCCCCSC1CCCCC1 62a_100010269958_100000210327 [0,0,0,1,0,0|2,0,1]=4 9788 B13R1.28 C#CCCCNCC1CCCCC1 2230a_100000210473_100000731252 [0,0,0,1,0,0|2,0,1]=4 9789 B13R1.28 C#CCCCNCC1CCCCC1 34a_100000210473_100000695029 [0,0,0,1,0,0|2,0,1]=4 9790 B13R1.28 C#CCCCNCC1CCCCC1 34a_100000718082_100000211423 [0,0,0,1,0,0|2,0,1]=4 9791 B13R1.28 C#CCCCNCC1CCCCO1 2230a_100000174945_100000731252 [0,0,0,1,0,0|1,0,2]=4 9792 B13R1.28 C#CCCCNCC1CCCCO1 34a_100000174945_100000695029 [0,0,0,1,0,0|1,0,2]=4 9793 B13R1.28 C#CCCCNCC1CCCCO1 34a_100000718082_100000211543 [0,0,0,1,0,0|1,0,2]=4 9794 B13R1.28 C#CCCCOCC1CCCCC1 34a_100000212181_100000695029 [0,0,0,1,0,0|2,0,1]=4 9795 B13R1.28 C#CCCCOCC1CCCCC1 34a_100000215630_100000211423 [0,0,0,1,0,0|2,0,1]=4 9796 B13R1.28 C#CCCCOCC1CCCCC1 7a_100000212181_100011215417 [0,0,0,1,0,0|2,0,1]=4 9797 B13R1.28 C#CCCCOCC1CCCCC1 7a_100000215630_100000211423 [0,0,0,1,0,0|2,0,1]=4 9798 B13R1.28 C#CCCCOCC1CCCCO1 34a_100000211370_100000695029 [0,0,0,1,0,0|1,0,2]=4 9799 B13R1.28 C#CCCCOCC1CCCCO1 34a_100000215630_100000211543 [0,0,0,1,0,0|1,0,2]=4 9800 B13R1.28 C#CCCCOCC1CCCCO1 7a_100000211370_100011215417 [0,0,0,1,0,0|1,0,2]=4 9801 B13R1.28 C#CCCCOCC1CCCCO1 7a_100000215630_100000211543 [0,0,0,1,0,0|1,0,2]=4 9802 B13R1.28 C#CCCCSCC1CCCCC1 62a_100000211423_100011215417 [0,0,0,1,0,0|2,0,1]=4 9803 B13R1.28 C#CCCCSCC1CCCCC1 62a_100011215417_100000211423 [0,0,0,1,0,0|2,0,1]=4 9804 B13R1.28 C#CCCCSCC1CCCCO1 62a_100000211543_100011215417 [0,0,0,1,0,0|1,0,2]=4 9805 B13R1.28 C#CCCCSCC1CCCCO1 62a_100011215417_100000211543 [0,0,0,1,0,0|1,0,2]=4 9806 B13R1.28 C#CCCNCCC1CCCCC1 2230a_100000738074_100000688953 [0,0,0,1,0,0|2,0,1]=4 9807 B13R1.28 C#CCCNCCC1CCCCC1 34a_100000738074_100000688953 [0,0,0,1,0,0|2,0,1]=4 9808 B13R1.28 C#CCCNCCC1CCCCC1 34a_100000755551_100011209188 [0,0,0,1,0,0|2,0,1]=4 9809 B13R1.28 C#CCCNCCC1CCCCO1 2230a_100015183643_100000688953 [0,0,0,1,0,0|1,0,2]=4 9810 B13R1.28 C#CCCNCCC1CCCCO1 34a_100015183643_100000688953 [0,0,0,1,0,0|1,0,2]=4 9811 B13R1.28 C#CCCOCCC1CCCCC1 34a_100011215631_100011209188 [0,0,0,1,0,0|2,0,1]=4 9812 B13R1.28 C#CCCOCCC1CCCCC1 34a_100011217863_100000688953 [0,0,0,1,0,0|2,0,1]=4 9813 B13R1.28 C#CCCOCCC1CCCCC1 7a_100011217863_100000688953 [0,0,0,1,0,0|2,0,1]=4 9814 B13R1.28 C#CCCSCCC1CCCCC1 62a_100000688953_100012355289 [0,0,0,1,0,0|2,0,1]=4 9815 B13R1.28 C#CCCSCCC1CCCCC1 62a_100012355289_100000688953 [0,0,0,1,0,0|2,0,1]=4 9816 B13R1.28 C#CCNCCCC1CCCCC1 2230a_100011211642_100000038162 [0,0,0,1,0,0|2,0,1]=4 9817 B13R1.28 C#CCNCCCC1CCCCC1 34a_100000212058_100011713725 [0,0,0,1,0,0|2,0,1]=4 9818 B13R1.28 C#CCNCCCC1CCCCC1 34a_100011211642_100000184674 [0,0,0,1,0,0|2,0,1]=4 9819 B13R1.28 C#CCOCCCC1CCCCC1 34a_100000198086_100000184674 [0,0,0,1,0,0|2,0,1]=4 9820 B13R1.28 C#CCOCCCC1CCCCC1 34a_100000210247_100011713725 [0,0,0,1,0,0|2,0,1]=4 9821 B13R1.28 C#CCOCCCC1CCCCC1 7a_100000198086_100000038162 [0,0,0,1,0,0|2,0,1]=4 9822 B13R1.28 C#CCSCCCC1CCCCC1 62a_100000038162_100011713725 [0,0,0,1,0,0|2,0,1]=4 9823 B13R1.28 C/C=C/CCOCC1CCCCO1 34a_100016278192_100000211543 [0,0,0,1,0,0|1,0,2]=4 9824 B13R1.28 C/C=C/CNCCC1CCCCO1 34a_100015183643_100102629194 [0,0,0,1,0,0|1,0,2]=4 9825 B13R1.28 C=CCCCCNC1CCCCC1 2230a_100000182618_100011215482 [0,0,0,1,0,0|2,0,1]=4 9826 B13R1.28 C=CCCCCNC1CCCCC1 270004a_100000703577_100000210434 [0,0,0,1,0,0|2,0,1]=4 9827 B13R1.28 C=CCCCCNC1CCCCC1 34a_100000182618_100011215482 [0,0,0,1,0,0|2,0,1]=4 9828 B13R1.28 C=CCCCCNC1CCCCC1 34a_100000703577_100000210327 [0,0,0,1,0,0|2,0,1]=4 9829 B13R1.28 C=CCCCCOC1CCCCC1 34a_100000210231_100011215482 [0,0,0,1,0,0|2,0,1]=4 9830 B13R1.28 C=CCCCCOC1CCCCC1 34a_100000766645_100000210327 [0,0,0,1,0,0|2,0,1]=4 9831 B13R1.28 C=CCCCCOC1CCCCC1 7a_100000210231_100011215482 [0,0,0,1,0,0|2,0,1]=4 9832 B13R1.28 C=CCCCCOC1CCCCC1 7a_100000766645_100000210327 [0,0,0,1,0,0|2,0,1]=4 9833 B13R1.28 C=CCCCCOC1CCCCO1 34a_100000033831_100011215482 [0,0,0,1,0,0|1,0,2]=4 9834 B13R1.28 C=CCCCCSC1CCCCC1 62a_100000210327_100011215482 [0,0,0,1,0,0|2,0,1]=4 9835 B13R1.28 C=CCCCCSC1CCCCC1 62a_100011215482_100000210327 [0,0,0,1,0,0|2,0,1]=4 9836 B13R1.28 C=CCCCNCC1CCCCC1 2230a_100000210473_100011713584 [0,0,0,1,0,0|2,0,1]=4 9837 B13R1.28 C=CCCCNCC1CCCCC1 2230a_100000700776_100000211423 [0,0,0,1,0,0|2,0,1]=4 9838 B13R1.28 C=CCCCNCC1CCCCC1 269862a_100000700776_100000211278 [0,0,0,1,0,0|2,0,1]=4 9839 B13R1.28 C=CCCCNCC1CCCCC1 34a_100000210473_100000757094 [0,0,0,1,0,0|2,0,1]=4 9840 B13R1.28 C=CCCCNCC1CCCCC1 34a_100000700776_100000211423 [0,0,0,1,0,0|2,0,1]=4 9841 B13R1.28 C=CCCCNCC1CCCCO1 2230a_100000174945_100011713584 [0,0,0,1,0,0|1,0,2]=4 9842 B13R1.28 C=CCCCNCC1CCCCO1 2230a_100000700776_100000211543 [0,0,0,1,0,0|1,0,2]=4 9843 B13R1.28 C=CCCCNCC1CCCCO1 34a_100000174945_100000757094 [0,0,0,1,0,0|1,0,2]=4 9844 B13R1.28 C=CCCCNCC1CCCCO1 34a_100000700776_100000211543 [0,0,0,1,0,0|1,0,2]=4 9845 B13R1.28 C=CCCCOCC1CCCCC1 34a_100000212181_100000757094 [0,0,0,1,0,0|2,0,1]=4 9846 B13R1.28 C=CCCCOCC1CCCCC1 34a_100000758997_100000211423 [0,0,0,1,0,0|2,0,1]=4 9847 B13R1.28 C=CCCCOCC1CCCCC1 7a_100000212181_100000757094 [0,0,0,1,0,0|2,0,1]=4 9848 B13R1.28 C=CCCCOCC1CCCCC1 7a_100000758997_100000211423 [0,0,0,1,0,0|2,0,1]=4 9849 B13R1.28 C=CCCCOCC1CCCCO1 34a_100000211370_100000757094 [0,0,0,1,0,0|1,0,2]=4 9850 B13R1.28 C=CCCCOCC1CCCCO1 34a_100000758997_100000211543 [0,0,0,1,0,0|1,0,2]=4 9851 B13R1.28 C=CCCCOCC1CCCCO1 7a_100000211370_100000757094 [0,0,0,1,0,0|1,0,2]=4 9852 B13R1.28 C=CCCCOCC1CCCCO1 7a_100000758997_100000211543 [0,0,0,1,0,0|1,0,2]=4 9853 B13R1.28 C=CCCCSCC1CCCCC1 62a_100000211423_100000757094 [0,0,0,1,0,0|2,0,1]=4 9854 B13R1.28 C=CCCCSCC1CCCCC1 62a_100011713584_100000211423 [0,0,0,1,0,0|2,0,1]=4 9855 B13R1.28 C=CCCCSCC1CCCCO1 62a_100000211543_100000757094 [0,0,0,1,0,0|1,0,2]=4 9856 B13R1.28 C=CCCCSCC1CCCCO1 62a_100011713584_100000211543 [0,0,0,1,0,0|1,0,2]=4 9857 B13R1.28 C=CCCNCCC1CCCCC1 2230a_100000738074_100000754431 [0,0,0,1,0,0|2,0,1]=4 9858 B13R1.28 C=CCCNCCC1CCCCC1 2230a_100015191253_100012355289 [0,0,0,1,0,0|2,0,1]=4 9859 B13R1.28 C=CCCNCCC1CCCCC1 270004a_100015191253_100011713444 [0,0,0,1,0,0|2,0,1]=4 9860 B13R1.28 C=CCCNCCC1CCCCC1 34a_100000738074_100000754431 [0,0,0,1,0,0|2,0,1]=4 9861 B13R1.28 C=CCCNCCC1CCCCO1 2230a_100015183643_100000754431 [0,0,0,1,0,0|1,0,2]=4 9862 B13R1.28 C=CCCNCCC1CCCCO1 34a_100015183643_100000754431 [0,0,0,1,0,0|1,0,2]=4 9863 B13R1.28 C=CCCOCCC1CCCCC1 34a_100011205117_100011209188 [0,0,0,1,0,0|2,0,1]=4 9864 B13R1.28 C=CCCOCCC1CCCCC1 34a_100011217863_100000754431 [0,0,0,1,0,0|2,0,1]=4 9865 B13R1.28 C=CCCOCCC1CCCCC1 7a_100011217863_100000754431 [0,0,0,1,0,0|2,0,1]=4 9866 B13R1.28 C=CCCSCCC1CCCCC1 62a_100000754431_100012355289 [0,0,0,1,0,0|2,0,1]=4 9867 B13R1.28 C=CCCSCCC1CCCCC1 62a_100012355289_100000754431 [0,0,0,1,0,0|2,0,1]=4 9868 B13R1.28 C=CCNCCCC1CCCCC1 2230a_100011211642_100000210623 [0,0,0,1,0,0|2,0,1]=4 9869 B13R1.28 C=CCNCCCC1CCCCC1 2230a_100020586998_100011713725 [0,0,0,1,0,0|2,0,1]=4 9870 B13R1.28 C=CCNCCCC1CCCCC1 34a_100011211642_100015514636 [0,0,0,1,0,0|2,0,1]=4 9871 B13R1.28 C=CCOCCCC1CCCCC1 34a_100000198086_100015514636 [0,0,0,1,0,0|2,0,1]=4 9872 B13R1.28 C=CCOCCCC1CCCCC1 34a_200000210373_100011713725 [0,0,0,1,0,0|2,0,1]=4 9873 B13R1.28 C=CCOCCCC1CCCCC1 7a_100000198086_100015514636 [0,0,0,1,0,0|2,0,1]=4 9874 B13R1.28 C=CCSCCCC1CCCCC1 62a_100000210623_100011713725 [0,0,0,1,0,0|2,0,1]=4 9875 B13R1.28 C=CCSCCCC1CCCCC1 62a_100011713725_100000210623 [0,0,0,1,0,0|2,0,1]=4 9876 B13R1.28 CC#CCCOCC1CCCCO1 34a_100000750427_100000211543 [0,0,0,1,0,0|1,0,2]=4 9877 B13R1.28 CC#CCNCCC1CCCCO1 2230a_100015183643_100000748600 [0,0,0,1,0,0|1,0,2]=4 9878 B13R1.28 CC#CCNCCC1CCCCO1 34a_100015183643_100000748600 [0,0,0,1,0,0|1,0,2]=4 9879 B13R1.28 CC/C=C\CCOC1CCCCO1 34a_100000033831_100015370543 [0,0,0,1,0,0|1,0,2]=4 9880 B13R1.28 CC/C=C\CNCC1CCCCO1 2230a_100000174945_100103147603 [0,0,0,1,0,0|1,0,2]=4 9881 B13R1.28 CC/C=C\CNCC1CCCCO1 34a_100000174945_100103147603 [0,0,0,1,0,0|1,0,2]=4 9882 B13R1.28 CC/C=C\COCC1CCCCO1 34a_100000211370_100103147603 [0,0,0,1,0,0|1,0,2]=4 9883 B13R1.28 CC/C=C\COCC1CCCCO1 34a_100016268518_100000211543 [0,0,0,1,0,0|1,0,2]=4 9884 B13R1.28 CC/C=C\COCC1CCCCO1 7a_100000211370_100103147603 [0,0,0,1,0,0|1,0,2]=4 9885 B13R1.28 CC/C=C\CSCC1CCCCO1 62a_100000211543_100103147603 [0,0,0,1,0,0|1,0,2]=4 9886 B13R1.28 CC/C=C\CSCC1CCCCO1 62a_100103147603_100000211543 [0,0,0,1,0,0|1,0,2]=4 9887 B13R1.28 CC=CCNCCC1CCCCO1 2230a_100015183643_100000070051 [0,0,0,1,0,0|1,0,2]=4 9888 B13R1.28 CC=CCNCCC1CCCCO1 34a_100015183643_100000070051 [0,0,0,1,0,0|1,0,2]=4 9889 B13R1.28 CCC#CCNCC1CCCCO1 2230a_100000174945_100009813939 [0,0,0,1,0,0|1,0,2]=4 9890 B13R1.28 CCC#CCNCC1CCCCO1 34a_100000174945_100009813939 [0,0,0,1,0,0|1,0,2]=4 9891 B13R1.28 CCC#CCOCC1CCCCO1 34a_100000032950_100000211543 [0,0,0,1,0,0|1,0,2]=4 9892 B13R1.28 CCC#CCOCC1CCCCO1 34a_100000211370_100009813939 [0,0,0,1,0,0|1,0,2]=4 9893 B13R1.28 CCC#CCOCC1CCCCO1 7a_100000211370_100009813939 [0,0,0,1,0,0|1,0,2]=4 9894 B13R1.28 CCC#CCSCC1CCCCO1 62a_100000211543_100009813939 [0,0,0,1,0,0|1,0,2]=4 9895 B13R1.28 CCC#CCSCC1CCCCO1 62a_100009813939_100000211543 [0,0,0,1,0,0|1,0,2]=4 9896 B13R1.28 CCCCCCCN1CCCOC1 2230a_100000131196_100000210681 [0,0,0,1,0,0|3,0,0]=4 9897 B13R1.28 CCCCCCCN1CCCOC1 269982a_100000131196_100000210681 [0,0,0,1,0,0|3,0,0]=4 9898 B13R1.28 CCCCCCCN1CCCOC1 34a_100000131196_100000210614 [0,0,0,1,0,0|3,0,0]=4 9899 B13R1.28 CCCCCCCN1CCOCC1 2230a_100015191051_100000210681 [0,0,0,1,0,0|3,0,0]=4 9900 B13R1.28 CCCCCCCN1CCOCC1 269982a_100015191051_100000210681 [0,0,0,1,0,0|3,0,0]=4 9901 B13R1.28 CCCCCCCN1CCOCC1 34a_100015191051_100000210614 [0,0,0,1,0,0|3,0,0]=4 9902 B13R1.28 CCCCCCCN1CCSCC1 2230a_100000737611_100000210681 [0,0,0,1,0,0|3,0,0]=4 9903 B13R1.28 CCCCCCCN1CCSCC1 269982a_100000737611_100000210681 [0,0,0,1,0,0|3,0,0]=4 9904 B13R1.28 CCCCCCNC1C=CCCC1 2230a_100000210581_100000751183 [0,0,0,1,0,0|2,0,1]=4 9905 B13R1.28 CCCCCCNC1CCCCC1 2230a_100000182618_100000210314 [0,0,0,1,0,0|2,0,0]=3 9906 B13R1.28 CCCCCCNC1CCCCC1 270004a_100000210581_100000210434 [0,0,0,1,0,0|2,0,0]=3 9907 B13R1.28 CCCCCCNC1CCCCC1 34a_100000182618_100000210314 [0,0,0,1,0,0|2,0,0]=3 9908 B13R1.28 CCCCCCNC1CCCOC1 2230a_100000719290_100000210314 [0,0,0,1,0,0|3,0,0]=4 9909 B13R1.28 CCCCCCNC1CCCOC1 270004a_100000210581_100000753404 [0,0,0,1,0,0|3,0,0]=4 9910 B13R1.28 CCCCCCNC1CCCOC1 34a_100000719290_100000210314 [0,0,0,1,0,0|3,0,0]=4 9911 B13R1.28 CCCCCCNC1CCCSC1 270004a_100000210581_100000057913 [0,0,0,1,0,0|3,0,0]=4 9912 B13R1.28 CCCCCCNC1CCNCC1 270004a_100000210581_100015192401 [0,0,0,1,0,0|3,0,0]=4 9913 B13R1.28 CCCCCCNC1CCOCC1 2230a_100000741149_100000210314 [0,0,0,1,0,0|3,0,0]=4 9914 B13R1.28 CCCCCCNC1CCOCC1 270004a_100000210581_100011217826 [0,0,0,1,0,0|3,0,0]=4 9915 B13R1.28 CCCCCCNC1CCOCC1 34a_100000741149_100000210314 [0,0,0,1,0,0|3,0,0]=4 9916 B13R1.28 CCCCCCNC1CCSCC1 2230a_100000748639_100000210314 [0,0,0,1,0,0|3,0,0]=4 9917 B13R1.28 CCCCCCNC1CCSCC1 270004a_100000210581_100000203788 [0,0,0,1,0,0|3,0,0]=4 9918 B13R1.28 CCCCCCNC1CCSCC1 34a_100000748639_100000210314 [0,0,0,1,0,0|3,0,0]=4 9919 B13R1.28 CCCCCCOC1C=CCCC1 34a_100011215024_100000210314 [0,0,0,1,0,0|2,0,1]=4 9920 B13R1.28 CCCCCCOC1C=CCCC1 7a_100000210259_100000751183 [0,0,0,1,0,0|2,0,1]=4 9921 B13R1.28 CCCCCCOC1CCCCC1 34a_100000210231_100000210314 [0,0,0,1,0,0|2,0,0]=3 9922 B13R1.28 CCCCCCOC1CCCCC1 34a_100000210259_100000210327 [0,0,0,1,0,0|2,0,0]=3 9923 B13R1.28 CCCCCCOC1CCCCC1 7a_100000210231_100000210314 [0,0,0,1,0,0|2,0,0]=3 9924 B13R1.28 CCCCCCOC1CCCCC1 7a_100000210259_100000210327 [0,0,0,1,0,0|2,0,0]=3 9925 B13R1.28 CCCCCCOC1CCCCO1 34a_100000033831_100000210314 [0,0,0,1,0,0|1,0,0]=2 9926 B13R1.28 CCCCCCOC1CCCOC1 34a_100000210259_100000693364 [0,0,0,1,0,0|3,0,0]=4 9927 B13R1.28 CCCCCCOC1CCCOC1 34a_100000754041_100000210314 [0,0,0,1,0,0|3,0,0]=4 9928 B13R1.28 CCCCCCOC1CCCOC1 7a_100000210259_100000693364 [0,0,0,1,0,0|3,0,0]=4 9929 B13R1.28 CCCCCCOC1CCCSC1 7a_100015962668_100000210314 [0,0,0,1,0,0|3,0,0]=4 9930 B13R1.28 CCCCCCOC1CCOCC1 34a_100000744328_100000210314 [0,0,0,1,0,0|3,0,0]=4 9931 B13R1.28 CCCCCCOC1CCOCC1 7a_100000210259_100000686592 [0,0,0,1,0,0|3,0,0]=4 9932 B13R1.28 CCCCCCOC1CCSCC1 34a_100000210259_100000069128 [0,0,0,1,0,0|3,0,0]=4 9933 B13R1.28 CCCCCCOC1CCSCC1 34a_100000731022_100000210314 [0,0,0,1,0,0|3,0,0]=4 9934 B13R1.28 CCCCCCOC1CCSCC1 7a_100000210259_100011500858 [0,0,0,1,0,0|3,0,0]=4 9935 B13R1.28 CCCCCCOC1CCSCC1 7a_100000731022_100000210314 [0,0,0,1,0,0|3,0,0]=4 9936 B13R1.28 CCCCCCSC1C=CCCC1 62a_100000210314_100000751183 [0,0,0,1,0,0|2,0,1]=4 9937 B13R1.28 CCCCCCSC1C=CCCC1 62a_100000751183_100000210757 [0,0,0,1,0,0|2,0,1]=4 9938 B13R1.28 CCCCCCSC1CCCCC1 62a_100000210314_100000210327 [0,0,0,1,0,0|2,0,0]=3 9939 B13R1.28 CCCCCCSC1CCCCC1 62a_100000210327_100000210757 [0,0,0,1,0,0|2,0,0]=3 9940 B13R1.28 CCCCCCSC1CCCOC1 62a_100000210314_100000693364 [0,0,0,1,0,0|3,0,0]=4 9941 B13R1.28 CCCCCCSC1CCOCC1 62a_100000210314_100011324220 [0,0,0,1,0,0|3,0,0]=4 9942 B13R1.28 CCCCCCSC1CCSCC1 62a_100000210314_100000069128 [0,0,0,1,0,0|3,0,0]=4 9943 B13R1.28 CCCCCNCC1CCCCC1 2230a_100000209983_100000211423 [0,0,0,1,0,0|2,0,0]=3 9944 B13R1.28 CCCCCNCC1CCCCC1 2230a_100000210473_100000210326 [0,0,0,1,0,0|2,0,0]=3 9945 B13R1.28 CCCCCNCC1CCCCC1 269862a_100000209983_100000211278 [0,0,0,1,0,0|2,0,0]=3 9946 B13R1.28 CCCCCNCC1CCCCC1 34a_100000210473_100000718602 [0,0,0,1,0,0|2,0,0]=3 9947 B13R1.28 CCCCCNCC1CCCCO1 2230a_100000174945_100000210326 [0,0,0,1,0,0|1,0,0]=2 9948 B13R1.28 CCCCCNCC1CCCCO1 2230a_100000209983_100000211543 [0,0,0,1,0,0|1,0,0]=2 9949 B13R1.28 CCCCCNCC1CCCCO1 34a_100000174945_100000718602 [0,0,0,1,0,0|1,0,0]=2 9950 B13R1.28 CCCCCNCC1CCCOC1 2230a_100000209983_100000741521 [0,0,0,1,0,0|3,0,0]=4 9951 B13R1.28 CCCCCNCC1CCCOC1 2230a_100000720124_100000210326 [0,0,0,1,0,0|3,0,0]=4 9952 B13R1.28 CCCCCNCC1CCCOC1 34a_100000720124_100000718602 [0,0,0,1,0,0|3,0,0]=4 9953 B13R1.28 CCCCCNCC1CCOCC1 2230a_100000209983_100000754603 [0,0,0,1,0,0|3,0,0]=4 9954 B13R1.28 CCCCCNCC1CCOCC1 2230a_100000746373_100000210326 [0,0,0,1,0,0|3,0,0]=4 9955 B13R1.28 CCCCCNCC1CCOCC1 269862a_100000209983_100000749017 [0,0,0,1,0,0|3,0,0]=4 9956 B13R1.28 CCCCCNCC1CCOCC1 34a_100000746373_100000718602 [0,0,0,1,0,0|3,0,0]=4 9957 B13R1.28 CCCCCNCC1CCSCC1 2230a_100015188806_100000210326 [0,0,0,1,0,0|3,0,0]=4 9958 B13R1.28 CCCCCNCC1CCSCC1 269862a_100000209983_100000067145 [0,0,0,1,0,0|3,0,0]=4 9959 B13R1.28 CCCCCNCC1CCSCC1 270004a_100000209983_100000067145 [0,0,0,1,0,0|3,0,0]=4 9960 B13R1.28 CCCCCNCC1CCSCC1 34a_100015188806_100000718602 [0,0,0,1,0,0|3,0,0]=4 9961 B13R1.28 CCCCCNC[C@H]1COCCO1 2230a_100010981119_100000210326 [0,0,0,1,0,0|2,0,0]=3 9962 B13R1.28 CCCCCNC[C@H]1COCCO1 34a_100010981119_100000718602 [0,0,0,1,0,0|2,0,0]=3 9963 B13R1.28 CCCCCOCC1CCC=CO1 34a_100011217868_100000718602 [0,0,0,1,0,0|1,0,2]=4 9964 B13R1.28 CCCCCOCC1CCCCC1 34a_100000210253_100000211423 [0,0,0,1,0,0|2,0,0]=3 9965 B13R1.28 CCCCCOCC1CCCCC1 34a_100000212181_100000718602 [0,0,0,1,0,0|2,0,0]=3 9966 B13R1.28 CCCCCOCC1CCCCC1 7a_100000210253_100000211423 [0,0,0,1,0,0|2,0,0]=3 9967 B13R1.28 CCCCCOCC1CCCCC1 7a_100000212181_100000210326 [0,0,0,1,0,0|2,0,0]=3 9968 B13R1.28 CCCCCOCC1CCCCN1 34a_100000210821_100000718602 [0,0,0,1,0,0|2,0,0]=3 9969 B13R1.28 CCCCCOCC1CCCCO1 34a_100000210253_100000211543 [0,0,0,1,0,0|1,0,0]=2 9970 B13R1.28 CCCCCOCC1CCCCO1 34a_100000211370_100000718602 [0,0,0,1,0,0|1,0,0]=2 9971 B13R1.28 CCCCCOCC1CCCCO1 7a_100000210253_100000211543 [0,0,0,1,0,0|1,0,0]=2 9972 B13R1.28 CCCCCOCC1CCCCO1 7a_100000211370_100000210326 [0,0,0,1,0,0|1,0,0]=2 9973 B13R1.28 CCCCCOCC1CCCNC1 34a_100000211344_100000718602 [0,0,0,1,0,0|3,0,0]=4 9974 B13R1.28 CCCCCOCC1CCCOC1 34a_100000210253_100000741521 [0,0,0,1,0,0|3,0,0]=4 9975 B13R1.28 CCCCCOCC1CCCOC1 34a_100000741520_100000718602 [0,0,0,1,0,0|3,0,0]=4 9976 B13R1.28 CCCCCOCC1CCCOC1 7a_100000210253_100000741521 [0,0,0,1,0,0|3,0,0]=4 9977 B13R1.28 CCCCCOCC1CCNCC1 34a_100000738675_100000718602 [0,0,0,1,0,0|3,0,0]=4 9978 B13R1.28 CCCCCOCC1CCOCC1 34a_100000210253_100000754603 [0,0,0,1,0,0|3,0,0]=4 9979 B13R1.28 CCCCCOCC1CCOCC1 34a_100000749013_100000718602 [0,0,0,1,0,0|3,0,0]=4 9980 B13R1.28 CCCCCOCC1CCOCC1 7a_100000210253_100000754603 [0,0,0,1,0,0|3,0,0]=4 9981 B13R1.28 CCCCCOCC1CCSCC1 34a_100000070558_100000718602 [0,0,0,1,0,0|3,0,0]=4 9982 B13R1.28 CCCCCOCC1CCSCC1 7a_100000070558_100000210326 [0,0,0,1,0,0|3,0,0]=4 9983 B13R1.28 CCCCCOC[C@@H]1CNCCO1 34a_100015189573_100000718602 [0,0,0,1,0,0|2,0,0]=3 9984 B13R1.28 CCCCCOC[C@@H]1COCCN1 34a_100000717676_100000718602 [0,0,0,1,0,0|3,0,0]=4 9985 B13R1.28 CCCCCOC[C@H]1COCCO1 34a_100009875890_100000718602 [0,0,0,1,0,0|2,0,0]=3 9986 B13R1.28 CCCCCSCC1CCCCC1 62a_100000210326_100000211423 [0,0,0,1,0,0|2,0,0]=3 9987 B13R1.28 CCCCCSCC1CCCCC1 62a_100000211423_100000210326 [0,0,0,1,0,0|2,0,0]=3 9988 B13R1.28 CCCCCSCC1CCCCO1 62a_100000210326_100000211543 [0,0,0,1,0,0|1,0,0]=2 9989 B13R1.28 CCCCCSCC1CCCCO1 62a_100000211543_100000210326 [0,0,0,1,0,0|1,0,0]=2 9990 B13R1.28 CCCCCSCC1CCCOC1 62a_100000210326_100000741521 [0,0,0,1,0,0|3,0,0]=4 9991 B13R1.28 CCCCCSCC1CCCOC1 62a_100000741521_100000210326 [0,0,0,1,0,0|3,0,0]=4 9992 B13R1.28 CCCCCSCC1CCOCC1 62a_100000210326_100000749018 [0,0,0,1,0,0|3,0,0]=4 9993 B13R1.28 CCCCCSCC1CCOCC1 62a_100000754603_100000210326 [0,0,0,1,0,0|3,0,0]=4 9994 B13R1.28 CCCCNCCC1=CCCCC1 2230a_100000212019_100000210211 [0,0,0,1,0,0|2,0,1]=4 9995 B13R1.28 CCCCNCCC1=CCCCC1 34a_100000212019_100000210210 [0,0,0,1,0,0|2,0,1]=4 9996 B13R1.28 CCCCNCCC1CCCCC1 2230a_100000102301_100012355289 [0,0,0,1,0,0|2,0,0]=3 9997 B13R1.28 CCCCNCCC1CCCCC1 2230a_100000738074_100000210211 [0,0,0,1,0,0|2,0,0]=3 9998 B13R1.28 CCCCNCCC1CCCCC1 270004a_100000102301_100011713444 [0,0,0,1,0,0|2,0,0]=3 9999 B13R1.28 CCCCNCCC1CCCCC1 34a_100000738074_100000210210 [0,0,0,1,0,0|2,0,0]=3 10000 B13R1.28 CCCCNCCC1CCCCC1 7a_106832991798_100011273959 [0,0,0,1,0,0|2,0,0]=3 10001 B13R1.28 CCCCNCCC1CCCCO1 2230a_100015183643_100000210211 [0,0,0,1,0,0|1,0,0]=2 10002 B13R1.28 CCCCNCCC1CCCCO1 34a_100015183643_100000210210 [0,0,0,1,0,0|1,0,0]=2 10003 B13R1.28 CCCCNCCC1CCOCC1 2230a_100000102301_100011934994 [0,0,0,1,0,0|3,0,0]=4 10004 B13R1.28 CCCCNCCC1CCOCC1 2230a_100000755988_100000210211 [0,0,0,1,0,0|3,0,0]=4 10005 B13R1.28 CCCCNCCC1CCOCC1 34a_100000755988_100000210210 [0,0,0,1,0,0|3,0,0]=4 10006 B13R1.28 CCCCNCCC1CCOCC1 7a_106832991798_100011934994 [0,0,0,1,0,0|3,0,0]=4 10007 B13R1.28 CCCCNCCC1OCCCO1 2230a_100000102301_100000764188 [0,0,0,1,0,0|2,0,0]=3 10008 B13R1.28 CCCCNCCC1OCCCO1 7a_106832991798_100000764188 [0,0,0,1,0,0|2,0,0]=3 10009 B13R1.28 CCCCNCCN1CCCCC1 2230a_100000102301_100000739454 [0,0,0,1,0,0|3,0,0]=4 10010 B13R1.28 CCCCNCCN1CCCCC1 7a_106832991798_100000739454 [0,0,0,1,0,0|3,0,0]=4 10011 B13R1.28 CCCCNCOC1CCCCC1 2230a_100000102301_100011935260 [0,0,0,1,0,0|3,0,0]=4 10012 B13R1.28 CCCCNCOC1CCCCC1 7a_106832991798_100011935260 [0,0,0,1,0,0|3,0,0]=4 10013 B13R1.28 CCCCOCCC1CCCCC1 34a_100000210227_100011209188 [0,0,0,1,0,0|2,0,0]=3 10014 B13R1.28 CCCCOCCC1CCCCC1 34a_100011217863_100000210210 [0,0,0,1,0,0|2,0,0]=3 10015 B13R1.28 CCCCOCCC1CCCCC1 7a_100000210227_100011273959 [0,0,0,1,0,0|2,0,0]=3 10016 B13R1.28 CCCCOCCC1CCCCC1 7a_100011217863_100000210211 [0,0,0,1,0,0|2,0,0]=3 10017 B13R1.28 CCCCOCCC1CCCCN1 34a_100000211664_100000210210 [0,0,0,1,0,0|2,0,0]=3 10018 B13R1.28 CCCCOCCC1CCCNC1 34a_100000752241_100000210210 [0,0,0,1,0,0|3,0,0]=4 10019 B13R1.28 CCCCOCCC1CCNCC1 34a_100015190746_100000210210 [0,0,0,1,0,0|3,0,0]=4 10020 B13R1.28 CCCCOCCC1CCOCC1 34a_100000210227_100011934994 [0,0,0,1,0,0|3,0,0]=4 10021 B13R1.28 CCCCOCCC1CCOCC1 34a_100011933979_100000210210 [0,0,0,1,0,0|3,0,0]=4 10022 B13R1.28 CCCCOCCC1CCOCC1 7a_100000210227_100011934994 [0,0,0,1,0,0|3,0,0]=4 10023 B13R1.28 CCCCOCCC1CCOCC1 7a_100011933979_100000210211 [0,0,0,1,0,0|3,0,0]=4 10024 B13R1.28 CCCCOCCC1OCCCO1 34a_100000210227_100000764188 [0,0,0,1,0,0|2,0,0]=3 10025 B13R1.28 CCCCOCCC1OCCCO1 7a_100000210227_100000764188 [0,0,0,1,0,0|2,0,0]=3 10026 B13R1.28 CCCCOCCC1SCCCS1 34a_200011025297_100000210210 [0,0,0,1,0,0|2,1,0]=4 10027 B13R1.28 CCCCOCCC1SCCCS1 7a_200011025297_100000210211 [0,0,0,1,0,0|2,1,0]=4 10028 B13R1.28 CCCCOCCN1CCCCC1 34a_100000210227_100000739454 [0,0,0,1,0,0|3,0,0]=4 10029 B13R1.28 CCCCOCCN1CCCCC1 7a_100000210227_100000739454 [0,0,0,1,0,0|3,0,0]=4 10030 B13R1.28 CCCCOCC[C@@H]1CNCCN1 34a_100016989929_100000210210 [0,0,0,1,0,0|3,0,0]=4 10031 B13R1.28 CCCCOCNC1CCCCC1 2230a_100000182618_100011995733 [0,0,0,1,0,0|3,0,0]=4 10032 B13R1.28 CCCCOCNC1CCCCC1 34a_100000182618_100011995733 [0,0,0,1,0,0|3,0,0]=4 10033 B13R1.28 CCCCOCOC1CCCCC1 34a_100000210227_100011935260 [0,0,0,1,0,0|3,0,0]=4 10034 B13R1.28 CCCCOCOC1CCCCC1 34a_100000210231_100011995733 [0,0,0,1,0,0|3,0,0]=4 10035 B13R1.28 CCCCOCOC1CCCCC1 7a_100000210227_100011935260 [0,0,0,1,0,0|3,0,0]=4 10036 B13R1.28 CCCCOCOC1CCCCO1 34a_100000033831_100011995733 [0,0,0,1,0,0|2,0,0]=3 10037 B13R1.28 CCCCOCSC1CCCCC1 62a_100000210327_100011995733 [0,0,0,1,0,0|3,0,0]=4 10038 B13R1.28 CCCCOCSC1CCCCC1 62a_100011995733_100000210327 [0,0,0,1,0,0|3,0,0]=4 10039 B13R1.28 CCCCSCCC1CCCCC1 62a_100000210211_100012355289 [0,0,0,1,0,0|2,0,0]=3 10040 B13R1.28 CCCCSCCC1CCCCC1 62a_100012355289_100000210210 [0,0,0,1,0,0|2,0,0]=3 10041 B13R1.28 CCCCSCCC1CCOCC1 62a_100000210211_100011934994 [0,0,0,1,0,0|3,0,0]=4 10042 B13R1.28 CCCCSCCC1CCOCC1 62a_100011934994_100000210210 [0,0,0,1,0,0|3,0,0]=4 10043 B13R1.28 CCCCSCCC1OCCCO1 62a_100000210211_100000764188 [0,0,0,1,0,0|2,0,0]=3 10044 B13R1.28 CCCCSCCC1OCCCO1 62a_100000764188_100000210210 [0,0,0,1,0,0|2,0,0]=3 10045 B13R1.28 CCCCSCCN1CCCCC1 62a_100000210211_100000739454 [0,0,0,1,0,0|3,0,0]=4 10046 B13R1.28 CCCCSCCN1CCCCC1 62a_100000739454_100000210210 [0,0,0,1,0,0|3,0,0]=4 10047 B13R1.28 CCCCSCOC1CCCCC1 62a_100000210211_100011935260 [0,0,0,1,0,0|3,0,0]=4 10048 B13R1.28 CCCCSCOC1CCCCC1 62a_100011935260_100000210210 [0,0,0,1,0,0|3,0,0]=4 10049 B13R1.28 CCCNCCCC1CCCCC1 2230a_100011211642_100000210303 [0,0,0,1,0,0|2,0,0]=3 10050 B13R1.28 CCCNCCCC1CCCCC1 34a_100011211642_100000210303 [0,0,0,1,0,0|2,0,0]=3 10051 B13R1.28 CCCNCCOC1CCCCC1 34a_100015206981_100000210303 [0,0,0,1,0,0|3,0,0]=4 10052 B13R1.28 CCCOCCCC1CCCCC1 34a_100000198086_100000210303 [0,0,0,1,0,0|2,0,0]=3 10053 B13R1.28 CCCOCCCC1CCCCC1 34a_100000210258_100011713725 [0,0,0,1,0,0|2,0,0]=3 10054 B13R1.28 CCCOCCCC1CCCCC1 7a_100000198086_100000210303 [0,0,0,1,0,0|2,0,0]=3 10055 B13R1.28 CCCOCCCC1CCCCN1 34a_100011934581_100000210303 [0,0,0,1,0,0|2,0,0]=3 10056 B13R1.28 CCCOCCCC1CCCNC1 34a_100150707839_100000210303 [0,0,0,1,0,0|3,0,0]=4 10057 B13R1.28 CCCOCCCC1CCNCC1 34a_100016988962_100000210303 [0,0,0,1,0,0|3,0,0]=4 10058 B13R1.28 CCCOCCCN1CCCCC1 34a_100000210258_100000690320 [0,0,0,1,0,0|3,0,0]=4 10059 B13R1.28 CCCOCCCN1CCCCC1 34a_100000212458_100000210303 [0,0,0,1,0,0|3,0,0]=4 10060 B13R1.28 CCCOCCNC1CCCCC1 2230a_100000182618_100011215938 [0,0,0,1,0,0|3,0,0]=4 10061 B13R1.28 CCCOCCNC1CCCCC1 270004a_100161115042_100000210434 [0,0,0,1,0,0|3,0,0]=4 10062 B13R1.28 CCCOCCNC1CCCCC1 34a_100000182618_100011215938 [0,0,0,1,0,0|3,0,0]=4 10063 B13R1.28 CCCOCCNC1CCCCC1 34a_100000200466_100000210303 [0,0,0,1,0,0|3,0,0]=4 10064 B13R1.28 CCCOCCNC1CCCCC1 34a_100161115042_100000210327 [0,0,0,1,0,0|3,0,0]=4 10065 B13R1.28 CCCOCCOC1CCCCC1 34a_100000210231_100011215938 [0,0,0,1,0,0|3,0,0]=4 10066 B13R1.28 CCCOCCOC1CCCCC1 34a_100000210258_100011211530 [0,0,0,1,0,0|3,0,0]=4 10067 B13R1.28 CCCOCCOC1CCCCC1 34a_100000752267_100000210327 [0,0,0,1,0,0|3,0,0]=4 10068 B13R1.28 CCCOCCOC1CCCCC1 34a_100011249652_100000210303 [0,0,0,1,0,0|3,0,0]=4 10069 B13R1.28 CCCOCCOC1CCCCC1 7a_100000210231_100011215938 [0,0,0,1,0,0|3,0,0]=4 10070 B13R1.28 CCCOCCOC1CCCCC1 7a_100000752267_100000210327 [0,0,0,1,0,0|3,0,0]=4 10071 B13R1.28 CCCOCCOC1CCCCC1 7a_100011249652_100000210303 [0,0,0,1,0,0|3,0,0]=4 10072 B13R1.28 CCCOCCOC1CCCCO1 34a_100000033831_100011215938 [0,0,0,1,0,0|2,0,0]=3 10073 B13R1.28 CCCOCCOC1CCCCO1 34a_100000034223_100000210303 [0,0,0,1,0,0|2,0,0]=3 10074 B13R1.28 CCCOCCOC1CCCCO1 34a_100000210258_100000744793 [0,0,0,1,0,0|2,0,0]=3 10075 B13R1.28 CCCOCCOC1CCCCO1 7a_100000034223_100000210303 [0,0,0,1,0,0|2,0,0]=3 10076 B13R1.28 CCCOCCSC1CCCCC1 62a_100000210327_100011215938 [0,0,0,1,0,0|3,0,0]=4 10077 B13R1.28 CCCOCCSC1CCCCC1 62a_100011215938_100000210327 [0,0,0,1,0,0|3,0,0]=4 10078 B13R1.28 CCCSCCCC1CCCCC1 62a_100000210303_100011713725 [0,0,0,1,0,0|2,0,0]=3 10079 B13R1.28 CCCSCCCC1CCCCC1 62a_100011713725_100000210303 [0,0,0,1,0,0|2,0,0]=3 10080 B13R1.28 CCCSCCCN1CCCCC1 62a_100000210303_100000007876 [0,0,0,1,0,0|3,0,0]=4 10081 B13R1.28 CCCSCCCN1CCCCC1 62a_100132302099_100000210303 [0,0,0,1,0,0|3,0,0]=4 10082 B13R1.28 CCCSCCNC1CCCCC1 270004a_100020603323_100000210434 [0,0,0,1,0,0|3,0,0]=4 10083 B13R1.28 CCCSCCOC1CCCCC1 34a_200000230433_100000210327 [0,0,0,1,0,0|3,0,0]=4 10084 B13R1.28 CCCSCCOC1CCCCC1 62a_100000210303_100011211530 [0,0,0,1,0,0|3,0,0]=4 10085 B13R1.28 CCCSCCOC1CCCCC1 62a_100011211530_100000210303 [0,0,0,1,0,0|3,0,0]=4 10086 B13R1.28 CCCSCCOC1CCCCC1 7a_200000230433_100000210327 [0,0,0,1,0,0|3,0,0]=4 10087 B13R1.28 CCCSCCOC1CCCCO1 62a_100000210303_100000744793 [0,0,0,1,0,0|2,0,0]=3 10088 B13R1.28 CCCSCCOC1CCCCO1 62a_100000744793_100000210303 [0,0,0,1,0,0|2,0,0]=3 10089 B13R1.28 CCNCCCOC1CCCCC1 34a_100000205933_100000210202 [0,0,0,1,0,0|3,0,0]=4 10090 B13R1.28 CCNCCCOC1CCCCO1 2230a_100015525214_100000700653 [0,0,0,1,0,0|2,0,0]=3 10091 B13R1.28 CCOCCCCC1CCCCC1 34a_100011215267_100000210202 [0,0,0,1,0,0|2,0,0]=3 10092 B13R1.28 CCOCCCCC1CCCCC1 7a_100011215267_100000210202 [0,0,0,1,0,0|2,0,0]=3 10093 B13R1.28 CCOCCCCC1CCNCC1 34a_100016989291_100000210202 [0,0,0,1,0,0|3,0,0]=4 10094 B13R1.28 CCOCCCNC1CCCCC1 2230a_100000182618_100012232248 [0,0,0,1,0,0|3,0,0]=4 10095 B13R1.28 CCOCCCNC1CCCCC1 270004a_100000210961_100000210434 [0,0,0,1,0,0|3,0,0]=4 10096 B13R1.28 CCOCCCNC1CCCCC1 34a_100000182618_100012232248 [0,0,0,1,0,0|3,0,0]=4 10097 B13R1.28 CCOCCCNC1CCCCC1 34a_100000210961_100000210327 [0,0,0,1,0,0|3,0,0]=4 10098 B13R1.28 CCOCCCOC1CCCCC1 34a_100000210231_100012232248 [0,0,0,1,0,0|3,0,0]=4 10099 B13R1.28 CCOCCCOC1CCCCC1 34a_100000757476_100000210327 [0,0,0,1,0,0|3,0,0]=4 10100 B13R1.28 CCOCCCOC1CCCCC1 7a_100000210231_100012232248 [0,0,0,1,0,0|3,0,0]=4 10101 B13R1.28 CCOCCCOC1CCCCC1 7a_100000757476_100000210327 [0,0,0,1,0,0|3,0,0]=4 10102 B13R1.28 CCOCCCOC1CCCCO1 34a_100000033831_100012232248 [0,0,0,1,0,0|2,0,0]=3 10103 B13R1.28 CCOCCCOC1CCCCO1 34a_100121572206_100000700653 [0,0,0,1,0,0|2,0,0]=3 10104 B13R1.28 CCOCCCSC1CCCCC1 62a_100000210327_100012232248 [0,0,0,1,0,0|3,0,0]=4 10105 B13R1.28 CCOCCCSC1CCCCC1 62a_100012232248_100000210327 [0,0,0,1,0,0|3,0,0]=4 10106 B13R1.28 CCOCCNCC1CCCCC1 2230a_100000210473_100011215890 [0,0,0,1,0,0|3,0,0]=4 10107 B13R1.28 CCOCCNCC1CCCCC1 2230a_102516460346_100000211423 [0,0,0,1,0,0|3,0,0]=4 10108 B13R1.28 CCOCCNCC1CCCCC1 269862a_100011200944_100000211278 [0,0,0,1,0,0|3,0,0]=4 10109 B13R1.28 CCOCCNCC1CCCCC1 34a_100000210473_100000210147 [0,0,0,1,0,0|3,0,0]=4 10110 B13R1.28 CCOCCNCC1CCCCC1 34a_102516460346_100000211423 [0,0,0,1,0,0|3,0,0]=4 10111 B13R1.28 CCOCCNCC1CCCCO1 2230a_100000174945_100011215890 [0,0,0,1,0,0|2,0,0]=3 10112 B13R1.28 CCOCCNCC1CCCCO1 2230a_102516460346_100000211543 [0,0,0,1,0,0|2,0,0]=3 10113 B13R1.28 CCOCCNCC1CCCCO1 34a_100000174945_100000210147 [0,0,0,1,0,0|2,0,0]=3 10114 B13R1.28 CCOCCNCC1CCCCO1 34a_102516460346_100000211543 [0,0,0,1,0,0|2,0,0]=3 10115 B13R1.28 CCOCCNC[C@H]1COCCO1 2230a_100010981119_100011215890 [0,0,0,1,0,0|3,0,0]=4 10116 B13R1.28 CCOCCNC[C@H]1COCCO1 34a_100010981119_100000210147 [0,0,0,1,0,0|3,0,0]=4 10117 B13R1.28 CCOCCOCC1CCCCC1 34a_100000210136_100000211423 [0,0,0,1,0,0|3,0,0]=4 10118 B13R1.28 CCOCCOCC1CCCCC1 34a_100000212181_100000210147 [0,0,0,1,0,0|3,0,0]=4 10119 B13R1.28 CCOCCOCC1CCCCC1 7a_100000210136_100000211423 [0,0,0,1,0,0|3,0,0]=4 10120 B13R1.28 CCOCCOCC1CCCCC1 7a_100000212181_100011215890 [0,0,0,1,0,0|3,0,0]=4 10121 B13R1.28 CCOCCOCC1CCCCN1 34a_100000210821_100000210147 [0,0,0,1,0,0|3,0,0]=4 10122 B13R1.28 CCOCCOCC1CCCCO1 34a_100000210136_100000211543 [0,0,0,1,0,0|2,0,0]=3 10123 B13R1.28 CCOCCOCC1CCCCO1 34a_100000211370_100000210147 [0,0,0,1,0,0|2,0,0]=3 10124 B13R1.28 CCOCCOCC1CCCCO1 7a_100000210136_100000211543 [0,0,0,1,0,0|2,0,0]=3 10125 B13R1.28 CCOCCOCC1CCCCO1 7a_100000211370_100011215890 [0,0,0,1,0,0|2,0,0]=3 10126 B13R1.28 CCOCCOC[C@@H]1CNCCO1 34a_100015189573_100000210147 [0,0,0,1,0,0|3,0,0]=4 10127 B13R1.28 CCOCCOC[C@H]1COCCO1 34a_100009875890_100000210147 [0,0,0,1,0,0|3,0,0]=4 10128 B13R1.28 CCOCCSCC1CCCCC1 62a_100000210147_100000211423 [0,0,0,1,0,0|3,0,0]=4 10129 B13R1.28 CCOCCSCC1CCCCC1 62a_100000211423_100011215890 [0,0,0,1,0,0|3,0,0]=4 10130 B13R1.28 CCOCCSCC1CCCCO1 62a_100000210147_100000211543 [0,0,0,1,0,0|2,0,0]=3 10131 B13R1.28 CCOCCSCC1CCCCO1 62a_100000211543_100011215890 [0,0,0,1,0,0|2,0,0]=3 10132 B13R1.28 CCOCSCCC1CCCCC1 62a_100000739092_100012355289 [0,0,0,1,0,0|3,0,0]=4 10133 B13R1.28 CCOCSCCC1CCCCC1 62a_100012355289_100000739092 [0,0,0,1,0,0|3,0,0]=4 10134 B13R1.28 CCOCSCCC1OCCCO1 62a_100000739092_100000764188 [0,0,0,1,0,0|3,0,0]=4 10135 B13R1.28 CCOCSCCC1OCCCO1 62a_100000764188_100000739092 [0,0,0,1,0,0|3,0,0]=4 10136 B13R1.28 CCSCCCOC1CCCCC1 34a_100011216438_100000210327 [0,0,0,1,0,0|3,0,0]=4 10137 B13R1.28 CCSCCCOC1CCCCC1 7a_100011216438_100000210327 [0,0,0,1,0,0|3,0,0]=4 10138 B13R1.28 CCSCCCOC1CCCCO1 62a_100000210202_100000700653 [0,0,0,1,0,0|2,0,0]=3 10139 B13R1.28 CCSCCCOC1CCCCO1 62a_100000700653_100000210202 [0,0,0,1,0,0|2,0,0]=3 10140 B13R1.28 CCSCCNCC1CCCCC1 2230a_100000106463_100000211423 [0,0,0,1,0,0|3,0,0]=4 10141 B13R1.28 CCSCCNCC1CCCCC1 2230a_100000210473_100000757381 [0,0,0,1,0,0|3,0,0]=4 10142 B13R1.28 CCSCCNCC1CCCCC1 269862a_100000106463_100000211278 [0,0,0,1,0,0|3,0,0]=4 10143 B13R1.28 CCSCCNCC1CCCCC1 34a_100000210473_100000757381 [0,0,0,1,0,0|3,0,0]=4 10144 B13R1.28 CCSCCNCC1CCCCO1 2230a_100000106463_100000211543 [0,0,0,1,0,0|2,0,0]=3 10145 B13R1.28 CCSCCNCC1CCCCO1 2230a_100000174945_100000757381 [0,0,0,1,0,0|2,0,0]=3 10146 B13R1.28 CCSCCNCC1CCCCO1 34a_100000174945_100000757381 [0,0,0,1,0,0|2,0,0]=3 10147 B13R1.28 CCSCCNC[C@H]1COCCO1 2230a_100010981119_100000757381 [0,0,0,1,0,0|3,0,0]=4 10148 B13R1.28 CCSCCNC[C@H]1COCCO1 34a_100010981119_100000757381 [0,0,0,1,0,0|3,0,0]=4 10149 B13R1.28 CCSCCOCC1CCCCC1 34a_100000212035_100000211423 [0,0,0,1,0,0|3,0,0]=4 10150 B13R1.28 CCSCCOCC1CCCCC1 34a_100000212181_100000757381 [0,0,0,1,0,0|3,0,0]=4 10151 B13R1.28 CCSCCOCC1CCCCC1 7a_100000212035_100000211423 [0,0,0,1,0,0|3,0,0]=4 10152 B13R1.28 CCSCCOCC1CCCCC1 7a_100000212181_100000757381 [0,0,0,1,0,0|3,0,0]=4 10153 B13R1.28 CCSCCOCC1CCCCN1 34a_100000210821_100000757381 [0,0,0,1,0,0|3,0,0]=4 10154 B13R1.28 CCSCCOCC1CCCCO1 34a_100000211370_100000757381 [0,0,0,1,0,0|2,0,0]=3 10155 B13R1.28 CCSCCOCC1CCCCO1 34a_100000212035_100000211543 [0,0,0,1,0,0|2,0,0]=3 10156 B13R1.28 CCSCCOCC1CCCCO1 7a_100000211370_100000757381 [0,0,0,1,0,0|2,0,0]=3 10157 B13R1.28 CCSCCOCC1CCCCO1 7a_100000212035_100000211543 [0,0,0,1,0,0|2,0,0]=3 10158 B13R1.28 CCSCCOC[C@@H]1CNCCO1 34a_100015189573_100000757381 [0,0,0,1,0,0|3,0,0]=4 10159 B13R1.28 CCSCCOC[C@H]1COCCO1 34a_100009875890_100000757381 [0,0,0,1,0,0|3,0,0]=4 10160 B13R1.28 CCSCCSCC1CCCCC1 62a_100000211423_100000757381 [0,0,0,1,0,0|3,0,0]=4 10161 B13R1.28 CCSCCSCC1CCCCC1 62a_100000757381_100000211423 [0,0,0,1,0,0|3,0,0]=4 10162 B13R1.28 CCSCCSCC1CCCCO1 62a_100000211543_100000757381 [0,0,0,1,0,0|2,0,0]=3 10163 B13R1.28 CCSCCSCC1CCCCO1 62a_100000757381_100000211543 [0,0,0,1,0,0|2,0,0]=3 10164 B13R1.28 CNCCCCOC1CCCCO1 2230a_106832991635_100000031530 [0,0,0,1,0,0|2,0,0]=3 10165 B13R1.28 CNCCCCOC1CCCCO1 34a_100102657272_100000031530 [0,0,0,1,0,0|2,0,0]=3 10166 B13R1.28 CNCCCCOC1CCCCO1 7a_106832991635_100000031530 [0,0,0,1,0,0|2,0,0]=3 10167 B13R1.28 CNCCCOCC1CCCCC1 34a_100000213112_100000211423 [0,0,0,1,0,0|3,0,0]=4 10168 B13R1.28 CNCCCOCC1CCCCO1 34a_100000213112_100000211543 [0,0,0,1,0,0|2,0,0]=3 10169 B13R1.28 COCCCCCN1CCCCC1 34a_100011216611_200000210301 [0,0,0,1,0,0|3,0,0]=4 10170 B13R1.28 COCCCCCN1CCCCC1 7a_100011216611_200000210301 [0,0,0,1,0,0|3,0,0]=4 10171 B13R1.28 COCCCCNC1CCCCC1 2230a_100000182618_100000730899 [0,0,0,1,0,0|3,0,0]=4 10172 B13R1.28 COCCCCNC1CCCCC1 34a_100000182618_100000755781 [0,0,0,1,0,0|3,0,0]=4 10173 B13R1.28 COCCCCOC1CCCCC1 34a_100000210231_100000755781 [0,0,0,1,0,0|3,0,0]=4 10174 B13R1.28 COCCCCOC1CCCCC1 34a_100000740925_100000210327 [0,0,0,1,0,0|3,0,0]=4 10175 B13R1.28 COCCCCOC1CCCCC1 7a_100000210231_100000730899 [0,0,0,1,0,0|3,0,0]=4 10176 B13R1.28 COCCCCOC1CCCCO1 34a_100000033831_100000755781 [0,0,0,1,0,0|2,0,0]=3 10177 B13R1.28 COCCCCOC1CCCCO1 34a_100138415774_100000031530 [0,0,0,1,0,0|2,0,0]=3 10178 B13R1.28 COCCCCSC1CCCCC1 62a_100000210327_100000730899 [0,0,0,1,0,0|3,0,0]=4 10179 B13R1.28 COCCCCSC1CCCCC1 62a_100000730899_100000210327 [0,0,0,1,0,0|3,0,0]=4 10180 B13R1.28 COCCCNCC1CCCCC1 2230a_100000210473_100000740836 [0,0,0,1,0,0|3,0,0]=4 10181 B13R1.28 COCCCNCC1CCCCC1 269862a_100150723488_100000211278 [0,0,0,1,0,0|3,0,0]=4 10182 B13R1.28 COCCCNCC1CCCCC1 34a_100000210473_100000740836 [0,0,0,1,0,0|3,0,0]=4 10183 B13R1.28 COCCCNCC1CCCCC1 34a_100150723488_100000211423 [0,0,0,1,0,0|3,0,0]=4 10184 B13R1.28 COCCCNCC1CCCCO1 2230a_100000174945_100000740836 [0,0,0,1,0,0|2,0,0]=3 10185 B13R1.28 COCCCNCC1CCCCO1 34a_100000174945_100000740836 [0,0,0,1,0,0|2,0,0]=3 10186 B13R1.28 COCCCNCC1CCCCO1 34a_100150723488_100000211543 [0,0,0,1,0,0|2,0,0]=3 10187 B13R1.28 COCCCNC[C@H]1COCCO1 2230a_100010981119_100000740836 [0,0,0,1,0,0|3,0,0]=4 10188 B13R1.28 COCCCNC[C@H]1COCCO1 34a_100010981119_100000740836 [0,0,0,1,0,0|3,0,0]=4 10189 B13R1.28 COCCCOCC1CCCCC1 34a_100000212181_100000740836 [0,0,0,1,0,0|3,0,0]=4 10190 B13R1.28 COCCCOCC1CCCCC1 34a_100000740835_100000211423 [0,0,0,1,0,0|3,0,0]=4 10191 B13R1.28 COCCCOCC1CCCCC1 7a_100000212181_100000740836 [0,0,0,1,0,0|3,0,0]=4 10192 B13R1.28 COCCCOCC1CCCCN1 34a_100000210821_100000740836 [0,0,0,1,0,0|3,0,0]=4 10193 B13R1.28 COCCCOCC1CCCCO1 34a_100000211370_100000740836 [0,0,0,1,0,0|2,0,0]=3 10194 B13R1.28 COCCCOCC1CCCCO1 34a_100000740835_100000211543 [0,0,0,1,0,0|2,0,0]=3 10195 B13R1.28 COCCCOCC1CCCCO1 7a_100000211370_100000740836 [0,0,0,1,0,0|2,0,0]=3 10196 B13R1.28 COCCCOC[C@@H]1CNCCO1 34a_100015189573_100000740836 [0,0,0,1,0,0|3,0,0]=4 10197 B13R1.28 COCCCOC[C@H]1COCCO1 34a_100009875890_100000740836 [0,0,0,1,0,0|3,0,0]=4 10198 B13R1.28 COCCCSCC1CCCCC1 62a_100000211423_100000709357 [0,0,0,1,0,0|3,0,0]=4 10199 B13R1.28 COCCCSCC1CCCCC1 62a_100000709357_100000211423 [0,0,0,1,0,0|3,0,0]=4 10200 B13R1.28 COCCCSCC1CCCCO1 62a_100000211543_100000709357 [0,0,0,1,0,0|2,0,0]=3 10201 B13R1.28 COCCCSCC1CCCCO1 62a_100000709357_100000211543 [0,0,0,1,0,0|2,0,0]=3 10202 B13R1.28 COCCNCCC1CCCCC1 2230a_100000209980_100012355289 [0,0,0,1,0,0|3,0,0]=4 10203 B13R1.28 COCCNCCC1CCCCC1 2230a_100000738074_100011201679 [0,0,0,1,0,0|3,0,0]=4 10204 B13R1.28 COCCNCCC1CCCCC1 270004a_100000209980_100011713444 [0,0,0,1,0,0|3,0,0]=4 10205 B13R1.28 COCCNCCC1CCCCC1 34a_100000738074_100011201679 [0,0,0,1,0,0|3,0,0]=4 10206 B13R1.28 COCCNCCC1CCCCO1 2230a_100015183643_100011201679 [0,0,0,1,0,0|2,0,0]=3 10207 B13R1.28 COCCNCCC1CCCCO1 34a_100015183643_100011201679 [0,0,0,1,0,0|2,0,0]=3 10208 B13R1.28 COCCNCCC1OCCCO1 2230a_100000209980_100000764188 [0,0,0,1,0,0|3,0,0]=4 10209 B13R1.28 COCCOCCC1CCCCC1 34a_100000210237_100011209188 [0,0,0,1,0,0|3,0,0]=4 10210 B13R1.28 COCCOCCC1CCCCC1 34a_100011217863_100011201679 [0,0,0,1,0,0|3,0,0]=4 10211 B13R1.28 COCCOCCC1CCCCC1 7a_100011217863_100000233755 [0,0,0,1,0,0|3,0,0]=4 10212 B13R1.28 COCCOCCC1CCCCN1 34a_100000211664_100011201679 [0,0,0,1,0,0|3,0,0]=4 10213 B13R1.28 COCCOCCC1OCCCO1 34a_100000210237_100000764188 [0,0,0,1,0,0|3,0,0]=4 10214 B13R1.28 COCCSCCC1CCCCC1 62a_100000233755_100012355289 [0,0,0,1,0,0|3,0,0]=4 10215 B13R1.28 COCCSCCC1CCCCC1 62a_100012355289_100000233755 [0,0,0,1,0,0|3,0,0]=4 10216 B13R1.28 COCCSCCC1OCCCO1 62a_100000233755_100000764188 [0,0,0,1,0,0|3,0,0]=4 10217 B13R1.28 COCCSCCC1OCCCO1 62a_100000764188_100000233755 [0,0,0,1,0,0|3,0,0]=4 10218 B13R1.28 COCNCCCC1CCCCC1 2230a_100011211642_100000766300 [0,0,0,1,0,0|3,0,0]=4 10219 B13R1.28 COCSCCCC1CCCCC1 62a_100000766300_100011713725 [0,0,0,1,0,0|3,0,0]=4 10220 B13R1.28 COCSCCCC1CCCCC1 62a_100011713725_100000766300 [0,0,0,1,0,0|3,0,0]=4 10221 B13R1.28 COCSCCOC1CCCCO1 62a_100000744793_100000766300 [0,0,0,1,0,0|3,0,0]=4 10222 B13R1.28 COCSCCOC1CCCCO1 62a_100000766300_100000744793 [0,0,0,1,0,0|3,0,0]=4 10223 B13R1.28 CSCCCCOC1CCCCC1 34a_100011217163_100000210327 [0,0,0,1,0,0|3,0,0]=4 10224 B13R1.28 CSCCCCOC1CCCCC1 7a_100011217163_100000210327 [0,0,0,1,0,0|3,0,0]=4 10225 B13R1.28 CSCCCCOC1CCCCO1 62a_100000031530_200000210301 [0,0,0,1,0,0|2,0,0]=3 10226 B13R1.28 CSCCCCOC1CCCCO1 62a_200000210301_100000031530 [0,0,0,1,0,0|2,0,0]=3 10227 B13R1.28 CSCCCNCC1CCCCC1 2230a_100000749238_100000211423 [0,0,0,1,0,0|3,0,0]=4 10228 B13R1.28 CSCCCNCC1CCCCC1 269862a_100000749238_100000211278 [0,0,0,1,0,0|3,0,0]=4 10229 B13R1.28 CSCCCNCC1CCCCO1 2230a_100000749238_100000211543 [0,0,0,1,0,0|2,0,0]=3 10230 B13R1.28 CSCCCOCC1CCCCC1 34a_100000690336_100000211423 [0,0,0,1,0,0|3,0,0]=4 10231 B13R1.28 CSCCCOCC1CCCCC1 7a_100000690336_100000211423 [0,0,0,1,0,0|3,0,0]=4 10232 B13R1.28 CSCCCOCC1CCCCO1 34a_100000690336_100000211543 [0,0,0,1,0,0|2,0,0]=3 10233 B13R1.28 CSCCCOCC1CCCCO1 7a_100000690336_100000211543 [0,0,0,1,0,0|2,0,0]=3 10234 B13R1.28 CSCCNCCC1CCCCC1 2230a_100000738074_100000751147 [0,0,0,1,0,0|3,0,0]=4 10235 B13R1.28 CSCCNCCC1CCCCC1 2230a_100020590264_100012355289 [0,0,0,1,0,0|3,0,0]=4 10236 B13R1.28 CSCCNCCC1CCCCC1 270004a_100020590264_100011713444 [0,0,0,1,0,0|3,0,0]=4 10237 B13R1.28 CSCCNCCC1CCCCC1 34a_100000738074_100000212216 [0,0,0,1,0,0|3,0,0]=4 10238 B13R1.28 CSCCNCCC1CCCCO1 2230a_100015183643_100000751147 [0,0,0,1,0,0|2,0,0]=3 10239 B13R1.28 CSCCNCCC1CCCCO1 34a_100015183643_100000212216 [0,0,0,1,0,0|2,0,0]=3 10240 B13R1.28 CSCCNCCC1OCCCO1 2230a_100020590264_100000764188 [0,0,0,1,0,0|3,0,0]=4 10241 B13R1.28 CSCCOCCC1CCCCC1 34a_100000230434_100011209188 [0,0,0,1,0,0|3,0,0]=4 10242 B13R1.28 CSCCOCCC1CCCCC1 34a_100011217863_100000212216 [0,0,0,1,0,0|3,0,0]=4 10243 B13R1.28 CSCCOCCC1CCCCC1 7a_100000230434_100011273959 [0,0,0,1,0,0|3,0,0]=4 10244 B13R1.28 CSCCOCCC1CCCCC1 7a_100011217863_100000212216 [0,0,0,1,0,0|3,0,0]=4 10245 B13R1.28 CSCCOCCC1CCCCN1 34a_100000211664_100000212216 [0,0,0,1,0,0|3,0,0]=4 10246 B13R1.28 CSCCOCCC1OCCCO1 34a_100000230434_100000764188 [0,0,0,1,0,0|3,0,0]=4 10247 B13R1.28 CSCCOCCC1OCCCO1 7a_100000230434_100000764188 [0,0,0,1,0,0|3,0,0]=4 10248 B13R1.28 CSCCSCCC1CCCCC1 62a_100000212216_100012355289 [0,0,0,1,0,0|3,0,0]=4 10249 B13R1.28 CSCCSCCC1CCCCC1 62a_100012355289_100000751147 [0,0,0,1,0,0|3,0,0]=4 10250 B13R1.28 CSCCSCCC1OCCCO1 62a_100000212216_100000764188 [0,0,0,1,0,0|3,0,0]=4 10251 B13R1.28 CSCCSCCC1OCCCO1 62a_100000764188_100000751147 [0,0,0,1,0,0|3,0,0]=4 10252 B13R1.28 CSCNCCCC1CCCCC1 2230a_100011211642_100011218213 [0,0,0,1,0,0|3,0,0]=4 10253 B13R1.28 CSCNCCCC1CCCCC1 34a_100011211642_100011218213 [0,0,0,1,0,0|3,0,0]=4 10254 B13R1.28 CSCOCCCC1CCCCC1 34a_100000198086_100011218213 [0,0,0,1,0,0|3,0,0]=4 10255 B13R1.28 CSCOCCCC1CCCCN1 34a_100011934581_100011218213 [0,0,0,1,0,0|3,0,0]=4 10256 B13R1.28 CSCOCCOC1CCCCO1 34a_100000034223_100011218213 [0,0,0,1,0,0|3,0,0]=4 10257 B13R1.28 CSCSCCCC1CCCCC1 62a_100011218213_100011713725 [0,0,0,1,0,0|3,0,0]=4 10258 B13R1.28 CSCSCCCC1CCCCC1 62a_100011713725_100011218213 [0,0,0,1,0,0|3,0,0]=4 10259 B13R1.28 CSCSCCOC1CCCCO1 62a_100000744793_100011218213 [0,0,0,1,0,0|3,0,0]=4 10260 B13R1.28 CSCSCCOC1CCCCO1 62a_100011218213_100000744793 [0,0,0,1,0,0|3,0,0]=4 10261 B13R1.28 ClCCCCCOC1CCCCC1 34a_100000746330_100000210327 [0,0,0,1,0,0|2,0,0]=3 10262 B13R1.28 ClCCCCCOC1CCCCC1 7a_100000746330_100000210327 [0,0,0,1,0,0|2,0,0]=3 10263 B13R1.28 ClCCCCCOC1CCCOC1 34a_100000746330_100000693364 [0,0,0,1,0,0|3,0,0]=4 10264 B13R1.28 ClCCCCCOC1CCCOC1 7a_100000746330_100000693364 [0,0,0,1,0,0|3,0,0]=4 10265 B13R1.28 ClCCCCCOC1CCOCC1 7a_100000746330_100000686592 [0,0,0,1,0,0|3,0,0]=4 10266 B13R1.28 ClCCCCCOC1CCSCC1 34a_100000746330_100000069128 [0,0,0,1,0,0|3,0,0]=4 10267 B13R1.28 ClCCCCCOC1CCSCC1 7a_100000746330_100011500858 [0,0,0,1,0,0|3,0,0]=4 10268 B13R1.28 ClCCCCOCC1CCCCC1 34a_100000210776_100000211423 [0,0,0,1,0,0|2,0,0]=3 10269 B13R1.28 ClCCCCOCC1CCCCC1 7a_100000210776_100000211423 [0,0,0,1,0,0|2,0,0]=3 10270 B13R1.28 ClCCCCOCC1CCCCO1 34a_100000210776_100000211543 [0,0,0,1,0,0|2,0,0]=3 10271 B13R1.28 ClCCCCOCC1CCCCO1 7a_100000210776_100000211543 [0,0,0,1,0,0|2,0,0]=3 10272 B13R1.28 ClCCCCOCC1CCCOC1 34a_100000210776_100000741521 [0,0,0,1,0,0|3,0,0]=4 10273 B13R1.28 ClCCCCOCC1CCCOC1 7a_100000210776_100000741521 [0,0,0,1,0,0|3,0,0]=4 10274 B13R1.28 ClCCCCOCC1CCOCC1 34a_100000210776_100000754603 [0,0,0,1,0,0|3,0,0]=4 10275 B13R1.28 ClCCCCOCC1CCOCC1 7a_100000210776_100000754603 [0,0,0,1,0,0|3,0,0]=4 10276 B13R1.28 ClCCCOCCC1CCCCC1 34a_100000230001_100011209188 [0,0,0,1,0,0|2,0,0]=3 10277 B13R1.28 ClCCCOCCC1CCOCC1 34a_100000230001_100011934994 [0,0,0,1,0,0|3,0,0]=4 10278 B13R1.28 ClCCCOCCC1OCCCO1 34a_100000230001_100000764188 [0,0,0,1,0,0|3,0,0]=4 10279 B13R1.28 ClCCCOCCN1CCCCC1 34a_100000230001_100000739454 [0,0,0,1,0,0|3,0,0]=4 10280 B13R1.28 ClCCCOCOC1CCCCC1 34a_100000230001_100011935260 [0,0,0,1,0,0|3,0,0]=4 10281 B13R1.28 ClCCOCCOC1CCCCC1 34a_100011215305_100000210327 [0,0,0,1,0,0|3,0,0]=4 10282 B13R1.28 ClCCOCCOC1CCCCC1 7a_100011215305_100000210327 [0,0,0,1,0,0|3,0,0]=4 10283 B13R1.28 FCCCCCCN1CCCOC1 2230a_100000131196_100015922095 [0,0,0,1,0,0|3,0,0]=4 10284 B13R1.28 FCCCCCCN1CCCOC1 269982a_100000131196_100015922095 [0,0,0,1,0,0|3,0,0]=4 10285 B13R1.28 FCCCCCCN1CCCOC1 34a_100000131196_100015922095 [0,0,0,1,0,0|3,0,0]=4 10286 B13R1.28 FCCCCCCN1CCOCC1 2230a_100015191051_100015922095 [0,0,0,1,0,0|3,0,0]=4 10287 B13R1.28 FCCCCCCN1CCOCC1 269982a_100015191051_100015922095 [0,0,0,1,0,0|3,0,0]=4 10288 B13R1.28 FCCCCCCN1CCOCC1 34a_100015191051_100015922095 [0,0,0,1,0,0|3,0,0]=4 10289 B13R1.28 FCCCCCCN1CCSCC1 2230a_100000737611_100015922095 [0,0,0,1,0,0|3,0,0]=4 10290 B13R1.28 FCCCCCCN1CCSCC1 269982a_100000737611_100015922095 [0,0,0,1,0,0|3,0,0]=4 10291 B13R1.28 FCCCCCNC1CCCCC1 2230a_100000182618_100000729378 [0,0,0,1,0,0|2,0,0]=3 10292 B13R1.28 FCCCCCNC1CCCCC1 34a_100000182618_100000729378 [0,0,0,1,0,0|2,0,0]=3 10293 B13R1.28 FCCCCCNC1CCCOC1 2230a_100000719290_100000729378 [0,0,0,1,0,0|3,0,0]=4 10294 B13R1.28 FCCCCCNC1CCCOC1 34a_100000719290_100000729378 [0,0,0,1,0,0|3,0,0]=4 10295 B13R1.28 FCCCCCNC1CCOCC1 2230a_100000741149_100000729378 [0,0,0,1,0,0|3,0,0]=4 10296 B13R1.28 FCCCCCNC1CCOCC1 34a_100000741149_100000729378 [0,0,0,1,0,0|3,0,0]=4 10297 B13R1.28 FCCCCCNC1CCSCC1 2230a_100000748639_100000729378 [0,0,0,1,0,0|3,0,0]=4 10298 B13R1.28 FCCCCCNC1CCSCC1 34a_100000748639_100000729378 [0,0,0,1,0,0|3,0,0]=4 10299 B13R1.28 FCCCCCOC1CCCCC1 34a_100000210231_100000729378 [0,0,0,1,0,0|2,0,0]=3 10300 B13R1.28 FCCCCCOC1CCCCC1 7a_100000210231_100000729378 [0,0,0,1,0,0|2,0,0]=3 10301 B13R1.28 FCCCCCOC1CCCCO1 34a_100000033831_100000729378 [0,0,0,1,0,0|2,0,0]=3 10302 B13R1.28 FCCCCCOC1CCCOC1 34a_100000754041_100000729378 [0,0,0,1,0,0|3,0,0]=4 10303 B13R1.28 FCCCCCOC1CCCSC1 7a_100015962668_100000729378 [0,0,0,1,0,0|3,0,0]=4 10304 B13R1.28 FCCCCCOC1CCOCC1 34a_100000744328_100000729378 [0,0,0,1,0,0|3,0,0]=4 10305 B13R1.28 FCCCCCOC1CCSCC1 34a_100000731022_100000729378 [0,0,0,1,0,0|3,0,0]=4 10306 B13R1.28 FCCCCCOC1CCSCC1 7a_100000731022_100000729378 [0,0,0,1,0,0|3,0,0]=4 10307 B13R1.28 FCCCCCSC1CCCCC1 62a_100000210327_100000729378 [0,0,0,1,0,0|2,0,0]=3 10308 B13R1.28 FCCCCCSC1CCCCC1 62a_100000729378_100000210327 [0,0,0,1,0,0|2,0,0]=3 10309 B13R1.28 FCCCCCSC1CCCOC1 62a_100000729378_100000693364 [0,0,0,1,0,0|3,0,0]=4 10310 B13R1.28 FCCCCCSC1CCOCC1 62a_100000729378_100011324220 [0,0,0,1,0,0|3,0,0]=4 10311 B13R1.28 FCCCCCSC1CCSCC1 62a_100000729378_100000069128 [0,0,0,1,0,0|3,0,0]=4 10312 B13R1.28 FCCCCNCC1CCCCC1 2230a_100000210473_100000729493 [0,0,0,1,0,0|2,0,0]=3 10313 B13R1.28 FCCCCNCC1CCCCC1 34a_100000210473_100000729493 [0,0,0,1,0,0|2,0,0]=3 10314 B13R1.28 FCCCCNCC1CCCCO1 2230a_100000174945_100000729493 [0,0,0,1,0,0|2,0,0]=3 10315 B13R1.28 FCCCCNCC1CCCCO1 34a_100000174945_100000729493 [0,0,0,1,0,0|2,0,0]=3 10316 B13R1.28 FCCCCNCC1CCCOC1 2230a_100000720124_100000729493 [0,0,0,1,0,0|3,0,0]=4 10317 B13R1.28 FCCCCNCC1CCCOC1 34a_100000720124_100000729493 [0,0,0,1,0,0|3,0,0]=4 10318 B13R1.28 FCCCCNCC1CCOCC1 2230a_100000746373_100000729493 [0,0,0,1,0,0|3,0,0]=4 10319 B13R1.28 FCCCCNCC1CCOCC1 34a_100000746373_100000729493 [0,0,0,1,0,0|3,0,0]=4 10320 B13R1.28 FCCCCNCC1CCSCC1 2230a_100015188806_100000729493 [0,0,0,1,0,0|3,0,0]=4 10321 B13R1.28 FCCCCNCC1CCSCC1 34a_100015188806_100000729493 [0,0,0,1,0,0|3,0,0]=4 10322 B13R1.28 FCCCCNC[C@H]1COCCO1 2230a_100010981119_100000729493 [0,0,0,1,0,0|3,0,0]=4 10323 B13R1.28 FCCCCNC[C@H]1COCCO1 34a_100010981119_100000729493 [0,0,0,1,0,0|3,0,0]=4 10324 B13R1.28 FCCCCOCC1CCCCC1 34a_100000212181_100000729493 [0,0,0,1,0,0|2,0,0]=3 10325 B13R1.28 FCCCCOCC1CCCCC1 34a_100011995726_100000211423 [0,0,0,1,0,0|2,0,0]=3 10326 B13R1.28 FCCCCOCC1CCCCC1 7a_100000212181_100000729493 [0,0,0,1,0,0|2,0,0]=3 10327 B13R1.28 FCCCCOCC1CCCCC1 7a_100011995726_100000211423 [0,0,0,1,0,0|2,0,0]=3 10328 B13R1.28 FCCCCOCC1CCCCN1 34a_100000210821_100000729493 [0,0,0,1,0,0|3,0,0]=4 10329 B13R1.28 FCCCCOCC1CCCCO1 34a_100000211370_100000729493 [0,0,0,1,0,0|2,0,0]=3 10330 B13R1.28 FCCCCOCC1CCCCO1 34a_100011995726_100000211543 [0,0,0,1,0,0|2,0,0]=3 10331 B13R1.28 FCCCCOCC1CCCCO1 7a_100000211370_100000729493 [0,0,0,1,0,0|2,0,0]=3 10332 B13R1.28 FCCCCOCC1CCCCO1 7a_100011995726_100000211543 [0,0,0,1,0,0|2,0,0]=3 10333 B13R1.28 FCCCCOCC1CCCNC1 34a_100000211344_100000729493 [0,0,0,1,0,0|3,0,0]=4 10334 B13R1.28 FCCCCOCC1CCCOC1 34a_100000741520_100000729493 [0,0,0,1,0,0|3,0,0]=4 10335 B13R1.28 FCCCCOCC1CCCOC1 34a_100011995726_100000741521 [0,0,0,1,0,0|3,0,0]=4 10336 B13R1.28 FCCCCOCC1CCCOC1 7a_100011995726_100000741521 [0,0,0,1,0,0|3,0,0]=4 10337 B13R1.28 FCCCCOCC1CCNCC1 34a_100000738675_100000729493 [0,0,0,1,0,0|3,0,0]=4 10338 B13R1.28 FCCCCOCC1CCOCC1 34a_100000749013_100000729493 [0,0,0,1,0,0|3,0,0]=4 10339 B13R1.28 FCCCCOCC1CCOCC1 34a_100011995726_100000754603 [0,0,0,1,0,0|3,0,0]=4 10340 B13R1.28 FCCCCOCC1CCOCC1 7a_100011995726_100000754603 [0,0,0,1,0,0|3,0,0]=4 10341 B13R1.28 FCCCCOCC1CCSCC1 34a_100000070558_100000729493 [0,0,0,1,0,0|3,0,0]=4 10342 B13R1.28 FCCCCOCC1CCSCC1 7a_100000070558_100000729493 [0,0,0,1,0,0|3,0,0]=4 10343 B13R1.28 FCCCCOC[C@@H]1CNCCO1 34a_100015189573_100000729493 [0,0,0,1,0,0|3,0,0]=4 10344 B13R1.28 FCCCCOC[C@H]1COCCO1 34a_100009875890_100000729493 [0,0,0,1,0,0|3,0,0]=4 10345 B13R1.28 FCCCCSCC1CCCCC1 62a_100000211423_100000729493 [0,0,0,1,0,0|2,0,0]=3 10346 B13R1.28 FCCCCSCC1CCCCC1 62a_100000729493_100000211423 [0,0,0,1,0,0|2,0,0]=3 10347 B13R1.28 FCCCCSCC1CCCCO1 62a_100000211543_100000729493 [0,0,0,1,0,0|2,0,0]=3 10348 B13R1.28 FCCCCSCC1CCCCO1 62a_100000729493_100000211543 [0,0,0,1,0,0|2,0,0]=3 10349 B13R1.28 FCCCCSCC1CCCOC1 62a_100000729493_100000741521 [0,0,0,1,0,0|3,0,0]=4 10350 B13R1.28 FCCCCSCC1CCCOC1 62a_100000741521_100000729493 [0,0,0,1,0,0|3,0,0]=4 10351 B13R1.28 FCCCCSCC1CCOCC1 62a_100000729493_100000749018 [0,0,0,1,0,0|3,0,0]=4 10352 B13R1.28 FCCCCSCC1CCOCC1 62a_100000754603_100000729493 [0,0,0,1,0,0|3,0,0]=4 10353 B13R1.28 FCCCNCCC1CCCCC1 2230a_100000738074_100011934791 [0,0,0,1,0,0|2,0,0]=3 10354 B13R1.28 FCCCNCCC1CCCCC1 2230a_100015189416_100012355289 [0,0,0,1,0,0|2,0,0]=3 10355 B13R1.28 FCCCNCCC1CCCCC1 270004a_100015189416_100011713444 [0,0,0,1,0,0|2,0,0]=3 10356 B13R1.28 FCCCNCCC1CCCCC1 34a_100000738074_100011934791 [0,0,0,1,0,0|2,0,0]=3 10357 B13R1.28 FCCCNCCC1CCCCC1 34a_100015189416_100011209188 [0,0,0,1,0,0|2,0,0]=3 10358 B13R1.28 FCCCNCCC1CCCCO1 2230a_100015183643_100011934791 [0,0,0,1,0,0|2,0,0]=3 10359 B13R1.28 FCCCNCCC1CCCCO1 34a_100015183643_100011934791 [0,0,0,1,0,0|2,0,0]=3 10360 B13R1.28 FCCCNCCC1CCOCC1 2230a_100000755988_100011934791 [0,0,0,1,0,0|3,0,0]=4 10361 B13R1.28 FCCCNCCC1CCOCC1 2230a_100015189416_100011934994 [0,0,0,1,0,0|3,0,0]=4 10362 B13R1.28 FCCCNCCC1CCOCC1 34a_100000755988_100011934791 [0,0,0,1,0,0|3,0,0]=4 10363 B13R1.28 FCCCNCCC1CCOCC1 34a_100015189416_100011934994 [0,0,0,1,0,0|3,0,0]=4 10364 B13R1.28 FCCCNCCC1OCCCO1 2230a_100015189416_100000764188 [0,0,0,1,0,0|3,0,0]=4 10365 B13R1.28 FCCCNCCC1OCCCO1 34a_100015189416_100000764188 [0,0,0,1,0,0|3,0,0]=4 10366 B13R1.28 FCCCNCCN1CCCCC1 2230a_100015189416_100000739454 [0,0,0,1,0,0|3,0,0]=4 10367 B13R1.28 FCCCNCCN1CCCCC1 34a_100015189416_100000739454 [0,0,0,1,0,0|3,0,0]=4 10368 B13R1.28 FCCCNCOC1CCCCC1 2230a_100015189416_100011935260 [0,0,0,1,0,0|3,0,0]=4 10369 B13R1.28 FCCCNCOC1CCCCC1 34a_100015189416_100011935260 [0,0,0,1,0,0|3,0,0]=4 10370 B13R1.28 FCCCOCCC1CCCCC1 34a_100000759539_100011209188 [0,0,0,1,0,0|2,0,0]=3 10371 B13R1.28 FCCCOCCC1CCCCC1 34a_100011217863_100011934791 [0,0,0,1,0,0|2,0,0]=3 10372 B13R1.28 FCCCOCCC1CCCCC1 7a_100011217863_100011934791 [0,0,0,1,0,0|2,0,0]=3 10373 B13R1.28 FCCCOCCC1CCCCN1 34a_100000211664_100011934791 [0,0,0,1,0,0|3,0,0]=4 10374 B13R1.28 FCCCOCCC1CCCNC1 34a_100000752241_100011934791 [0,0,0,1,0,0|3,0,0]=4 10375 B13R1.28 FCCCOCCC1CCNCC1 34a_100015190746_100011934791 [0,0,0,1,0,0|3,0,0]=4 10376 B13R1.28 FCCCOCCC1CCOCC1 34a_100000759539_100011934994 [0,0,0,1,0,0|3,0,0]=4 10377 B13R1.28 FCCCOCCC1CCOCC1 34a_100011933979_100011934791 [0,0,0,1,0,0|3,0,0]=4 10378 B13R1.28 FCCCOCCC1CCOCC1 7a_100011933979_100011934791 [0,0,0,1,0,0|3,0,0]=4 10379 B13R1.28 FCCCOCCC1OCCCO1 34a_100000759539_100000764188 [0,0,0,1,0,0|3,0,0]=4 10380 B13R1.28 FCCCOCCN1CCCCC1 34a_100000759539_100000739454 [0,0,0,1,0,0|3,0,0]=4 10381 B13R1.28 FCCCOCOC1CCCCC1 34a_100000759539_100011935260 [0,0,0,1,0,0|3,0,0]=4 10382 B13R1.28 FCCCSCCC1CCCCC1 62a_100011934791_100012355289 [0,0,0,1,0,0|2,0,0]=3 10383 B13R1.28 FCCCSCCC1CCCCC1 62a_100012355289_100011934791 [0,0,0,1,0,0|2,0,0]=3 10384 B13R1.28 FCCCSCCC1CCOCC1 62a_100011934791_100011934994 [0,0,0,1,0,0|3,0,0]=4 10385 B13R1.28 FCCCSCCC1CCOCC1 62a_100011934994_100011934791 [0,0,0,1,0,0|3,0,0]=4 10386 B13R1.28 FCCCSCCC1OCCCO1 62a_100000764188_100011934791 [0,0,0,1,0,0|3,0,0]=4 10387 B13R1.28 FCCCSCCC1OCCCO1 62a_100011934791_100000764188 [0,0,0,1,0,0|3,0,0]=4 10388 B13R1.28 FCCCSCCN1CCCCC1 62a_100000739454_100011934791 [0,0,0,1,0,0|3,0,0]=4 10389 B13R1.28 FCCCSCCN1CCCCC1 62a_100011934791_100000739454 [0,0,0,1,0,0|3,0,0]=4 10390 B13R1.28 FCCCSCOC1CCCCC1 62a_100011934791_100011935260 [0,0,0,1,0,0|3,0,0]=4 10391 B13R1.28 FCCCSCOC1CCCCC1 62a_100011935260_100011934791 [0,0,0,1,0,0|3,0,0]=4 10392 B13R1.28 FCCNCCCC1CCCCC1 2230a_100011211642_100011217306 [0,0,0,1,0,0|2,0,0]=3 10393 B13R1.28 FCCNCCCC1CCCCC1 34a_100000724931_100011713725 [0,0,0,1,0,0|2,0,0]=3 10394 B13R1.28 FCCNCCCC1CCCCC1 34a_100011211642_100011217306 [0,0,0,1,0,0|2,0,0]=3 10395 B13R1.28 FCCNCCCN1CCCCC1 34a_100000724931_100000690320 [0,0,0,1,0,0|3,0,0]=4 10396 B13R1.28 FCCNCCOC1CCCCC1 34a_100000724931_100011211530 [0,0,0,1,0,0|3,0,0]=4 10397 B13R1.28 FCCNCCOC1CCCCC1 34a_100015206981_100011217306 [0,0,0,1,0,0|3,0,0]=4 10398 B13R1.28 FCCNCCOC1CCCCO1 34a_100000724931_100000744793 [0,0,0,1,0,0|3,0,0]=4 10399 B13R1.28 FCCOCCCC1CCCCC1 34a_100000198086_100011217306 [0,0,0,1,0,0|2,0,0]=3 10400 B13R1.28 FCCOCCCC1CCCCC1 7a_100000198086_100011217306 [0,0,0,1,0,0|2,0,0]=3 10401 B13R1.28 FCCOCCCC1CCCCN1 34a_100011934581_100011217306 [0,0,0,1,0,0|3,0,0]=4 10402 B13R1.28 FCCOCCCC1CCCNC1 34a_100150707839_100011217306 [0,0,0,1,0,0|3,0,0]=4 10403 B13R1.28 FCCOCCCC1CCNCC1 34a_100016988962_100011217306 [0,0,0,1,0,0|3,0,0]=4 10404 B13R1.28 FCCOCCCN1CCCCC1 34a_100000212458_100011217306 [0,0,0,1,0,0|3,0,0]=4 10405 B13R1.28 FCCOCCNC1CCCCC1 34a_100000200466_100011217306 [0,0,0,1,0,0|3,0,0]=4 10406 B13R1.28 FCCOCCOC1CCCCC1 34a_100011249652_100011217306 [0,0,0,1,0,0|3,0,0]=4 10407 B13R1.28 FCCOCCOC1CCCCC1 34a_200015357709_100000210327 [0,0,0,1,0,0|3,0,0]=4 10408 B13R1.28 FCCOCCOC1CCCCC1 7a_100011249652_100011217306 [0,0,0,1,0,0|3,0,0]=4 10409 B13R1.28 FCCOCCOC1CCCCC1 7a_200015357709_100000210327 [0,0,0,1,0,0|3,0,0]=4 10410 B13R1.28 FCCOCCOC1CCCCO1 34a_100000034223_100011217306 [0,0,0,1,0,0|3,0,0]=4 10411 B13R1.28 FCCOCCOC1CCCCO1 7a_100000034223_100011217306 [0,0,0,1,0,0|3,0,0]=4 10412 B13R1.28 FCCSCCCC1CCCCC1 62a_100011217306_100011713725 [0,0,0,1,0,0|2,0,0]=3 10413 B13R1.28 FCCSCCCC1CCCCC1 62a_100011713725_100011217306 [0,0,0,1,0,0|2,0,0]=3 10414 B13R1.28 FCCSCCCN1CCCCC1 62a_100011217306_100000007876 [0,0,0,1,0,0|3,0,0]=4 10415 B13R1.28 FCCSCCCN1CCCCC1 62a_100132302099_100011217306 [0,0,0,1,0,0|3,0,0]=4 10416 B13R1.28 FCCSCCOC1CCCCC1 62a_100011211530_100011217306 [0,0,0,1,0,0|3,0,0]=4 10417 B13R1.28 FCCSCCOC1CCCCC1 62a_100011217306_100011211530 [0,0,0,1,0,0|3,0,0]=4 10418 B13R1.28 FCCSCCOC1CCCCO1 62a_100000744793_100011217306 [0,0,0,1,0,0|3,0,0]=4 10419 B13R1.28 FCCSCCOC1CCCCO1 62a_100011217306_100000744793 [0,0,0,1,0,0|3,0,0]=4 10420 B13R1.28 FCNCCCOC1CCCCC1 34a_100000205933_100015361967 [0,0,0,1,0,0|3,0,0]=4 10421 B13R1.28 FCOCCCCC1CCCCC1 34a_100011215267_100015361967 [0,0,0,1,0,0|2,0,0]=3 10422 B13R1.28 FCOCCCCC1CCCCC1 7a_100011215267_100015361967 [0,0,0,1,0,0|2,0,0]=3 10423 B13R1.28 FCOCCCCC1CCNCC1 34a_100016989291_100015361967 [0,0,0,1,0,0|3,0,0]=4 10424 B13R1.28 FCSCCCOC1CCCCO1 62a_100000700653_100015361967 [0,0,0,1,0,0|3,0,0]=4 10425 B13R1.28 FCSCCCOC1CCCCO1 62a_100015361967_100000700653 [0,0,0,1,0,0|3,0,0]=4 10426 B13R1.28 ICCCCCOC1CCCCC1 34a_200012148887_100000210327 [0,0,0,1,0,0|2,0,0]=3 10427 B13R1.28 ICCCCCOC1CCCCC1 7a_200012148887_100000210327 [0,0,0,1,0,0|2,0,0]=3 10428 B13R1.28 ICCCCCOC1CCCOC1 34a_200012148887_100000693364 [0,0,0,1,0,0|3,0,0]=4 10429 B13R1.28 ICCCCCOC1CCCOC1 7a_200012148887_100000693364 [0,0,0,1,0,0|3,0,0]=4 10430 B13R1.28 ICCCCCOC1CCOCC1 7a_200012148887_100000686592 [0,0,0,1,0,0|3,0,0]=4 10431 B13R1.28 ICCCCCOC1CCSCC1 34a_200012148887_100000069128 [0,0,0,1,0,0|3,0,0]=4 10432 B13R1.28 ICCCCCOC1CCSCC1 7a_200012148887_100011500858 [0,0,0,1,0,0|3,0,0]=4 10433 B13R1.28 ICCCCOCC1CCCCC1 34a_200012148704_100000211423 [0,0,0,1,0,0|2,0,0]=3 10434 B13R1.28 ICCCCOCC1CCCCO1 34a_200012148704_100000211543 [0,0,0,1,0,0|2,0,0]=3 10435 B13R1.28 ICCCCOCC1CCCOC1 34a_200012148704_100000741521 [0,0,0,1,0,0|3,0,0]=4 10436 B13R1.28 ICCCCOCC1CCOCC1 34a_200012148704_100000754603 [0,0,0,1,0,0|3,0,0]=4 10437 B13R1.28 ICCOCCOC1CCCCC1 34a_100012149058_100000210327 [0,0,0,1,0,0|3,0,0]=4 10438 B13R1.28 ICCOCCOC1CCCCC1 7a_100012149058_100000210327 [0,0,0,1,0,0|3,0,0]=4 10439 B13R1.28 N#CCCCCNC1CCCCC1 2230a_100000182618_100000211819 [0,0,0,1,0,0|2,0,1]=4 10440 B13R1.28 N#CCCCCNC1CCCCC1 270004a_100000751965_100000210434 [0,0,0,1,0,0|2,0,1]=4 10441 B13R1.28 N#CCCCCOC1CCCCC1 7a_100000210231_100000211819 [0,0,0,1,0,0|2,0,1]=4 10442 B13R1.28 N#CCCCCSC1CCCCC1 62a_100000210327_100000211819 [0,0,0,1,0,0|2,0,1]=4 10443 B13R1.28 N#CCCCCSC1CCCCC1 62a_100011219923_100000210327 [0,0,0,1,0,0|2,0,1]=4 10444 B13R1.28 N#CCCCNCC1CCCCC1 2230a_100000210473_100000687738 [0,0,0,1,0,0|2,0,1]=4 10445 B13R1.28 N#CCCCNCC1CCCCO1 2230a_100000174945_100000687738 [0,0,0,1,0,0|2,0,1]=4 10446 B13R1.28 N#CCCCOCC1CCCCC1 7a_100000212181_100000687738 [0,0,0,1,0,0|2,0,1]=4 10447 B13R1.28 N#CCCCOCC1CCCCO1 7a_100000211370_100000687738 [0,0,0,1,0,0|2,0,1]=4 10448 B13R1.28 N#CCCCSCC1CCCCC1 62a_100000211423_100000687738 [0,0,0,1,0,0|2,0,1]=4 10449 B13R1.28 N#CCCCSCC1CCCCC1 62a_100000687738_100000211423 [0,0,0,1,0,0|2,0,1]=4 10450 B13R1.28 N#CCCCSCC1CCCCO1 62a_100000211543_100000687738 [0,0,0,1,0,0|2,0,1]=4 10451 B13R1.28 N#CCCCSCC1CCCCO1 62a_100000687738_100000211543 [0,0,0,1,0,0|2,0,1]=4 10452 B13R1.28 N#CCCNCCC1CCCCC1 2230a_100000738074_100011215226 [0,0,0,1,0,0|2,0,1]=4 10453 B13R1.28 N#CCCNCCC1CCCCC1 270004a_100000720768_100011713444 [0,0,0,1,0,0|2,0,1]=4 10454 B13R1.28 N#CCCNCCC1CCCCO1 2230a_100015183643_100011215226 [0,0,0,1,0,0|2,0,1]=4 10455 B13R1.28 N#CCCOCCC1CCCCC1 7a_100011217863_100000184422 [0,0,0,1,0,0|2,0,1]=4 10456 B13R1.28 N#CCCSCCC1CCCCC1 62a_100011215226_100012355289 [0,0,0,1,0,0|2,0,1]=4 10457 B13R1.28 N#CCCSCCC1CCCCC1 62a_100012355289_100011215226 [0,0,0,1,0,0|2,0,1]=4 10458 B13R1.28 N#CCNCCCC1CCCCC1 2230a_100011211642_100011215382 [0,0,0,1,0,0|2,0,1]=4 10459 B13R1.28 N#CCOCCCC1CCCCC1 7a_100000198086_100011215382 [0,0,0,1,0,0|2,0,1]=4 10460 B13R1.28 N#CCSCCCC1CCCCC1 62a_100011215382_100011713725 [0,0,0,1,0,0|2,0,1]=4 10461 B13R1.28 N#CCSCCCC1CCCCC1 62a_100011713725_100011215382 [0,0,0,1,0,0|2,0,1]=4 10462 B13R1.28 NCCCCCOC1CCCCC1 34a_100000762737_100000210327 [0,0,0,1,0,0|2,0,0]=3 10463 B13R1.28 NCCCCCOC1CCCOC1 34a_100000762737_100000693364 [0,0,0,1,0,0|3,0,0]=4 10464 B13R1.28 NCCCCCOC1CCSCC1 34a_100000762737_100000069128 [0,0,0,1,0,0|3,0,0]=4 10465 B13R1.28 NCCCCOCC1CCCCC1 34a_100000750430_100000211423 [0,0,0,1,0,0|2,0,0]=3 10466 B13R1.28 NCCCCOCC1CCCCO1 34a_100000750430_100000211543 [0,0,0,1,0,0|2,0,0]=3 10467 B13R1.28 NCCCCOCC1CCCOC1 34a_100000750430_100000741521 [0,0,0,1,0,0|3,0,0]=4 10468 B13R1.28 NCCCCOCC1CCOCC1 34a_100000750430_100000754603 [0,0,0,1,0,0|3,0,0]=4 10469 B13R1.28 NCCCOCCC1CCCCC1 34a_100000182051_100011209188 [0,0,0,1,0,0|2,0,0]=3 10470 B13R1.28 NCCCOCCC1CCOCC1 34a_100000182051_100011934994 [0,0,0,1,0,0|3,0,0]=4 10471 B13R1.28 NCCCOCCC1OCCCO1 34a_100000182051_100000764188 [0,0,0,1,0,0|3,0,0]=4 10472 B13R1.28 NCCCOCCN1CCCCC1 34a_100000182051_100000739454 [0,0,0,1,0,0|3,0,0]=4 10473 B13R1.28 NCCCOCOC1CCCCC1 34a_100000182051_100011935260 [0,0,0,1,0,0|3,0,0]=4 10474 B13R1.28 NCCOCCCC1CCCCC1 34a_100000210304_100011713725 [0,0,0,1,0,0|2,0,0]=3 10475 B13R1.28 NCCOCCCN1CCCCC1 34a_100000210304_100000690320 [0,0,0,1,0,0|3,0,0]=4 10476 B13R1.28 NCCOCCOC1CCCCC1 34a_100000210304_100011211530 [0,0,0,1,0,0|3,0,0]=4 10477 B13R1.28 NCCOCCOC1CCCCC1 34a_100000211614_100000210327 [0,0,0,1,0,0|3,0,0]=4 10478 B13R1.28 NCCOCCOC1CCCCO1 34a_100000210304_100000744793 [0,0,0,1,0,0|3,0,0]=4 10479 B13R1.28 NOCCOCCC1CCCCC1 34a_100000700252_100011209188 [0,0,0,1,0,0|3,0,0]=4 10480 B13R1.28 O=CCCCCNC1CCCCC1 2230a_100000182618_100000139335 [0,0,0,1,0,0|1,0,2]=4 10481 B13R1.28 O=CCCCCOC1CCCCC1 7a_100000210231_100000139335 [0,0,0,1,0,0|1,0,2]=4 10482 B13R1.28 O=CCCCCSC1CCCCC1 62a_100000139335_100000210327 [0,0,0,1,0,0|1,0,2]=4 10483 B13R1.28 O=CCCCCSC1CCCCC1 62a_100000210327_100000139335 [0,0,0,1,0,0|1,0,2]=4 10484 B13R1.28 O=CCCCNCC1CCCCC1 2230a_100000210473_200011292268 [0,0,0,1,0,0|1,0,2]=4 10485 B13R1.28 O=CCCCNCC1CCCCO1 2230a_100000174945_200011292268 [0,0,0,1,0,0|2,0,1]=4 10486 B13R1.28 O=CCCCOCC1CCCCC1 7a_100000212181_200011292268 [0,0,0,1,0,0|1,0,2]=4 10487 B13R1.28 O=CCCCOCC1CCCCO1 7a_100000211370_200011292268 [0,0,0,1,0,0|2,0,1]=4 10488 B13R1.28 O=CCCCSCC1CCCCC1 62a_100000211423_200011292268 [0,0,0,1,0,0|1,0,2]=4 10489 B13R1.28 O=CCCCSCC1CCCCC1 62a_200011292268_100000211423 [0,0,0,1,0,0|1,0,2]=4 10490 B13R1.28 O=CCCCSCC1CCCCO1 62a_100000211543_200011292268 [0,0,0,1,0,0|2,0,1]=4 10491 B13R1.28 O=CCCCSCC1CCCCO1 62a_200011292268_100000211543 [0,0,0,1,0,0|2,0,1]=4 10492 B13R1.28 O=CCNCCCC1CCCCC1 2230a_100011211642_200015260668 [0,0,0,1,0,0|1,0,2]=4 10493 B13R1.28 O=CCNCCCC1CCCCC1 34a_100011211642_200009817547 [0,0,0,1,0,0|1,0,2]=4 10494 B13R1.28 O=CCOCCCC1CCCCC1 34a_100000198086_200009817547 [0,0,0,1,0,0|1,0,2]=4 10495 B13R1.28 O=CCOCCCC1CCCCC1 7a_100000198086_200015260668 [0,0,0,1,0,0|1,0,2]=4 10496 B13R1.28 O=CCSCCCC1CCCCC1 62a_100011713725_200015260668 [0,0,0,1,0,0|1,0,2]=4 10497 B13R1.28 O=CCSCCCC1CCCCC1 62a_200015260668_100011713725 [0,0,0,1,0,0|1,0,2]=4 10498 B13R1.28 OCC#CCNCC1CCCCC1 2230a_100000210473_200000047223 [0,0,0,1,0,0|1,0,2]=4 10499 B13R1.28 OCC#CCNCC1CCCCC1 34a_100000210473_200000047223 [0,0,0,1,0,0|1,0,2]=4 10500 B13R1.28 OCC#CCOCC1CCCCC1 34a_100000212181_200000047223 [0,0,0,1,0,0|1,0,2]=4 10501 B13R1.28 OCC#CCOCC1CCCCC1 7a_100000212181_200000047223 [0,0,0,1,0,0|1,0,2]=4 10502 B13R1.28 OCC#CCSCC1CCCCC1 62a_100000211423_200000047223 [0,0,0,1,0,0|1,0,2]=4 10503 B13R1.28 OCC#CCSCC1CCCCC1 62a_200000047223_100000211423 [0,0,0,1,0,0|1,0,2]=4 10504 B13R1.28 OCCCCCCN1CC=CCC1 2230a_100000698166_100000766143 [0,0,0,1,0,0|1,0,2]=4 10505 B13R1.28 OCCCCCCN1CC=CCC1 269982a_100000698166_100000766143 [0,0,0,1,0,0|1,0,2]=4 10506 B13R1.28 OCCCCCCN1CC=CCC1 34a_100000698166_100000766143 [0,0,0,1,0,0|1,0,2]=4 10507 B13R1.28 OCCCCCCN1CCCOC1 2230a_100000131196_100000766143 [0,0,0,1,0,0|2,0,0]=3 10508 B13R1.28 OCCCCCCN1CCCOC1 269982a_100000131196_100000766143 [0,0,0,1,0,0|2,0,0]=3 10509 B13R1.28 OCCCCCCN1CCCOC1 34a_100000131196_100000766143 [0,0,0,1,0,0|2,0,0]=3 10510 B13R1.28 OCCCCCCN1CCOCC1 2230a_100015191051_100000766143 [0,0,0,1,0,0|2,0,0]=3 10511 B13R1.28 OCCCCCCN1CCOCC1 269982a_100015191051_100000766143 [0,0,0,1,0,0|2,0,0]=3 10512 B13R1.28 OCCCCCCN1CCOCC1 34a_100015191051_100000766143 [0,0,0,1,0,0|2,0,0]=3 10513 B13R1.28 OCCCCCCN1CCSCC1 2230a_100000737611_100000766143 [0,0,0,1,0,0|2,0,0]=3 10514 B13R1.28 OCCCCCCN1CCSCC1 269982a_100000737611_100000766143 [0,0,0,1,0,0|2,0,0]=3 10515 B13R1.28 OCCCCCNC1C=CCCC1 2230a_100000762737_100000751183 [0,0,0,1,0,0|1,0,2]=4 10516 B13R1.28 OCCCCCNC1CCCCC1 2230a_100000182618_100000746330 [0,0,0,1,0,0|1,0,0]=2 10517 B13R1.28 OCCCCCNC1CCCCC1 270004a_100000762737_100000210434 [0,0,0,1,0,0|1,0,0]=2 10518 B13R1.28 OCCCCCNC1CCCCC1 34a_100000182618_100000746330 [0,0,0,1,0,0|1,0,0]=2 10519 B13R1.28 OCCCCCNC1CCCCC1 34a_100000762737_100000210327 [0,0,0,1,0,0|1,0,0]=2 10520 B13R1.28 OCCCCCNC1CCCOC1 2230a_100000719290_100000746330 [0,0,0,1,0,0|2,0,0]=3 10521 B13R1.28 OCCCCCNC1CCCOC1 270004a_100000762737_100000753404 [0,0,0,1,0,0|2,0,0]=3 10522 B13R1.28 OCCCCCNC1CCCOC1 34a_100000719290_100000746330 [0,0,0,1,0,0|2,0,0]=3 10523 B13R1.28 OCCCCCNC1CCCOC1 34a_100000762737_100000693364 [0,0,0,1,0,0|2,0,0]=3 10524 B13R1.28 OCCCCCNC1CCCSC1 270004a_100000762737_100000057913 [0,0,0,1,0,0|2,0,0]=3 10525 B13R1.28 OCCCCCNC1CCNCC1 270004a_100000762737_100015192401 [0,0,0,1,0,0|2,0,0]=3 10526 B13R1.28 OCCCCCNC1CCOCC1 2230a_100000741149_100000746330 [0,0,0,1,0,0|2,0,0]=3 10527 B13R1.28 OCCCCCNC1CCOCC1 270004a_100000762737_100011217826 [0,0,0,1,0,0|2,0,0]=3 10528 B13R1.28 OCCCCCNC1CCOCC1 34a_100000741149_100000746330 [0,0,0,1,0,0|2,0,0]=3 10529 B13R1.28 OCCCCCNC1CCSCC1 2230a_100000748639_100000746330 [0,0,0,1,0,0|2,0,0]=3 10530 B13R1.28 OCCCCCNC1CCSCC1 270004a_100000762737_100000203788 [0,0,0,1,0,0|2,0,0]=3 10531 B13R1.28 OCCCCCNC1CCSCC1 34a_100000748639_100000746330 [0,0,0,1,0,0|2,0,0]=3 10532 B13R1.28 OCCCCCNC1CCSCC1 34a_100000762737_100000069128 [0,0,0,1,0,0|2,0,0]=3 10533 B13R1.28 OCCCCCOC1C=CCCC1 34a_100011215024_100000746330 [0,0,0,1,0,0|1,0,2]=4 10534 B13R1.28 OCCCCCOC1CC=CCC1 34a_100000073881_100000746330 [0,0,0,1,0,0|1,0,2]=4 10535 B13R1.28 OCCCCCOC1CCCCC1 34a_100000210231_100000746330 [0,0,0,1,0,0|1,0,0]=2 10536 B13R1.28 OCCCCCOC1CCCCC1 7a_100000210231_100000746330 [0,0,0,1,0,0|1,0,0]=2 10537 B13R1.28 OCCCCCOC1CCCCO1 34a_100000033831_100000746330 [0,0,0,1,0,0|2,0,0]=3 10538 B13R1.28 OCCCCCOC1CCCOC1 34a_100000754041_100000746330 [0,0,0,1,0,0|2,0,0]=3 10539 B13R1.28 OCCCCCOC1CCCSC1 7a_100015962668_100000746330 [0,0,0,1,0,0|2,0,0]=3 10540 B13R1.28 OCCCCCOC1CCOCC1 34a_100000744328_100000746330 [0,0,0,1,0,0|2,0,0]=3 10541 B13R1.28 OCCCCCOC1CCSCC1 34a_100000731022_100000746330 [0,0,0,1,0,0|2,0,0]=3 10542 B13R1.28 OCCCCCOC1CCSCC1 7a_100000731022_100000746330 [0,0,0,1,0,0|2,0,0]=3 10543 B13R1.28 OCCCCCSC1C=CCCC1 62a_100000746330_100000751183 [0,0,0,1,0,0|1,0,2]=4 10544 B13R1.28 OCCCCCSC1C=CCCC1 62a_100000751183_100000746330 [0,0,0,1,0,0|1,0,2]=4 10545 B13R1.28 OCCCCCSC1CCCCC1 62a_100000210327_100000746330 [0,0,0,1,0,0|1,0,0]=2 10546 B13R1.28 OCCCCCSC1CCCCC1 62a_100000746330_100000210327 [0,0,0,1,0,0|1,0,0]=2 10547 B13R1.28 OCCCCCSC1CCCOC1 62a_100000746330_100000693364 [0,0,0,1,0,0|2,0,0]=3 10548 B13R1.28 OCCCCCSC1CCOCC1 62a_100000746330_100011324220 [0,0,0,1,0,0|2,0,0]=3 10549 B13R1.28 OCCCCCSC1CCSCC1 62a_100000746330_100000069128 [0,0,0,1,0,0|2,0,0]=3 10550 B13R1.28 OCCCCNCC1CC=CCC1 270004a_100000750430_100000189434 [0,0,0,1,0,0|1,0,2]=4 10551 B13R1.28 OCCCCNCC1CCCCC1 2230a_100000210473_100000210776 [0,0,0,1,0,0|1,0,0]=2 10552 B13R1.28 OCCCCNCC1CCCCC1 2230a_100000750430_100000211423 [0,0,0,1,0,0|1,0,0]=2 10553 B13R1.28 OCCCCNCC1CCCCC1 269862a_100000750430_100000211278 [0,0,0,1,0,0|1,0,0]=2 10554 B13R1.28 OCCCCNCC1CCCCC1 34a_100000210473_100011216708 [0,0,0,1,0,0|1,0,0]=2 10555 B13R1.28 OCCCCNCC1CCCCC1 34a_100000750430_100000211423 [0,0,0,1,0,0|1,0,0]=2 10556 B13R1.28 OCCCCNCC1CCCCO1 2230a_100000174945_100000210776 [0,0,0,1,0,0|2,0,0]=3 10557 B13R1.28 OCCCCNCC1CCCCO1 2230a_100000750430_100000211543 [0,0,0,1,0,0|2,0,0]=3 10558 B13R1.28 OCCCCNCC1CCCCO1 34a_100000174945_100011216708 [0,0,0,1,0,0|2,0,0]=3 10559 B13R1.28 OCCCCNCC1CCCCO1 34a_100000750430_100000211543 [0,0,0,1,0,0|2,0,0]=3 10560 B13R1.28 OCCCCNCC1CCCOC1 2230a_100000720124_100000210776 [0,0,0,1,0,0|2,0,0]=3 10561 B13R1.28 OCCCCNCC1CCCOC1 2230a_100000750430_100000741521 [0,0,0,1,0,0|2,0,0]=3 10562 B13R1.28 OCCCCNCC1CCCOC1 34a_100000720124_100011216708 [0,0,0,1,0,0|2,0,0]=3 10563 B13R1.28 OCCCCNCC1CCCOC1 34a_100000750430_100000741521 [0,0,0,1,0,0|2,0,0]=3 10564 B13R1.28 OCCCCNCC1CCOCC1 2230a_100000746373_100000210776 [0,0,0,1,0,0|2,0,0]=3 10565 B13R1.28 OCCCCNCC1CCOCC1 2230a_100000750430_100000754603 [0,0,0,1,0,0|2,0,0]=3 10566 B13R1.28 OCCCCNCC1CCOCC1 269862a_100000750430_100000749017 [0,0,0,1,0,0|2,0,0]=3 10567 B13R1.28 OCCCCNCC1CCOCC1 34a_100000746373_100011216708 [0,0,0,1,0,0|2,0,0]=3 10568 B13R1.28 OCCCCNCC1CCOCC1 34a_100000750430_100000754603 [0,0,0,1,0,0|2,0,0]=3 10569 B13R1.28 OCCCCNCC1CCSCC1 2230a_100015188806_100000210776 [0,0,0,1,0,0|2,0,0]=3 10570 B13R1.28 OCCCCNCC1CCSCC1 269862a_100000750430_100000067145 [0,0,0,1,0,0|2,0,0]=3 10571 B13R1.28 OCCCCNCC1CCSCC1 270004a_100000750430_100000067145 [0,0,0,1,0,0|2,0,0]=3 10572 B13R1.28 OCCCCNCC1CCSCC1 34a_100015188806_100011216708 [0,0,0,1,0,0|2,0,0]=3 10573 B13R1.28 OCCCCNC[C@H]1COCCO1 2230a_100010981119_100000210776 [0,0,0,1,0,0|3,0,0]=4 10574 B13R1.28 OCCCCNC[C@H]1COCCO1 34a_100010981119_100011216708 [0,0,0,1,0,0|3,0,0]=4 10575 B13R1.28 OCCCCOCC1CC=CCC1 34a_100000210713_100011216708 [0,0,0,1,0,0|1,0,2]=4 10576 B13R1.28 OCCCCOCC1CCCCC1 34a_100000212181_100011216708 [0,0,0,1,0,0|1,0,0]=2 10577 B13R1.28 OCCCCOCC1CCCCC1 7a_100000212181_100000210776 [0,0,0,1,0,0|1,0,0]=2 10578 B13R1.28 OCCCCOCC1CCCCN1 34a_100000210821_100011216708 [0,0,0,1,0,0|2,0,0]=3 10579 B13R1.28 OCCCCOCC1CCCCO1 34a_100000211370_100011216708 [0,0,0,1,0,0|2,0,0]=3 10580 B13R1.28 OCCCCOCC1CCCCO1 7a_100000211370_100000210776 [0,0,0,1,0,0|2,0,0]=3 10581 B13R1.28 OCCCCOCC1CCCNC1 34a_100000211344_100011216708 [0,0,0,1,0,0|2,0,0]=3 10582 B13R1.28 OCCCCOCC1CCCOC1 34a_100000741520_100011216708 [0,0,0,1,0,0|2,0,0]=3 10583 B13R1.28 OCCCCOCC1CCNCC1 34a_100000738675_100011216708 [0,0,0,1,0,0|2,0,0]=3 10584 B13R1.28 OCCCCOCC1CCOCC1 34a_100000749013_100011216708 [0,0,0,1,0,0|2,0,0]=3 10585 B13R1.28 OCCCCOCC1CCSCC1 34a_100000070558_100011216708 [0,0,0,1,0,0|2,0,0]=3 10586 B13R1.28 OCCCCOCC1CCSCC1 7a_100000070558_100000210776 [0,0,0,1,0,0|2,0,0]=3 10587 B13R1.28 OCCCCOC[C@@H]1CNCCO1 34a_100015189573_100011216708 [0,0,0,1,0,0|3,0,0]=4 10588 B13R1.28 OCCCCOC[C@@H]1COCCN1 34a_100000717676_100011216708 [0,0,0,1,0,0|3,0,0]=4 10589 B13R1.28 OCCCCOC[C@H]1COCCO1 34a_100009875890_100011216708 [0,0,0,1,0,0|3,0,0]=4 10590 B13R1.28 OCCCCSCC1CCCCC1 62a_100000210776_100000211423 [0,0,0,1,0,0|1,0,0]=2 10591 B13R1.28 OCCCCSCC1CCCCC1 62a_100000211423_100000210776 [0,0,0,1,0,0|1,0,0]=2 10592 B13R1.28 OCCCCSCC1CCCCO1 62a_100000210776_100000211543 [0,0,0,1,0,0|2,0,0]=3 10593 B13R1.28 OCCCCSCC1CCCCO1 62a_100000211543_100000210776 [0,0,0,1,0,0|2,0,0]=3 10594 B13R1.28 OCCCCSCC1CCCOC1 62a_100000210776_100000741521 [0,0,0,1,0,0|2,0,0]=3 10595 B13R1.28 OCCCCSCC1CCCOC1 62a_100000741521_100000210776 [0,0,0,1,0,0|2,0,0]=3 10596 B13R1.28 OCCCCSCC1CCOCC1 62a_100000210776_100000749018 [0,0,0,1,0,0|2,0,0]=3 10597 B13R1.28 OCCCCSCC1CCOCC1 62a_100000754603_100000210776 [0,0,0,1,0,0|2,0,0]=3 10598 B13R1.28 OCCCNCCC1=CCCCC1 2230a_100000212019_100000230001 [0,0,0,1,0,0|1,0,2]=4 10599 B13R1.28 OCCCNCCC1=CCCCC1 34a_100000212019_100000230001 [0,0,0,1,0,0|1,0,2]=4 10600 B13R1.28 OCCCNCCC1CCCCC1 2230a_100000738074_100000230001 [0,0,0,1,0,0|1,0,0]=2 10601 B13R1.28 OCCCNCCC1CCCCC1 270004a_100000182051_100011713444 [0,0,0,1,0,0|1,0,0]=2 10602 B13R1.28 OCCCNCCC1CCCCC1 34a_100000738074_100000230001 [0,0,0,1,0,0|1,0,0]=2 10603 B13R1.28 OCCCNCCC1CCCCO1 2230a_100015183643_100000230001 [0,0,0,1,0,0|2,0,0]=3 10604 B13R1.28 OCCCNCCC1CCCCO1 34a_100015183643_100000230001 [0,0,0,1,0,0|2,0,0]=3 10605 B13R1.28 OCCCNCCC1CCOCC1 2230a_100000755988_100000230001 [0,0,0,1,0,0|2,0,0]=3 10606 B13R1.28 OCCCNCCC1CCOCC1 34a_100000755988_100000230001 [0,0,0,1,0,0|2,0,0]=3 10607 B13R1.28 OCCCNCCN1CCSCC1 2230a_100000755026_100000230001 [0,0,0,1,0,0|3,0,0]=4 10608 B13R1.28 OCCCOCCC1CCCCC1 34a_100011217863_100000230001 [0,0,0,1,0,0|1,0,0]=2 10609 B13R1.28 OCCCOCCC1CCCCC1 7a_100011217863_100011215043 [0,0,0,1,0,0|1,0,0]=2 10610 B13R1.28 OCCCOCCC1CCCCN1 34a_100000211664_100000230001 [0,0,0,1,0,0|2,0,0]=3 10611 B13R1.28 OCCCOCCC1CCCNC1 34a_100000752241_100000230001 [0,0,0,1,0,0|2,0,0]=3 10612 B13R1.28 OCCCOCCC1CCNCC1 34a_100015190746_100000230001 [0,0,0,1,0,0|2,0,0]=3 10613 B13R1.28 OCCCOCCC1CCOCC1 34a_100011933979_100000230001 [0,0,0,1,0,0|2,0,0]=3 10614 B13R1.28 OCCCOCCC1CCOCC1 7a_100011933979_100011215043 [0,0,0,1,0,0|2,0,0]=3 10615 B13R1.28 OCCCOCCC1SCCCS1 34a_200011025297_100000230001 [0,0,0,1,0,0|3,0,0]=4 10616 B13R1.28 OCCCOCCC1SCCCS1 7a_200011025297_100011215043 [0,0,0,1,0,0|3,0,0]=4 10617 B13R1.28 OCCCOCCN1CCSCC1 7a_100000686052_100011215043 [0,0,0,1,0,0|3,0,0]=4 10618 B13R1.28 OCCCOCC[C@@H]1CNCCN1 34a_100016989929_100000230001 [0,0,0,1,0,0|3,0,0]=4 10619 B13R1.28 OCCCSCCC1CCCCC1 62a_100011215043_100012355289 [0,0,0,1,0,0|1,0,0]=2 10620 B13R1.28 OCCCSCCC1CCCCC1 62a_100012355289_100011215043 [0,0,0,1,0,0|1,0,0]=2 10621 B13R1.28 OCCCSCCC1CCOCC1 62a_100011215043_100011934994 [0,0,0,1,0,0|2,0,0]=3 10622 B13R1.28 OCCCSCCC1CCOCC1 62a_100011934994_100011215043 [0,0,0,1,0,0|2,0,0]=3 10623 B13R1.28 OCCCSCCC1OCCCO1 62a_100000764188_100011215043 [0,0,0,1,0,0|3,0,0]=4 10624 B13R1.28 OCCCSCCC1OCCCO1 62a_100011215043_100000764188 [0,0,0,1,0,0|3,0,0]=4 10625 B13R1.28 OCCCSCCN1CCCCC1 62a_100000739454_100011215043 [0,0,0,1,0,0|2,0,0]=3 10626 B13R1.28 OCCCSCCN1CCCCC1 62a_100011215043_100000739454 [0,0,0,1,0,0|2,0,0]=3 10627 B13R1.28 OCCCSCCN1CCOCC1 62a_100011215043_100000211760 [0,0,0,1,0,0|3,0,0]=4 10628 B13R1.28 OCCCSCOC1CCCCC1 62a_100011215043_100011935260 [0,0,0,1,0,0|2,0,0]=3 10629 B13R1.28 OCCCSCOC1CCCCC1 62a_100011935260_100011215043 [0,0,0,1,0,0|2,0,0]=3 10630 B13R1.28 OCCNCCCC1CCCCC1 2230a_100011211642_100000211926 [0,0,0,1,0,0|1,0,0]=2 10631 B13R1.28 OCCNCCCC1CCCCC1 2230a_100016997473_100011713725 [0,0,0,1,0,0|1,0,0]=2 10632 B13R1.28 OCCNCCCC1CCCCC1 34a_100011211642_100000211926 [0,0,0,1,0,0|1,0,0]=2 10633 B13R1.28 OCCNCCCC1CCCCC1 34a_100016990907_100011713725 [0,0,0,1,0,0|1,0,0]=2 10634 B13R1.28 OCCNCCCN1CCCCC1 2230a_100016997473_100000690320 [0,0,0,1,0,0|2,0,0]=3 10635 B13R1.28 OCCNCCCN1CCCCC1 34a_100016990907_100000690320 [0,0,0,1,0,0|2,0,0]=3 10636 B13R1.28 OCCNCCCN1CCOCC1 2230a_100016997473_100000748698 [0,0,0,1,0,0|3,0,0]=4 10637 B13R1.28 OCCNCCCN1CCOCC1 34a_100016990907_100000748698 [0,0,0,1,0,0|3,0,0]=4 10638 B13R1.28 OCCNCCOC1CCCCC1 2230a_100016997473_100011211530 [0,0,0,1,0,0|2,0,0]=3 10639 B13R1.28 OCCNCCOC1CCCCC1 34a_100015206981_100000211926 [0,0,0,1,0,0|2,0,0]=3 10640 B13R1.28 OCCNCCOC1CCCCC1 34a_100016990907_100011211530 [0,0,0,1,0,0|2,0,0]=3 10641 B13R1.28 OCCNCCOC1CCCCO1 2230a_100016997473_100000744793 [0,0,0,1,0,0|3,0,0]=4 10642 B13R1.28 OCCNCCOC1CCCCO1 34a_100016990907_100000744793 [0,0,0,1,0,0|3,0,0]=4 10643 B13R1.28 OCCNN=CCC1CCCCC1 4a_100000210001_100011713444 [0,0,0,1,0,0|2,0,1]=4 10644 B13R1.28 OCCOCCCC1CCCCC1 34a_100000198086_100000211926 [0,0,0,1,0,0|1,0,0]=2 10645 B13R1.28 OCCOCCCC1CCCCC1 7a_100000198086_100000211926 [0,0,0,1,0,0|1,0,0]=2 10646 B13R1.28 OCCOCCCC1CCCCN1 34a_100011934581_100000211926 [0,0,0,1,0,0|2,0,0]=3 10647 B13R1.28 OCCOCCCC1CCCNC1 34a_100150707839_100000211926 [0,0,0,1,0,0|2,0,0]=3 10648 B13R1.28 OCCOCCCC1CCNCC1 34a_100016988962_100000211926 [0,0,0,1,0,0|2,0,0]=3 10649 B13R1.28 OCCOCCCN1CCCCC1 34a_100000212458_100000211926 [0,0,0,1,0,0|2,0,0]=3 10650 B13R1.28 OCCOCCCN1CCOCC1 34a_100000212840_100000211926 [0,0,0,1,0,0|3,0,0]=4 10651 B13R1.28 OCCOCCNC1CCCCC1 2230a_100000182618_100011215305 [0,0,0,1,0,0|2,0,0]=3 10652 B13R1.28 OCCOCCNC1CCCCC1 270004a_100000211614_100000210434 [0,0,0,1,0,0|2,0,0]=3 10653 B13R1.28 OCCOCCNC1CCCCC1 34a_100000182618_100000692535 [0,0,0,1,0,0|2,0,0]=3 10654 B13R1.28 OCCOCCNC1CCCCC1 34a_100000200466_100000211926 [0,0,0,1,0,0|2,0,0]=3 10655 B13R1.28 OCCOCCNC1CCCCC1 34a_100000211614_100000210327 [0,0,0,1,0,0|2,0,0]=3 10656 B13R1.28 OCCOCCNC1CCCOC1 2230a_100000719290_100011215305 [0,0,0,1,0,0|3,0,0]=4 10657 B13R1.28 OCCOCCNC1CCCOC1 270004a_100000211614_100000753404 [0,0,0,1,0,0|3,0,0]=4 10658 B13R1.28 OCCOCCNC1CCCOC1 34a_100000211614_100000693364 [0,0,0,1,0,0|3,0,0]=4 10659 B13R1.28 OCCOCCNC1CCCOC1 34a_100000719290_100000692535 [0,0,0,1,0,0|3,0,0]=4 10660 B13R1.28 OCCOCCNC1CCCSC1 270004a_100000211614_100000057913 [0,0,0,1,0,0|3,0,0]=4 10661 B13R1.28 OCCOCCNC1CCNCC1 270004a_100000211614_100015192401 [0,0,0,1,0,0|3,0,0]=4 10662 B13R1.28 OCCOCCNC1CCOCC1 2230a_100000741149_100011215305 [0,0,0,1,0,0|3,0,0]=4 10663 B13R1.28 OCCOCCNC1CCOCC1 270004a_100000211614_100011217826 [0,0,0,1,0,0|3,0,0]=4 10664 B13R1.28 OCCOCCNC1CCOCC1 34a_100000708129_100000211926 [0,0,0,1,0,0|3,0,0]=4 10665 B13R1.28 OCCOCCNC1CCOCC1 34a_100000741149_100000692535 [0,0,0,1,0,0|3,0,0]=4 10666 B13R1.28 OCCOCCNC1CCSCC1 2230a_100000748639_100011215305 [0,0,0,1,0,0|3,0,0]=4 10667 B13R1.28 OCCOCCNC1CCSCC1 270004a_100000211614_100000203788 [0,0,0,1,0,0|3,0,0]=4 10668 B13R1.28 OCCOCCNC1CCSCC1 34a_100000211614_100000069128 [0,0,0,1,0,0|3,0,0]=4 10669 B13R1.28 OCCOCCNC1CCSCC1 34a_100000748639_100000692535 [0,0,0,1,0,0|3,0,0]=4 10670 B13R1.28 OCCOCCOC1CCCCC1 34a_100000210231_100000692535 [0,0,0,1,0,0|2,0,0]=3 10671 B13R1.28 OCCOCCOC1CCCCC1 34a_100011249652_100000211926 [0,0,0,1,0,0|2,0,0]=3 10672 B13R1.28 OCCOCCOC1CCCCC1 7a_100000210231_100011215305 [0,0,0,1,0,0|2,0,0]=3 10673 B13R1.28 OCCOCCOC1CCCCC1 7a_100011249652_100000211926 [0,0,0,1,0,0|2,0,0]=3 10674 B13R1.28 OCCOCCOC1CCCCO1 34a_100000033831_100000692535 [0,0,0,1,0,0|3,0,0]=4 10675 B13R1.28 OCCOCCOC1CCCCO1 34a_100000034223_100000211926 [0,0,0,1,0,0|3,0,0]=4 10676 B13R1.28 OCCOCCOC1CCCCO1 7a_100000034223_100000211926 [0,0,0,1,0,0|3,0,0]=4 10677 B13R1.28 OCCOCCOC1CCCOC1 34a_100000754041_100000692535 [0,0,0,1,0,0|3,0,0]=4 10678 B13R1.28 OCCOCCOC1CCCSC1 7a_100015962668_100011215305 [0,0,0,1,0,0|3,0,0]=4 10679 B13R1.28 OCCOCCOC1CCOCC1 34a_100000744328_100000692535 [0,0,0,1,0,0|3,0,0]=4 10680 B13R1.28 OCCOCCOC1CCSCC1 34a_100000731022_100000692535 [0,0,0,1,0,0|3,0,0]=4 10681 B13R1.28 OCCOCCOC1CCSCC1 7a_100000731022_100011215305 [0,0,0,1,0,0|3,0,0]=4 10682 B13R1.28 OCCOCCSC1CCCCC1 62a_100000210327_100011215305 [0,0,0,1,0,0|2,0,0]=3 10683 B13R1.28 OCCOCCSC1CCCCC1 62a_100011215305_100000210327 [0,0,0,1,0,0|2,0,0]=3 10684 B13R1.28 OCCOCCSC1CCCOC1 62a_100011215305_100000693364 [0,0,0,1,0,0|3,0,0]=4 10685 B13R1.28 OCCOCCSC1CCOCC1 62a_100011215305_100011324220 [0,0,0,1,0,0|3,0,0]=4 10686 B13R1.28 OCCOCCSC1CCSCC1 62a_100011215305_100000069128 [0,0,0,1,0,0|3,0,0]=4 10687 B13R1.28 OCCSCCCC1CCCCC1 62a_100000211926_100011713725 [0,0,0,1,0,0|1,0,0]=2 10688 B13R1.28 OCCSCCCC1CCCCC1 62a_100011713725_100000211926 [0,0,0,1,0,0|1,0,0]=2 10689 B13R1.28 OCCSCCCN1CCCCC1 62a_100000211926_100000007876 [0,0,0,1,0,0|2,0,0]=3 10690 B13R1.28 OCCSCCCN1CCCCC1 62a_100132302099_100000211926 [0,0,0,1,0,0|2,0,0]=3 10691 B13R1.28 OCCSCCCN1CCOCC1 62a_100000211926_100000748698 [0,0,0,1,0,0|3,0,0]=4 10692 B13R1.28 OCCSCCNC1CCCCC1 270004a_100011219999_100000210434 [0,0,0,1,0,0|2,0,0]=3 10693 B13R1.28 OCCSCCNC1CCCOC1 270004a_100011219999_100000753404 [0,0,0,1,0,0|3,0,0]=4 10694 B13R1.28 OCCSCCNC1CCCSC1 270004a_100011219999_100000057913 [0,0,0,1,0,0|3,0,0]=4 10695 B13R1.28 OCCSCCNC1CCNCC1 270004a_100011219999_100015192401 [0,0,0,1,0,0|3,0,0]=4 10696 B13R1.28 OCCSCCNC1CCOCC1 270004a_100011219999_100011217826 [0,0,0,1,0,0|3,0,0]=4 10697 B13R1.28 OCCSCCNC1CCSCC1 270004a_100011219999_100000203788 [0,0,0,1,0,0|3,0,0]=4 10698 B13R1.28 OCCSCCOC1CCCCC1 62a_100000211926_100011211530 [0,0,0,1,0,0|2,0,0]=3 10699 B13R1.28 OCCSCCOC1CCCCC1 62a_100011211530_100000211926 [0,0,0,1,0,0|2,0,0]=3 10700 B13R1.28 OCCSCCOC1CCCCO1 62a_100000211926_100000744793 [0,0,0,1,0,0|3,0,0]=4 10701 B13R1.28 OCCSCCOC1CCCCO1 62a_100000744793_100000211926 [0,0,0,1,0,0|3,0,0]=4 10702 B13R1.28 [13CH3]OCCCCCN1CCCCC1 34a_100011216611_200025704644 [0,0,0,1,0,0|3,0,0]=4 10703 B13R1.28 [13CH3]OCCCCCN1CCCCC1 7a_100011216611_200025704644 [0,0,0,1,0,0|3,0,0]=4 10704 B13R1.28 [13CH3]SCCCCOC1CCCCO1 62a_100000031530_200025704644 [0,0,0,1,0,0|2,0,0]=3 10705 B13R1.28 [13CH3]SCCCCOC1CCCCO1 62a_200025704644_100000031530 [0,0,0,1,0,0|2,0,0]=3 10706 B13R1.34 CCCCNC1CCCCCC1=O 7a_106832991798_100000243696 [0,0,0,1,0,0|1,0,2]=4 10707 B13R1.34 CCCCOC1CCCCCC1=O 7a_100000210227_100000243696 [0,0,0,1,0,0|1,0,2]=4 10708 B13R1.34 CCCCSC1CCCCCC1=O 62a_100000210211_100000243696 [0,0,0,1,0,0|1,0,2]=4 10709 B13R1.34 CCCCSC1CCCCCC1=O 62a_100000243696_100000210210 [0,0,0,1,0,0|1,0,2]=4 10710 B13R1.34 O=C1CCCCCC1SCCCO 62a_100000243696_100011215043 [0,0,0,1,0,0|2,0,1]=4 10711 B13R1.34 O=C1CCCCCC1SCCCO 62a_100011215043_100000243696 [0,0,0,1,0,0|2,0,1]=4 10712 B13R1.84 C#CC1CCCCN1CCCCC 2230a_200020621307_100000210326 [0,0,0,1,0,0|2,0,1]=4 10713 B13R1.84 C#CC1CCCCN1CCCCC 269982a_200020621307_100000210215 [0,0,0,1,0,0|2,0,1]=4 10714 B13R1.84 C#CC1CCCCN1CCCCC 34a_200020621307_100000718602 [0,0,0,1,0,0|2,0,1]=4 10715 B13R1.84 C#CC1CCCCN1CCCCO 2230a_200020621307_100000210776 [0,0,0,1,0,0|1,0,2]=4 10716 B13R1.84 C#CC1CCCCN1CCCCO 269982a_200020621307_100000210776 [0,0,0,1,0,0|1,0,2]=4 10717 B13R1.84 C#CC1CCCCN1CCCCO 34a_200020621307_100011216708 [0,0,0,1,0,0|1,0,2]=4 10718 B13R1.84 C#CCCCN1CCCCC1CC 2230a_100000210034_100000731252 [0,0,0,1,0,0|2,0,1]=4 10719 B13R1.84 C#CCCCN1CCCCC1CC 269982a_100000210034_100011215417 [0,0,0,1,0,0|2,0,1]=4 10720 B13R1.84 C#CCCCN1CCCCC1CC 34a_100000210034_100000695029 [0,0,0,1,0,0|2,0,1]=4 10721 B13R1.84 C#CCCCN1CCCCC1CO 2230a_100000210821_100000731252 [0,0,0,1,0,0|1,0,2]=4 10722 B13R1.84 C#CCCCN1CCCCC1CO 269982a_100000210821_100011215417 [0,0,0,1,0,0|1,0,2]=4 10723 B13R1.84 C#CCCCN1CCCCC1CO 34a_100000210821_100000695029 [0,0,0,1,0,0|1,0,2]=4 10724 B13R1.84 C#CCCOC1CCCCC1CC 34a_100000210738_100000688953 [0,0,0,1,0,0|2,0,1]=4 10725 B13R1.84 C#CCCOC1CCCCC1CC 7a_100000210738_100000688953 [0,0,0,1,0,0|2,0,1]=4 10726 B13R1.84 C=CCCCN1CCCCC1CC 2230a_100000210034_100011713584 [0,0,0,1,0,0|2,0,1]=4 10727 B13R1.84 C=CCCCN1CCCCC1CC 269982a_100000210034_100000757094 [0,0,0,1,0,0|2,0,1]=4 10728 B13R1.84 C=CCCCN1CCCCC1CC 34a_100000210034_100000757094 [0,0,0,1,0,0|2,0,1]=4 10729 B13R1.84 C=CCCCN1CCCCC1CO 2230a_100000210821_100011713584 [0,0,0,1,0,0|1,0,2]=4 10730 B13R1.84 C=CCCCN1CCCCC1CO 269982a_100000210821_100000757094 [0,0,0,1,0,0|1,0,2]=4 10731 B13R1.84 C=CCCCN1CCCCC1CO 34a_100000210821_100000757094 [0,0,0,1,0,0|1,0,2]=4 10732 B13R1.84 C=CCCNC1CCCCC1CC 269862a_100015191253_100000757040 [0,0,0,1,0,0|2,0,1]=4 10733 B13R1.84 C=CCCNC1CCCCC1CC 270004a_100015191253_100000757040 [0,0,0,1,0,0|2,0,1]=4 10734 B13R1.84 C=CCCNC1CCCCC1CO 270004a_100015191253_100009861125 [0,0,0,1,0,0|1,0,2]=4 10735 B13R1.84 C=CCCOC1CCCCC1CC 34a_100000210738_100000754431 [0,0,0,1,0,0|2,0,1]=4 10736 B13R1.84 C=CCCOC1CCCCC1CC 7a_100000210738_100000754431 [0,0,0,1,0,0|2,0,1]=4 10737 B13R1.84 CC/C=C\CN1CCCCC1CO 2230a_100000210821_100103147603 [0,0,0,1,0,0|1,0,2]=4 10738 B13R1.84 CC/C=C\CN1CCCCC1CO 269982a_100000210821_100103147603 [0,0,0,1,0,0|1,0,2]=4 10739 B13R1.84 CC/C=C\CN1CCCCC1CO 34a_100000210821_100103147603 [0,0,0,1,0,0|1,0,2]=4 10740 B13R1.84 CCC#CCN1CCCCC1CO 2230a_100000210821_100009813939 [0,0,0,1,0,0|1,0,2]=4 10741 B13R1.84 CCC#CCN1CCCCC1CO 34a_100000210821_100009813939 [0,0,0,1,0,0|1,0,2]=4 10742 B13R1.84 CCC1CCCCC1=NNCCO 4a_100000210001_100000757040 [0,0,0,1,0,0|2,0,1]=4 10743 B13R1.84 CCC1CCCCC1NCCC#N 270004a_100000720768_100000757040 [0,0,0,1,0,0|2,0,1]=4 10744 B13R1.84 CCC1CCCCC1NCCCF 269862a_100015189416_100000757040 [0,0,0,1,0,0|2,0,0]=3 10745 B13R1.84 CCC1CCCCC1NCCCF 270004a_100015189416_100000757040 [0,0,0,1,0,0|2,0,0]=3 10746 B13R1.84 CCC1CCCCC1NCCCO 269862a_100000182051_100000757040 [0,0,0,1,0,0|1,0,0]=2 10747 B13R1.84 CCC1CCCCC1NCCCO 270004a_100000182051_100000757040 [0,0,0,1,0,0|1,0,0]=2 10748 B13R1.84 CCC1CCCCC1NCCOC 269862a_100000209980_100000757040 [0,0,0,1,0,0|3,0,0]=4 10749 B13R1.84 CCC1CCCCC1NCCOC 270004a_100000209980_100000757040 [0,0,0,1,0,0|3,0,0]=4 10750 B13R1.84 CCC1CCCCC1NCCSC 269862a_100020590264_100000757040 [0,0,0,1,0,0|3,0,0]=4 10751 B13R1.84 CCC1CCCCC1NCCSC 270004a_100020590264_100000757040 [0,0,0,1,0,0|3,0,0]=4 10752 B13R1.84 CCC1CCCCC1OCCC#N 7a_100000210738_100000184422 [0,0,0,1,0,0|2,0,1]=4 10753 B13R1.84 CCC1CCCCC1OCCCF 34a_100000210738_100011934791 [0,0,0,1,0,0|2,0,0]=3 10754 B13R1.84 CCC1CCCCC1OCCCF 7a_100000210738_100011934791 [0,0,0,1,0,0|2,0,0]=3 10755 B13R1.84 CCC1CCCCC1OCCCO 34a_100000210738_100000230001 [0,0,0,1,0,0|1,0,0]=2 10756 B13R1.84 CCC1CCCCC1OCCCO 7a_100000210738_100011215043 [0,0,0,1,0,0|1,0,0]=2 10757 B13R1.84 CCC1CCCCC1OCCOC 34a_100000210738_100011201679 [0,0,0,1,0,0|3,0,0]=4 10758 B13R1.84 CCC1CCCCC1OCCOC 7a_100000210738_100000233755 [0,0,0,1,0,0|3,0,0]=4 10759 B13R1.84 CCC1CCCCC1OCCSC 34a_100000210738_100000212216 [0,0,0,1,0,0|3,0,0]=4 10760 B13R1.84 CCC1CCCCC1OCCSC 7a_100000210738_100000212216 [0,0,0,1,0,0|3,0,0]=4 10761 B13R1.84 CCC1CCCCN1CC#CCO 2230a_100000210034_200000047223 [0,0,0,1,0,0|1,0,2]=4 10762 B13R1.84 CCC1CCCCN1CC#CCO 34a_100000210034_200000047223 [0,0,0,1,0,0|1,0,2]=4 10763 B13R1.84 CCC1CCCCN1CCCC#N 2230a_100000210034_100000687738 [0,0,0,1,0,0|2,0,1]=4 10764 B13R1.84 CCC1CCCCN1CCCC#N 269982a_100000210034_100000687738 [0,0,0,1,0,0|2,0,1]=4 10765 B13R1.84 CCC1CCCCN1CCCC=O 2230a_100000210034_200011292268 [0,0,0,1,0,0|1,0,2]=4 10766 B13R1.84 CCC1CCCCN1CCCC=O 269982a_100000210034_200011292268 [0,0,0,1,0,0|1,0,2]=4 10767 B13R1.84 CCC1CCCCN1CCCCF 2230a_100000210034_100000729493 [0,0,0,1,0,0|2,0,0]=3 10768 B13R1.84 CCC1CCCCN1CCCCF 269982a_100000210034_100000729493 [0,0,0,1,0,0|2,0,0]=3 10769 B13R1.84 CCC1CCCCN1CCCCF 34a_100000210034_100000729493 [0,0,0,1,0,0|2,0,0]=3 10770 B13R1.84 CCC1CCCCN1CCCCO 2230a_100000210034_100000210776 [0,0,0,1,0,0|1,0,0]=2 10771 B13R1.84 CCC1CCCCN1CCCCO 269982a_100000210034_100000210776 [0,0,0,1,0,0|1,0,0]=2 10772 B13R1.84 CCC1CCCCN1CCCCO 34a_100000210034_100011216708 [0,0,0,1,0,0|1,0,0]=2 10773 B13R1.84 CCC1CCCCN1CCCNC 34a_100011191702_200000210301 [0,0,0,1,0,0|3,0,0]=4 10774 B13R1.84 CCC1CCCCN1CCCN[13CH3] 34a_100011191702_200025704644 [0,0,0,1,0,0|3,0,0]=4 10775 B13R1.84 CCC1CCCCN1CCCOC 2230a_100000210034_100000740836 [0,0,0,1,0,0|3,0,0]=4 10776 B13R1.84 CCC1CCCCN1CCCOC 269982a_100000210034_100000740836 [0,0,0,1,0,0|3,0,0]=4 10777 B13R1.84 CCC1CCCCN1CCCOC 34a_100000210034_100000740836 [0,0,0,1,0,0|3,0,0]=4 10778 B13R1.84 CCC1CCCCN1CCNCF 34a_100000755458_100015361967 [0,0,0,1,0,0|3,0,0]=4 10779 B13R1.84 CCCCCN1CCCCC1C#N 34a_100016989756_100000718602 [0,0,0,1,0,0|2,0,1]=4 10780 B13R1.84 CCCCCN1CCCCC1CC 2230a_100000210034_100000210326 [0,0,0,1,0,0|2,0,0]=3 10781 B13R1.84 CCCCCN1CCCCC1CC 269982a_100000210034_100000210215 [0,0,0,1,0,0|2,0,0]=3 10782 B13R1.84 CCCCCN1CCCCC1CC 34a_100000210034_100000718602 [0,0,0,1,0,0|2,0,0]=3 10783 B13R1.84 CCCCCN1CCCCC1CO 2230a_100000210821_100000210326 [0,0,0,1,0,0|1,0,0]=2 10784 B13R1.84 CCCCCN1CCCCC1CO 269982a_100000210821_100000210215 [0,0,0,1,0,0|1,0,0]=2 10785 B13R1.84 CCCCCN1CCCCC1CO 34a_100000210821_100000718602 [0,0,0,1,0,0|1,0,0]=2 10786 B13R1.84 CCCCCN1CCOC[C@@H]1CC 2230a_100016988097_100000210326 [0,0,0,1,0,0|3,0,0]=4 10787 B13R1.84 CCCCCN1CCOC[C@@H]1CC 269982a_100016988097_100000210215 [0,0,0,1,0,0|3,0,0]=4 10788 B13R1.84 CCCCCN1CCOC[C@@H]1CC 34a_100016988097_100000718602 [0,0,0,1,0,0|3,0,0]=4 10789 B13R1.84 CCCCCN1CCOC[C@H]1CO 2230a_100000717676_100000210326 [0,0,0,1,0,0|2,0,0]=3 10790 B13R1.84 CCCCCN1CCOC[C@H]1CO 269982a_100000717676_100000210215 [0,0,0,1,0,0|2,0,0]=3 10791 B13R1.84 CCCCCN1CCOC[C@H]1CO 34a_100000717676_100000718602 [0,0,0,1,0,0|2,0,0]=3 10792 B13R1.84 CCCCNC1CCCCC1CC 269862a_100000102301_100000757040 [0,0,0,1,0,0|2,0,0]=3 10793 B13R1.84 CCCCNC1CCCCC1CC 270004a_100000102301_100000757040 [0,0,0,1,0,0|2,0,0]=3 10794 B13R1.84 CCCCNC1CCCCC1CO 270004a_100000102301_100009861125 [0,0,0,1,0,0|1,0,0]=2 10795 B13R1.84 CCCCNC1CCCCC1OC 270004a_100000102301_100000740605 [0,0,0,1,0,0|3,0,0]=4 10796 B13R1.84 CCCCNC1CCCCC1OC 34a_100011208099_100000210210 [0,0,0,1,0,0|3,0,0]=4 10797 B13R1.84 CCCCNC1CCOCC1CO 2230a_214813039666_100000210211 [0,0,0,1,0,0|2,0,0]=3 10798 B13R1.84 CCCCNC1CCOCC1CO 34a_214813039666_100000210210 [0,0,0,1,0,0|2,0,0]=3 10799 B13R1.84 CCCCOC1CCCCC1CC 34a_100000210738_100000210210 [0,0,0,1,0,0|2,0,0]=3 10800 B13R1.84 CCCCOC1CCCCC1CC 7a_100000210738_100000210211 [0,0,0,1,0,0|2,0,0]=3 10801 B13R1.84 CCCCOC1CCCCC1CN 34a_100011216029_100000210210 [0,0,0,1,0,0|2,0,0]=3 10802 B13R1.84 CCCCO[C@@H]1CCCC[C@H]1NC 34a_100000708425_100000210210 [0,0,0,1,0,0|3,0,0]=4 10803 B13R1.84 CCCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000210210 [0,0,0,1,0,0|3,0,0]=4 10804 B13R1.84 CCCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000210211 [0,0,0,1,0,0|3,0,0]=4 10805 B13R1.84 CCCNCC1CCCCN1CC 2230a_100000754393_100000210303 [0,0,0,1,0,0|3,0,0]=4 10806 B13R1.84 CCCNCC1CCCCN1CC 34a_100000754393_100000210303 [0,0,0,1,0,0|3,0,0]=4 10807 B13R1.84 CCCNN=C1CCCCC1CO 4a_100000740057_100009861125 [0,0,0,1,0,0|2,0,1]=4 10808 B13R1.84 CCCOCC1CCCCN1CC 34a_100000225091_100000210303 [0,0,0,1,0,0|3,0,0]=4 10809 B13R1.84 CCCOCC1CCCCN1CC 7a_100000225091_100000210303 [0,0,0,1,0,0|3,0,0]=4 10810 B13R1.84 CCN1CCCCC1CCCOC 2230a_100011804088_100000210202 [0,0,0,1,0,0|3,0,0]=4 10811 B13R1.84 CCN1CCCCC1CCCOC 269982a_100011804088_100000204670 [0,0,0,1,0,0|3,0,0]=4 10812 B13R1.84 CCN1CCCCC1CCCOC 34a_100011804088_100000210202 [0,0,0,1,0,0|3,0,0]=4 10813 B13R1.84 CCN1CCCCC1CNCCF 2230a_100000754393_100011217306 [0,0,0,1,0,0|3,0,0]=4 10814 B13R1.84 CCN1CCCCC1CNCCF 34a_100000754393_100011217306 [0,0,0,1,0,0|3,0,0]=4 10815 B13R1.84 CCN1CCCCC1CNCCO 2230a_100000754393_100000211926 [0,0,0,1,0,0|2,0,0]=3 10816 B13R1.84 CCN1CCCCC1CNCCO 34a_100000754393_100000211926 [0,0,0,1,0,0|2,0,0]=3 10817 B13R1.84 CCN1CCCCC1COCCF 34a_100000225091_100011217306 [0,0,0,1,0,0|3,0,0]=4 10818 B13R1.84 CCN1CCCCC1COCCF 7a_100000225091_100011217306 [0,0,0,1,0,0|3,0,0]=4 10819 B13R1.84 CCN1CCCCC1COCCO 34a_100000225091_100000211926 [0,0,0,1,0,0|2,0,0]=3 10820 B13R1.84 CCN1CCCCC1COCCO 7a_100000225091_100000211926 [0,0,0,1,0,0|2,0,0]=3 10821 B13R1.84 CCNCCN1CCCCC1CC 2230a_100000755458_100000210202 [0,0,0,1,0,0|3,0,0]=4 10822 B13R1.84 CCNCCN1CCCCC1CC 34a_100000755458_100000210202 [0,0,0,1,0,0|3,0,0]=4 10823 B13R1.84 CCNCCN1CCCCC1CO 2230a_100011473795_100000210202 [0,0,0,1,0,0|2,0,0]=3 10824 B13R1.84 CCNCCN1CCCCC1CO 34a_100011473795_100000210202 [0,0,0,1,0,0|2,0,0]=3 10825 B13R1.84 CCOCCN1CCCCC1CC 2230a_100000210034_100011215890 [0,0,0,1,0,0|3,0,0]=4 10826 B13R1.84 CCOCCN1CCCCC1CC 269982a_100000210034_100011215890 [0,0,0,1,0,0|3,0,0]=4 10827 B13R1.84 CCOCCN1CCCCC1CC 34a_100000210034_100000210147 [0,0,0,1,0,0|3,0,0]=4 10828 B13R1.84 CCOCCN1CCCCC1CO 2230a_100000210821_100011215890 [0,0,0,1,0,0|2,0,0]=3 10829 B13R1.84 CCOCCN1CCCCC1CO 269982a_100000210821_100011215890 [0,0,0,1,0,0|2,0,0]=3 10830 B13R1.84 CCOCCN1CCCCC1CO 34a_100000210821_100000210147 [0,0,0,1,0,0|2,0,0]=3 10831 B13R1.84 CCOCCN1CCOC[C@H]1CO 2230a_100000717676_100011215890 [0,0,0,1,0,0|3,0,0]=4 10832 B13R1.84 CCOCCN1CCOC[C@H]1CO 269982a_100000717676_100011215890 [0,0,0,1,0,0|3,0,0]=4 10833 B13R1.84 CCOCCN1CCOC[C@H]1CO 34a_100000717676_100000210147 [0,0,0,1,0,0|3,0,0]=4 10834 B13R1.84 CCSCCN1CCCCC1CC 2230a_100000210034_100000757381 [0,0,0,1,0,0|3,0,0]=4 10835 B13R1.84 CCSCCN1CCCCC1CC 269982a_100000210034_100000757381 [0,0,0,1,0,0|3,0,0]=4 10836 B13R1.84 CCSCCN1CCCCC1CC 34a_100000210034_100000757381 [0,0,0,1,0,0|3,0,0]=4 10837 B13R1.84 CCSCCN1CCCCC1CO 2230a_100000210821_100000757381 [0,0,0,1,0,0|2,0,0]=3 10838 B13R1.84 CCSCCN1CCCCC1CO 269982a_100000210821_100000757381 [0,0,0,1,0,0|2,0,0]=3 10839 B13R1.84 CCSCCN1CCCCC1CO 34a_100000210821_100000757381 [0,0,0,1,0,0|2,0,0]=3 10840 B13R1.84 CCSCCN1CCOC[C@H]1CO 2230a_100000717676_100000757381 [0,0,0,1,0,0|3,0,0]=4 10841 B13R1.84 CCSCCN1CCOC[C@H]1CO 269982a_100000717676_100000757381 [0,0,0,1,0,0|3,0,0]=4 10842 B13R1.84 CCSCCN1CCOC[C@H]1CO 34a_100000717676_100000757381 [0,0,0,1,0,0|3,0,0]=4 10843 B13R1.84 CC[C@H]1COCCN1CCCCF 2230a_100016988097_100000729493 [0,0,0,1,0,0|3,0,0]=4 10844 B13R1.84 CC[C@H]1COCCN1CCCCF 269982a_100016988097_100000729493 [0,0,0,1,0,0|3,0,0]=4 10845 B13R1.84 CC[C@H]1COCCN1CCCCF 34a_100016988097_100000729493 [0,0,0,1,0,0|3,0,0]=4 10846 B13R1.84 CC[C@H]1COCCN1CCCCO 2230a_100016988097_100000210776 [0,0,0,1,0,0|2,0,0]=3 10847 B13R1.84 CC[C@H]1COCCN1CCCCO 269982a_100016988097_100000210776 [0,0,0,1,0,0|2,0,0]=3 10848 B13R1.84 CC[C@H]1COCCN1CCCCO 34a_100016988097_100011216708 [0,0,0,1,0,0|2,0,0]=3 10849 B13R1.84 CNCCCN1CCCCC1CO 34a_200011473794_200000210301 [0,0,0,1,0,0|2,0,0]=3 10850 B13R1.84 CN[C@@H]1CCCC[C@H]1OCCCF 34a_100000708425_100011934791 [0,0,0,1,0,0|3,0,0]=4 10851 B13R1.84 CN[C@@H]1CCCC[C@H]1OCCCO 34a_100000708425_100000230001 [0,0,0,1,0,0|2,0,0]=3 10852 B13R1.84 COC1CCCCC1NCCCF 270004a_100015189416_100000740605 [0,0,0,1,0,0|3,0,0]=4 10853 B13R1.84 COC1CCCCC1NCCCF 34a_100011208099_100011934791 [0,0,0,1,0,0|3,0,0]=4 10854 B13R1.84 COC1CCCCC1NCCCO 270004a_100000182051_100000740605 [0,0,0,1,0,0|2,0,0]=3 10855 B13R1.84 COC1CCCCC1NCCCO 34a_100011208099_100000230001 [0,0,0,1,0,0|2,0,0]=3 10856 B13R1.84 COC1COCCC1NCCCO 270004a_100000182051_100000095984 [0,0,0,1,0,0|3,0,0]=4 10857 B13R1.84 COCCCC1CCCCN1CF 269982a_100011804088_100015361967 [0,0,0,1,0,0|3,0,0]=4 10858 B13R1.84 COCCCC1CCCCN1CF 34a_100011804088_100015361967 [0,0,0,1,0,0|3,0,0]=4 10859 B13R1.84 COCCCN1CCCCC1CO 2230a_100000210821_100000740836 [0,0,0,1,0,0|2,0,0]=3 10860 B13R1.84 COCCCN1CCCCC1CO 269982a_100000210821_100000740836 [0,0,0,1,0,0|2,0,0]=3 10861 B13R1.84 COCCCN1CCCCC1CO 34a_100000210821_100000740836 [0,0,0,1,0,0|2,0,0]=3 10862 B13R1.84 COCCCN1CCOC[C@H]1CO 2230a_100000717676_100000740836 [0,0,0,1,0,0|3,0,0]=4 10863 B13R1.84 COCCCN1CCOC[C@H]1CO 269982a_100000717676_100000740836 [0,0,0,1,0,0|3,0,0]=4 10864 B13R1.84 COCCCN1CCOC[C@H]1CO 34a_100000717676_100000740836 [0,0,0,1,0,0|3,0,0]=4 10865 B13R1.84 COCCNC1CCCCC1CO 270004a_100000209980_100009861125 [0,0,0,1,0,0|2,0,0]=3 10866 B13R1.84 COCCNC1CCOCC1CO 2230a_214813039666_100011201679 [0,0,0,1,0,0|3,0,0]=4 10867 B13R1.84 COCCNC1CCOCC1CO 34a_214813039666_100011201679 [0,0,0,1,0,0|3,0,0]=4 10868 B13R1.84 COCCOC1CCCCC1CN 34a_100011216029_100011201679 [0,0,0,1,0,0|3,0,0]=4 10869 B13R1.84 CO[C@H]1CCCC[C@@H]1OCCCF 34a_200009815850_100011934791 [0,0,0,1,0,0|3,0,0]=4 10870 B13R1.84 CO[C@H]1CCCC[C@@H]1OCCCF 7a_200009815850_100011934791 [0,0,0,1,0,0|3,0,0]=4 10871 B13R1.84 CO[C@H]1CCCC[C@@H]1OCCCO 34a_200009815850_100000230001 [0,0,0,1,0,0|2,0,0]=3 10872 B13R1.84 CO[C@H]1CCCC[C@@H]1OCCCO 7a_200009815850_100011215043 [0,0,0,1,0,0|2,0,0]=3 10873 B13R1.84 CSCCNC1CCCCC1CO 270004a_100020590264_100009861125 [0,0,0,1,0,0|2,0,0]=3 10874 B13R1.84 CSCCNC1CCOCC1CO 2230a_214813039666_100000751147 [0,0,0,1,0,0|3,0,0]=4 10875 B13R1.84 CSCCNC1CCOCC1CO 34a_214813039666_100000212216 [0,0,0,1,0,0|3,0,0]=4 10876 B13R1.84 CSCCOC1CCCCC1CN 34a_100011216029_100000212216 [0,0,0,1,0,0|3,0,0]=4 10877 B13R1.84 N#CC1CCCCN1CCCCO 34a_100016989756_100011216708 [0,0,0,1,0,0|2,0,1]=4 10878 B13R1.84 N#CCCCN1CCCCC1CO 2230a_100000210821_100000687738 [0,0,0,1,0,0|2,0,1]=4 10879 B13R1.84 N#CCCCN1CCCCC1CO 269982a_100000210821_100000687738 [0,0,0,1,0,0|2,0,1]=4 10880 B13R1.84 N#CCCNC1CCCCC1CO 270004a_100000720768_100009861125 [0,0,0,1,0,0|2,0,1]=4 10881 B13R1.84 NCC1CCCCC1OCCCF 34a_100011216029_100011934791 [0,0,0,1,0,0|3,0,0]=4 10882 B13R1.84 NCC1CCCCC1OCCCO 34a_100011216029_100000230001 [0,0,0,1,0,0|2,0,0]=3 10883 B13R1.84 O=CCCCN1CCCCC1CO 2230a_100000210821_200011292268 [0,0,0,1,0,0|2,0,1]=4 10884 B13R1.84 O=CCCCN1CCCCC1CO 269982a_100000210821_200011292268 [0,0,0,1,0,0|2,0,1]=4 10885 B13R1.84 OCC1CCCCC1NCCCF 270004a_100015189416_100009861125 [0,0,0,1,0,0|2,0,0]=3 10886 B13R1.84 OCC1CCCCN1CCCCF 2230a_100000210821_100000729493 [0,0,0,1,0,0|2,0,0]=3 10887 B13R1.84 OCC1CCCCN1CCCCF 269982a_100000210821_100000729493 [0,0,0,1,0,0|2,0,0]=3 10888 B13R1.84 OCC1CCCCN1CCCCF 34a_100000210821_100000729493 [0,0,0,1,0,0|2,0,0]=3 10889 B13R1.84 OCC1CCCCN1CCNCF 34a_100011473795_100015361967 [0,0,0,1,0,0|3,0,0]=4 10890 B13R1.84 OCC1COCCC1NCCCF 2230a_214813039666_100011934791 [0,0,0,1,0,0|3,0,0]=4 10891 B13R1.84 OCC1COCCC1NCCCF 34a_214813039666_100011934791 [0,0,0,1,0,0|3,0,0]=4 10892 B13R1.84 OCCCCN1CCCCC1CO 2230a_100000210821_100000210776 [0,0,0,1,0,0|2,0,0]=3 10893 B13R1.84 OCCCCN1CCCCC1CO 269982a_100000210821_100000210776 [0,0,0,1,0,0|2,0,0]=3 10894 B13R1.84 OCCCCN1CCCCC1CO 34a_100000210821_100011216708 [0,0,0,1,0,0|2,0,0]=3 10895 B13R1.84 OCCCCN1CCOC[C@H]1CO 2230a_100000717676_100000210776 [0,0,0,1,0,0|3,0,0]=4 10896 B13R1.84 OCCCCN1CCOC[C@H]1CO 269982a_100000717676_100000210776 [0,0,0,1,0,0|3,0,0]=4 10897 B13R1.84 OCCCCN1CCOC[C@H]1CO 34a_100000717676_100011216708 [0,0,0,1,0,0|3,0,0]=4 10898 B13R1.84 OCCCNC1CCCCC1CO 270004a_100000182051_100009861125 [0,0,0,1,0,0|2,0,0]=3 10899 B13R1.84 OCCCNC1CCOCC1CO 2230a_214813039666_100000230001 [0,0,0,1,0,0|3,0,0]=4 10900 B13R1.84 OCCCNC1CCOCC1CO 34a_214813039666_100000230001 [0,0,0,1,0,0|3,0,0]=4 10901 B13R1.84 OC[C@@H]1COCCN1CCCCF 2230a_100000717676_100000729493 [0,0,0,1,0,0|3,0,0]=4 10902 B13R1.84 OC[C@@H]1COCCN1CCCCF 269982a_100000717676_100000729493 [0,0,0,1,0,0|3,0,0]=4 10903 B13R1.84 OC[C@@H]1COCCN1CCCCF 34a_100000717676_100000729493 [0,0,0,1,0,0|3,0,0]=4 10904 B13R1.84 [13CH3]NCCCN1CCCCC1CO 34a_200011473794_200025704644 [0,0,0,1,0,0|2,0,0]=3 10905 B13R1.119 BrCCCCCCOC1CCCC1 34a_100011215345_100000179811 [0,0,0,1,0,0|2,0,0]=3 10906 B13R1.119 BrCCCCCCOC1CCCC1 7a_100011215345_100000179811 [0,0,0,1,0,0|2,0,0]=3 10907 B13R1.119 BrCCCCCCOC1CCOC1 34a_100011215345_100000690089 [0,0,0,1,0,0|3,0,0]=4 10908 B13R1.119 BrCCCCCCOC1CCOC1 7a_100011215345_100000731011 [0,0,0,1,0,0|3,0,0]=4 10909 B13R1.119 BrCCCCCOCC1CCCC1 34a_100000746331_100000740388 [0,0,0,1,0,0|2,0,0]=3 10910 B13R1.119 BrCCCCCOCC1CCCC1 7a_100000746331_100000740388 [0,0,0,1,0,0|2,0,0]=3 10911 B13R1.119 BrCCCCCOCC1CCCO1 7a_100000746331_100000203698 [0,0,0,1,0,0|2,0,0]=3 10912 B13R1.119 BrCCCCCOCC1CCOC1 34a_100000746331_100011261433 [0,0,0,1,0,0|3,0,0]=4 10913 B13R1.119 BrCCCCCOCC1CCOC1 7a_100000746331_100000702531 [0,0,0,1,0,0|3,0,0]=4 10914 B13R1.119 BrCCCCCOCC1OCCO1 34a_100000746331_100000755774 [0,0,0,1,0,0|3,0,0]=4 10915 B13R1.119 BrCCCCCOCC1OCCO1 7a_100000746331_100000755774 [0,0,0,1,0,0|3,0,0]=4 10916 B13R1.119 BrCCCCOCCC1CCCC1 34a_100011216708_100000760354 [0,0,0,1,0,0|2,0,0]=3 10917 B13R1.119 BrCCCCOCCC1OCCO1 34a_100011216708_100000740749 [0,0,0,1,0,0|3,0,0]=4 10918 B13R1.119 BrCCCOCCCC1CCCC1 34a_100011217188_100011713738 [0,0,0,1,0,0|2,0,0]=3 10919 B13R1.119 BrCCCOCCCC1OCCO1 34a_100011217188_100009861162 [0,0,0,1,0,0|3,0,0]=4 10920 B13R1.119 BrCCCOCCCN1CCCC1 34a_100011217188_100016991639 [0,0,0,1,0,0|3,0,0]=4 10921 B13R1.119 BrCCOCCCCC1OCCO1 34a_100000211926_200009813554 [0,0,0,1,0,0|3,0,0]=4 10922 B13R1.119 BrCCOCCOCC1CCCC1 34a_100000692535_100000740388 [0,0,0,1,0,0|3,0,0]=4 10923 B13R1.119 BrCCOCCOCC1CCCC1 7a_100000692535_100000740388 [0,0,0,1,0,0|3,0,0]=4 10924 B13R1.119 BrCCOCCOCC1CCCO1 7a_100000692535_100000203698 [0,0,0,1,0,0|3,0,0]=4 10925 B13R1.119 C#CCCCCCCN1CCCC1 2230a_100000188435_100012276617 [0,0,0,1,0,0|2,0,1]=4 10926 B13R1.119 C#CCCCCCCN1CCCC1 269982a_100000188435_100012276617 [0,0,0,1,0,0|2,0,1]=4 10927 B13R1.119 C#CCCCCCNC1CCCC1 2230a_100000211070_100012094781 [0,0,0,1,0,0|2,0,1]=4 10928 B13R1.119 C#CCCCCCNC1CCCC1 34a_100000211070_100012094781 [0,0,0,1,0,0|2,0,1]=4 10929 B13R1.119 C#CCCCCCOC1CCCC1 34a_100000210269_100012094781 [0,0,0,1,0,0|2,0,1]=4 10930 B13R1.119 C#CCCCCCOC1CCCC1 34a_100000766912_100000179811 [0,0,0,1,0,0|2,0,1]=4 10931 B13R1.119 C#CCCCCCOC1CCCC1 7a_100000210269_100012094781 [0,0,0,1,0,0|2,0,1]=4 10932 B13R1.119 C#CCCCCCOC1CCCC1 7a_100000766912_100000179811 [0,0,0,1,0,0|2,0,1]=4 10933 B13R1.119 C#CCCCCCOC1CCCO1 34a_100000085407_100012094781 [0,0,0,1,0,0|1,0,2]=4 10934 B13R1.119 C#CCCCCCSC1CCCC1 62a_100011217020_100012094781 [0,0,0,1,0,0|2,0,1]=4 10935 B13R1.119 C#CCCCCCSC1CCCC1 62a_100012094781_100000179811 [0,0,0,1,0,0|2,0,1]=4 10936 B13R1.119 C#CCCCCNCC1CCCC1 2230a_100000706060_100000740388 [0,0,0,1,0,0|2,0,1]=4 10937 B13R1.119 C#CCCCCNCC1CCCC1 2230a_100000737975_100010269958 [0,0,0,1,0,0|2,0,1]=4 10938 B13R1.119 C#CCCCCNCC1CCCC1 34a_100000706060_100000740388 [0,0,0,1,0,0|2,0,1]=4 10939 B13R1.119 C#CCCCCNCC1CCCC1 34a_100000737975_100010269958 [0,0,0,1,0,0|2,0,1]=4 10940 B13R1.119 C#CCCCCNCC1CCCO1 2230a_100000706060_100000203698 [0,0,0,1,0,0|1,0,2]=4 10941 B13R1.119 C#CCCCCNC[C@@H]1CCCO1 2230a_100020590478_100010269958 [0,0,0,1,0,0|1,0,2]=4 10942 B13R1.119 C#CCCCCNC[C@@H]1CCCO1 34a_100020590478_100010269958 [0,0,0,1,0,0|1,0,2]=4 10943 B13R1.119 C#CCCCCOCC1CCCC1 34a_100000742336_100010269958 [0,0,0,1,0,0|2,0,1]=4 10944 B13R1.119 C#CCCCCOCC1CCCC1 34a_100000766709_100000740388 [0,0,0,1,0,0|2,0,1]=4 10945 B13R1.119 C#CCCCCOCC1CCCC1 7a_100000742336_100010269958 [0,0,0,1,0,0|2,0,1]=4 10946 B13R1.119 C#CCCCCOCC1CCCC1 7a_100000766709_100000740388 [0,0,0,1,0,0|2,0,1]=4 10947 B13R1.119 C#CCCCCOCC1CCCO1 34a_100000210270_100010269958 [0,0,0,1,0,0|1,0,2]=4 10948 B13R1.119 C#CCCCCOCC1CCCO1 7a_100000210270_100010269958 [0,0,0,1,0,0|1,0,2]=4 10949 B13R1.119 C#CCCCCOCC1CCCO1 7a_100000766709_100000203698 [0,0,0,1,0,0|1,0,2]=4 10950 B13R1.119 C#CCCCCSCC1CCCC1 62a_100000740388_100010269958 [0,0,0,1,0,0|2,0,1]=4 10951 B13R1.119 C#CCCCCSCC1CCCC1 62a_100010269958_100000740388 [0,0,0,1,0,0|2,0,1]=4 10952 B13R1.119 C#CCCCCSCC1CCCO1 62a_100000203698_100010269958 [0,0,0,1,0,0|1,0,2]=4 10953 B13R1.119 C#CCCCCSCC1CCCO1 62a_100010269958_100000203698 [0,0,0,1,0,0|1,0,2]=4 10954 B13R1.119 C#CCCCNCCC1CCCC1 2230a_100000739158_100000731252 [0,0,0,1,0,0|2,0,1]=4 10955 B13R1.119 C#CCCCNCCC1CCCC1 34a_100000718082_100000760354 [0,0,0,1,0,0|2,0,1]=4 10956 B13R1.119 C#CCCCNCCC1CCCC1 34a_100000739158_100000695029 [0,0,0,1,0,0|2,0,1]=4 10957 B13R1.119 C#CCCCOCCC1CCCC1 34a_100000215630_100000760354 [0,0,0,1,0,0|2,0,1]=4 10958 B13R1.119 C#CCCCOCCC1CCCC1 34a_100000749090_100000695029 [0,0,0,1,0,0|2,0,1]=4 10959 B13R1.119 C#CCCCOCCC1CCCC1 7a_100000215630_100000760354 [0,0,0,1,0,0|2,0,1]=4 10960 B13R1.119 C#CCCCOCCC1CCCC1 7a_100000749090_100011215417 [0,0,0,1,0,0|2,0,1]=4 10961 B13R1.119 C#CCCCSCCC1CCCC1 62a_100000760354_100011215417 [0,0,0,1,0,0|2,0,1]=4 10962 B13R1.119 C#CCCCSCCC1CCCC1 62a_100011215417_100000760354 [0,0,0,1,0,0|2,0,1]=4 10963 B13R1.119 C#CCCNCCCC1CCCC1 2230a_100000736752_100000688953 [0,0,0,1,0,0|2,0,1]=4 10964 B13R1.119 C#CCCNCCCC1CCCC1 34a_100000736752_100000688953 [0,0,0,1,0,0|2,0,1]=4 10965 B13R1.119 C#CCCNCCCC1CCCC1 34a_100000755551_100011713738 [0,0,0,1,0,0|2,0,1]=4 10966 B13R1.119 C#CCCOCCCC1CCCC1 34a_100011215328_100000688953 [0,0,0,1,0,0|2,0,1]=4 10967 B13R1.119 C#CCCOCCCC1CCCC1 34a_100011215631_100011713738 [0,0,0,1,0,0|2,0,1]=4 10968 B13R1.119 C#CCCOCCCC1CCCC1 7a_100011215328_100000688953 [0,0,0,1,0,0|2,0,1]=4 10969 B13R1.119 C#CCCSCCCC1CCCC1 62a_100000688953_100011713738 [0,0,0,1,0,0|2,0,1]=4 10970 B13R1.119 C#CCCSCCCC1CCCC1 62a_100011713738_100000688953 [0,0,0,1,0,0|2,0,1]=4 10971 B13R1.119 C=CCCCCCCN1CCCC1 2230a_100000188435_100011215473 [0,0,0,1,0,0|2,0,1]=4 10972 B13R1.119 C=CCCCCCCN1CCCC1 269982a_100000188435_100011215473 [0,0,0,1,0,0|2,0,1]=4 10973 B13R1.119 C=CCCCCCNC1CCCC1 2230a_100000211070_100000700193 [0,0,0,1,0,0|2,0,1]=4 10974 B13R1.119 C=CCCCCCNC1CCCC1 34a_100000211070_100000700193 [0,0,0,1,0,0|2,0,1]=4 10975 B13R1.119 C=CCCCCCOC1CCCC1 34a_100000210269_100000700193 [0,0,0,1,0,0|2,0,1]=4 10976 B13R1.119 C=CCCCCCOC1CCCC1 34a_100011216702_100000179811 [0,0,0,1,0,0|2,0,1]=4 10977 B13R1.119 C=CCCCCCOC1CCCC1 7a_100000210269_100000700193 [0,0,0,1,0,0|2,0,1]=4 10978 B13R1.119 C=CCCCCCOC1CCCC1 7a_100011216702_100000179811 [0,0,0,1,0,0|2,0,1]=4 10979 B13R1.119 C=CCCCCCOC1CCCO1 34a_100000085407_100000700193 [0,0,0,1,0,0|1,0,2]=4 10980 B13R1.119 C=CCCCCCSC1CCCC1 62a_100000700193_100000179811 [0,0,0,1,0,0|2,0,1]=4 10981 B13R1.119 C=CCCCCCSC1CCCC1 62a_100011217020_100000700193 [0,0,0,1,0,0|2,0,1]=4 10982 B13R1.119 C=CCCCCNCC1CCCC1 2230a_100000703577_100000740388 [0,0,0,1,0,0|2,0,1]=4 10983 B13R1.119 C=CCCCCNCC1CCCC1 2230a_100000737975_100011215482 [0,0,0,1,0,0|2,0,1]=4 10984 B13R1.119 C=CCCCCNCC1CCCC1 269862a_100000703577_100000746403 [0,0,0,1,0,0|2,0,1]=4 10985 B13R1.119 C=CCCCCNCC1CCCC1 34a_100000703577_100000740388 [0,0,0,1,0,0|2,0,1]=4 10986 B13R1.119 C=CCCCCNCC1CCCC1 34a_100000737975_100011215482 [0,0,0,1,0,0|2,0,1]=4 10987 B13R1.119 C=CCCCCNCC1CCCO1 2230a_100000703577_100000203698 [0,0,0,1,0,0|1,0,2]=4 10988 B13R1.119 C=CCCCCNC[C@@H]1CCCO1 2230a_100020590478_100011215482 [0,0,0,1,0,0|1,0,2]=4 10989 B13R1.119 C=CCCCCNC[C@@H]1CCCO1 34a_100020590478_100011215482 [0,0,0,1,0,0|1,0,2]=4 10990 B13R1.119 C=CCCCCOCC1CCCC1 34a_100000742336_100011215482 [0,0,0,1,0,0|2,0,1]=4 10991 B13R1.119 C=CCCCCOCC1CCCC1 34a_100000766645_100000740388 [0,0,0,1,0,0|2,0,1]=4 10992 B13R1.119 C=CCCCCOCC1CCCC1 7a_100000742336_100011215482 [0,0,0,1,0,0|2,0,1]=4 10993 B13R1.119 C=CCCCCOCC1CCCC1 7a_100000766645_100000740388 [0,0,0,1,0,0|2,0,1]=4 10994 B13R1.119 C=CCCCCOCC1CCCO1 34a_100000210270_100011215482 [0,0,0,1,0,0|1,0,2]=4 10995 B13R1.119 C=CCCCCOCC1CCCO1 7a_100000210270_100011215482 [0,0,0,1,0,0|1,0,2]=4 10996 B13R1.119 C=CCCCCOCC1CCCO1 7a_100000766645_100000203698 [0,0,0,1,0,0|1,0,2]=4 10997 B13R1.119 C=CCCCCSCC1CCCC1 62a_100000740388_100011215482 [0,0,0,1,0,0|2,0,1]=4 10998 B13R1.119 C=CCCCCSCC1CCCC1 62a_100011215482_100000740388 [0,0,0,1,0,0|2,0,1]=4 10999 B13R1.119 C=CCCCCSCC1CCCO1 62a_100000203698_100011215482 [0,0,0,1,0,0|1,0,2]=4 11000 B13R1.119 C=CCCCCSCC1CCCO1 62a_100011215482_100000203698 [0,0,0,1,0,0|1,0,2]=4 11001 B13R1.119 C=CCCCNCCC1CCCC1 2230a_100000700776_100000760354 [0,0,0,1,0,0|2,0,1]=4 11002 B13R1.119 C=CCCCNCCC1CCCC1 2230a_100000739158_100011713584 [0,0,0,1,0,0|2,0,1]=4 11003 B13R1.119 C=CCCCNCCC1CCCC1 34a_100000700776_100000760354 [0,0,0,1,0,0|2,0,1]=4 11004 B13R1.119 C=CCCCNCCC1CCCC1 34a_100000739158_100000757094 [0,0,0,1,0,0|2,0,1]=4 11005 B13R1.119 C=CCCCOCCC1CCCC1 34a_100000749090_100000757094 [0,0,0,1,0,0|2,0,1]=4 11006 B13R1.119 C=CCCCOCCC1CCCC1 34a_100000758997_100000760354 [0,0,0,1,0,0|2,0,1]=4 11007 B13R1.119 C=CCCCOCCC1CCCC1 7a_100000749090_100000757094 [0,0,0,1,0,0|2,0,1]=4 11008 B13R1.119 C=CCCCOCCC1CCCC1 7a_100000758997_100000760354 [0,0,0,1,0,0|2,0,1]=4 11009 B13R1.119 C=CCCCSCCC1CCCC1 62a_100000760354_100000757094 [0,0,0,1,0,0|2,0,1]=4 11010 B13R1.119 C=CCCCSCCC1CCCC1 62a_100011713584_100000760354 [0,0,0,1,0,0|2,0,1]=4 11011 B13R1.119 C=CCCNCCCC1CCCC1 2230a_100000736752_100000754431 [0,0,0,1,0,0|2,0,1]=4 11012 B13R1.119 C=CCCNCCCC1CCCC1 2230a_100015191253_100011713738 [0,0,0,1,0,0|2,0,1]=4 11013 B13R1.119 C=CCCNCCCC1CCCC1 34a_100000736752_100000754431 [0,0,0,1,0,0|2,0,1]=4 11014 B13R1.119 C=CCCOCCCC1CCCC1 34a_100011205117_100011713738 [0,0,0,1,0,0|2,0,1]=4 11015 B13R1.119 C=CCCOCCCC1CCCC1 34a_100011215328_100000754431 [0,0,0,1,0,0|2,0,1]=4 11016 B13R1.119 C=CCCOCCCC1CCCC1 7a_100011215328_100000754431 [0,0,0,1,0,0|2,0,1]=4 11017 B13R1.119 C=CCCSCCCC1CCCC1 62a_100000754431_100011713738 [0,0,0,1,0,0|2,0,1]=4 11018 B13R1.119 C=CCCSCCCC1CCCC1 62a_100011713738_100000754431 [0,0,0,1,0,0|2,0,1]=4 11019 B13R1.119 CC/C=C\CCNC[C@@H]1CCCO1 2230a_100020590478_100015370543 [0,0,0,1,0,0|1,0,2]=4 11020 B13R1.119 CC/C=C\CCNC[C@@H]1CCCO1 34a_100020590478_100015370543 [0,0,0,1,0,0|1,0,2]=4 11021 B13R1.119 CC/C=C\CCOCC1CCCO1 34a_100000210270_100015370543 [0,0,0,1,0,0|1,0,2]=4 11022 B13R1.119 CC/C=C\CCOCC1CCCO1 7a_100000210270_100015370543 [0,0,0,1,0,0|1,0,2]=4 11023 B13R1.119 CC/C=C\CCOCC1CCCO1 7a_100016288707_100000203698 [0,0,0,1,0,0|1,0,2]=4 11024 B13R1.119 CC/C=C\CCSCC1CCCO1 62a_100000203698_100015370543 [0,0,0,1,0,0|1,0,2]=4 11025 B13R1.119 CC/C=C\CCSCC1CCCO1 62a_100015370543_100000203698 [0,0,0,1,0,0|1,0,2]=4 11026 B13R1.119 CCC#CCCOCC1CCCO1 7a_100000036655_100000203698 [0,0,0,1,0,0|1,0,2]=4 11027 B13R1.119 CCC/C=C/COCC1CCCO1 7a_100016278788_100000203698 [0,0,0,1,0,0|1,0,2]=4 11028 B13R1.119 CCCC#CCOCC1CCCO1 7a_100000034806_100000203698 [0,0,0,1,0,0|1,0,2]=4 11029 B13R1.119 CCCCCCCCN1CCCC1 2230a_100000188435_100000210759 [0,0,0,1,0,0|2,0,0]=3 11030 B13R1.119 CCCCCCCCN1CCCC1 269982a_100000188435_100000210759 [0,0,0,1,0,0|2,0,0]=3 11031 B13R1.119 CCCCCCCCN1CCSC1 2230a_100011215254_100000210759 [0,0,0,1,0,0|3,0,0]=4 11032 B13R1.119 CCCCCCCCN1CCSC1 269982a_100011215254_100000210759 [0,0,0,1,0,0|3,0,0]=4 11033 B13R1.119 CCCCCCCNC1CCCC1 2230a_100000211070_100000210681 [0,0,0,1,0,0|2,0,0]=3 11034 B13R1.119 CCCCCCCNC1CCCC1 2230a_100000229938_100000179811 [0,0,0,1,0,0|2,0,0]=3 11035 B13R1.119 CCCCCCCNC1CCCC1 270004a_100000229938_100000210133 [0,0,0,1,0,0|2,0,0]=3 11036 B13R1.119 CCCCCCCNC1CCCC1 34a_100000211070_100000210614 [0,0,0,1,0,0|2,0,0]=3 11037 B13R1.119 CCCCCCCNC1CCOC1 2230a_100000229938_100000731011 [0,0,0,1,0,0|3,0,0]=4 11038 B13R1.119 CCCCCCCNC1CCOC1 270004a_100000229938_100000752484 [0,0,0,1,0,0|3,0,0]=4 11039 B13R1.119 CCCCCCCNC1CCSC1 270004a_100000229938_100000212027 [0,0,0,1,0,0|3,0,0]=4 11040 B13R1.119 CCCCCCCN[C@@H]1CCOC1 2230a_200015188469_100000210681 [0,0,0,1,0,0|3,0,0]=4 11041 B13R1.119 CCCCCCCN[C@H]1CCOC1 2230a_100015188467_100000210681 [0,0,0,1,0,0|3,0,0]=4 11042 B13R1.119 CCCCCCCN[C@H]1CCOC1 34a_100015188467_100000210614 [0,0,0,1,0,0|3,0,0]=4 11043 B13R1.119 CCCCCCCOC1CCCC1 34a_100000210269_100000210614 [0,0,0,1,0,0|2,0,0]=3 11044 B13R1.119 CCCCCCCOC1CCCC1 34a_100000210272_100000179811 [0,0,0,1,0,0|2,0,0]=3 11045 B13R1.119 CCCCCCCOC1CCCC1 7a_100000210269_100000210614 [0,0,0,1,0,0|2,0,0]=3 11046 B13R1.119 CCCCCCCOC1CCCC1 7a_100000210272_100000179811 [0,0,0,1,0,0|2,0,0]=3 11047 B13R1.119 CCCCCCCOC1CCCO1 34a_100000085407_100000210614 [0,0,0,1,0,0|1,0,0]=2 11048 B13R1.119 CCCCCCCOC1CCOC1 34a_100000210272_100000690089 [0,0,0,1,0,0|3,0,0]=4 11049 B13R1.119 CCCCCCCOC1CCOC1 7a_100000210272_100000731011 [0,0,0,1,0,0|3,0,0]=4 11050 B13R1.119 CCCCCCCOC1CCSC1 7a_100011232664_100000210614 [0,0,0,1,0,0|3,0,0]=4 11051 B13R1.119 CCCCCCCO[C@H]1CCOC1 34a_100000717292_100000210614 [0,0,0,1,0,0|3,0,0]=4 11052 B13R1.119 CCCCCCCSC1CCCC1 62a_100000210614_100000179811 [0,0,0,1,0,0|2,0,0]=3 11053 B13R1.119 CCCCCCCSC1CCCC1 62a_100011217020_100000210316 [0,0,0,1,0,0|2,0,0]=3 11054 B13R1.119 CCCCCCCSC1CCOC1 62a_100000210614_100000690089 [0,0,0,1,0,0|3,0,0]=4 11055 B13R1.119 CCCCCCNCC1CCCC1 2230a_100000210581_100000740388 [0,0,0,1,0,0|2,0,0]=3 11056 B13R1.119 CCCCCCNCC1CCCC1 2230a_100000737975_100000210314 [0,0,0,1,0,0|2,0,0]=3 11057 B13R1.119 CCCCCCNCC1CCCC1 269862a_100000210581_100000746403 [0,0,0,1,0,0|2,0,0]=3 11058 B13R1.119 CCCCCCNCC1CCCC1 34a_100000737975_100000210314 [0,0,0,1,0,0|2,0,0]=3 11059 B13R1.119 CCCCCCNCC1CCCO1 2230a_100000210581_100000203698 [0,0,0,1,0,0|1,0,0]=2 11060 B13R1.119 CCCCCCNCC1CCOC1 2230a_100000210581_100000702531 [0,0,0,1,0,0|3,0,0]=4 11061 B13R1.119 CCCCCCNCC1CCOC1 2230a_100000737293_100000210314 [0,0,0,1,0,0|3,0,0]=4 11062 B13R1.119 CCCCCCNCC1CCOC1 34a_100000737293_100000210314 [0,0,0,1,0,0|3,0,0]=4 11063 B13R1.119 CCCCCCNCC1OCCO1 2230a_100000036311_100000210314 [0,0,0,1,0,0|2,0,0]=3 11064 B13R1.119 CCCCCCNCC1OCCO1 2230a_100000210581_100000755774 [0,0,0,1,0,0|2,0,0]=3 11065 B13R1.119 CCCCCCNCC1OCCO1 34a_100000036311_100000210314 [0,0,0,1,0,0|2,0,0]=3 11066 B13R1.119 CCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210314 [0,0,0,1,0,0|1,0,0]=2 11067 B13R1.119 CCCCCCNC[C@@H]1CCCO1 34a_100020590478_100000210314 [0,0,0,1,0,0|1,0,0]=2 11068 B13R1.119 CCCCCCOCC1CCCC1 34a_100000210259_100000740388 [0,0,0,1,0,0|2,0,0]=3 11069 B13R1.119 CCCCCCOCC1CCCC1 34a_100000742336_100000210314 [0,0,0,1,0,0|2,0,0]=3 11070 B13R1.119 CCCCCCOCC1CCCC1 7a_100000210259_100000740388 [0,0,0,1,0,0|2,0,0]=3 11071 B13R1.119 CCCCCCOCC1CCCC1 7a_100000742336_100000210314 [0,0,0,1,0,0|2,0,0]=3 11072 B13R1.119 CCCCCCOCC1CCCO1 34a_100000210270_100000210314 [0,0,0,1,0,0|1,0,0]=2 11073 B13R1.119 CCCCCCOCC1CCCO1 7a_100000210259_100000203698 [0,0,0,1,0,0|1,0,0]=2 11074 B13R1.119 CCCCCCOCC1CCCO1 7a_100000210270_100000210314 [0,0,0,1,0,0|1,0,0]=2 11075 B13R1.119 CCCCCCOCC1CCNC1 34a_100000748654_100000210314 [0,0,0,1,0,0|3,0,0]=4 11076 B13R1.119 CCCCCCOCC1CCOC1 34a_100000210259_100011261433 [0,0,0,1,0,0|3,0,0]=4 11077 B13R1.119 CCCCCCOCC1CCOC1 34a_100000740260_100000210314 [0,0,0,1,0,0|3,0,0]=4 11078 B13R1.119 CCCCCCOCC1CCOC1 7a_100000210259_100000702531 [0,0,0,1,0,0|3,0,0]=4 11079 B13R1.119 CCCCCCOCC1COCO1 34a_100011216627_100000210314 [0,0,0,1,0,0|2,0,0]=3 11080 B13R1.119 CCCCCCOCC1OCCO1 34a_100000087154_100000210314 [0,0,0,1,0,0|2,0,0]=3 11081 B13R1.119 CCCCCCOCC1OCCO1 34a_100000210259_100000755774 [0,0,0,1,0,0|2,0,0]=3 11082 B13R1.119 CCCCCCOCC1OCCO1 7a_100000210259_100000755774 [0,0,0,1,0,0|2,0,0]=3 11083 B13R1.119 CCCCCCOC[C@H]1CCCN1 34a_100000745186_100000210314 [0,0,0,1,0,0|2,0,0]=3 11084 B13R1.119 CCCCCCSCC1CCCC1 62a_100000210314_100000740388 [0,0,0,1,0,0|2,0,0]=3 11085 B13R1.119 CCCCCCSCC1CCCC1 62a_100000740388_100000210757 [0,0,0,1,0,0|2,0,0]=3 11086 B13R1.119 CCCCCCSCC1CCCO1 62a_100000203698_100000210757 [0,0,0,1,0,0|1,0,0]=2 11087 B13R1.119 CCCCCCSCC1CCCO1 62a_100000210314_100000203698 [0,0,0,1,0,0|1,0,0]=2 11088 B13R1.119 CCCCCCSCC1CCOC1 62a_100000210314_100000702531 [0,0,0,1,0,0|3,0,0]=4 11089 B13R1.119 CCCCCCSCC1CCOC1 62a_100000702531_100000210757 [0,0,0,1,0,0|3,0,0]=4 11090 B13R1.119 CCCCCCSCC1OCCO1 62a_100000210314_100000755774 [0,0,0,1,0,0|2,0,0]=3 11091 B13R1.119 CCCCCCSCC1OCCO1 62a_100000755774_100000210757 [0,0,0,1,0,0|2,0,0]=3 11092 B13R1.119 CCCCCNCCC1CCCC1 2230a_100000209983_100000760354 [0,0,0,1,0,0|2,0,0]=3 11093 B13R1.119 CCCCCNCCC1CCCC1 2230a_100000739158_100000210326 [0,0,0,1,0,0|2,0,0]=3 11094 B13R1.119 CCCCCNCCC1CCCC1 34a_100000739158_100000718602 [0,0,0,1,0,0|2,0,0]=3 11095 B13R1.119 CCCCCNCCC1OCCO1 2230a_100000034215_100000210326 [0,0,0,1,0,0|2,0,0]=3 11096 B13R1.119 CCCCCNCCC1OCCO1 2230a_100000209983_100000740749 [0,0,0,1,0,0|2,0,0]=3 11097 B13R1.119 CCCCCNCCC1OCCO1 34a_100000034215_100000718602 [0,0,0,1,0,0|2,0,0]=3 11098 B13R1.119 CCCCCOCCC1CCCC1 34a_100000210253_100000760354 [0,0,0,1,0,0|2,0,0]=3 11099 B13R1.119 CCCCCOCCC1CCCC1 34a_100000749090_100000718602 [0,0,0,1,0,0|2,0,0]=3 11100 B13R1.119 CCCCCOCCC1CCCC1 7a_100000210253_100000760354 [0,0,0,1,0,0|2,0,0]=3 11101 B13R1.119 CCCCCOCCC1CCCC1 7a_100000749090_100000210326 [0,0,0,1,0,0|2,0,0]=3 11102 B13R1.119 CCCCCOCCC1CCNC1 34a_100016987287_100000718602 [0,0,0,1,0,0|3,0,0]=4 11103 B13R1.119 CCCCCOCCC1CCOC1 34a_100011879284_100000718602 [0,0,0,1,0,0|3,0,0]=4 11104 B13R1.119 CCCCCOCCC1OCCO1 34a_100000210253_100000740749 [0,0,0,1,0,0|2,0,0]=3 11105 B13R1.119 CCCCCOCCC1OCCO1 7a_100000210253_100000740749 [0,0,0,1,0,0|2,0,0]=3 11106 B13R1.119 CCCCCOCCN1CCCC1 7a_100000210253_100000004467 [0,0,0,1,0,0|3,0,0]=4 11107 B13R1.119 CCCCCSCCC1CCCC1 62a_100000210326_100000760354 [0,0,0,1,0,0|2,0,0]=3 11108 B13R1.119 CCCCCSCCC1CCCC1 62a_100000760354_100000210326 [0,0,0,1,0,0|2,0,0]=3 11109 B13R1.119 CCCCCSCCC1OCCO1 62a_100000210326_100000740749 [0,0,0,1,0,0|2,0,0]=3 11110 B13R1.119 CCCCCSCCN1CCCC1 62a_100000210326_100000004467 [0,0,0,1,0,0|3,0,0]=4 11111 B13R1.119 CCCCCSCCN1CCCC1 62a_100000700749_100000210326 [0,0,0,1,0,0|3,0,0]=4 11112 B13R1.119 CCCCNCCCC1CCCC1 2230a_100000102301_100011713738 [0,0,0,1,0,0|2,0,0]=3 11113 B13R1.119 CCCCNCCCC1CCCC1 2230a_100000736752_100000210211 [0,0,0,1,0,0|2,0,0]=3 11114 B13R1.119 CCCCNCCCC1CCCC1 34a_100000736752_100000210210 [0,0,0,1,0,0|2,0,0]=3 11115 B13R1.119 CCCCNCCCC1CCCC1 7a_106832991798_100011713738 [0,0,0,1,0,0|2,0,0]=3 11116 B13R1.119 CCCCNCCCC1OCCO1 2230a_100000102301_100000042513 [0,0,0,1,0,0|2,0,0]=3 11117 B13R1.119 CCCCNCCCC1OCCO1 7a_106832991798_100000042513 [0,0,0,1,0,0|2,0,0]=3 11118 B13R1.119 CCCCNCCCN1CCCC1 2230a_100000102301_100011445909 [0,0,0,1,0,0|3,0,0]=4 11119 B13R1.119 CCCCNCCCN1CCCC1 7a_106832991798_100011445909 [0,0,0,1,0,0|3,0,0]=4 11120 B13R1.119 CCCCNCCOC1CCCC1 34a_100000741755_100000210210 [0,0,0,1,0,0|3,0,0]=4 11121 B13R1.119 CCCCOCCCC1CCCC1 34a_100000210227_100011713738 [0,0,0,1,0,0|2,0,0]=3 11122 B13R1.119 CCCCOCCCC1CCCC1 34a_100011215328_100000210210 [0,0,0,1,0,0|2,0,0]=3 11123 B13R1.119 CCCCOCCCC1CCCC1 7a_100000210227_100011713738 [0,0,0,1,0,0|2,0,0]=3 11124 B13R1.119 CCCCOCCCC1CCCC1 7a_100011215328_100000210211 [0,0,0,1,0,0|2,0,0]=3 11125 B13R1.119 CCCCOCCCC1OCCO1 34a_100000210227_100009861162 [0,0,0,1,0,0|2,0,0]=3 11126 B13R1.119 CCCCOCCCC1OCCO1 34a_100009871617_100000210210 [0,0,0,1,0,0|2,0,0]=3 11127 B13R1.119 CCCCOCCCC1OCCO1 7a_100000210227_100000042513 [0,0,0,1,0,0|2,0,0]=3 11128 B13R1.119 CCCCOCCCC1OCCO1 7a_100009871617_100000210211 [0,0,0,1,0,0|2,0,0]=3 11129 B13R1.119 CCCCOCCCN1CCCC1 34a_100000210227_100016991639 [0,0,0,1,0,0|3,0,0]=4 11130 B13R1.119 CCCCOCCCN1CCCC1 7a_100000210227_100011445909 [0,0,0,1,0,0|3,0,0]=4 11131 B13R1.119 CCCCOCCNC1CCCC1 2230a_100000211070_100000743108 [0,0,0,1,0,0|3,0,0]=4 11132 B13R1.119 CCCCOCCNC1CCCC1 34a_100000211070_100000743108 [0,0,0,1,0,0|3,0,0]=4 11133 B13R1.119 CCCCOCCNC1CCCC1 34a_200000200444_100000210210 [0,0,0,1,0,0|3,0,0]=4 11134 B13R1.119 CCCCOCCOC1CCCC1 34a_100000210238_100000179811 [0,0,0,1,0,0|3,0,0]=4 11135 B13R1.119 CCCCOCCOC1CCCC1 34a_100000210269_100000743108 [0,0,0,1,0,0|3,0,0]=4 11136 B13R1.119 CCCCOCCOC1CCCC1 34a_100000738311_100000210210 [0,0,0,1,0,0|3,0,0]=4 11137 B13R1.119 CCCCOCCOC1CCCC1 7a_100000210238_100000179811 [0,0,0,1,0,0|3,0,0]=4 11138 B13R1.119 CCCCOCCOC1CCCC1 7a_100000210269_100000743108 [0,0,0,1,0,0|3,0,0]=4 11139 B13R1.119 CCCCOCCOC1CCCC1 7a_100000738311_100000210211 [0,0,0,1,0,0|3,0,0]=4 11140 B13R1.119 CCCCOCCOC1CCCO1 34a_100000085407_100000743108 [0,0,0,1,0,0|2,0,0]=3 11141 B13R1.119 CCCCOCCSC1CCCC1 62a_100000743108_100000179811 [0,0,0,1,0,0|3,0,0]=4 11142 B13R1.119 CCCCOCCSC1CCCC1 62a_100011217020_100000743108 [0,0,0,1,0,0|3,0,0]=4 11143 B13R1.119 CCCCOCNCC1CCCC1 2230a_100000737975_100011995733 [0,0,0,1,0,0|3,0,0]=4 11144 B13R1.119 CCCCOCNCC1CCCC1 34a_100000737975_100011995733 [0,0,0,1,0,0|3,0,0]=4 11145 B13R1.119 CCCCOCNCC1OCCO1 2230a_100000036311_100011995733 [0,0,0,1,0,0|3,0,0]=4 11146 B13R1.119 CCCCOCNCC1OCCO1 34a_100000036311_100011995733 [0,0,0,1,0,0|3,0,0]=4 11147 B13R1.119 CCCCOCNC[C@@H]1CCCO1 2230a_100020590478_100011995733 [0,0,0,1,0,0|2,0,0]=3 11148 B13R1.119 CCCCOCNC[C@@H]1CCCO1 34a_100020590478_100011995733 [0,0,0,1,0,0|2,0,0]=3 11149 B13R1.119 CCCCOCOCC1CCCC1 34a_100000742336_100011995733 [0,0,0,1,0,0|3,0,0]=4 11150 B13R1.119 CCCCOCOCC1CCCO1 34a_100000210270_100011995733 [0,0,0,1,0,0|2,0,0]=3 11151 B13R1.119 CCCCOCOCC1COCO1 34a_100011216627_100011995733 [0,0,0,1,0,0|3,0,0]=4 11152 B13R1.119 CCCCOCOCC1OCCO1 34a_100000087154_100011995733 [0,0,0,1,0,0|3,0,0]=4 11153 B13R1.119 CCCCOCOC[C@H]1CCCN1 34a_100000745186_100011995733 [0,0,0,1,0,0|3,0,0]=4 11154 B13R1.119 CCCCOCSCC1CCCC1 62a_100000740388_100011995733 [0,0,0,1,0,0|3,0,0]=4 11155 B13R1.119 CCCCOCSCC1CCCC1 62a_100011995733_100000740388 [0,0,0,1,0,0|3,0,0]=4 11156 B13R1.119 CCCCOCSCC1CCCO1 62a_100000203698_100011995733 [0,0,0,1,0,0|2,0,0]=3 11157 B13R1.119 CCCCOCSCC1CCCO1 62a_100011995733_100000203698 [0,0,0,1,0,0|2,0,0]=3 11158 B13R1.119 CCCCOCSCC1OCCO1 62a_100000755774_100011995733 [0,0,0,1,0,0|3,0,0]=4 11159 B13R1.119 CCCCOCSCC1OCCO1 62a_100011995733_100000755774 [0,0,0,1,0,0|3,0,0]=4 11160 B13R1.119 CCCCSCCCC1CCCC1 62a_100000210211_100011713738 [0,0,0,1,0,0|2,0,0]=3 11161 B13R1.119 CCCCSCCCC1CCCC1 62a_100011713738_100000210210 [0,0,0,1,0,0|2,0,0]=3 11162 B13R1.119 CCCCSCCCC1OCCO1 62a_100000210211_100000042513 [0,0,0,1,0,0|2,0,0]=3 11163 B13R1.119 CCCCSCCCN1CCCC1 62a_100000210211_100011445909 [0,0,0,1,0,0|3,0,0]=4 11164 B13R1.119 CCCCSCCCN1CCCC1 62a_100016991639_100000210210 [0,0,0,1,0,0|3,0,0]=4 11165 B13R1.119 CCCCSCCNC1CCCC1 2230a_100025743550_100000179811 [0,0,0,1,0,0|3,0,0]=4 11166 B13R1.119 CCCCSCCNC1CCCC1 270004a_100025743550_100000210133 [0,0,0,1,0,0|3,0,0]=4 11167 B13R1.119 CCCCSCCOC1CCCC1 34a_200000230436_100000179811 [0,0,0,1,0,0|3,0,0]=4 11168 B13R1.119 CCCCSCCOC1CCCC1 7a_200000230436_100000179811 [0,0,0,1,0,0|3,0,0]=4 11169 B13R1.119 CCCNCCCOC1CCCC1 34a_100000747560_100000210303 [0,0,0,1,0,0|3,0,0]=4 11170 B13R1.119 CCCOCCCCC1OCCO1 34a_100000210258_200009813554 [0,0,0,1,0,0|2,0,0]=3 11171 B13R1.119 CCCOCCCNC1CCCC1 2230a_100011217757_100000179811 [0,0,0,1,0,0|3,0,0]=4 11172 B13R1.119 CCCOCCCNC1CCCC1 270004a_100011217757_100000210133 [0,0,0,1,0,0|3,0,0]=4 11173 B13R1.119 CCCOCCCNC1CCCC1 34a_100011217757_100000179811 [0,0,0,1,0,0|3,0,0]=4 11174 B13R1.119 CCCOCCNCC1CCCC1 2230a_100000737975_100011215938 [0,0,0,1,0,0|3,0,0]=4 11175 B13R1.119 CCCOCCNCC1CCCC1 2230a_100161115042_100000740388 [0,0,0,1,0,0|3,0,0]=4 11176 B13R1.119 CCCOCCNCC1CCCC1 269862a_100161115042_100000746403 [0,0,0,1,0,0|3,0,0]=4 11177 B13R1.119 CCCOCCNCC1CCCC1 34a_100000737975_100011215938 [0,0,0,1,0,0|3,0,0]=4 11178 B13R1.119 CCCOCCNCC1CCCC1 34a_100161115042_100000740388 [0,0,0,1,0,0|3,0,0]=4 11179 B13R1.119 CCCOCCNCC1CCCO1 2230a_100161115042_100000203698 [0,0,0,1,0,0|2,0,0]=3 11180 B13R1.119 CCCOCCNCC1OCCO1 2230a_100000036311_100011215938 [0,0,0,1,0,0|3,0,0]=4 11181 B13R1.119 CCCOCCNCC1OCCO1 2230a_100161115042_100000755774 [0,0,0,1,0,0|3,0,0]=4 11182 B13R1.119 CCCOCCNCC1OCCO1 34a_100000036311_100011215938 [0,0,0,1,0,0|3,0,0]=4 11183 B13R1.119 CCCOCCNCC1OCCO1 34a_100161115042_100000755774 [0,0,0,1,0,0|3,0,0]=4 11184 B13R1.119 CCCOCCNC[C@@H]1CCCO1 2230a_100020590478_100011215938 [0,0,0,1,0,0|2,0,0]=3 11185 B13R1.119 CCCOCCNC[C@@H]1CCCO1 34a_100020590478_100011215938 [0,0,0,1,0,0|2,0,0]=3 11186 B13R1.119 CCCOCCOCC1CCCC1 34a_100000742336_100011215938 [0,0,0,1,0,0|3,0,0]=4 11187 B13R1.119 CCCOCCOCC1CCCC1 34a_100000752267_100000740388 [0,0,0,1,0,0|3,0,0]=4 11188 B13R1.119 CCCOCCOCC1CCCC1 7a_100000742336_100011215938 [0,0,0,1,0,0|3,0,0]=4 11189 B13R1.119 CCCOCCOCC1CCCC1 7a_100000752267_100000740388 [0,0,0,1,0,0|3,0,0]=4 11190 B13R1.119 CCCOCCOCC1CCCO1 34a_100000210270_100011215938 [0,0,0,1,0,0|2,0,0]=3 11191 B13R1.119 CCCOCCOCC1CCCO1 7a_100000210270_100011215938 [0,0,0,1,0,0|2,0,0]=3 11192 B13R1.119 CCCOCCOCC1CCCO1 7a_100000752267_100000203698 [0,0,0,1,0,0|2,0,0]=3 11193 B13R1.119 CCCOCCOCC1COCO1 34a_100011216627_100011215938 [0,0,0,1,0,0|3,0,0]=4 11194 B13R1.119 CCCOCCOCC1OCCO1 34a_100000087154_100011215938 [0,0,0,1,0,0|3,0,0]=4 11195 B13R1.119 CCCOCCOCC1OCCO1 34a_100000752267_100000755774 [0,0,0,1,0,0|3,0,0]=4 11196 B13R1.119 CCCOCCOCC1OCCO1 7a_100000752267_100000755774 [0,0,0,1,0,0|3,0,0]=4 11197 B13R1.119 CCCOCCOC[C@H]1CCCN1 34a_100000745186_100011215938 [0,0,0,1,0,0|3,0,0]=4 11198 B13R1.119 CCCOCCSCC1CCCC1 62a_100000740388_100011215938 [0,0,0,1,0,0|3,0,0]=4 11199 B13R1.119 CCCOCCSCC1CCCC1 62a_100011215938_100000740388 [0,0,0,1,0,0|3,0,0]=4 11200 B13R1.119 CCCOCCSCC1CCCO1 62a_100000203698_100011215938 [0,0,0,1,0,0|2,0,0]=3 11201 B13R1.119 CCCOCCSCC1CCCO1 62a_100011215938_100000203698 [0,0,0,1,0,0|2,0,0]=3 11202 B13R1.119 CCCOCCSCC1OCCO1 62a_100000755774_100011215938 [0,0,0,1,0,0|3,0,0]=4 11203 B13R1.119 CCCOCCSCC1OCCO1 62a_100011215938_100000755774 [0,0,0,1,0,0|3,0,0]=4 11204 B13R1.119 CCCSCCCCC1OCCO1 62a_100000210303_100000034956 [0,0,0,1,0,0|2,0,0]=3 11205 B13R1.119 CCCSCCNCC1CCCC1 2230a_100020603323_100000740388 [0,0,0,1,0,0|3,0,0]=4 11206 B13R1.119 CCCSCCNCC1CCCC1 269862a_100020603323_100000746403 [0,0,0,1,0,0|3,0,0]=4 11207 B13R1.119 CCCSCCNCC1CCCO1 2230a_100020603323_100000203698 [0,0,0,1,0,0|2,0,0]=3 11208 B13R1.119 CCCSCCNCC1OCCO1 2230a_100020603323_100000755774 [0,0,0,1,0,0|3,0,0]=4 11209 B13R1.119 CCCSCCOCC1CCCC1 34a_200000230433_100000740388 [0,0,0,1,0,0|3,0,0]=4 11210 B13R1.119 CCCSCCOCC1CCCC1 7a_200000230433_100000740388 [0,0,0,1,0,0|3,0,0]=4 11211 B13R1.119 CCCSCCOCC1CCCO1 7a_200000230433_100000203698 [0,0,0,1,0,0|2,0,0]=3 11212 B13R1.119 CCCSCCOCC1OCCO1 34a_200000230433_100000755774 [0,0,0,1,0,0|3,0,0]=4 11213 B13R1.119 CCCSCCOCC1OCCO1 7a_200000230433_100000755774 [0,0,0,1,0,0|3,0,0]=4 11214 B13R1.119 CCOCCCCOC1CCCO1 34a_100011018183_100000210202 [0,0,0,1,0,0|2,0,0]=3 11215 B13R1.119 CCOCCCCOC1CCCO1 7a_100011018183_100000210202 [0,0,0,1,0,0|2,0,0]=3 11216 B13R1.119 CCOCCCNCC1CCCC1 2230a_100000210961_100000740388 [0,0,0,1,0,0|3,0,0]=4 11217 B13R1.119 CCOCCCNCC1CCCC1 2230a_100000737975_100012232248 [0,0,0,1,0,0|3,0,0]=4 11218 B13R1.119 CCOCCCNCC1CCCC1 269862a_100000210961_100000746403 [0,0,0,1,0,0|3,0,0]=4 11219 B13R1.119 CCOCCCNCC1CCCC1 34a_100000210961_100000740388 [0,0,0,1,0,0|3,0,0]=4 11220 B13R1.119 CCOCCCNCC1CCCC1 34a_100000737975_100012232248 [0,0,0,1,0,0|3,0,0]=4 11221 B13R1.119 CCOCCCNCC1CCCO1 2230a_100000210961_100000203698 [0,0,0,1,0,0|2,0,0]=3 11222 B13R1.119 CCOCCCNCC1OCCO1 2230a_100000036311_100012232248 [0,0,0,1,0,0|3,0,0]=4 11223 B13R1.119 CCOCCCNCC1OCCO1 2230a_100000210961_100000755774 [0,0,0,1,0,0|3,0,0]=4 11224 B13R1.119 CCOCCCNCC1OCCO1 34a_100000036311_100012232248 [0,0,0,1,0,0|3,0,0]=4 11225 B13R1.119 CCOCCCNCC1OCCO1 34a_100000210961_100000755774 [0,0,0,1,0,0|3,0,0]=4 11226 B13R1.119 CCOCCCNC[C@@H]1CCCO1 2230a_100020590478_100012232248 [0,0,0,1,0,0|2,0,0]=3 11227 B13R1.119 CCOCCCNC[C@@H]1CCCO1 34a_100020590478_100012232248 [0,0,0,1,0,0|2,0,0]=3 11228 B13R1.119 CCOCCCOCC1CCCC1 34a_100000742336_100012232248 [0,0,0,1,0,0|3,0,0]=4 11229 B13R1.119 CCOCCCOCC1CCCC1 34a_100000757476_100000740388 [0,0,0,1,0,0|3,0,0]=4 11230 B13R1.119 CCOCCCOCC1CCCC1 7a_100000742336_100012232248 [0,0,0,1,0,0|3,0,0]=4 11231 B13R1.119 CCOCCCOCC1CCCC1 7a_100000757476_100000740388 [0,0,0,1,0,0|3,0,0]=4 11232 B13R1.119 CCOCCCOCC1CCCO1 34a_100000210270_100012232248 [0,0,0,1,0,0|2,0,0]=3 11233 B13R1.119 CCOCCCOCC1CCCO1 7a_100000210270_100012232248 [0,0,0,1,0,0|2,0,0]=3 11234 B13R1.119 CCOCCCOCC1CCCO1 7a_100000757476_100000203698 [0,0,0,1,0,0|2,0,0]=3 11235 B13R1.119 CCOCCCOCC1COCO1 34a_100011216627_100012232248 [0,0,0,1,0,0|3,0,0]=4 11236 B13R1.119 CCOCCCOCC1OCCO1 34a_100000087154_100012232248 [0,0,0,1,0,0|3,0,0]=4 11237 B13R1.119 CCOCCCOCC1OCCO1 34a_100000757476_100000755774 [0,0,0,1,0,0|3,0,0]=4 11238 B13R1.119 CCOCCCOCC1OCCO1 7a_100000757476_100000755774 [0,0,0,1,0,0|3,0,0]=4 11239 B13R1.119 CCOCCCOC[C@H]1CCCN1 34a_100000745186_100012232248 [0,0,0,1,0,0|3,0,0]=4 11240 B13R1.119 CCOCCCSCC1CCCC1 62a_100000740388_100012232248 [0,0,0,1,0,0|3,0,0]=4 11241 B13R1.119 CCOCCCSCC1CCCC1 62a_100012232248_100000740388 [0,0,0,1,0,0|3,0,0]=4 11242 B13R1.119 CCOCCCSCC1CCCO1 62a_100000203698_100012232248 [0,0,0,1,0,0|2,0,0]=3 11243 B13R1.119 CCOCCCSCC1CCCO1 62a_100012232248_100000203698 [0,0,0,1,0,0|2,0,0]=3 11244 B13R1.119 CCOCCCSCC1OCCO1 62a_100000755774_100012232248 [0,0,0,1,0,0|3,0,0]=4 11245 B13R1.119 CCOCCCSCC1OCCO1 62a_100012232248_100000755774 [0,0,0,1,0,0|3,0,0]=4 11246 B13R1.119 CCOCCNCCC1CCCC1 2230a_100000739158_100011215890 [0,0,0,1,0,0|3,0,0]=4 11247 B13R1.119 CCOCCNCCC1CCCC1 2230a_102516460346_100000760354 [0,0,0,1,0,0|3,0,0]=4 11248 B13R1.119 CCOCCNCCC1CCCC1 34a_100000739158_100000210147 [0,0,0,1,0,0|3,0,0]=4 11249 B13R1.119 CCOCCNCCC1CCCC1 34a_102516460346_100000760354 [0,0,0,1,0,0|3,0,0]=4 11250 B13R1.119 CCOCCNCCC1OCCO1 2230a_100000034215_100011215890 [0,0,0,1,0,0|3,0,0]=4 11251 B13R1.119 CCOCCNCCC1OCCO1 2230a_102516460346_100000740749 [0,0,0,1,0,0|3,0,0]=4 11252 B13R1.119 CCOCCNCCC1OCCO1 34a_100000034215_100000210147 [0,0,0,1,0,0|3,0,0]=4 11253 B13R1.119 CCOCCNCCC1OCCO1 34a_102516460346_100000740749 [0,0,0,1,0,0|3,0,0]=4 11254 B13R1.119 CCOCCOCCC1CCCC1 34a_100000210136_100000760354 [0,0,0,1,0,0|3,0,0]=4 11255 B13R1.119 CCOCCOCCC1CCCC1 34a_100000749090_100000210147 [0,0,0,1,0,0|3,0,0]=4 11256 B13R1.119 CCOCCOCCC1CCCC1 7a_100000210136_100000760354 [0,0,0,1,0,0|3,0,0]=4 11257 B13R1.119 CCOCCOCCC1CCCC1 7a_100000749090_100011215890 [0,0,0,1,0,0|3,0,0]=4 11258 B13R1.119 CCOCCOCCC1OCCO1 34a_100000210136_100000740749 [0,0,0,1,0,0|3,0,0]=4 11259 B13R1.119 CCOCCOCCC1OCCO1 7a_100000210136_100000740749 [0,0,0,1,0,0|3,0,0]=4 11260 B13R1.119 CCOCCSCCC1CCCC1 62a_100000210147_100000760354 [0,0,0,1,0,0|3,0,0]=4 11261 B13R1.119 CCOCCSCCC1CCCC1 62a_100000760354_100011215890 [0,0,0,1,0,0|3,0,0]=4 11262 B13R1.119 CCOCCSCCC1OCCO1 62a_100000210147_100000740749 [0,0,0,1,0,0|3,0,0]=4 11263 B13R1.119 CCOCSCCCC1CCCC1 62a_100000739092_100011713738 [0,0,0,1,0,0|3,0,0]=4 11264 B13R1.119 CCOCSCCCC1CCCC1 62a_100011713738_100000739092 [0,0,0,1,0,0|3,0,0]=4 11265 B13R1.119 CCOCSCCCC1OCCO1 62a_100000739092_100000042513 [0,0,0,1,0,0|3,0,0]=4 11266 B13R1.119 CCSCCCOCC1CCCC1 34a_100011216438_100000740388 [0,0,0,1,0,0|3,0,0]=4 11267 B13R1.119 CCSCCCOCC1CCCC1 7a_100011216438_100000740388 [0,0,0,1,0,0|3,0,0]=4 11268 B13R1.119 CCSCCCOCC1CCCO1 7a_100011216438_100000203698 [0,0,0,1,0,0|2,0,0]=3 11269 B13R1.119 CCSCCCOCC1OCCO1 34a_100011216438_100000755774 [0,0,0,1,0,0|3,0,0]=4 11270 B13R1.119 CCSCCCOCC1OCCO1 7a_100011216438_100000755774 [0,0,0,1,0,0|3,0,0]=4 11271 B13R1.119 CCSCCNCCC1CCCC1 2230a_100000106463_100000760354 [0,0,0,1,0,0|3,0,0]=4 11272 B13R1.119 CCSCCNCCC1CCCC1 2230a_100000739158_100000757381 [0,0,0,1,0,0|3,0,0]=4 11273 B13R1.119 CCSCCNCCC1CCCC1 34a_100000739158_100000757381 [0,0,0,1,0,0|3,0,0]=4 11274 B13R1.119 CCSCCNCCC1OCCO1 2230a_100000034215_100000757381 [0,0,0,1,0,0|3,0,0]=4 11275 B13R1.119 CCSCCNCCC1OCCO1 2230a_100000106463_100000740749 [0,0,0,1,0,0|3,0,0]=4 11276 B13R1.119 CCSCCNCCC1OCCO1 34a_100000034215_100000757381 [0,0,0,1,0,0|3,0,0]=4 11277 B13R1.119 CCSCCOCCC1CCCC1 34a_100000212035_100000760354 [0,0,0,1,0,0|3,0,0]=4 11278 B13R1.119 CCSCCOCCC1CCCC1 34a_100000749090_100000757381 [0,0,0,1,0,0|3,0,0]=4 11279 B13R1.119 CCSCCOCCC1CCCC1 7a_100000212035_100000760354 [0,0,0,1,0,0|3,0,0]=4 11280 B13R1.119 CCSCCOCCC1CCCC1 7a_100000749090_100000757381 [0,0,0,1,0,0|3,0,0]=4 11281 B13R1.119 CCSCCOCCC1OCCO1 34a_100000212035_100000740749 [0,0,0,1,0,0|3,0,0]=4 11282 B13R1.119 CCSCCOCCC1OCCO1 7a_100000212035_100000740749 [0,0,0,1,0,0|3,0,0]=4 11283 B13R1.119 CCSCCSCCC1CCCC1 62a_100000757381_100000760354 [0,0,0,1,0,0|3,0,0]=4 11284 B13R1.119 CCSCCSCCC1CCCC1 62a_100000760354_100000757381 [0,0,0,1,0,0|3,0,0]=4 11285 B13R1.119 CCSCCSCCC1OCCO1 62a_100000757381_100000740749 [0,0,0,1,0,0|3,0,0]=4 11286 B13R1.119 CNCCCCCOC1CCCC1 34a_100000722520_100000179811 [0,0,0,1,0,0|3,0,0]=4 11287 B13R1.119 CNCCCOCCC1CCCC1 34a_100000213112_100000760354 [0,0,0,1,0,0|3,0,0]=4 11288 B13R1.119 CNCCCOCCC1OCCO1 34a_100000213112_100000740749 [0,0,0,1,0,0|3,0,0]=4 11289 B13R1.119 COCCCCCCN1CCCC1 2230a_100000188435_100011998445 [0,0,0,1,0,0|3,0,0]=4 11290 B13R1.119 COCCCCCCN1CCCC1 269982a_100000188435_100011998445 [0,0,0,1,0,0|3,0,0]=4 11291 B13R1.119 COCCCCCNC1CCCC1 2230a_100000747528_100000179811 [0,0,0,1,0,0|3,0,0]=4 11292 B13R1.119 COCCCCCNC1CCCC1 270004a_100000747528_100000210133 [0,0,0,1,0,0|3,0,0]=4 11293 B13R1.119 COCCCCCNC1CCCC1 34a_100000747528_100000179811 [0,0,0,1,0,0|3,0,0]=4 11294 B13R1.119 COCCCCNCC1CCCC1 2230a_100000737975_100000730899 [0,0,0,1,0,0|3,0,0]=4 11295 B13R1.119 COCCCCNCC1CCCC1 34a_100000737975_100000755781 [0,0,0,1,0,0|3,0,0]=4 11296 B13R1.119 COCCCCNCC1OCCO1 2230a_100000036311_100000730899 [0,0,0,1,0,0|3,0,0]=4 11297 B13R1.119 COCCCCNCC1OCCO1 34a_100000036311_100000755781 [0,0,0,1,0,0|3,0,0]=4 11298 B13R1.119 COCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000730899 [0,0,0,1,0,0|2,0,0]=3 11299 B13R1.119 COCCCCNC[C@@H]1CCCO1 34a_100020590478_100000755781 [0,0,0,1,0,0|2,0,0]=3 11300 B13R1.119 COCCCCOCC1CCCC1 34a_100000740925_100000740388 [0,0,0,1,0,0|3,0,0]=4 11301 B13R1.119 COCCCCOCC1CCCC1 34a_100000742336_100000755781 [0,0,0,1,0,0|3,0,0]=4 11302 B13R1.119 COCCCCOCC1CCCC1 7a_100000742336_100000730899 [0,0,0,1,0,0|3,0,0]=4 11303 B13R1.119 COCCCCOCC1CCCO1 34a_100000210270_100000755781 [0,0,0,1,0,0|2,0,0]=3 11304 B13R1.119 COCCCCOCC1CCCO1 7a_100000210270_100000730899 [0,0,0,1,0,0|2,0,0]=3 11305 B13R1.119 COCCCCOCC1COCO1 34a_100011216627_100000755781 [0,0,0,1,0,0|3,0,0]=4 11306 B13R1.119 COCCCCOCC1OCCO1 34a_100000087154_100000755781 [0,0,0,1,0,0|3,0,0]=4 11307 B13R1.119 COCCCCOCC1OCCO1 34a_100000740925_100000755774 [0,0,0,1,0,0|3,0,0]=4 11308 B13R1.119 COCCCCOC[C@H]1CCCN1 34a_100000745186_100000755781 [0,0,0,1,0,0|3,0,0]=4 11309 B13R1.119 COCCCCSCC1CCCC1 62a_100000730899_100000740388 [0,0,0,1,0,0|3,0,0]=4 11310 B13R1.119 COCCCCSCC1CCCC1 62a_100000740388_100000730899 [0,0,0,1,0,0|3,0,0]=4 11311 B13R1.119 COCCCCSCC1CCCO1 62a_100000203698_100000730899 [0,0,0,1,0,0|2,0,0]=3 11312 B13R1.119 COCCCCSCC1CCCO1 62a_100000730899_100000203698 [0,0,0,1,0,0|2,0,0]=3 11313 B13R1.119 COCCCCSCC1OCCO1 62a_100000730899_100000755774 [0,0,0,1,0,0|3,0,0]=4 11314 B13R1.119 COCCCCSCC1OCCO1 62a_100000755774_100000730899 [0,0,0,1,0,0|3,0,0]=4 11315 B13R1.119 COCCCNCCC1CCCC1 2230a_100000739158_100000740836 [0,0,0,1,0,0|3,0,0]=4 11316 B13R1.119 COCCCNCCC1CCCC1 34a_100000739158_100000740836 [0,0,0,1,0,0|3,0,0]=4 11317 B13R1.119 COCCCNCCC1CCCC1 34a_100150723488_100000760354 [0,0,0,1,0,0|3,0,0]=4 11318 B13R1.119 COCCCNCCC1OCCO1 2230a_100000034215_100000740836 [0,0,0,1,0,0|3,0,0]=4 11319 B13R1.119 COCCCNCCC1OCCO1 34a_100000034215_100000740836 [0,0,0,1,0,0|3,0,0]=4 11320 B13R1.119 COCCCNCCC1OCCO1 34a_100150723488_100000740749 [0,0,0,1,0,0|3,0,0]=4 11321 B13R1.119 COCCCOCCC1CCCC1 34a_100000740835_100000760354 [0,0,0,1,0,0|3,0,0]=4 11322 B13R1.119 COCCCOCCC1CCCC1 34a_100000749090_100000740836 [0,0,0,1,0,0|3,0,0]=4 11323 B13R1.119 COCCCOCCC1CCCC1 7a_100000749090_100000740836 [0,0,0,1,0,0|3,0,0]=4 11324 B13R1.119 COCCCOCCC1OCCO1 34a_100000740835_100000740749 [0,0,0,1,0,0|3,0,0]=4 11325 B13R1.119 COCCCSCCC1CCCC1 62a_100000709357_100000760354 [0,0,0,1,0,0|3,0,0]=4 11326 B13R1.119 COCCCSCCC1CCCC1 62a_100000760354_100000709357 [0,0,0,1,0,0|3,0,0]=4 11327 B13R1.119 COCCCSCCC1OCCO1 62a_100000709357_100000740749 [0,0,0,1,0,0|3,0,0]=4 11328 B13R1.119 COCCNCCCC1CCCC1 2230a_100000209980_100011713738 [0,0,0,1,0,0|3,0,0]=4 11329 B13R1.119 COCCNCCCC1CCCC1 2230a_100000736752_100011201679 [0,0,0,1,0,0|3,0,0]=4 11330 B13R1.119 COCCNCCCC1CCCC1 34a_100000736752_100011201679 [0,0,0,1,0,0|3,0,0]=4 11331 B13R1.119 COCCNCCCC1OCCO1 2230a_100000209980_100000042513 [0,0,0,1,0,0|3,0,0]=4 11332 B13R1.119 COCCOCCCC1CCCC1 34a_100000210237_100011713738 [0,0,0,1,0,0|3,0,0]=4 11333 B13R1.119 COCCOCCCC1CCCC1 34a_100011215328_100011201679 [0,0,0,1,0,0|3,0,0]=4 11334 B13R1.119 COCCOCCCC1CCCC1 7a_100011215328_100000233755 [0,0,0,1,0,0|3,0,0]=4 11335 B13R1.119 COCCOCCCC1OCCO1 34a_100000210237_100009861162 [0,0,0,1,0,0|3,0,0]=4 11336 B13R1.119 COCCOCCCC1OCCO1 34a_100009871617_100011201679 [0,0,0,1,0,0|3,0,0]=4 11337 B13R1.119 COCCOCCCC1OCCO1 7a_100009871617_100000233755 [0,0,0,1,0,0|3,0,0]=4 11338 B13R1.119 COCCOCCOC1CCCO1 34a_100000085407_100000695917 [0,0,0,1,0,0|3,0,0]=4 11339 B13R1.119 COCCOCNC[C@@H]1CCCO1 2230a_100020590478_100000231047 [0,0,0,1,0,0|3,0,0]=4 11340 B13R1.119 COCCOCSCC1CCCO1 62a_100000203698_100000231047 [0,0,0,1,0,0|3,0,0]=4 11341 B13R1.119 COCCOCSCC1CCCO1 62a_100000231047_100000203698 [0,0,0,1,0,0|3,0,0]=4 11342 B13R1.119 COCCSCCCC1CCCC1 62a_100000233755_100011713738 [0,0,0,1,0,0|3,0,0]=4 11343 B13R1.119 COCCSCCCC1CCCC1 62a_100011713738_100000233755 [0,0,0,1,0,0|3,0,0]=4 11344 B13R1.119 COCCSCCCC1OCCO1 62a_100000233755_100000042513 [0,0,0,1,0,0|3,0,0]=4 11345 B13R1.119 COCSCCCCC1OCCO1 62a_100000766300_100000034956 [0,0,0,1,0,0|3,0,0]=4 11346 B13R1.119 CSCCCCOCC1CCCC1 34a_100011217163_100000740388 [0,0,0,1,0,0|3,0,0]=4 11347 B13R1.119 CSCCCCOCC1CCCC1 7a_100011217163_100000740388 [0,0,0,1,0,0|3,0,0]=4 11348 B13R1.119 CSCCCCOCC1CCCO1 7a_100011217163_100000203698 [0,0,0,1,0,0|2,0,0]=3 11349 B13R1.119 CSCCCCOCC1OCCO1 34a_100011217163_100000755774 [0,0,0,1,0,0|3,0,0]=4 11350 B13R1.119 CSCCCCOCC1OCCO1 7a_100011217163_100000755774 [0,0,0,1,0,0|3,0,0]=4 11351 B13R1.119 CSCCCNCCC1CCCC1 2230a_100000749238_100000760354 [0,0,0,1,0,0|3,0,0]=4 11352 B13R1.119 CSCCCNCCC1OCCO1 2230a_100000749238_100000740749 [0,0,0,1,0,0|3,0,0]=4 11353 B13R1.119 CSCCCOCCC1CCCC1 34a_100000690336_100000760354 [0,0,0,1,0,0|3,0,0]=4 11354 B13R1.119 CSCCCOCCC1CCCC1 7a_100000690336_100000760354 [0,0,0,1,0,0|3,0,0]=4 11355 B13R1.119 CSCCCOCCC1OCCO1 34a_100000690336_100000740749 [0,0,0,1,0,0|3,0,0]=4 11356 B13R1.119 CSCCCOCCC1OCCO1 7a_100000690336_100000740749 [0,0,0,1,0,0|3,0,0]=4 11357 B13R1.119 CSCCNCCCC1CCCC1 2230a_100000736752_100000751147 [0,0,0,1,0,0|3,0,0]=4 11358 B13R1.119 CSCCNCCCC1CCCC1 2230a_100020590264_100011713738 [0,0,0,1,0,0|3,0,0]=4 11359 B13R1.119 CSCCNCCCC1CCCC1 34a_100000736752_100000212216 [0,0,0,1,0,0|3,0,0]=4 11360 B13R1.119 CSCCNCCCC1OCCO1 2230a_100020590264_100000042513 [0,0,0,1,0,0|3,0,0]=4 11361 B13R1.119 CSCCOCCCC1CCCC1 34a_100000230434_100011713738 [0,0,0,1,0,0|3,0,0]=4 11362 B13R1.119 CSCCOCCCC1CCCC1 34a_100011215328_100000212216 [0,0,0,1,0,0|3,0,0]=4 11363 B13R1.119 CSCCOCCCC1CCCC1 7a_100000230434_100011713738 [0,0,0,1,0,0|3,0,0]=4 11364 B13R1.119 CSCCOCCCC1CCCC1 7a_100011215328_100000212216 [0,0,0,1,0,0|3,0,0]=4 11365 B13R1.119 CSCCOCCCC1OCCO1 34a_100000230434_100009861162 [0,0,0,1,0,0|3,0,0]=4 11366 B13R1.119 CSCCOCCCC1OCCO1 34a_100009871617_100000212216 [0,0,0,1,0,0|3,0,0]=4 11367 B13R1.119 CSCCOCCCC1OCCO1 7a_100000230434_100000042513 [0,0,0,1,0,0|3,0,0]=4 11368 B13R1.119 CSCCOCCCC1OCCO1 7a_100009871617_100000212216 [0,0,0,1,0,0|3,0,0]=4 11369 B13R1.119 CSCCSCCCC1CCCC1 62a_100000212216_100011713738 [0,0,0,1,0,0|3,0,0]=4 11370 B13R1.119 CSCCSCCCC1CCCC1 62a_100011713738_100000751147 [0,0,0,1,0,0|3,0,0]=4 11371 B13R1.119 CSCCSCCCC1OCCO1 62a_100000212216_100000042513 [0,0,0,1,0,0|3,0,0]=4 11372 B13R1.119 CSCSCCCCC1OCCO1 62a_100011218213_100000034956 [0,0,0,1,0,0|3,0,0]=4 11373 B13R1.119 ClCCCCCCOC1CCCC1 34a_100000766143_100000179811 [0,0,0,1,0,0|2,0,0]=3 11374 B13R1.119 ClCCCCCCOC1CCCC1 7a_100000766143_100000179811 [0,0,0,1,0,0|2,0,0]=3 11375 B13R1.119 ClCCCCCCOC1CCOC1 34a_100000766143_100000690089 [0,0,0,1,0,0|3,0,0]=4 11376 B13R1.119 ClCCCCCCOC1CCOC1 7a_100000766143_100000731011 [0,0,0,1,0,0|3,0,0]=4 11377 B13R1.119 ClCCCCCOCC1CCCC1 34a_100000746330_100000740388 [0,0,0,1,0,0|2,0,0]=3 11378 B13R1.119 ClCCCCCOCC1CCCC1 7a_100000746330_100000740388 [0,0,0,1,0,0|2,0,0]=3 11379 B13R1.119 ClCCCCCOCC1CCCO1 7a_100000746330_100000203698 [0,0,0,1,0,0|2,0,0]=3 11380 B13R1.119 ClCCCCCOCC1CCOC1 34a_100000746330_100011261433 [0,0,0,1,0,0|3,0,0]=4 11381 B13R1.119 ClCCCCCOCC1CCOC1 7a_100000746330_100000702531 [0,0,0,1,0,0|3,0,0]=4 11382 B13R1.119 ClCCCCCOCC1OCCO1 34a_100000746330_100000755774 [0,0,0,1,0,0|3,0,0]=4 11383 B13R1.119 ClCCCCCOCC1OCCO1 7a_100000746330_100000755774 [0,0,0,1,0,0|3,0,0]=4 11384 B13R1.119 ClCCCCOCCC1CCCC1 34a_100000210776_100000760354 [0,0,0,1,0,0|2,0,0]=3 11385 B13R1.119 ClCCCCOCCC1CCCC1 7a_100000210776_100000760354 [0,0,0,1,0,0|2,0,0]=3 11386 B13R1.119 ClCCCCOCCC1OCCO1 34a_100000210776_100000740749 [0,0,0,1,0,0|3,0,0]=4 11387 B13R1.119 ClCCCCOCCC1OCCO1 7a_100000210776_100000740749 [0,0,0,1,0,0|3,0,0]=4 11388 B13R1.119 ClCCCCOCCN1CCCC1 7a_100000210776_100000004467 [0,0,0,1,0,0|3,0,0]=4 11389 B13R1.119 ClCCCOCCCC1CCCC1 34a_100000230001_100011713738 [0,0,0,1,0,0|2,0,0]=3 11390 B13R1.119 ClCCCOCCCC1OCCO1 34a_100000230001_100009861162 [0,0,0,1,0,0|3,0,0]=4 11391 B13R1.119 ClCCCOCCCN1CCCC1 34a_100000230001_100016991639 [0,0,0,1,0,0|3,0,0]=4 11392 B13R1.119 ClCCOCCOCC1CCCC1 34a_100011215305_100000740388 [0,0,0,1,0,0|3,0,0]=4 11393 B13R1.119 ClCCOCCOCC1CCCC1 7a_100011215305_100000740388 [0,0,0,1,0,0|3,0,0]=4 11394 B13R1.119 ClCCOCCOCC1CCCO1 7a_100011215305_100000203698 [0,0,0,1,0,0|3,0,0]=4 11395 B13R1.119 FCCCCCCNC1CCCC1 2230a_100000211070_100015922095 [0,0,0,1,0,0|2,0,0]=3 11396 B13R1.119 FCCCCCCNC1CCCC1 34a_100000211070_100015922095 [0,0,0,1,0,0|2,0,0]=3 11397 B13R1.119 FCCCCCCN[C@@H]1CCOC1 2230a_200015188469_100015922095 [0,0,0,1,0,0|3,0,0]=4 11398 B13R1.119 FCCCCCCN[C@H]1CCOC1 2230a_100015188467_100015922095 [0,0,0,1,0,0|3,0,0]=4 11399 B13R1.119 FCCCCCCN[C@H]1CCOC1 34a_100015188467_100015922095 [0,0,0,1,0,0|3,0,0]=4 11400 B13R1.119 FCCCCCCOC1CCCC1 34a_100000210269_100015922095 [0,0,0,1,0,0|2,0,0]=3 11401 B13R1.119 FCCCCCCOC1CCCC1 34a_100000732779_100000179811 [0,0,0,1,0,0|2,0,0]=3 11402 B13R1.119 FCCCCCCOC1CCCC1 7a_100000210269_100015922095 [0,0,0,1,0,0|2,0,0]=3 11403 B13R1.119 FCCCCCCOC1CCCC1 7a_100000732779_100000179811 [0,0,0,1,0,0|2,0,0]=3 11404 B13R1.119 FCCCCCCOC1CCCO1 34a_100000085407_100015922095 [0,0,0,1,0,0|2,0,0]=3 11405 B13R1.119 FCCCCCCOC1CCOC1 34a_100000732779_100000690089 [0,0,0,1,0,0|3,0,0]=4 11406 B13R1.119 FCCCCCCOC1CCOC1 7a_100000732779_100000731011 [0,0,0,1,0,0|3,0,0]=4 11407 B13R1.119 FCCCCCCOC1CCSC1 7a_100011232664_100015922095 [0,0,0,1,0,0|3,0,0]=4 11408 B13R1.119 FCCCCCCO[C@H]1CCOC1 34a_100000717292_100015922095 [0,0,0,1,0,0|3,0,0]=4 11409 B13R1.119 FCCCCCCSC1CCCC1 62a_100011217020_100015922095 [0,0,0,1,0,0|2,0,0]=3 11410 B13R1.119 FCCCCCCSC1CCCC1 62a_100015922095_100000179811 [0,0,0,1,0,0|2,0,0]=3 11411 B13R1.119 FCCCCCCSC1CCOC1 62a_100015922095_100000690089 [0,0,0,1,0,0|3,0,0]=4 11412 B13R1.119 FCCCCCNCC1CCCC1 2230a_100000737975_100000729378 [0,0,0,1,0,0|2,0,0]=3 11413 B13R1.119 FCCCCCNCC1CCCC1 34a_100000737975_100000729378 [0,0,0,1,0,0|2,0,0]=3 11414 B13R1.119 FCCCCCNCC1CCOC1 2230a_100000737293_100000729378 [0,0,0,1,0,0|3,0,0]=4 11415 B13R1.119 FCCCCCNCC1CCOC1 34a_100000737293_100000729378 [0,0,0,1,0,0|3,0,0]=4 11416 B13R1.119 FCCCCCNCC1OCCO1 2230a_100000036311_100000729378 [0,0,0,1,0,0|3,0,0]=4 11417 B13R1.119 FCCCCCNCC1OCCO1 34a_100000036311_100000729378 [0,0,0,1,0,0|3,0,0]=4 11418 B13R1.119 FCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000729378 [0,0,0,1,0,0|2,0,0]=3 11419 B13R1.119 FCCCCCNC[C@@H]1CCCO1 34a_100020590478_100000729378 [0,0,0,1,0,0|2,0,0]=3 11420 B13R1.119 FCCCCCOCC1CCCC1 34a_100000742336_100000729378 [0,0,0,1,0,0|2,0,0]=3 11421 B13R1.119 FCCCCCOCC1CCCC1 7a_100000742336_100000729378 [0,0,0,1,0,0|2,0,0]=3 11422 B13R1.119 FCCCCCOCC1CCCO1 34a_100000210270_100000729378 [0,0,0,1,0,0|2,0,0]=3 11423 B13R1.119 FCCCCCOCC1CCCO1 7a_100000210270_100000729378 [0,0,0,1,0,0|2,0,0]=3 11424 B13R1.119 FCCCCCOCC1CCNC1 34a_100000748654_100000729378 [0,0,0,1,0,0|3,0,0]=4 11425 B13R1.119 FCCCCCOCC1CCOC1 34a_100000740260_100000729378 [0,0,0,1,0,0|3,0,0]=4 11426 B13R1.119 FCCCCCOCC1COCO1 34a_100011216627_100000729378 [0,0,0,1,0,0|3,0,0]=4 11427 B13R1.119 FCCCCCOCC1OCCO1 34a_100000087154_100000729378 [0,0,0,1,0,0|3,0,0]=4 11428 B13R1.119 FCCCCCOC[C@H]1CCCN1 34a_100000745186_100000729378 [0,0,0,1,0,0|3,0,0]=4 11429 B13R1.119 FCCCCCSCC1CCCC1 62a_100000729378_100000740388 [0,0,0,1,0,0|2,0,0]=3 11430 B13R1.119 FCCCCCSCC1CCCC1 62a_100000740388_100000729378 [0,0,0,1,0,0|2,0,0]=3 11431 B13R1.119 FCCCCCSCC1CCCO1 62a_100000203698_100000729378 [0,0,0,1,0,0|2,0,0]=3 11432 B13R1.119 FCCCCCSCC1CCCO1 62a_100000729378_100000203698 [0,0,0,1,0,0|2,0,0]=3 11433 B13R1.119 FCCCCCSCC1CCOC1 62a_100000702531_100000729378 [0,0,0,1,0,0|3,0,0]=4 11434 B13R1.119 FCCCCCSCC1CCOC1 62a_100000729378_100000702531 [0,0,0,1,0,0|3,0,0]=4 11435 B13R1.119 FCCCCCSCC1OCCO1 62a_100000729378_100000755774 [0,0,0,1,0,0|3,0,0]=4 11436 B13R1.119 FCCCCCSCC1OCCO1 62a_100000755774_100000729378 [0,0,0,1,0,0|3,0,0]=4 11437 B13R1.119 FCCCCNCCC1CCCC1 2230a_100000739158_100000729493 [0,0,0,1,0,0|2,0,0]=3 11438 B13R1.119 FCCCCNCCC1CCCC1 34a_100000739158_100000729493 [0,0,0,1,0,0|2,0,0]=3 11439 B13R1.119 FCCCCNCCC1OCCO1 2230a_100000034215_100000729493 [0,0,0,1,0,0|3,0,0]=4 11440 B13R1.119 FCCCCNCCC1OCCO1 34a_100000034215_100000729493 [0,0,0,1,0,0|3,0,0]=4 11441 B13R1.119 FCCCCOCCC1CCCC1 34a_100000749090_100000729493 [0,0,0,1,0,0|2,0,0]=3 11442 B13R1.119 FCCCCOCCC1CCCC1 34a_100011995726_100000760354 [0,0,0,1,0,0|2,0,0]=3 11443 B13R1.119 FCCCCOCCC1CCCC1 7a_100000749090_100000729493 [0,0,0,1,0,0|2,0,0]=3 11444 B13R1.119 FCCCCOCCC1CCCC1 7a_100011995726_100000760354 [0,0,0,1,0,0|2,0,0]=3 11445 B13R1.119 FCCCCOCCC1CCNC1 34a_100016987287_100000729493 [0,0,0,1,0,0|3,0,0]=4 11446 B13R1.119 FCCCCOCCC1CCOC1 34a_100011879284_100000729493 [0,0,0,1,0,0|3,0,0]=4 11447 B13R1.119 FCCCCOCCC1OCCO1 34a_100011995726_100000740749 [0,0,0,1,0,0|3,0,0]=4 11448 B13R1.119 FCCCCOCCC1OCCO1 7a_100011995726_100000740749 [0,0,0,1,0,0|3,0,0]=4 11449 B13R1.119 FCCCCOCCN1CCCC1 7a_100011995726_100000004467 [0,0,0,1,0,0|3,0,0]=4 11450 B13R1.119 FCCCCSCCC1CCCC1 62a_100000729493_100000760354 [0,0,0,1,0,0|2,0,0]=3 11451 B13R1.119 FCCCCSCCC1CCCC1 62a_100000760354_100000729493 [0,0,0,1,0,0|2,0,0]=3 11452 B13R1.119 FCCCCSCCC1OCCO1 62a_100000729493_100000740749 [0,0,0,1,0,0|3,0,0]=4 11453 B13R1.119 FCCCCSCCN1CCCC1 62a_100000700749_100000729493 [0,0,0,1,0,0|3,0,0]=4 11454 B13R1.119 FCCCCSCCN1CCCC1 62a_100000729493_100000004467 [0,0,0,1,0,0|3,0,0]=4 11455 B13R1.119 FCCCNCCCC1CCCC1 2230a_100000736752_100011934791 [0,0,0,1,0,0|2,0,0]=3 11456 B13R1.119 FCCCNCCCC1CCCC1 2230a_100015189416_100011713738 [0,0,0,1,0,0|2,0,0]=3 11457 B13R1.119 FCCCNCCCC1CCCC1 34a_100000736752_100011934791 [0,0,0,1,0,0|2,0,0]=3 11458 B13R1.119 FCCCNCCCC1CCCC1 34a_100015189416_100011713738 [0,0,0,1,0,0|2,0,0]=3 11459 B13R1.119 FCCCNCCCC1OCCO1 2230a_100015189416_100000042513 [0,0,0,1,0,0|3,0,0]=4 11460 B13R1.119 FCCCNCCCC1OCCO1 34a_100015189416_100009861162 [0,0,0,1,0,0|3,0,0]=4 11461 B13R1.119 FCCCNCCCN1CCCC1 2230a_100015189416_100011445909 [0,0,0,1,0,0|3,0,0]=4 11462 B13R1.119 FCCCNCCCN1CCCC1 34a_100015189416_100016991639 [0,0,0,1,0,0|3,0,0]=4 11463 B13R1.119 FCCCNCCOC1CCCC1 34a_100000741755_100011934791 [0,0,0,1,0,0|3,0,0]=4 11464 B13R1.119 FCCCOCCCC1CCCC1 34a_100000759539_100011713738 [0,0,0,1,0,0|2,0,0]=3 11465 B13R1.119 FCCCOCCCC1CCCC1 34a_100011215328_100011934791 [0,0,0,1,0,0|2,0,0]=3 11466 B13R1.119 FCCCOCCCC1CCCC1 7a_100011215328_100011934791 [0,0,0,1,0,0|2,0,0]=3 11467 B13R1.119 FCCCOCCCC1OCCO1 34a_100000759539_100009861162 [0,0,0,1,0,0|3,0,0]=4 11468 B13R1.119 FCCCOCCCC1OCCO1 34a_100009871617_100011934791 [0,0,0,1,0,0|3,0,0]=4 11469 B13R1.119 FCCCOCCCC1OCCO1 7a_100009871617_100011934791 [0,0,0,1,0,0|3,0,0]=4 11470 B13R1.119 FCCCOCCCN1CCCC1 34a_100000759539_100016991639 [0,0,0,1,0,0|3,0,0]=4 11471 B13R1.119 FCCCOCCNC1CCCC1 34a_200000200444_100011934791 [0,0,0,1,0,0|3,0,0]=4 11472 B13R1.119 FCCCOCCOC1CCCC1 34a_100000738311_100011934791 [0,0,0,1,0,0|3,0,0]=4 11473 B13R1.119 FCCCOCCOC1CCCC1 7a_100000738311_100011934791 [0,0,0,1,0,0|3,0,0]=4 11474 B13R1.119 FCCCSCCCC1CCCC1 62a_100011713738_100011934791 [0,0,0,1,0,0|2,0,0]=3 11475 B13R1.119 FCCCSCCCC1CCCC1 62a_100011934791_100011713738 [0,0,0,1,0,0|2,0,0]=3 11476 B13R1.119 FCCCSCCCC1OCCO1 62a_100011934791_100000042513 [0,0,0,1,0,0|3,0,0]=4 11477 B13R1.119 FCCCSCCCN1CCCC1 62a_100011934791_100011445909 [0,0,0,1,0,0|3,0,0]=4 11478 B13R1.119 FCCCSCCCN1CCCC1 62a_100016991639_100011934791 [0,0,0,1,0,0|3,0,0]=4 11479 B13R1.119 FCCNCCCCC1OCCO1 34a_100000724931_200009813554 [0,0,0,1,0,0|3,0,0]=4 11480 B13R1.119 FCCNCCCOC1CCCC1 34a_100000747560_100011217306 [0,0,0,1,0,0|3,0,0]=4 11481 B13R1.119 FCCOCCOCC1CCCC1 34a_200015357709_100000740388 [0,0,0,1,0,0|3,0,0]=4 11482 B13R1.119 FCCOCCOCC1CCCC1 7a_200015357709_100000740388 [0,0,0,1,0,0|3,0,0]=4 11483 B13R1.119 FCCOCCOCC1CCCO1 7a_200015357709_100000203698 [0,0,0,1,0,0|3,0,0]=4 11484 B13R1.119 FCCSCCCCC1OCCO1 62a_100011217306_100000034956 [0,0,0,1,0,0|3,0,0]=4 11485 B13R1.119 FCOCCCCOC1CCCO1 34a_100011018183_100015361967 [0,0,0,1,0,0|3,0,0]=4 11486 B13R1.119 FCOCCCCOC1CCCO1 7a_100011018183_100015361967 [0,0,0,1,0,0|3,0,0]=4 11487 B13R1.119 ICCCCCOCC1CCCC1 34a_200012148887_100000740388 [0,0,0,1,0,0|2,0,0]=3 11488 B13R1.119 ICCCCCOCC1CCCC1 7a_200012148887_100000740388 [0,0,0,1,0,0|2,0,0]=3 11489 B13R1.119 ICCCCCOCC1CCCO1 7a_200012148887_100000203698 [0,0,0,1,0,0|2,0,0]=3 11490 B13R1.119 ICCCCCOCC1CCOC1 34a_200012148887_100011261433 [0,0,0,1,0,0|3,0,0]=4 11491 B13R1.119 ICCCCCOCC1CCOC1 7a_200012148887_100000702531 [0,0,0,1,0,0|3,0,0]=4 11492 B13R1.119 ICCCCCOCC1OCCO1 34a_200012148887_100000755774 [0,0,0,1,0,0|3,0,0]=4 11493 B13R1.119 ICCCCCOCC1OCCO1 7a_200012148887_100000755774 [0,0,0,1,0,0|3,0,0]=4 11494 B13R1.119 ICCCCOCCC1CCCC1 34a_200012148704_100000760354 [0,0,0,1,0,0|2,0,0]=3 11495 B13R1.119 ICCCCOCCC1OCCO1 34a_200012148704_100000740749 [0,0,0,1,0,0|3,0,0]=4 11496 B13R1.119 ICCOCCOCC1CCCC1 34a_100012149058_100000740388 [0,0,0,1,0,0|3,0,0]=4 11497 B13R1.119 ICCOCCOCC1CCCC1 7a_100012149058_100000740388 [0,0,0,1,0,0|3,0,0]=4 11498 B13R1.119 ICCOCCOCC1CCCO1 7a_100012149058_100000203698 [0,0,0,1,0,0|3,0,0]=4 11499 B13R1.119 N#CCCCCCCN1CCCC1 2230a_100000188435_100009813337 [0,0,0,1,0,0|2,0,1]=4 11500 B13R1.119 N#CCCCCCCN1CCCC1 269982a_100000188435_100009813337 [0,0,0,1,0,0|2,0,1]=4 11501 B13R1.119 N#CCCCCCNC1CCCC1 2230a_100000211070_100009813376 [0,0,0,1,0,0|2,0,1]=4 11502 B13R1.119 N#CCCCCCNC1CCCC1 270004a_100000061152_100000210133 [0,0,0,1,0,0|2,0,1]=4 11503 B13R1.119 N#CCCCCCOC1CCCC1 7a_100000210269_100009813376 [0,0,0,1,0,0|2,0,1]=4 11504 B13R1.119 N#CCCCCCSC1CCCC1 62a_100009813376_100000179811 [0,0,0,1,0,0|2,0,1]=4 11505 B13R1.119 N#CCCCCCSC1CCCC1 62a_100011217020_100009813376 [0,0,0,1,0,0|2,0,1]=4 11506 B13R1.119 N#CCCCCNCC1CCCC1 2230a_100000737975_100000211819 [0,0,0,1,0,0|2,0,1]=4 11507 B13R1.119 N#CCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000211819 [0,0,0,1,0,0|2,0,1]=4 11508 B13R1.119 N#CCCCCOCC1CCCC1 7a_100000742336_100000211819 [0,0,0,1,0,0|2,0,1]=4 11509 B13R1.119 N#CCCCCOCC1CCCO1 7a_100000210270_100000211819 [0,0,0,1,0,0|2,0,1]=4 11510 B13R1.119 N#CCCCCSCC1CCCC1 62a_100000740388_100000211819 [0,0,0,1,0,0|2,0,1]=4 11511 B13R1.119 N#CCCCCSCC1CCCC1 62a_100011219923_100000740388 [0,0,0,1,0,0|2,0,1]=4 11512 B13R1.119 N#CCCCCSCC1CCCO1 62a_100000203698_100000211819 [0,0,0,1,0,0|2,0,1]=4 11513 B13R1.119 N#CCCCCSCC1CCCO1 62a_100011219923_100000203698 [0,0,0,1,0,0|2,0,1]=4 11514 B13R1.119 N#CCCCNCCC1CCCC1 2230a_100000739158_100000687738 [0,0,0,1,0,0|2,0,1]=4 11515 B13R1.119 N#CCCCOCCC1CCCC1 7a_100000749090_100000687738 [0,0,0,1,0,0|2,0,1]=4 11516 B13R1.119 N#CCCCSCCC1CCCC1 62a_100000687738_100000760354 [0,0,0,1,0,0|2,0,1]=4 11517 B13R1.119 N#CCCCSCCC1CCCC1 62a_100000760354_100000687738 [0,0,0,1,0,0|2,0,1]=4 11518 B13R1.119 N#CCCNCCCC1CCCC1 2230a_100000736752_100011215226 [0,0,0,1,0,0|2,0,1]=4 11519 B13R1.119 N#CCCOCCCC1CCCC1 7a_100011215328_100000184422 [0,0,0,1,0,0|2,0,1]=4 11520 B13R1.119 N#CCCSCCCC1CCCC1 62a_100011215226_100011713738 [0,0,0,1,0,0|2,0,1]=4 11521 B13R1.119 N#CCCSCCCC1CCCC1 62a_100011713738_100011215226 [0,0,0,1,0,0|2,0,1]=4 11522 B13R1.119 NCCCCCCOC1CCCC1 34a_100000686447_100000179811 [0,0,0,1,0,0|2,0,0]=3 11523 B13R1.119 NCCCCCCOC1CCOC1 34a_100000686447_100000690089 [0,0,0,1,0,0|3,0,0]=4 11524 B13R1.119 NCCCCCOCC1CCCC1 34a_100000762737_100000740388 [0,0,0,1,0,0|2,0,0]=3 11525 B13R1.119 NCCCCCOCC1CCOC1 34a_100000762737_100011261433 [0,0,0,1,0,0|3,0,0]=4 11526 B13R1.119 NCCCCCOCC1OCCO1 34a_100000762737_100000755774 [0,0,0,1,0,0|3,0,0]=4 11527 B13R1.119 NCCCCOCCC1CCCC1 34a_100000750430_100000760354 [0,0,0,1,0,0|2,0,0]=3 11528 B13R1.119 NCCCCOCCC1OCCO1 34a_100000750430_100000740749 [0,0,0,1,0,0|3,0,0]=4 11529 B13R1.119 NCCCOCCCC1CCCC1 34a_100000182051_100011713738 [0,0,0,1,0,0|2,0,0]=3 11530 B13R1.119 NCCCOCCCC1OCCO1 34a_100000182051_100009861162 [0,0,0,1,0,0|3,0,0]=4 11531 B13R1.119 NCCCOCCCN1CCCC1 34a_100000182051_100016991639 [0,0,0,1,0,0|3,0,0]=4 11532 B13R1.119 NCCOCCCCC1OCCO1 34a_100000210304_200009813554 [0,0,0,1,0,0|3,0,0]=4 11533 B13R1.119 NCCOCCOCC1CCCC1 34a_100000211614_100000740388 [0,0,0,1,0,0|3,0,0]=4 11534 B13R1.119 NOCCOCCCC1CCCC1 34a_100000700252_100011713738 [0,0,0,1,0,0|3,0,0]=4 11535 B13R1.119 O=CCCCCCNC1CCCC1 2230a_100000211070_100000139337 [0,0,0,1,0,0|1,0,2]=4 11536 B13R1.119 O=CCCCCCOC1CCCC1 7a_100000210269_100000139337 [0,0,0,1,0,0|1,0,2]=4 11537 B13R1.119 O=CCCCCCSC1CCCC1 62a_100000139337_100000179811 [0,0,0,1,0,0|1,0,2]=4 11538 B13R1.119 O=CCCCCCSC1CCCC1 62a_100011217020_100000139337 [0,0,0,1,0,0|1,0,2]=4 11539 B13R1.119 O=CCCCCNCC1CCCC1 2230a_100000737975_100000139335 [0,0,0,1,0,0|1,0,2]=4 11540 B13R1.119 O=CCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000139335 [0,0,0,1,0,0|2,0,1]=4 11541 B13R1.119 O=CCCCCOCC1CCCC1 7a_100000742336_100000139335 [0,0,0,1,0,0|1,0,2]=4 11542 B13R1.119 O=CCCCCOCC1CCCO1 7a_100000210270_100000139335 [0,0,0,1,0,0|2,0,1]=4 11543 B13R1.119 O=CCCCCSCC1CCCC1 62a_100000139335_100000740388 [0,0,0,1,0,0|1,0,2]=4 11544 B13R1.119 O=CCCCCSCC1CCCC1 62a_100000740388_100000139335 [0,0,0,1,0,0|1,0,2]=4 11545 B13R1.119 O=CCCCCSCC1CCCO1 62a_100000139335_100000203698 [0,0,0,1,0,0|2,0,1]=4 11546 B13R1.119 O=CCCCCSCC1CCCO1 62a_100000203698_100000139335 [0,0,0,1,0,0|2,0,1]=4 11547 B13R1.119 O=CCCCNCCC1CCCC1 2230a_100000739158_200011292268 [0,0,0,1,0,0|1,0,2]=4 11548 B13R1.119 O=CCCCOCCC1CCCC1 7a_100000749090_200011292268 [0,0,0,1,0,0|1,0,2]=4 11549 B13R1.119 O=CCCCSCCC1CCCC1 62a_100000760354_200011292268 [0,0,0,1,0,0|1,0,2]=4 11550 B13R1.119 O=CCCCSCCC1CCCC1 62a_200011292268_100000760354 [0,0,0,1,0,0|1,0,2]=4 11551 B13R1.119 OCC#CCNCCC1CCCC1 2230a_100000739158_200000047223 [0,0,0,1,0,0|1,0,2]=4 11552 B13R1.119 OCC#CCNCCC1CCCC1 34a_100000739158_200000047223 [0,0,0,1,0,0|1,0,2]=4 11553 B13R1.119 OCC#CCOCCC1CCCC1 34a_100000749090_200000047223 [0,0,0,1,0,0|1,0,2]=4 11554 B13R1.119 OCC#CCOCCC1CCCC1 7a_100000749090_200000047223 [0,0,0,1,0,0|1,0,2]=4 11555 B13R1.119 OCC#CCSCCC1CCCC1 62a_100000760354_200000047223 [0,0,0,1,0,0|1,0,2]=4 11556 B13R1.119 OCC#CCSCCC1CCCC1 62a_200000047223_100000760354 [0,0,0,1,0,0|1,0,2]=4 11557 B13R1.119 OCCCCC=NNC1CCCC1 4a_100000737850_100000031955 [0,0,0,1,0,0|2,0,1]=4 11558 B13R1.119 OCCCCCCCN1CC=CC1 269982a_100015195280_100000760002 [0,0,0,1,0,0|1,0,2]=4 11559 B13R1.119 OCCCCCCCN1CCCC1 2230a_100000188435_100000760002 [0,0,0,1,0,0|1,0,0]=2 11560 B13R1.119 OCCCCCCCN1CCCC1 269982a_100000188435_100000760002 [0,0,0,1,0,0|1,0,0]=2 11561 B13R1.119 OCCCCCCCN1CCSC1 2230a_100011215254_100000760002 [0,0,0,1,0,0|2,0,0]=3 11562 B13R1.119 OCCCCCCCN1CCSC1 269982a_100011215254_100000760002 [0,0,0,1,0,0|2,0,0]=3 11563 B13R1.119 OCCCCCCNC1CC=CC1 2230a_100015188752_100000766143 [0,0,0,1,0,0|1,0,2]=4 11564 B13R1.119 OCCCCCCNC1CCCC1 2230a_100000211070_100000766143 [0,0,0,1,0,0|1,0,0]=2 11565 B13R1.119 OCCCCCCNC1CCCC1 2230a_100000686447_100000179811 [0,0,0,1,0,0|1,0,0]=2 11566 B13R1.119 OCCCCCCNC1CCCC1 270004a_100000686447_100000210133 [0,0,0,1,0,0|1,0,0]=2 11567 B13R1.119 OCCCCCCNC1CCCC1 34a_100000211070_100000766143 [0,0,0,1,0,0|1,0,0]=2 11568 B13R1.119 OCCCCCCNC1CCCC1 34a_100000686447_100000179811 [0,0,0,1,0,0|1,0,0]=2 11569 B13R1.119 OCCCCCCNC1CCOC1 2230a_100000686447_100000731011 [0,0,0,1,0,0|2,0,0]=3 11570 B13R1.119 OCCCCCCNC1CCOC1 270004a_100000686447_100000752484 [0,0,0,1,0,0|2,0,0]=3 11571 B13R1.119 OCCCCCCNC1CCOC1 34a_100000686447_100000690089 [0,0,0,1,0,0|2,0,0]=3 11572 B13R1.119 OCCCCCCNC1CCSC1 270004a_100000686447_100000212027 [0,0,0,1,0,0|2,0,0]=3 11573 B13R1.119 OCCCCCCN[C@@H]1CCOC1 2230a_200015188469_100000766143 [0,0,0,1,0,0|2,0,0]=3 11574 B13R1.119 OCCCCCCN[C@H]1CCOC1 2230a_100015188467_100000766143 [0,0,0,1,0,0|2,0,0]=3 11575 B13R1.119 OCCCCCCN[C@H]1CCOC1 34a_100015188467_100000766143 [0,0,0,1,0,0|2,0,0]=3 11576 B13R1.119 OCCCCCCOC1CCCC1 34a_100000210269_100000766143 [0,0,0,1,0,0|1,0,0]=2 11577 B13R1.119 OCCCCCCOC1CCCC1 7a_100000210269_100000766143 [0,0,0,1,0,0|1,0,0]=2 11578 B13R1.119 OCCCCCCOC1CCCO1 34a_100000085407_100000766143 [0,0,0,1,0,0|2,0,0]=3 11579 B13R1.119 OCCCCCCOC1CCSC1 7a_100011232664_100000766143 [0,0,0,1,0,0|2,0,0]=3 11580 B13R1.119 OCCCCCCO[C@H]1CCOC1 34a_100000717292_100000766143 [0,0,0,1,0,0|2,0,0]=3 11581 B13R1.119 OCCCCCCSC1CCCC1 62a_100000766143_100000179811 [0,0,0,1,0,0|1,0,0]=2 11582 B13R1.119 OCCCCCCSC1CCCC1 62a_100011217020_100000766143 [0,0,0,1,0,0|1,0,0]=2 11583 B13R1.119 OCCCCCCSC1CCOC1 62a_100000766143_100000690089 [0,0,0,1,0,0|2,0,0]=3 11584 B13R1.119 OCCCCCNCC1CCCC1 2230a_100000737975_100000746330 [0,0,0,1,0,0|1,0,0]=2 11585 B13R1.119 OCCCCCNCC1CCCC1 2230a_100000762737_100000740388 [0,0,0,1,0,0|1,0,0]=2 11586 B13R1.119 OCCCCCNCC1CCCC1 269862a_100000762737_100000746403 [0,0,0,1,0,0|1,0,0]=2 11587 B13R1.119 OCCCCCNCC1CCCC1 34a_100000737975_100000746330 [0,0,0,1,0,0|1,0,0]=2 11588 B13R1.119 OCCCCCNCC1CCCC1 34a_100000762737_100000740388 [0,0,0,1,0,0|1,0,0]=2 11589 B13R1.119 OCCCCCNCC1CCCO1 2230a_100000762737_100000203698 [0,0,0,1,0,0|2,0,0]=3 11590 B13R1.119 OCCCCCNCC1CCOC1 2230a_100000737293_100000746330 [0,0,0,1,0,0|2,0,0]=3 11591 B13R1.119 OCCCCCNCC1CCOC1 2230a_100000762737_100000702531 [0,0,0,1,0,0|2,0,0]=3 11592 B13R1.119 OCCCCCNCC1CCOC1 34a_100000737293_100000746330 [0,0,0,1,0,0|2,0,0]=3 11593 B13R1.119 OCCCCCNCC1CCOC1 34a_100000762737_100011261433 [0,0,0,1,0,0|2,0,0]=3 11594 B13R1.119 OCCCCCNCC1OCCO1 2230a_100000036311_100000746330 [0,0,0,1,0,0|3,0,0]=4 11595 B13R1.119 OCCCCCNCC1OCCO1 2230a_100000762737_100000755774 [0,0,0,1,0,0|3,0,0]=4 11596 B13R1.119 OCCCCCNCC1OCCO1 34a_100000036311_100000746330 [0,0,0,1,0,0|3,0,0]=4 11597 B13R1.119 OCCCCCNCC1OCCO1 34a_100000762737_100000755774 [0,0,0,1,0,0|3,0,0]=4 11598 B13R1.119 OCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000746330 [0,0,0,1,0,0|2,0,0]=3 11599 B13R1.119 OCCCCCNC[C@@H]1CCCO1 34a_100020590478_100000746330 [0,0,0,1,0,0|2,0,0]=3 11600 B13R1.119 OCCCCCOCC1CC=CC1 34a_100000688395_100000746330 [0,0,0,1,0,0|1,0,2]=4 11601 B13R1.119 OCCCCCOCC1CCCC1 34a_100000742336_100000746330 [0,0,0,1,0,0|1,0,0]=2 11602 B13R1.119 OCCCCCOCC1CCCC1 7a_100000742336_100000746330 [0,0,0,1,0,0|1,0,0]=2 11603 B13R1.119 OCCCCCOCC1CCCO1 34a_100000210270_100000746330 [0,0,0,1,0,0|2,0,0]=3 11604 B13R1.119 OCCCCCOCC1CCCO1 7a_100000210270_100000746330 [0,0,0,1,0,0|2,0,0]=3 11605 B13R1.119 OCCCCCOCC1CCNC1 34a_100000748654_100000746330 [0,0,0,1,0,0|2,0,0]=3 11606 B13R1.119 OCCCCCOCC1CCOC1 34a_100000740260_100000746330 [0,0,0,1,0,0|2,0,0]=3 11607 B13R1.119 OCCCCCOCC1COCO1 34a_100011216627_100000746330 [0,0,0,1,0,0|3,0,0]=4 11608 B13R1.119 OCCCCCOCC1OCCO1 34a_100000087154_100000746330 [0,0,0,1,0,0|3,0,0]=4 11609 B13R1.119 OCCCCCOC[C@H]1CCCN1 34a_100000745186_100000746330 [0,0,0,1,0,0|2,0,0]=3 11610 B13R1.119 OCCCCCSCC1CCCC1 62a_100000740388_100000746330 [0,0,0,1,0,0|1,0,0]=2 11611 B13R1.119 OCCCCCSCC1CCCC1 62a_100000746330_100000740388 [0,0,0,1,0,0|1,0,0]=2 11612 B13R1.119 OCCCCCSCC1CCCO1 62a_100000203698_100000746330 [0,0,0,1,0,0|2,0,0]=3 11613 B13R1.119 OCCCCCSCC1CCCO1 62a_100000746330_100000203698 [0,0,0,1,0,0|2,0,0]=3 11614 B13R1.119 OCCCCCSCC1CCOC1 62a_100000702531_100000746330 [0,0,0,1,0,0|2,0,0]=3 11615 B13R1.119 OCCCCCSCC1CCOC1 62a_100000746330_100000702531 [0,0,0,1,0,0|2,0,0]=3 11616 B13R1.119 OCCCCCSCC1OCCO1 62a_100000746330_100000755774 [0,0,0,1,0,0|3,0,0]=4 11617 B13R1.119 OCCCCCSCC1OCCO1 62a_100000755774_100000746330 [0,0,0,1,0,0|3,0,0]=4 11618 B13R1.119 OCCCCNCCC1CCCC1 2230a_100000739158_100000210776 [0,0,0,1,0,0|1,0,0]=2 11619 B13R1.119 OCCCCNCCC1CCCC1 2230a_100000750430_100000760354 [0,0,0,1,0,0|1,0,0]=2 11620 B13R1.119 OCCCCNCCC1CCCC1 34a_100000739158_100011216708 [0,0,0,1,0,0|1,0,0]=2 11621 B13R1.119 OCCCCNCCC1CCCC1 34a_100000750430_100000760354 [0,0,0,1,0,0|1,0,0]=2 11622 B13R1.119 OCCCCNCCC1OCCO1 2230a_100000034215_100000210776 [0,0,0,1,0,0|3,0,0]=4 11623 B13R1.119 OCCCCNCCC1OCCO1 2230a_100000750430_100000740749 [0,0,0,1,0,0|3,0,0]=4 11624 B13R1.119 OCCCCNCCC1OCCO1 34a_100000034215_100011216708 [0,0,0,1,0,0|3,0,0]=4 11625 B13R1.119 OCCCCNCCC1OCCO1 34a_100000750430_100000740749 [0,0,0,1,0,0|3,0,0]=4 11626 B13R1.119 OCCCCOCCC1CCCC1 34a_100000749090_100011216708 [0,0,0,1,0,0|1,0,0]=2 11627 B13R1.119 OCCCCOCCC1CCCC1 7a_100000749090_100000210776 [0,0,0,1,0,0|1,0,0]=2 11628 B13R1.119 OCCCCOCCC1CCNC1 34a_100016987287_100011216708 [0,0,0,1,0,0|2,0,0]=3 11629 B13R1.119 OCCCCOCCC1CCOC1 34a_100011879284_100011216708 [0,0,0,1,0,0|2,0,0]=3 11630 B13R1.119 OCCCCSCCC1CCCC1 62a_100000210776_100000760354 [0,0,0,1,0,0|1,0,0]=2 11631 B13R1.119 OCCCCSCCC1CCCC1 62a_100000760354_100000210776 [0,0,0,1,0,0|1,0,0]=2 11632 B13R1.119 OCCCCSCCC1OCCO1 62a_100000210776_100000740749 [0,0,0,1,0,0|3,0,0]=4 11633 B13R1.119 OCCCCSCCN1CCCC1 62a_100000210776_100000004467 [0,0,0,1,0,0|2,0,0]=3 11634 B13R1.119 OCCCCSCCN1CCCC1 62a_100000700749_100000210776 [0,0,0,1,0,0|2,0,0]=3 11635 B13R1.119 OCCCNCCCC1CCCC1 2230a_100000736752_100000230001 [0,0,0,1,0,0|1,0,0]=2 11636 B13R1.119 OCCCNCCCC1CCCC1 34a_100000736752_100000230001 [0,0,0,1,0,0|1,0,0]=2 11637 B13R1.119 OCCCNCCOC1CCCC1 34a_100000741755_100000230001 [0,0,0,1,0,0|2,0,0]=3 11638 B13R1.119 OCCCOCCCC1CCCC1 34a_100011215328_100000230001 [0,0,0,1,0,0|1,0,0]=2 11639 B13R1.119 OCCCOCCCC1CCCC1 7a_100011215328_100011215043 [0,0,0,1,0,0|1,0,0]=2 11640 B13R1.119 OCCCOCCCC1OCCO1 34a_100009871617_100000230001 [0,0,0,1,0,0|3,0,0]=4 11641 B13R1.119 OCCCOCCCC1OCCO1 7a_100009871617_100011215043 [0,0,0,1,0,0|3,0,0]=4 11642 B13R1.119 OCCCOCCNC1CCCC1 34a_200000200444_100000230001 [0,0,0,1,0,0|2,0,0]=3 11643 B13R1.119 OCCCOCCOC1CCCC1 34a_100000738311_100000230001 [0,0,0,1,0,0|2,0,0]=3 11644 B13R1.119 OCCCOCCOC1CCCC1 7a_100000738311_100011215043 [0,0,0,1,0,0|2,0,0]=3 11645 B13R1.119 OCCCSCCCC1CCCC1 62a_100011215043_100011713738 [0,0,0,1,0,0|1,0,0]=2 11646 B13R1.119 OCCCSCCCC1CCCC1 62a_100011713738_100011215043 [0,0,0,1,0,0|1,0,0]=2 11647 B13R1.119 OCCCSCCCC1OCCO1 62a_100011215043_100000042513 [0,0,0,1,0,0|3,0,0]=4 11648 B13R1.119 OCCCSCCCN1CCCC1 62a_100011215043_100011445909 [0,0,0,1,0,0|2,0,0]=3 11649 B13R1.119 OCCCSCCCN1CCCC1 62a_100016991639_100011215043 [0,0,0,1,0,0|2,0,0]=3 11650 B13R1.119 OCCNCCCCC1OCCO1 2230a_100016997473_100000034956 [0,0,0,1,0,0|3,0,0]=4 11651 B13R1.119 OCCNCCCCC1OCCO1 34a_100016990907_200009813554 [0,0,0,1,0,0|3,0,0]=4 11652 B13R1.119 OCCNCCCOC1CCCC1 34a_100000747560_100000211926 [0,0,0,1,0,0|2,0,0]=3 11653 B13R1.119 OCCNN=CCCC1CCCC1 4a_100000210001_100011713431 [0,0,0,1,0,0|2,0,1]=4 11654 B13R1.119 OCCOCCNCC1CCCC1 2230a_100000211614_100000740388 [0,0,0,1,0,0|2,0,0]=3 11655 B13R1.119 OCCOCCNCC1CCCC1 2230a_100000737975_100011215305 [0,0,0,1,0,0|2,0,0]=3 11656 B13R1.119 OCCOCCNCC1CCCC1 269862a_100000211614_100000746403 [0,0,0,1,0,0|2,0,0]=3 11657 B13R1.119 OCCOCCNCC1CCCC1 34a_100000211614_100000740388 [0,0,0,1,0,0|2,0,0]=3 11658 B13R1.119 OCCOCCNCC1CCCC1 34a_100000737975_100000692535 [0,0,0,1,0,0|2,0,0]=3 11659 B13R1.119 OCCOCCNCC1CCCO1 2230a_100000211614_100000203698 [0,0,0,1,0,0|3,0,0]=4 11660 B13R1.119 OCCOCCNCC1CCOC1 2230a_100000211614_100000702531 [0,0,0,1,0,0|3,0,0]=4 11661 B13R1.119 OCCOCCNCC1CCOC1 2230a_100000737293_100011215305 [0,0,0,1,0,0|3,0,0]=4 11662 B13R1.119 OCCOCCNCC1CCOC1 34a_100000211614_100011261433 [0,0,0,1,0,0|3,0,0]=4 11663 B13R1.119 OCCOCCNCC1CCOC1 34a_100000737293_100000692535 [0,0,0,1,0,0|3,0,0]=4 11664 B13R1.119 OCCOCCNC[C@@H]1CCCO1 2230a_100020590478_100011215305 [0,0,0,1,0,0|3,0,0]=4 11665 B13R1.119 OCCOCCNC[C@@H]1CCCO1 34a_100020590478_100000692535 [0,0,0,1,0,0|3,0,0]=4 11666 B13R1.119 OCCOCCOCC1CCCC1 34a_100000742336_100000692535 [0,0,0,1,0,0|2,0,0]=3 11667 B13R1.119 OCCOCCOCC1CCCC1 7a_100000742336_100011215305 [0,0,0,1,0,0|2,0,0]=3 11668 B13R1.119 OCCOCCOCC1CCCO1 34a_100000210270_100000692535 [0,0,0,1,0,0|3,0,0]=4 11669 B13R1.119 OCCOCCOCC1CCCO1 7a_100000210270_100011215305 [0,0,0,1,0,0|3,0,0]=4 11670 B13R1.119 OCCOCCOCC1CCNC1 34a_100000748654_100000692535 [0,0,0,1,0,0|3,0,0]=4 11671 B13R1.119 OCCOCCOCC1CCOC1 34a_100000740260_100000692535 [0,0,0,1,0,0|3,0,0]=4 11672 B13R1.119 OCCOCCOC[C@H]1CCCN1 34a_100000745186_100000692535 [0,0,0,1,0,0|3,0,0]=4 11673 B13R1.119 OCCOCCSCC1CCCC1 62a_100000740388_100011215305 [0,0,0,1,0,0|2,0,0]=3 11674 B13R1.119 OCCOCCSCC1CCCC1 62a_100011215305_100000740388 [0,0,0,1,0,0|2,0,0]=3 11675 B13R1.119 OCCOCCSCC1CCCO1 62a_100000203698_100011215305 [0,0,0,1,0,0|3,0,0]=4 11676 B13R1.119 OCCOCCSCC1CCCO1 62a_100011215305_100000203698 [0,0,0,1,0,0|3,0,0]=4 11677 B13R1.119 OCCOCCSCC1CCOC1 62a_100000702531_100011215305 [0,0,0,1,0,0|3,0,0]=4 11678 B13R1.119 OCCOCCSCC1CCOC1 62a_100011215305_100000702531 [0,0,0,1,0,0|3,0,0]=4 11679 B13R1.119 OCCSCCCCC1OCCO1 62a_100000211926_100000034956 [0,0,0,1,0,0|3,0,0]=4 11680 B13R1.119 OCCSCCNCC1CCCC1 2230a_100011219999_100000740388 [0,0,0,1,0,0|2,0,0]=3 11681 B13R1.119 OCCSCCNCC1CCCC1 269862a_100011219999_100000746403 [0,0,0,1,0,0|2,0,0]=3 11682 B13R1.119 OCCSCCNCC1CCCO1 2230a_100011219999_100000203698 [0,0,0,1,0,0|3,0,0]=4 11683 B13R1.119 OCCSCCNCC1CCOC1 2230a_100011219999_100000702531 [0,0,0,1,0,0|3,0,0]=4 11684 B13R1.137 C#CCCCCN1CCCC1CC 2230a_100000754278_100010269958 [0,0,0,1,0,0|2,0,1]=4 11685 B13R1.137 C#CCCCCN1CCCC1CC 269982a_100000754278_100010269958 [0,0,0,1,0,0|2,0,1]=4 11686 B13R1.137 C#CCCCCN1CCCC1CC 34a_100000754278_100010269958 [0,0,0,1,0,0|2,0,1]=4 11687 B13R1.137 C#CCCCCN1CCC[C@@H]1CO 2230a_100000745186_100010269958 [0,0,0,1,0,0|1,0,2]=4 11688 B13R1.137 C#CCCCCN1CCC[C@@H]1CO 269982a_100000745186_100010269958 [0,0,0,1,0,0|1,0,2]=4 11689 B13R1.137 C#CCCCCN1CCC[C@@H]1CO 34a_100000745186_100010269958 [0,0,0,1,0,0|1,0,2]=4 11690 B13R1.137 C#CCCCNC1CCCC1CC 270004a_100000718082_100000749056 [0,0,0,1,0,0|2,0,1]=4 11691 B13R1.137 C=CCCCCN1CCCC1CC 2230a_100000754278_100011215482 [0,0,0,1,0,0|2,0,1]=4 11692 B13R1.137 C=CCCCCN1CCCC1CC 269982a_100000754278_100011215482 [0,0,0,1,0,0|2,0,1]=4 11693 B13R1.137 C=CCCCCN1CCCC1CC 34a_100000754278_100011215482 [0,0,0,1,0,0|2,0,1]=4 11694 B13R1.137 C=CCCCCN1CCC[C@@H]1CO 2230a_100000745186_100011215482 [0,0,0,1,0,0|1,0,2]=4 11695 B13R1.137 C=CCCCCN1CCC[C@@H]1CO 269982a_100000745186_100011215482 [0,0,0,1,0,0|1,0,2]=4 11696 B13R1.137 C=CCCCCN1CCC[C@@H]1CO 34a_100000745186_100011215482 [0,0,0,1,0,0|1,0,2]=4 11697 B13R1.137 C=CCCCNC1CCCC1CC 269862a_100000700776_100000749056 [0,0,0,1,0,0|2,0,1]=4 11698 B13R1.137 C=CCCCNC1CCCC1CC 270004a_100000700776_100000749056 [0,0,0,1,0,0|2,0,1]=4 11699 B13R1.137 CC/C=C\CCN1CCC[C@@H]1CO 2230a_100000745186_100015370543 [0,0,0,1,0,0|1,0,2]=4 11700 B13R1.137 CC/C=C\CCN1CCC[C@@H]1CO 269982a_100000745186_100015370543 [0,0,0,1,0,0|1,0,2]=4 11701 B13R1.137 CC/C=C\CCN1CCC[C@@H]1CO 34a_100000745186_100015370543 [0,0,0,1,0,0|1,0,2]=4 11702 B13R1.137 CCC1C=CCN1CCCCCO 2230a_100000730860_100000746330 [0,0,0,1,0,0|1,0,2]=4 11703 B13R1.137 CCC1C=CCN1CCCCCO 269982a_100000730860_100000746330 [0,0,0,1,0,0|1,0,2]=4 11704 B13R1.137 CCC1C=CCN1CCCCCO 34a_100000730860_100000746330 [0,0,0,1,0,0|1,0,2]=4 11705 B13R1.137 CCC1CCCC1NCCCCO 269862a_100000750430_100000749056 [0,0,0,1,0,0|1,0,0]=2 11706 B13R1.137 CCC1CCCC1NCCCCO 270004a_100000750430_100000749056 [0,0,0,1,0,0|1,0,0]=2 11707 B13R1.137 CCC1CCCC1NCCCOC 269862a_100150723488_100000749056 [0,0,0,1,0,0|3,0,0]=4 11708 B13R1.137 CCC1CCCC1NCCCOC 270004a_100150723488_100000749056 [0,0,0,1,0,0|3,0,0]=4 11709 B13R1.137 CCC1CCCC1NCCCSC 269862a_100000749238_100000749056 [0,0,0,1,0,0|3,0,0]=4 11710 B13R1.137 CCC1CCCC1NCCCSC 270004a_100000749238_100000749056 [0,0,0,1,0,0|3,0,0]=4 11711 B13R1.137 CCC1CCCN1CCCCC#N 2230a_100000754278_100000211819 [0,0,0,1,0,0|2,0,1]=4 11712 B13R1.137 CCC1CCCN1CCCCC#N 269982a_100000754278_100011219923 [0,0,0,1,0,0|2,0,1]=4 11713 B13R1.137 CCC1CCCN1CCCCC=O 2230a_100000754278_100000139335 [0,0,0,1,0,0|1,0,2]=4 11714 B13R1.137 CCC1CCCN1CCCCC=O 269982a_100000754278_100000139335 [0,0,0,1,0,0|1,0,2]=4 11715 B13R1.137 CCC1CCCN1CCCCCF 2230a_100000754278_100000729378 [0,0,0,1,0,0|2,0,0]=3 11716 B13R1.137 CCC1CCCN1CCCCCF 269982a_100000754278_100000729378 [0,0,0,1,0,0|2,0,0]=3 11717 B13R1.137 CCC1CCCN1CCCCCF 34a_100000754278_100000729378 [0,0,0,1,0,0|2,0,0]=3 11718 B13R1.137 CCC1CCCN1CCCCCO 2230a_100000754278_100000746330 [0,0,0,1,0,0|1,0,0]=2 11719 B13R1.137 CCC1CCCN1CCCCCO 269982a_100000754278_100000746330 [0,0,0,1,0,0|1,0,0]=2 11720 B13R1.137 CCC1CCCN1CCCCCO 34a_100000754278_100000746330 [0,0,0,1,0,0|1,0,0]=2 11721 B13R1.137 CCC1CCCN1CCCCOC 2230a_100000754278_100000730899 [0,0,0,1,0,0|3,0,0]=4 11722 B13R1.137 CCC1CCCN1CCCCOC 269982a_100000754278_100000730899 [0,0,0,1,0,0|3,0,0]=4 11723 B13R1.137 CCC1CCCN1CCCCOC 34a_100000754278_100000755781 [0,0,0,1,0,0|3,0,0]=4 11724 B13R1.137 CCC1CCCN1CCOCCO 2230a_100000754278_100011215305 [0,0,0,1,0,0|2,0,0]=3 11725 B13R1.137 CCC1CCCN1CCOCCO 269982a_100000754278_100011215305 [0,0,0,1,0,0|2,0,0]=3 11726 B13R1.137 CCC1CCCN1CCOCCO 34a_100000754278_100000692535 [0,0,0,1,0,0|2,0,0]=3 11727 B13R1.137 CCCCCCC1CCCC1NC 269862a_106832991636_100000189428 [0,0,0,1,0,0|2,0,0]=3 11728 B13R1.137 CCCCCCC1CCCC1NC 270004a_106832991635_100000189428 [0,0,0,1,0,0|2,0,0]=3 11729 B13R1.137 CCCCCCN1CCCC1C#N 2230a_100000701862_100000210314 [0,0,0,1,0,0|2,0,1]=4 11730 B13R1.137 CCCCCCN1CCCC1CC 2230a_100000754278_100000210314 [0,0,0,1,0,0|2,0,0]=3 11731 B13R1.137 CCCCCCN1CCCC1CC 269982a_100000754278_100000210757 [0,0,0,1,0,0|2,0,0]=3 11732 B13R1.137 CCCCCCN1CCCC1CC 34a_100000754278_100000210314 [0,0,0,1,0,0|2,0,0]=3 11733 B13R1.137 CCCCCCN1CCC[C@@H]1C#N 2230a_106645074975_100000210314 [0,0,0,1,0,0|2,0,1]=4 11734 B13R1.137 CCCCCCN1CCC[C@@H]1C#N 269982a_106645074975_100000210757 [0,0,0,1,0,0|2,0,1]=4 11735 B13R1.137 CCCCCCN1CCC[C@@H]1CO 2230a_100000745186_100000210314 [0,0,0,1,0,0|1,0,0]=2 11736 B13R1.137 CCCCCCN1CCC[C@@H]1CO 269982a_100000745186_100000210757 [0,0,0,1,0,0|1,0,0]=2 11737 B13R1.137 CCCCCCN1CCC[C@@H]1CO 34a_100000745186_100000210314 [0,0,0,1,0,0|1,0,0]=2 11738 B13R1.137 CCCCCNC1CCCC1CC 269862a_100000209983_100000749056 [0,0,0,1,0,0|2,0,0]=3 11739 B13R1.137 CCCCCNC1CCCC1CC 270004a_100000209983_100000749056 [0,0,0,1,0,0|2,0,0]=3 11740 B13R1.137 CCCCCO[C@@H]1CCC[C@H]1C#N 34a_100011907464_100000718602 [0,0,0,1,0,0|2,0,1]=4 11741 B13R1.137 CCCCCO[C@@H]1CCC[C@H]1C#N 7a_100011907464_100000210326 [0,0,0,1,0,0|2,0,1]=4 11742 B13R1.137 CCCCNCC1CCCN1CC 2230a_100000211693_100000210211 [0,0,0,1,0,0|3,0,0]=4 11743 B13R1.137 CCCCOCN1CCCC1CC 2230a_100000754278_100011995733 [0,0,0,1,0,0|3,0,0]=4 11744 B13R1.137 CCCCOCN1CCCC1CC 269982a_100000754278_100011995733 [0,0,0,1,0,0|3,0,0]=4 11745 B13R1.137 CCCCOCN1CCCC1CC 34a_100000754278_100011995733 [0,0,0,1,0,0|3,0,0]=4 11746 B13R1.137 CCCCOCN1CCC[C@@H]1CO 2230a_100000745186_100011995733 [0,0,0,1,0,0|2,0,0]=3 11747 B13R1.137 CCCCOCN1CCC[C@@H]1CO 269982a_100000745186_100011995733 [0,0,0,1,0,0|2,0,0]=3 11748 B13R1.137 CCCCOCN1CCC[C@@H]1CO 34a_100000745186_100011995733 [0,0,0,1,0,0|2,0,0]=3 11749 B13R1.137 CCCCOC[C@H]1CCCN1CC 34a_100011739246_100000210210 [0,0,0,1,0,0|3,0,0]=4 11750 B13R1.137 CCCCOC[C@H]1CCCN1CC 7a_100011739246_100000210211 [0,0,0,1,0,0|3,0,0]=4 11751 B13R1.137 CCCOCCN1CCCC1CC 2230a_100000754278_100011215938 [0,0,0,1,0,0|3,0,0]=4 11752 B13R1.137 CCCOCCN1CCCC1CC 269982a_100000754278_100011215938 [0,0,0,1,0,0|3,0,0]=4 11753 B13R1.137 CCCOCCN1CCCC1CC 34a_100000754278_100011215938 [0,0,0,1,0,0|3,0,0]=4 11754 B13R1.137 CCCOCCN1CCC[C@@H]1CO 2230a_100000745186_100011215938 [0,0,0,1,0,0|2,0,0]=3 11755 B13R1.137 CCCOCCN1CCC[C@@H]1CO 269982a_100000745186_100011215938 [0,0,0,1,0,0|2,0,0]=3 11756 B13R1.137 CCCOCCN1CCC[C@@H]1CO 34a_100000745186_100011215938 [0,0,0,1,0,0|2,0,0]=3 11757 B13R1.137 CCN1CCCC1CNCCCF 2230a_100000211693_100011934791 [0,0,0,1,0,0|3,0,0]=4 11758 B13R1.137 CCN1CCCC1CNCCCO 2230a_100000211693_100000230001 [0,0,0,1,0,0|2,0,0]=3 11759 B13R1.137 CCN1CCC[C@@H]1COCCCF 34a_100011739246_100011934791 [0,0,0,1,0,0|3,0,0]=4 11760 B13R1.137 CCN1CCC[C@@H]1COCCCF 7a_100011739246_100011934791 [0,0,0,1,0,0|3,0,0]=4 11761 B13R1.137 CCN1CCC[C@@H]1COCCCO 34a_100011739246_100000230001 [0,0,0,1,0,0|2,0,0]=3 11762 B13R1.137 CCN1CCC[C@@H]1COCCCO 7a_100011739246_100011215043 [0,0,0,1,0,0|2,0,0]=3 11763 B13R1.137 CCOCCCN1CCCC1CC 2230a_100000754278_100012232248 [0,0,0,1,0,0|3,0,0]=4 11764 B13R1.137 CCOCCCN1CCCC1CC 269982a_100000754278_100012232248 [0,0,0,1,0,0|3,0,0]=4 11765 B13R1.137 CCOCCCN1CCCC1CC 34a_100000754278_100012232248 [0,0,0,1,0,0|3,0,0]=4 11766 B13R1.137 CCOCCCN1CCC[C@@H]1CO 2230a_100000745186_100012232248 [0,0,0,1,0,0|2,0,0]=3 11767 B13R1.137 CCOCCCN1CCC[C@@H]1CO 269982a_100000745186_100012232248 [0,0,0,1,0,0|2,0,0]=3 11768 B13R1.137 CCOCCCN1CCC[C@@H]1CO 34a_100000745186_100012232248 [0,0,0,1,0,0|2,0,0]=3 11769 B13R1.137 CCOCCNC1CCCC1CC 269862a_100011200944_100000749056 [0,0,0,1,0,0|3,0,0]=4 11770 B13R1.137 CCOCCNC1CCCC1CC 270004a_102516460346_100000749056 [0,0,0,1,0,0|3,0,0]=4 11771 B13R1.137 CCSCCNC1CCCC1CC 269862a_100000106463_100000749056 [0,0,0,1,0,0|3,0,0]=4 11772 B13R1.137 CCSCCNC1CCCC1CC 270004a_100000106463_100000749056 [0,0,0,1,0,0|3,0,0]=4 11773 B13R1.137 COCCCCN1CCC[C@@H]1CO 2230a_100000745186_100000730899 [0,0,0,1,0,0|2,0,0]=3 11774 B13R1.137 COCCCCN1CCC[C@@H]1CO 269982a_100000745186_100000730899 [0,0,0,1,0,0|2,0,0]=3 11775 B13R1.137 COCCCCN1CCC[C@@H]1CO 34a_100000745186_100000755781 [0,0,0,1,0,0|2,0,0]=3 11776 B13R1.137 COCCOCN1CCC[C@@H]1CO 2230a_100000745186_100000231047 [0,0,0,1,0,0|3,0,0]=4 11777 B13R1.137 COCCOCN1CCC[C@@H]1CO 269982a_100000745186_100000231047 [0,0,0,1,0,0|3,0,0]=4 11778 B13R1.137 N#CC1CCCN1CCCCCO 2230a_100000701862_100000746330 [0,0,0,1,0,0|2,0,1]=4 11779 B13R1.137 N#CCCCCN1CCC[C@@H]1CO 2230a_100000745186_100000211819 [0,0,0,1,0,0|2,0,1]=4 11780 B13R1.137 N#CCCCCN1CCC[C@@H]1CO 269982a_100000745186_100011219923 [0,0,0,1,0,0|2,0,1]=4 11781 B13R1.137 N#C[C@@H]1CCC[C@H]1OCCCCO 34a_100011907464_100011216708 [0,0,0,1,0,0|2,0,1]=4 11782 B13R1.137 N#C[C@@H]1CCC[C@H]1OCCCCO 7a_100011907464_100000210776 [0,0,0,1,0,0|2,0,1]=4 11783 B13R1.137 N#C[C@H]1CCCN1CCCCCO 2230a_106645074975_100000746330 [0,0,0,1,0,0|2,0,1]=4 11784 B13R1.137 N#C[C@H]1CCCN1CCCCCO 269982a_106645074975_100000746330 [0,0,0,1,0,0|2,0,1]=4 11785 B13R1.137 O=CCCCCN1CCC[C@@H]1CO 2230a_100000745186_100000139335 [0,0,0,1,0,0|2,0,1]=4 11786 B13R1.137 O=CCCCCN1CCC[C@@H]1CO 269982a_100000745186_100000139335 [0,0,0,1,0,0|2,0,1]=4 11787 B13R1.137 OCCCCCN1CCC[C@@H]1CO 2230a_100000745186_100000746330 [0,0,0,1,0,0|2,0,0]=3 11788 B13R1.137 OCCCCCN1CCC[C@@H]1CO 269982a_100000745186_100000746330 [0,0,0,1,0,0|2,0,0]=3 11789 B13R1.137 OCCCCCN1CCC[C@@H]1CO 34a_100000745186_100000746330 [0,0,0,1,0,0|2,0,0]=3 11790 B13R1.137 OCCOCCN1CCC[C@@H]1CO 2230a_100000745186_100011215305 [0,0,0,1,0,0|3,0,0]=4 11791 B13R1.137 OCCOCCN1CCC[C@@H]1CO 269982a_100000745186_100011215305 [0,0,0,1,0,0|3,0,0]=4 11792 B13R1.137 OCCOCCN1CCC[C@@H]1CO 34a_100000745186_100000692535 [0,0,0,1,0,0|3,0,0]=4 11793 B13R1.137 OC[C@H]1CCCN1CCCCCF 2230a_100000745186_100000729378 [0,0,0,1,0,0|2,0,0]=3 11794 B13R1.137 OC[C@H]1CCCN1CCCCCF 269982a_100000745186_100000729378 [0,0,0,1,0,0|2,0,0]=3 11795 B13R1.137 OC[C@H]1CCCN1CCCCCF 34a_100000745186_100000729378 [0,0,0,1,0,0|2,0,0]=3 11796 B13R1.192 CCCCCCN1CCC1COC 2230a_100015195929_100000210314 [0,0,0,1,0,0|3,0,0]=4 11797 B13R1.192 CCCCCCN1CCC1COC 269982a_100015195929_100000210757 [0,0,0,1,0,0|3,0,0]=4 11798 B13R1.192 CCCCCCN1CCC1COC 34a_100015195929_100000210314 [0,0,0,1,0,0|3,0,0]=4 11799 B13R1.192 COCC1CCN1CCCCCF 2230a_100015195929_100000729378 [0,0,0,1,0,0|3,0,0]=4 11800 B13R1.192 COCC1CCN1CCCCCF 269982a_100015195929_100000729378 [0,0,0,1,0,0|3,0,0]=4 11801 B13R1.192 COCC1CCN1CCCCCF 34a_100015195929_100000729378 [0,0,0,1,0,0|3,0,0]=4 11802 B13R1.192 COCC1CCN1CCCCCO 2230a_100015195929_100000746330 [0,0,0,1,0,0|2,0,0]=3 11803 B13R1.192 COCC1CCN1CCCCCO 269982a_100015195929_100000746330 [0,0,0,1,0,0|2,0,0]=3 11804 B13R1.192 COCC1CCN1CCCCCO 34a_100015195929_100000746330 [0,0,0,1,0,0|2,0,0]=3 11805 B13R1.192 COCC1CCN1CCOCCO 2230a_100015195929_100011215305 [0,0,0,1,0,0|3,0,0]=4 11806 B13R1.192 COCC1CCN1CCOCCO 269982a_100015195929_100011215305 [0,0,0,1,0,0|3,0,0]=4 11807 B13R1.192 COCC1CCN1CCOCCO 34a_100015195929_100000692535 [0,0,0,1,0,0|3,0,0]=4 11808 B13R1.485 C#CCCN1CCCCC1CCC 2230a_100000701414_100000688953 [0,0,0,1,0,0|2,0,1]=4 11809 B13R1.485 C#CCCN1CCCCC1CCC 269982a_100000701414_100000730999 [0,0,0,1,0,0|2,0,1]=4 11810 B13R1.485 C#CCCN1CCCCC1CCC 34a_100000701414_100000688953 [0,0,0,1,0,0|2,0,1]=4 11811 B13R1.485 C#CCCN1CCCCC1CCO 2230a_100000211664_100000688953 [0,0,0,1,0,0|1,0,2]=4 11812 B13R1.485 C#CCCN1CCCCC1CCO 269982a_100000211664_100000730999 [0,0,0,1,0,0|1,0,2]=4 11813 B13R1.485 C#CCCN1CCCCC1CCO 34a_100000211664_100000688953 [0,0,0,1,0,0|1,0,2]=4 11814 B13R1.485 C#CCN1CCCCC1CCCO 2230a_100011934581_100000038162 [0,0,0,1,0,0|1,0,2]=4 11815 B13R1.485 C#CCN1CCCCC1CCCO 34a_100011934581_100000184674 [0,0,0,1,0,0|1,0,2]=4 11816 B13R1.485 C#CCOC1CCCCC1CCC 34a_100011217265_100000184674 [0,0,0,1,0,0|2,0,1]=4 11817 B13R1.485 C#CCOC1CCCCC1CCC 7a_100011217265_100000038162 [0,0,0,1,0,0|2,0,1]=4 11818 B13R1.485 C/C=C/CN1CCCCC1CCO 269982a_100000211664_100102629194 [0,0,0,1,0,0|1,0,2]=4 11819 B13R1.485 C/C=C/CN1CCCCC1CCO 34a_100000211664_100102629194 [0,0,0,1,0,0|1,0,2]=4 11820 B13R1.485 C=CCC1CCCCC1NCCC 269862a_100020643023_100011214939 [0,0,0,1,0,0|2,0,1]=4 11821 B13R1.485 C=CCC1CCCCC1NCCC 270004a_100020643023_100011214939 [0,0,0,1,0,0|2,0,1]=4 11822 B13R1.485 C=CCC1CCCCC1NCCO 269862a_100000210304_100011214939 [0,0,0,1,0,0|1,0,2]=4 11823 B13R1.485 C=CCC1CCCCC1NCCO 270004a_100000210304_100011214939 [0,0,0,1,0,0|1,0,2]=4 11824 B13R1.485 C=CCCN1CCCCC1CCC 2230a_100000701414_100000754431 [0,0,0,1,0,0|2,0,1]=4 11825 B13R1.485 C=CCCN1CCCCC1CCC 269982a_100000701414_100000754431 [0,0,0,1,0,0|2,0,1]=4 11826 B13R1.485 C=CCCN1CCCCC1CCC 34a_100000701414_100000754431 [0,0,0,1,0,0|2,0,1]=4 11827 B13R1.485 C=CCCN1CCCCC1CCO 2230a_100000211664_100000754431 [0,0,0,1,0,0|1,0,2]=4 11828 B13R1.485 C=CCCN1CCCCC1CCO 269982a_100000211664_100000754431 [0,0,0,1,0,0|1,0,2]=4 11829 B13R1.485 C=CCCN1CCCCC1CCO 34a_100000211664_100000754431 [0,0,0,1,0,0|1,0,2]=4 11830 B13R1.485 C=CCN1CCCCC1CCCO 2230a_100011934581_100000210623 [0,0,0,1,0,0|1,0,2]=4 11831 B13R1.485 C=CCN1CCCCC1CCCO 269982a_100011934581_100000210623 [0,0,0,1,0,0|1,0,2]=4 11832 B13R1.485 C=CCN1CCCCC1CCCO 34a_100011934581_100015514636 [0,0,0,1,0,0|1,0,2]=4 11833 B13R1.485 C=CCNC1CCCCC1CCC 270004a_100020586998_100011218038 [0,0,0,1,0,0|2,0,1]=4 11834 B13R1.485 C=CCOC1CCCCC1CCC 34a_100011217265_100015514636 [0,0,0,1,0,0|2,0,1]=4 11835 B13R1.485 C=CCOC1CCCCC1CCC 7a_100011217265_100015514636 [0,0,0,1,0,0|2,0,1]=4 11836 B13R1.485 CC#CCN1CCCCC1CCO 2230a_100000211664_100000748600 [0,0,0,1,0,0|1,0,2]=4 11837 B13R1.485 CC#CCN1CCCCC1CCO 34a_100000211664_100000748600 [0,0,0,1,0,0|1,0,2]=4 11838 B13R1.485 CC=CCN1CCCCC1CCO 2230a_100000211664_100000070051 [0,0,0,1,0,0|1,0,2]=4 11839 B13R1.485 CC=CCN1CCCCC1CCO 34a_100000211664_100000070051 [0,0,0,1,0,0|1,0,2]=4 11840 B13R1.485 CCCC1CCCCC1NCCF 269862a_100000724931_100011218038 [0,0,0,1,0,0|2,0,0]=3 11841 B13R1.485 CCCC1CCCCC1NCCO 269862a_100000210304_100011218038 [0,0,0,1,0,0|1,0,0]=2 11842 B13R1.485 CCCC1CCCCC1NCCO 270004a_100000210304_100011218038 [0,0,0,1,0,0|1,0,0]=2 11843 B13R1.485 CCCC1CCCCC1OCC#N 7a_100011217265_100011215382 [0,0,0,1,0,0|2,0,1]=4 11844 B13R1.485 CCCC1CCCCC1OCC=O 34a_100011217265_200009817547 [0,0,0,1,0,0|1,0,2]=4 11845 B13R1.485 CCCC1CCCCC1OCC=O 7a_100011217265_200015260668 [0,0,0,1,0,0|1,0,2]=4 11846 B13R1.485 CCCC1CCCCC1OCCF 34a_100011217265_100011217306 [0,0,0,1,0,0|2,0,0]=3 11847 B13R1.485 CCCC1CCCCC1OCCF 7a_100011217265_100011217306 [0,0,0,1,0,0|2,0,0]=3 11848 B13R1.485 CCCC1CCCCC1OCCO 34a_100011217265_100000211926 [0,0,0,1,0,0|1,0,0]=2 11849 B13R1.485 CCCC1CCCCC1OCCO 7a_100011217265_100000211926 [0,0,0,1,0,0|1,0,0]=2 11850 B13R1.485 CCCC1CCCCC1OCSC 34a_100011217265_100011218213 [0,0,0,1,0,0|3,0,0]=4 11851 B13R1.485 CCCC1CCCCN1CCC#N 2230a_100000701414_100011215226 [0,0,0,1,0,0|2,0,1]=4 11852 B13R1.485 CCCC1CCCCN1CCC#N 269982a_100000701414_100011215226 [0,0,0,1,0,0|2,0,1]=4 11853 B13R1.485 CCCC1CCCCN1CCCF 2230a_100000701414_100011934791 [0,0,0,1,0,0|2,0,0]=3 11854 B13R1.485 CCCC1CCCCN1CCCF 269982a_100000701414_100011934791 [0,0,0,1,0,0|2,0,0]=3 11855 B13R1.485 CCCC1CCCCN1CCCF 34a_100000701414_100011934791 [0,0,0,1,0,0|2,0,0]=3 11856 B13R1.485 CCCC1CCCCN1CCCO 2230a_100000701414_100000230001 [0,0,0,1,0,0|1,0,0]=2 11857 B13R1.485 CCCC1CCCCN1CCCO 269982a_100000701414_100011215043 [0,0,0,1,0,0|1,0,0]=2 11858 B13R1.485 CCCC1CCCCN1CCCO 34a_100000701414_100000230001 [0,0,0,1,0,0|1,0,0]=2 11859 B13R1.485 CCCC1CCCCN1CCOC 2230a_100000701414_100011201679 [0,0,0,1,0,0|3,0,0]=4 11860 B13R1.485 CCCC1CCCCN1CCOC 269982a_100000701414_100000233755 [0,0,0,1,0,0|3,0,0]=4 11861 B13R1.485 CCCC1CCCCN1CCOC 34a_100000701414_100011201679 [0,0,0,1,0,0|3,0,0]=4 11862 B13R1.485 CCCC1CCCCN1CCSC 2230a_100000701414_100000751147 [0,0,0,1,0,0|3,0,0]=4 11863 B13R1.485 CCCC1CCCCN1CCSC 269982a_100000701414_100000212216 [0,0,0,1,0,0|3,0,0]=4 11864 B13R1.485 CCCC1CCCCN1CCSC 34a_100000701414_100000212216 [0,0,0,1,0,0|3,0,0]=4 11865 B13R1.485 CCCC1CCCCN1COCC 269982a_100000701414_100000739092 [0,0,0,1,0,0|3,0,0]=4 11866 B13R1.485 CCCC1COCCN1CCCF 2230a_102495339903_100011934791 [0,0,0,1,0,0|3,0,0]=4 11867 B13R1.485 CCCC1COCCN1CCCF 269982a_102495339903_100011934791 [0,0,0,1,0,0|3,0,0]=4 11868 B13R1.485 CCCC1COCCN1CCCF 34a_102495339903_100011934791 [0,0,0,1,0,0|3,0,0]=4 11869 B13R1.485 CCCC1COCCN1CCCO 2230a_102495339903_100000230001 [0,0,0,1,0,0|2,0,0]=3 11870 B13R1.485 CCCC1COCCN1CCCO 269982a_102495339903_100011215043 [0,0,0,1,0,0|2,0,0]=3 11871 B13R1.485 CCCC1COCCN1CCCO 34a_102495339903_100000230001 [0,0,0,1,0,0|2,0,0]=3 11872 B13R1.485 CCCCN1CCCCC1CC#N 2230a_100000133382_100000210211 [0,0,0,1,0,0|2,0,1]=4 11873 B13R1.485 CCCCN1CCCCC1CC#N 34a_100000133382_100000210210 [0,0,0,1,0,0|2,0,1]=4 11874 B13R1.485 CCCCN1CCCCC1CCC 2230a_100000701414_100000210211 [0,0,0,1,0,0|2,0,0]=3 11875 B13R1.485 CCCCN1CCCCC1CCC 269982a_100000701414_100000210211 [0,0,0,1,0,0|2,0,0]=3 11876 B13R1.485 CCCCN1CCCCC1CCC 34a_100000701414_100000210210 [0,0,0,1,0,0|2,0,0]=3 11877 B13R1.485 CCCCN1CCCCC1CCO 2230a_100000211664_100000210211 [0,0,0,1,0,0|1,0,0]=2 11878 B13R1.485 CCCCN1CCCCC1CCO 269982a_100000211664_100000210211 [0,0,0,1,0,0|1,0,0]=2 11879 B13R1.485 CCCCN1CCCCC1CCO 34a_100000211664_100000210210 [0,0,0,1,0,0|1,0,0]=2 11880 B13R1.485 CCCCN1CCCCC1COC 2230a_100015184032_100000210211 [0,0,0,1,0,0|3,0,0]=4 11881 B13R1.485 CCCCN1CCCCC1COC 269982a_100015184032_100000210211 [0,0,0,1,0,0|3,0,0]=4 11882 B13R1.485 CCCCN1CCCCC1COC 34a_100015184032_100000210210 [0,0,0,1,0,0|3,0,0]=4 11883 B13R1.485 CCCCN1CCOCC1CCC 2230a_102495339903_100000210211 [0,0,0,1,0,0|3,0,0]=4 11884 B13R1.485 CCCCN1CCOCC1CCC 269982a_102495339903_100000210211 [0,0,0,1,0,0|3,0,0]=4 11885 B13R1.485 CCCCN1CCOCC1CCC 34a_102495339903_100000210210 [0,0,0,1,0,0|3,0,0]=4 11886 B13R1.485 CCCN1CCCCC1CCCO 2230a_100011934581_100000210303 [0,0,0,1,0,0|1,0,0]=2 11887 B13R1.485 CCCN1CCCCC1CCCO 269982a_100011934581_100000210303 [0,0,0,1,0,0|1,0,0]=2 11888 B13R1.485 CCCN1CCCCC1CCCO 34a_100011934581_100000210303 [0,0,0,1,0,0|1,0,0]=2 11889 B13R1.485 CCCN1CCCCC1CCOC 2230a_100015186528_100000210303 [0,0,0,1,0,0|3,0,0]=4 11890 B13R1.485 CCCN1CCCCC1CCOC 269982a_100015186528_100000210303 [0,0,0,1,0,0|3,0,0]=4 11891 B13R1.485 CCCN1CCCCC1CCOC 34a_100015186528_100000210303 [0,0,0,1,0,0|3,0,0]=4 11892 B13R1.485 CCCNC1CCCCC1CC#N 270004a_100020643023_100009866218 [0,0,0,1,0,0|2,0,1]=4 11893 B13R1.485 CCCNC1CCCCC1CCC 269862a_100020643023_100011218038 [0,0,0,1,0,0|2,0,0]=3 11894 B13R1.485 CCCNC1CCCCC1CCC 270004a_100020643023_100011218038 [0,0,0,1,0,0|2,0,0]=3 11895 B13R1.485 CCCNC1CCCCC1OCC 270004a_100020643023_200000031474 [0,0,0,1,0,0|3,0,0]=4 11896 B13R1.485 CCCOC1CCCCC1CCC 34a_100011217265_100000210303 [0,0,0,1,0,0|2,0,0]=3 11897 B13R1.485 CCCOC1CCCCC1CCC 7a_100011217265_100000210303 [0,0,0,1,0,0|2,0,0]=3 11898 B13R1.485 CCNC1CCCCC1CCC#N 270004a_100015525214_100000034616 [0,0,0,1,0,0|2,0,1]=4 11899 B13R1.485 CCOC1CCCCC1NCCO 270004a_100000210304_200000031474 [0,0,0,1,0,0|2,0,0]=3 11900 B13R1.485 CCOCC1CCCCN1CCN 34a_100011473795_100000210202 [0,0,0,1,0,0|3,0,0]=4 11901 B13R1.485 CCOCN1CCCCC1CCO 269982a_100000211664_100000739092 [0,0,0,1,0,0|2,0,0]=3 11902 B13R1.485 COCC1CCCCN1CCCF 2230a_100015184032_100011934791 [0,0,0,1,0,0|3,0,0]=4 11903 B13R1.485 COCC1CCCCN1CCCF 269982a_100015184032_100011934791 [0,0,0,1,0,0|3,0,0]=4 11904 B13R1.485 COCC1CCCCN1CCCF 34a_100015184032_100011934791 [0,0,0,1,0,0|3,0,0]=4 11905 B13R1.485 COCC1CCCCN1CCCN 34a_200011473794_200000210301 [0,0,0,1,0,0|3,0,0]=4 11906 B13R1.485 COCC1CCCCN1CCCO 2230a_100015184032_100000230001 [0,0,0,1,0,0|2,0,0]=3 11907 B13R1.485 COCC1CCCCN1CCCO 269982a_100015184032_100011215043 [0,0,0,1,0,0|2,0,0]=3 11908 B13R1.485 COCC1CCCCN1CCCO 34a_100015184032_100000230001 [0,0,0,1,0,0|2,0,0]=3 11909 B13R1.485 COCCC1CCCCN1CCF 2230a_100015186528_100011217306 [0,0,0,1,0,0|3,0,0]=4 11910 B13R1.485 COCCC1CCCCN1CCF 269982a_100015186528_100011217306 [0,0,0,1,0,0|3,0,0]=4 11911 B13R1.485 COCCC1CCCCN1CCF 34a_100015186528_100011217306 [0,0,0,1,0,0|3,0,0]=4 11912 B13R1.485 COCCC1CCCCN1CCO 2230a_100015186528_100000211926 [0,0,0,1,0,0|2,0,0]=3 11913 B13R1.485 COCCC1CCCCN1CCO 269982a_100015186528_100000211926 [0,0,0,1,0,0|2,0,0]=3 11914 B13R1.485 COCCC1CCCCN1CCO 34a_100015186528_100000211926 [0,0,0,1,0,0|2,0,0]=3 11915 B13R1.485 COCCN1CCCCC1CCO 2230a_100000211664_100011201679 [0,0,0,1,0,0|2,0,0]=3 11916 B13R1.485 COCCN1CCCCC1CCO 269982a_100000211664_100000233755 [0,0,0,1,0,0|2,0,0]=3 11917 B13R1.485 COCCN1CCCCC1CCO 34a_100000211664_100011201679 [0,0,0,1,0,0|2,0,0]=3 11918 B13R1.485 COCN1CCCCC1CCCO 2230a_100011934581_100000766300 [0,0,0,1,0,0|2,0,0]=3 11919 B13R1.485 COCN1CCCCC1CCCO 269982a_100011934581_100000766300 [0,0,0,1,0,0|2,0,0]=3 11920 B13R1.485 COC[C@H]1COCCN1CCCO 2230a_100016989928_100000230001 [0,0,0,1,0,0|3,0,0]=4 11921 B13R1.485 COC[C@H]1COCCN1CCCO 269982a_100016989928_100011215043 [0,0,0,1,0,0|3,0,0]=4 11922 B13R1.485 COC[C@H]1COCCN1CCCO 34a_100016989928_100000230001 [0,0,0,1,0,0|3,0,0]=4 11923 B13R1.485 CSCCN1CCCCC1CCO 2230a_100000211664_100000751147 [0,0,0,1,0,0|2,0,0]=3 11924 B13R1.485 CSCCN1CCCCC1CCO 269982a_100000211664_100000212216 [0,0,0,1,0,0|2,0,0]=3 11925 B13R1.485 CSCCN1CCCCC1CCO 34a_100000211664_100000212216 [0,0,0,1,0,0|2,0,0]=3 11926 B13R1.485 CSCN1CCCCC1CCCO 2230a_100011934581_100011218213 [0,0,0,1,0,0|2,0,0]=3 11927 B13R1.485 CSCN1CCCCC1CCCO 269982a_100011934581_100011218213 [0,0,0,1,0,0|2,0,0]=3 11928 B13R1.485 CSCN1CCCCC1CCCO 34a_100011934581_100011218213 [0,0,0,1,0,0|2,0,0]=3 11929 B13R1.485 N#CCC1CCCCC1NCCO 270004a_100000210304_100009866218 [0,0,0,1,0,0|2,0,1]=4 11930 B13R1.485 N#CCC1CCCCN1CCCO 2230a_100000133382_100000230001 [0,0,0,1,0,0|2,0,1]=4 11931 B13R1.485 N#CCC1CCCCN1CCCO 34a_100000133382_100000230001 [0,0,0,1,0,0|2,0,1]=4 11932 B13R1.485 N#CCCN1CCCCC1CCO 2230a_100000211664_100011215226 [0,0,0,1,0,0|2,0,1]=4 11933 B13R1.485 N#CCCN1CCCCC1CCO 269982a_100000211664_100011215226 [0,0,0,1,0,0|2,0,1]=4 11934 B13R1.485 N#CCN1CCCCC1CCCO 2230a_100011934581_100011215382 [0,0,0,1,0,0|2,0,1]=4 11935 B13R1.485 N#CCN1CCCCC1CCCO 269982a_100011934581_100011214920 [0,0,0,1,0,0|2,0,1]=4 11936 B13R1.485 O=CCN1CCCCC1CCCO 2230a_100011934581_200015260668 [0,0,0,1,0,0|2,0,1]=4 11937 B13R1.485 O=CCN1CCCCC1CCCO 269982a_100011934581_200015260668 [0,0,0,1,0,0|2,0,1]=4 11938 B13R1.485 O=CCN1CCCCC1CCCO 34a_100011934581_200009817547 [0,0,0,1,0,0|2,0,1]=4 11939 B13R1.485 OCCC1CCCCN1CCCF 2230a_100000211664_100011934791 [0,0,0,1,0,0|2,0,0]=3 11940 B13R1.485 OCCC1CCCCN1CCCF 269982a_100000211664_100011934791 [0,0,0,1,0,0|2,0,0]=3 11941 B13R1.485 OCCC1CCCCN1CCCF 34a_100000211664_100011934791 [0,0,0,1,0,0|2,0,0]=3 11942 B13R1.485 OCCCC1CCCCN1CCF 2230a_100011934581_100011217306 [0,0,0,1,0,0|2,0,0]=3 11943 B13R1.485 OCCCC1CCCCN1CCF 269982a_100011934581_100011217306 [0,0,0,1,0,0|2,0,0]=3 11944 B13R1.485 OCCCC1CCCCN1CCF 34a_100011934581_100011217306 [0,0,0,1,0,0|2,0,0]=3 11945 B13R1.485 OCCCC1CCCCN1CCO 2230a_100011934581_100000211926 [0,0,0,1,0,0|2,0,0]=3 11946 B13R1.485 OCCCC1CCCCN1CCO 269982a_100011934581_100000211926 [0,0,0,1,0,0|2,0,0]=3 11947 B13R1.485 OCCCC1CCCCN1CCO 34a_100011934581_100000211926 [0,0,0,1,0,0|2,0,0]=3 11948 B13R1.485 OCCCN1CCCCC1CCO 2230a_100000211664_100000230001 [0,0,0,1,0,0|2,0,0]=3 11949 B13R1.485 OCCCN1CCCCC1CCO 269982a_100000211664_100011215043 [0,0,0,1,0,0|2,0,0]=3 11950 B13R1.485 OCCCN1CCCCC1CCO 34a_100000211664_100000230001 [0,0,0,1,0,0|2,0,0]=3 11951 B13R1.485 [13CH3]OCC1CCCCN1CCCN 34a_200011473794_200025704644 [0,0,0,1,0,0|3,0,0]=4 11952 B13R1.489 C#CCCN1CCCCCCCC1 2230a_100000039187_100000688953 [0,0,0,1,0,0|2,0,1]=4 11953 B13R1.489 C#CCCN1CCCCCCCC1 269982a_100000039187_100000730999 [0,0,0,1,0,0|2,0,1]=4 11954 B13R1.489 C#CCCN1CCCCCCCC1 34a_100000039187_100000688953 [0,0,0,1,0,0|2,0,1]=4 11955 B13R1.489 C=CCCN1CCCCCCCC1 2230a_100000039187_100000754431 [0,0,0,1,0,0|2,0,1]=4 11956 B13R1.489 C=CCCN1CCCCCCCC1 269982a_100000039187_100000754431 [0,0,0,1,0,0|2,0,1]=4 11957 B13R1.489 C=CCCN1CCCCCCCC1 34a_100000039187_100000754431 [0,0,0,1,0,0|2,0,1]=4 11958 B13R1.489 C=CCNC1CCCCCCCC1 270004a_100020586998_100000038600 [0,0,0,1,0,0|2,0,1]=4 11959 B13R1.489 CCCCN1CCCCCCCC1 2230a_100000039187_100000210211 [0,0,0,1,0,0|2,0,0]=3 11960 B13R1.489 CCCCN1CCCCCCCC1 269982a_100000039187_100000210211 [0,0,0,1,0,0|2,0,0]=3 11961 B13R1.489 CCCCN1CCCCCCCC1 34a_100000039187_100000210210 [0,0,0,1,0,0|2,0,0]=3 11962 B13R1.489 CCCNC1CCCCCCCC1 270004a_100020643023_100000038600 [0,0,0,1,0,0|2,0,0]=3 11963 B13R1.489 CCOCN1CCCCCCCC1 269982a_100000039187_100000739092 [0,0,0,1,0,0|3,0,0]=4 11964 B13R1.489 COCCN1CCCCCCCC1 2230a_100000039187_100011201679 [0,0,0,1,0,0|3,0,0]=4 11965 B13R1.489 COCCN1CCCCCCCC1 269982a_100000039187_100000233755 [0,0,0,1,0,0|3,0,0]=4 11966 B13R1.489 COCCN1CCCCCCCC1 34a_100000039187_100011201679 [0,0,0,1,0,0|3,0,0]=4 11967 B13R1.489 CSCCN1CCCCCCCC1 2230a_100000039187_100000751147 [0,0,0,1,0,0|3,0,0]=4 11968 B13R1.489 CSCCN1CCCCCCCC1 269982a_100000039187_100000212216 [0,0,0,1,0,0|3,0,0]=4 11969 B13R1.489 CSCCN1CCCCCCCC1 34a_100000039187_100000212216 [0,0,0,1,0,0|3,0,0]=4 11970 B13R1.489 FCCCN1CCCCCCCC1 2230a_100000039187_100011934791 [0,0,0,1,0,0|2,0,0]=3 11971 B13R1.489 FCCCN1CCCCCCCC1 269982a_100000039187_100011934791 [0,0,0,1,0,0|2,0,0]=3 11972 B13R1.489 FCCCN1CCCCCCCC1 34a_100000039187_100011934791 [0,0,0,1,0,0|2,0,0]=3 11973 B13R1.489 N#CCCN1CCCCCCCC1 2230a_100000039187_100011215226 [0,0,0,1,0,0|2,0,1]=4 11974 B13R1.489 N#CCCN1CCCCCCCC1 269982a_100000039187_100011215226 [0,0,0,1,0,0|2,0,1]=4 11975 B13R1.489 OCCCN1CCCCCCCC1 2230a_100000039187_100000230001 [0,0,0,1,0,0|1,0,0]=2 11976 B13R1.489 OCCCN1CCCCCCCC1 269982a_100000039187_100011215043 [0,0,0,1,0,0|1,0,0]=2 11977 B13R1.489 OCCCN1CCCCCCCC1 34a_100000039187_100000230001 [0,0,0,1,0,0|1,0,0]=2 11978 B13R1.489 OCCNC1CCCCCCCC1 270004a_100000210304_100000038600 [0,0,0,1,0,0|1,0,0]=2 11979 B13R1.555 C#CCCCCN1CCCCC1C 2230a_100000211376_100010269958 [0,0,0,1,0,0|2,0,1]=4 11980 B13R1.555 C#CCCCCN1CCCCC1C 269982a_100000211376_100010269958 [0,0,0,1,0,0|2,0,1]=4 11981 B13R1.555 C#CCCCCN1CCCCC1C 34a_100000211376_100010269958 [0,0,0,1,0,0|2,0,1]=4 11982 B13R1.555 C#CCCCNC1CCCCC1C 2230a_100000211402_100000731252 [0,0,0,1,0,0|2,0,1]=4 11983 B13R1.555 C#CCCCNC1CCCCC1C 270004a_100000718082_100000210921 [0,0,0,1,0,0|2,0,1]=4 11984 B13R1.555 C#CCCCNC1CCCCC1C 34a_100000211402_100000695029 [0,0,0,1,0,0|2,0,1]=4 11985 B13R1.555 C#CCCCNC1CCCCC1O 34a_100000718082_100000038908 [0,0,0,1,0,0|1,0,2]=4 11986 B13R1.555 C#CCCCOC1CCCCC1C 34a_100000211207_100000695029 [0,0,0,1,0,0|2,0,1]=4 11987 B13R1.555 C#CCCCOC1CCCCC1C 7a_100000211207_100011215417 [0,0,0,1,0,0|2,0,1]=4 11988 B13R1.555 C#CCCCOC1CCCCC1O 34a_100000215630_100000038908 [0,0,0,1,0,0|1,0,2]=4 11989 B13R1.555 C#CCCCSC1CCCCC1O 62a_100000038908_100011215417 [0,0,0,1,0,0|1,0,2]=4 11990 B13R1.555 C#CCCCSC1CCCCC1O 62a_100011215417_100000038908 [0,0,0,1,0,0|1,0,2]=4 11991 B13R1.555 C#CCCNCC1CCCCC1O 34a_100011216029_100000688953 [0,0,0,1,0,0|1,0,2]=4 11992 B13R1.555 C/C=C/CCOC1CCCCC1O 34a_100016278192_100000038908 [0,0,0,1,0,0|1,0,2]=4 11993 B13R1.555 C/C=C/CNCC1CCCCC1O 34a_100011216029_100102629194 [0,0,0,1,0,0|1,0,2]=4 11994 B13R1.555 C=CCCCCN1CCCCC1C 2230a_100000211376_100011215482 [0,0,0,1,0,0|2,0,1]=4 11995 B13R1.555 C=CCCCCN1CCCCC1C 269982a_100000211376_100011215482 [0,0,0,1,0,0|2,0,1]=4 11996 B13R1.555 C=CCCCCN1CCCCC1C 34a_100000211376_100011215482 [0,0,0,1,0,0|2,0,1]=4 11997 B13R1.555 C=CCCCNC1CCCCC1C 2230a_100000211402_100011713584 [0,0,0,1,0,0|2,0,1]=4 11998 B13R1.555 C=CCCCNC1CCCCC1C 269862a_100000700776_100000210921 [0,0,0,1,0,0|2,0,1]=4 11999 B13R1.555 C=CCCCNC1CCCCC1C 270004a_100000700776_100000210921 [0,0,0,1,0,0|2,0,1]=4 12000 B13R1.555 C=CCCCNC1CCCCC1C 34a_100000211402_100000757094 [0,0,0,1,0,0|2,0,1]=4 12001 B13R1.555 C=CCCCNC1CCCCC1O 34a_100000700776_100000038908 [0,0,0,1,0,0|1,0,2]=4 12002 B13R1.555 C=CCCCOC1CCCCC1C 34a_100000211207_100000757094 [0,0,0,1,0,0|2,0,1]=4 12003 B13R1.555 C=CCCCOC1CCCCC1C 7a_100000211207_100000757094 [0,0,0,1,0,0|2,0,1]=4 12004 B13R1.555 C=CCCCOC1CCCCC1O 34a_100000758997_100000038908 [0,0,0,1,0,0|1,0,2]=4 12005 B13R1.555 C=CCCCSC1CCCCC1O 62a_100000038908_100000757094 [0,0,0,1,0,0|1,0,2]=4 12006 B13R1.555 C=CCCCSC1CCCCC1O 62a_100011713584_100000038908 [0,0,0,1,0,0|1,0,2]=4 12007 B13R1.555 C=CCCNCC1CCCCC1O 34a_100011216029_100000754431 [0,0,0,1,0,0|1,0,2]=4 12008 B13R1.555 CC#CCCOC1CCCCC1O 34a_100000750427_100000038908 [0,0,0,1,0,0|1,0,2]=4 12009 B13R1.555 CC#CCNCC1CCCCC1O 34a_100011216029_100000748600 [0,0,0,1,0,0|1,0,2]=4 12010 B13R1.555 CC/C=C\COC1CCCCC1O 34a_100016268518_100000038908 [0,0,0,1,0,0|1,0,2]=4 12011 B13R1.555 CC/C=C\CSC1CCCCC1O 62a_100000038908_100103147603 [0,0,0,1,0,0|1,0,2]=4 12012 B13R1.555 CC/C=C\CSC1CCCCC1O 62a_100103147603_100000038908 [0,0,0,1,0,0|1,0,2]=4 12013 B13R1.555 CC1CC=CCC1CNCCCO 269862a_100000182051_100000117039 [0,0,0,1,0,0|1,0,2]=4 12014 B13R1.555 CC1CC=CCC1CNCCCO 270004a_100000182051_100000117039 [0,0,0,1,0,0|1,0,2]=4 12015 B13R1.555 CC1CC=CCC1COCCCO 34a_100000211322_100000230001 [0,0,0,1,0,0|1,0,2]=4 12016 B13R1.555 CC1CCCCC1NCC#CCO 2230a_100000211402_200000047223 [0,0,0,1,0,0|1,0,2]=4 12017 B13R1.555 CC1CCCCC1NCC#CCO 34a_100000211402_200000047223 [0,0,0,1,0,0|1,0,2]=4 12018 B13R1.555 CC1CCCCC1NCCCC#N 2230a_100000211402_100000687738 [0,0,0,1,0,0|2,0,1]=4 12019 B13R1.555 CC1CCCCC1NCCCC=O 2230a_100000211402_200011292268 [0,0,0,1,0,0|1,0,2]=4 12020 B13R1.555 CC1CCCCC1NCCCCF 2230a_100000211402_100000729493 [0,0,0,1,0,0|2,0,0]=3 12021 B13R1.555 CC1CCCCC1NCCCCF 34a_100000211402_100000729493 [0,0,0,1,0,0|2,0,0]=3 12022 B13R1.555 CC1CCCCC1NCCCCO 2230a_100000211402_100000210776 [0,0,0,1,0,0|1,0,0]=2 12023 B13R1.555 CC1CCCCC1NCCCCO 269862a_100000750430_100000210921 [0,0,0,1,0,0|1,0,0]=2 12024 B13R1.555 CC1CCCCC1NCCCCO 270004a_100000750430_100000210921 [0,0,0,1,0,0|1,0,0]=2 12025 B13R1.555 CC1CCCCC1NCCCCO 34a_100000211402_100011216708 [0,0,0,1,0,0|1,0,0]=2 12026 B13R1.555 CC1CCCCC1OCC#CCO 34a_100000211207_200000047223 [0,0,0,1,0,0|1,0,2]=4 12027 B13R1.555 CC1CCCCC1OCC#CCO 7a_100000211207_200000047223 [0,0,0,1,0,0|1,0,2]=4 12028 B13R1.555 CC1CCCCC1OCCCC#N 7a_100000211207_100000687738 [0,0,0,1,0,0|2,0,1]=4 12029 B13R1.555 CC1CCCCC1OCCCC=O 7a_100000211207_200011292268 [0,0,0,1,0,0|1,0,2]=4 12030 B13R1.555 CC1CCCCC1OCCCCF 34a_100000211207_100000729493 [0,0,0,1,0,0|2,0,0]=3 12031 B13R1.555 CC1CCCCC1OCCCCF 7a_100000211207_100000729493 [0,0,0,1,0,0|2,0,0]=3 12032 B13R1.555 CC1CCCCC1OCCCCO 34a_100000211207_100011216708 [0,0,0,1,0,0|1,0,0]=2 12033 B13R1.555 CC1CCCCC1OCCCCO 7a_100000211207_100000210776 [0,0,0,1,0,0|1,0,0]=2 12034 B13R1.555 CC1CCCCN1CCCCC#N 2230a_100000211376_100000211819 [0,0,0,1,0,0|2,0,1]=4 12035 B13R1.555 CC1CCCCN1CCCCC#N 269982a_100000211376_100011219923 [0,0,0,1,0,0|2,0,1]=4 12036 B13R1.555 CC1CCCCN1CCCCC=O 2230a_100000211376_100000139335 [0,0,0,1,0,0|1,0,2]=4 12037 B13R1.555 CC1CCCCN1CCCCC=O 269982a_100000211376_100000139335 [0,0,0,1,0,0|1,0,2]=4 12038 B13R1.555 CC1CCCCN1CCCCCF 2230a_100000211376_100000729378 [0,0,0,1,0,0|2,0,0]=3 12039 B13R1.555 CC1CCCCN1CCCCCF 269982a_100000211376_100000729378 [0,0,0,1,0,0|2,0,0]=3 12040 B13R1.555 CC1CCCCN1CCCCCF 34a_100000211376_100000729378 [0,0,0,1,0,0|2,0,0]=3 12041 B13R1.555 CC1CCCCN1CCCCCO 2230a_100000211376_100000746330 [0,0,0,1,0,0|1,0,0]=2 12042 B13R1.555 CC1CCCCN1CCCCCO 269982a_100000211376_100000746330 [0,0,0,1,0,0|1,0,0]=2 12043 B13R1.555 CC1CCCCN1CCCCCO 34a_100000211376_100000746330 [0,0,0,1,0,0|1,0,0]=2 12044 B13R1.555 CC1CCCCN1CCCNCF 34a_100000212276_100015361967 [0,0,0,1,0,0|3,0,0]=4 12045 B13R1.555 CC1CCCCN1CCCOCF 34a_100000213889_100015361967 [0,0,0,1,0,0|3,0,0]=4 12046 B13R1.555 CC1CCCCN1CCCOCF 7a_100000213889_100015361967 [0,0,0,1,0,0|3,0,0]=4 12047 B13R1.555 CC1CCCCN1CCNCCF 2230a_100000739827_100011217306 [0,0,0,1,0,0|3,0,0]=4 12048 B13R1.555 CC1CCCCN1CCNCCF 34a_100000739827_100011217306 [0,0,0,1,0,0|3,0,0]=4 12049 B13R1.555 CC1CCCCN1CCNCCO 2230a_100000739827_100000211926 [0,0,0,1,0,0|2,0,0]=3 12050 B13R1.555 CC1CCCCN1CCNCCO 34a_100000739827_100000211926 [0,0,0,1,0,0|2,0,0]=3 12051 B13R1.555 CC1CCCCN1CCOCCF 34a_100011305533_100011217306 [0,0,0,1,0,0|3,0,0]=4 12052 B13R1.555 CC1CCCCN1CCOCCO 2230a_100000211376_100011215305 [0,0,0,1,0,0|2,0,0]=3 12053 B13R1.555 CC1CCCCN1CCOCCO 269982a_100000211376_100011215305 [0,0,0,1,0,0|2,0,0]=3 12054 B13R1.555 CC1CCCCN1CCOCCO 34a_100000211376_100000692535 [0,0,0,1,0,0|2,0,0]=3 12055 B13R1.555 CC1CCCCN1CCOCCO 34a_100011305533_100000211926 [0,0,0,1,0,0|2,0,0]=3 12056 B13R1.555 CC1CCNCC1OCCCCF 34a_100000696640_100000729493 [0,0,0,1,0,0|3,0,0]=4 12057 B13R1.555 CC1CCNCC1OCCCCO 34a_100000696640_100011216708 [0,0,0,1,0,0|2,0,0]=3 12058 B13R1.555 CC1CNCCC1NCCCCO 270004a_100000750430_100000703950 [0,0,0,1,0,0|2,0,0]=3 12059 B13R1.555 CC1CNCCC1OCCCCF 34a_100011998114_100000729493 [0,0,0,1,0,0|3,0,0]=4 12060 B13R1.555 CC1CNCCC1OCCCCO 34a_100011998114_100011216708 [0,0,0,1,0,0|2,0,0]=3 12061 B13R1.555 CC1COCCC1NCCCCO 270004a_100000750430_100000755695 [0,0,0,1,0,0|2,0,0]=3 12062 B13R1.555 CC=CCNCC1CCCCC1O 34a_100011216029_100000070051 [0,0,0,1,0,0|1,0,2]=4 12063 B13R1.555 CCC#CCOC1CCCCC1O 34a_100000032950_100000038908 [0,0,0,1,0,0|1,0,2]=4 12064 B13R1.555 CCC#CCSC1CCCCC1O 62a_100000038908_100009813939 [0,0,0,1,0,0|1,0,2]=4 12065 B13R1.555 CCC#CCSC1CCCCC1O 62a_100009813939_100000038908 [0,0,0,1,0,0|1,0,2]=4 12066 B13R1.555 CCCCCCN1CCCCC1C 2230a_100000211376_100000210314 [0,0,0,1,0,0|2,0,0]=3 12067 B13R1.555 CCCCCCN1CCCCC1C 269982a_100000211376_100000210757 [0,0,0,1,0,0|2,0,0]=3 12068 B13R1.555 CCCCCCN1CCCCC1C 34a_100000211376_100000210314 [0,0,0,1,0,0|2,0,0]=3 12069 B13R1.555 CCCCCCN1CCOC[C@@H]1C 2230a_100009815349_100000210314 [0,0,0,1,0,0|3,0,0]=4 12070 B13R1.555 CCCCCCN1CCOC[C@@H]1C 269982a_100009815349_100000210757 [0,0,0,1,0,0|3,0,0]=4 12071 B13R1.555 CCCCCCN1CCOC[C@@H]1C 34a_100009815349_100000210314 [0,0,0,1,0,0|3,0,0]=4 12072 B13R1.555 CCCCCNC1CCCCC1C 2230a_100000211402_100000210326 [0,0,0,1,0,0|2,0,0]=3 12073 B13R1.555 CCCCCNC1CCCCC1C 269862a_100000209983_100000210921 [0,0,0,1,0,0|2,0,0]=3 12074 B13R1.555 CCCCCNC1CCCCC1C 270004a_100000209983_100000210921 [0,0,0,1,0,0|2,0,0]=3 12075 B13R1.555 CCCCCNC1CCCCC1C 34a_100000211402_100000718602 [0,0,0,1,0,0|2,0,0]=3 12076 B13R1.555 CCCCCNC1CCNCC1C 270004a_100000209983_100000703950 [0,0,0,1,0,0|3,0,0]=4 12077 B13R1.555 CCCCCNC1CCOCC1C 270004a_100000209983_100000755695 [0,0,0,1,0,0|3,0,0]=4 12078 B13R1.555 CCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000210326 [0,0,0,1,0,0|2,0,0]=3 12079 B13R1.555 CCCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000718602 [0,0,0,1,0,0|2,0,0]=3 12080 B13R1.555 CCCCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100000210326 [0,0,0,1,0,0|2,0,0]=3 12081 B13R1.555 CCCCCN[C@H]1CCOC[C@@H]1F 2230a_100016994078_100000210326 [0,0,0,1,0,0|3,0,0]=4 12082 B13R1.555 CCCCCN[C@H]1CCOC[C@@H]1F 34a_100016994078_100000718602 [0,0,0,1,0,0|3,0,0]=4 12083 B13R1.555 CCCCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000210326 [0,0,0,1,0,0|2,0,0]=3 12084 B13R1.555 CCCCCOC1CCCCC1=O 34a_100000210253_100000754470 [0,0,0,1,0,0|1,0,2]=4 12085 B13R1.555 CCCCCOC1CCCCC1=O 34a_100011214950_100000718602 [0,0,0,1,0,0|1,0,2]=4 12086 B13R1.555 CCCCCOC1CCCCC1=O 7a_100000210253_100000204591 [0,0,0,1,0,0|1,0,2]=4 12087 B13R1.555 CCCCCOC1CCCCC1C 34a_100000211207_100000718602 [0,0,0,1,0,0|2,0,0]=3 12088 B13R1.555 CCCCCOC1CCCCC1C 7a_100000211207_100000210326 [0,0,0,1,0,0|2,0,0]=3 12089 B13R1.555 CCCCCOC1CCCCC1Cl 34a_100000038908_100000718602 [0,0,0,1,0,0|2,0,0]=3 12090 B13R1.555 CCCCCOC1CCCCC1Cl 7a_100000038908_100000210326 [0,0,0,1,0,0|2,0,0]=3 12091 B13R1.555 CCCCCOC1CCCCC1F 34a_100000210253_100015423560 [0,0,0,1,0,0|2,0,0]=3 12092 B13R1.555 CCCCCOC1CCCCC1O 34a_100000210253_100000038908 [0,0,0,1,0,0|1,0,0]=2 12093 B13R1.555 CCCCCOC1CCNCC1C 34a_100011998114_100000718602 [0,0,0,1,0,0|3,0,0]=4 12094 B13R1.555 CCCCCOC1CNCCC1C 34a_100000696640_100000718602 [0,0,0,1,0,0|3,0,0]=4 12095 B13R1.555 CCCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000718602 [0,0,0,1,0,0|2,0,0]=3 12096 B13R1.555 CCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000210326 [0,0,0,1,0,0|2,0,0]=3 12097 B13R1.555 CCCCCO[C@@H]1CCNC[C@@H]1F 34a_200016994291_100000718602 [0,0,0,1,0,0|3,0,0]=4 12098 B13R1.555 CCCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000718602 [0,0,0,1,0,0|2,0,0]=3 12099 B13R1.555 CCCCCO[C@H]1CCOC[C@@H]1N 34a_100015739063_100000718602 [0,0,0,1,0,0|3,0,0]=4 12100 B13R1.555 CCCCCO[C@H]1COCC[C@H]1N 34a_100016994285_100000718602 [0,0,0,1,0,0|3,0,0]=4 12101 B13R1.555 CCCCCSC1CCCCC1=O 62a_100000204591_100000210326 [0,0,0,1,0,0|1,0,2]=4 12102 B13R1.555 CCCCCSC1CCCCC1=O 62a_100000210326_100000204591 [0,0,0,1,0,0|1,0,2]=4 12103 B13R1.555 CCCCCSC1CCCCC1F 62a_100000210326_100015423560 [0,0,0,1,0,0|2,0,0]=3 12104 B13R1.555 CCCCCSC1CCCCC1F 62a_100015423560_100000210326 [0,0,0,1,0,0|2,0,0]=3 12105 B13R1.555 CCCCCSC1CCCCC1O 62a_100000038908_100000210326 [0,0,0,1,0,0|1,0,0]=2 12106 B13R1.555 CCCCCSC1CCCCC1O 62a_100000210326_100000038908 [0,0,0,1,0,0|1,0,0]=2 12107 B13R1.555 CCCCNCC1CCCCC1O 34a_100011216029_100000210210 [0,0,0,1,0,0|1,0,0]=2 12108 B13R1.555 CCCCNCC1CCCCN1C 34a_100011228421_100000210210 [0,0,0,1,0,0|3,0,0]=4 12109 B13R1.555 CCCCNCC1CCCCN1C 7a_106832991798_100015185383 [0,0,0,1,0,0|3,0,0]=4 12110 B13R1.555 CCCCNN=C1CCCCC1O 4a_100025702795_100011214950 [0,0,0,1,0,0|2,0,1]=4 12111 B13R1.555 CCCCOCC1CCCCC1=O 34a_100009861125_100000210210 [0,0,0,1,0,0|1,0,2]=4 12112 B13R1.555 CCCCOCC1CCCCC1=O 7a_100009861125_100000210211 [0,0,0,1,0,0|1,0,2]=4 12113 B13R1.555 CCCCOCC1CCCCN1C 34a_100000210227_100015186950 [0,0,0,1,0,0|3,0,0]=4 12114 B13R1.555 CCCCOCC1CCCCN1C 34a_100000225079_100000210210 [0,0,0,1,0,0|3,0,0]=4 12115 B13R1.555 CCCCOCC1CCCCN1C 7a_100000210227_100015185383 [0,0,0,1,0,0|3,0,0]=4 12116 B13R1.555 CCCCOCC1COCCC1N 34a_214813039666_100000210210 [0,0,0,1,0,0|3,0,0]=4 12117 B13R1.555 CCCCOCN1CCCCC1C 2230a_100000211376_100011995733 [0,0,0,1,0,0|3,0,0]=4 12118 B13R1.555 CCCCOCN1CCCCC1C 269982a_100000211376_100011995733 [0,0,0,1,0,0|3,0,0]=4 12119 B13R1.555 CCCCOCN1CCCCC1C 34a_100000211376_100011995733 [0,0,0,1,0,0|3,0,0]=4 12120 B13R1.555 CCCCSCC1CCCCN1C 62a_100000210211_100015185383 [0,0,0,1,0,0|3,0,0]=4 12121 B13R1.555 CCCCSCC1CCCCN1C 62a_100015185383_100000210210 [0,0,0,1,0,0|3,0,0]=4 12122 B13R1.555 CCCNCCN1CCCCC1C 2230a_100000739827_100000210303 [0,0,0,1,0,0|3,0,0]=4 12123 B13R1.555 CCCNCCN1CCCCC1C 34a_100000739827_100000210303 [0,0,0,1,0,0|3,0,0]=4 12124 B13R1.555 CCCOCCC1CCCCN1C 34a_100000210258_100000211948 [0,0,0,1,0,0|3,0,0]=4 12125 B13R1.555 CCCOCCN1CCCCC1C 2230a_100000211376_100011215938 [0,0,0,1,0,0|3,0,0]=4 12126 B13R1.555 CCCOCCN1CCCCC1C 269982a_100000211376_100011215938 [0,0,0,1,0,0|3,0,0]=4 12127 B13R1.555 CCCOCCN1CCCCC1C 34a_100000211376_100011215938 [0,0,0,1,0,0|3,0,0]=4 12128 B13R1.555 CCCOCCN1CCCCC1C 34a_100011305533_100000210303 [0,0,0,1,0,0|3,0,0]=4 12129 B13R1.555 CCCSCCC1CCCCN1C 62a_100000210303_100000211948 [0,0,0,1,0,0|3,0,0]=4 12130 B13R1.555 CCCSCCC1CCCCN1C 62a_100000211948_100000210303 [0,0,0,1,0,0|3,0,0]=4 12131 B13R1.555 CCNCCCN1CCCCC1C 34a_100000212276_100000210202 [0,0,0,1,0,0|3,0,0]=4 12132 B13R1.555 CCOCCCN1CCCCC1C 2230a_100000211376_100012232248 [0,0,0,1,0,0|3,0,0]=4 12133 B13R1.555 CCOCCCN1CCCCC1C 269982a_100000211376_100012232248 [0,0,0,1,0,0|3,0,0]=4 12134 B13R1.555 CCOCCCN1CCCCC1C 34a_100000211376_100012232248 [0,0,0,1,0,0|3,0,0]=4 12135 B13R1.555 CCOCCCN1CCCCC1C 34a_100000213889_100000210202 [0,0,0,1,0,0|3,0,0]=4 12136 B13R1.555 CCOCCCN1CCCCC1C 7a_100000213889_100000210202 [0,0,0,1,0,0|3,0,0]=4 12137 B13R1.555 CCOCCNC1CCCCC1C 2230a_100000211402_100011215890 [0,0,0,1,0,0|3,0,0]=4 12138 B13R1.555 CCOCCNC1CCCCC1C 269862a_100011200944_100000210921 [0,0,0,1,0,0|3,0,0]=4 12139 B13R1.555 CCOCCNC1CCCCC1C 270004a_102516460346_100000210921 [0,0,0,1,0,0|3,0,0]=4 12140 B13R1.555 CCOCCNC1CCCCC1C 34a_100000211402_100000210147 [0,0,0,1,0,0|3,0,0]=4 12141 B13R1.555 CCOCCNC1CCCCC1F 34a_102516460346_100015423560 [0,0,0,1,0,0|3,0,0]=4 12142 B13R1.555 CCOCCNC1CCCCC1O 34a_102516460346_100000038908 [0,0,0,1,0,0|2,0,0]=3 12143 B13R1.555 CCOCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100011215890 [0,0,0,1,0,0|3,0,0]=4 12144 B13R1.555 CCOCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000210147 [0,0,0,1,0,0|3,0,0]=4 12145 B13R1.555 CCOCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100011215890 [0,0,0,1,0,0|3,0,0]=4 12146 B13R1.555 CCOCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100011215890 [0,0,0,1,0,0|3,0,0]=4 12147 B13R1.555 CCOCCOC1CCCCC1C 34a_100000211207_100000210147 [0,0,0,1,0,0|3,0,0]=4 12148 B13R1.555 CCOCCOC1CCCCC1C 7a_100000211207_100011215890 [0,0,0,1,0,0|3,0,0]=4 12149 B13R1.555 CCOCCOC1CCCCC1Cl 34a_100000038908_100000210147 [0,0,0,1,0,0|3,0,0]=4 12150 B13R1.555 CCOCCOC1CCCCC1Cl 7a_100000038908_100011215890 [0,0,0,1,0,0|3,0,0]=4 12151 B13R1.555 CCOCCOC1CCCCC1F 34a_100000210136_100015423560 [0,0,0,1,0,0|3,0,0]=4 12152 B13R1.555 CCOCCOC1CCCCC1O 34a_100000210136_100000038908 [0,0,0,1,0,0|2,0,0]=3 12153 B13R1.555 CCOCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000210147 [0,0,0,1,0,0|3,0,0]=4 12154 B13R1.555 CCOCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100011215890 [0,0,0,1,0,0|3,0,0]=4 12155 B13R1.555 CCOCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000210147 [0,0,0,1,0,0|3,0,0]=4 12156 B13R1.555 CCOCCSC1CCCCC1F 62a_100000210147_100015423560 [0,0,0,1,0,0|3,0,0]=4 12157 B13R1.555 CCOCCSC1CCCCC1F 62a_100015423560_100011215890 [0,0,0,1,0,0|3,0,0]=4 12158 B13R1.555 CCOCCSC1CCCCC1O 62a_100000038908_100011215890 [0,0,0,1,0,0|2,0,0]=3 12159 B13R1.555 CCOCCSC1CCCCC1O 62a_100000210147_100000038908 [0,0,0,1,0,0|2,0,0]=3 12160 B13R1.555 CCSCCNC1CCCCC1C 2230a_100000211402_100000757381 [0,0,0,1,0,0|3,0,0]=4 12161 B13R1.555 CCSCCNC1CCCCC1C 269862a_100000106463_100000210921 [0,0,0,1,0,0|3,0,0]=4 12162 B13R1.555 CCSCCNC1CCCCC1C 270004a_100000106463_100000210921 [0,0,0,1,0,0|3,0,0]=4 12163 B13R1.555 CCSCCNC1CCCCC1C 34a_100000211402_100000757381 [0,0,0,1,0,0|3,0,0]=4 12164 B13R1.555 CCSCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000757381 [0,0,0,1,0,0|3,0,0]=4 12165 B13R1.555 CCSCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000757381 [0,0,0,1,0,0|3,0,0]=4 12166 B13R1.555 CCSCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100000757381 [0,0,0,1,0,0|3,0,0]=4 12167 B13R1.555 CCSCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000757381 [0,0,0,1,0,0|3,0,0]=4 12168 B13R1.555 CCSCCOC1CCCCC1C 34a_100000211207_100000757381 [0,0,0,1,0,0|3,0,0]=4 12169 B13R1.555 CCSCCOC1CCCCC1C 7a_100000211207_100000757381 [0,0,0,1,0,0|3,0,0]=4 12170 B13R1.555 CCSCCOC1CCCCC1Cl 34a_100000038908_100000757381 [0,0,0,1,0,0|3,0,0]=4 12171 B13R1.555 CCSCCOC1CCCCC1Cl 7a_100000038908_100000757381 [0,0,0,1,0,0|3,0,0]=4 12172 B13R1.555 CCSCCOC1CCCCC1F 34a_100000212035_100015423560 [0,0,0,1,0,0|3,0,0]=4 12173 B13R1.555 CCSCCOC1CCCCC1O 34a_100000212035_100000038908 [0,0,0,1,0,0|2,0,0]=3 12174 B13R1.555 CCSCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000757381 [0,0,0,1,0,0|3,0,0]=4 12175 B13R1.555 CCSCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000757381 [0,0,0,1,0,0|3,0,0]=4 12176 B13R1.555 CCSCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000757381 [0,0,0,1,0,0|3,0,0]=4 12177 B13R1.555 CCSCCSC1CCCCC1F 62a_100000757381_100015423560 [0,0,0,1,0,0|3,0,0]=4 12178 B13R1.555 CCSCCSC1CCCCC1F 62a_100015423560_100000757381 [0,0,0,1,0,0|3,0,0]=4 12179 B13R1.555 CCSCCSC1CCCCC1O 62a_100000038908_100000757381 [0,0,0,1,0,0|2,0,0]=3 12180 B13R1.555 CCSCCSC1CCCCC1O 62a_100000757381_100000038908 [0,0,0,1,0,0|2,0,0]=3 12181 B13R1.555 CN1CCCCC1CCNCCF 34a_100000724931_100000211948 [0,0,0,1,0,0|3,0,0]=4 12182 B13R1.555 CN1CCCCC1CCNCCO 2230a_100016997473_100000211948 [0,0,0,1,0,0|2,0,0]=3 12183 B13R1.555 CN1CCCCC1CCNCCO 34a_100016990907_100000211948 [0,0,0,1,0,0|2,0,0]=3 12184 B13R1.555 CN1CCCCC1CCOCCBr 34a_100000211926_100000211948 [0,0,0,1,0,0|3,0,0]=4 12185 B13R1.555 CN1CCCCC1CCOCCN 34a_100000210304_100000211948 [0,0,0,1,0,0|3,0,0]=4 12186 B13R1.555 CN1CCCCC1CCSCCF 62a_100000211948_100011217306 [0,0,0,1,0,0|3,0,0]=4 12187 B13R1.555 CN1CCCCC1CCSCCF 62a_100011217306_100000211948 [0,0,0,1,0,0|3,0,0]=4 12188 B13R1.555 CN1CCCCC1CCSCCO 62a_100000211926_100000211948 [0,0,0,1,0,0|2,0,0]=3 12189 B13R1.555 CN1CCCCC1CCSCCO 62a_100000211948_100000211926 [0,0,0,1,0,0|2,0,0]=3 12190 B13R1.555 CN1CCCCC1CNCCCF 34a_100011228421_100011934791 [0,0,0,1,0,0|3,0,0]=4 12191 B13R1.555 CN1CCCCC1CNCCCF 34a_100015189416_100015186950 [0,0,0,1,0,0|3,0,0]=4 12192 B13R1.555 CN1CCCCC1CNCCCO 34a_100011228421_100000230001 [0,0,0,1,0,0|2,0,0]=3 12193 B13R1.555 CN1CCCCC1COCCCBr 34a_100011217188_100015186950 [0,0,0,1,0,0|3,0,0]=4 12194 B13R1.555 CN1CCCCC1COCCCCl 34a_100000230001_100015186950 [0,0,0,1,0,0|3,0,0]=4 12195 B13R1.555 CN1CCCCC1COCCCF 34a_100000225079_100011934791 [0,0,0,1,0,0|3,0,0]=4 12196 B13R1.555 CN1CCCCC1COCCCF 34a_100000759539_100015186950 [0,0,0,1,0,0|3,0,0]=4 12197 B13R1.555 CN1CCCCC1COCCCN 34a_100000182051_100015186950 [0,0,0,1,0,0|3,0,0]=4 12198 B13R1.555 CN1CCCCC1COCCCO 34a_100000225079_100000230001 [0,0,0,1,0,0|2,0,0]=3 12199 B13R1.555 CN1CCCCC1CSCCCF 62a_100011934791_100015185383 [0,0,0,1,0,0|3,0,0]=4 12200 B13R1.555 CN1CCCCC1CSCCCF 62a_100015185383_100011934791 [0,0,0,1,0,0|3,0,0]=4 12201 B13R1.555 CN1CCCCC1CSCCCO 62a_100011215043_100015185383 [0,0,0,1,0,0|2,0,0]=3 12202 B13R1.555 CN1CCCCC1CSCCCO 62a_100015185383_100011215043 [0,0,0,1,0,0|2,0,0]=3 12203 B13R1.555 CN1CCOCC1COCCCO 34a_100013547906_100000230001 [0,0,0,1,0,0|3,0,0]=4 12204 B13R1.555 CNCCCOC1CCCCC1F 34a_100000213112_100015423560 [0,0,0,1,0,0|3,0,0]=4 12205 B13R1.555 CNCCCOC1CCCCC1O 34a_100000213112_100000038908 [0,0,0,1,0,0|2,0,0]=3 12206 B13R1.555 COCCCCN1CCCCC1C 2230a_100000211376_100000730899 [0,0,0,1,0,0|3,0,0]=4 12207 B13R1.555 COCCCCN1CCCCC1C 269982a_100000211376_100000730899 [0,0,0,1,0,0|3,0,0]=4 12208 B13R1.555 COCCCCN1CCCCC1C 34a_100000211376_100000755781 [0,0,0,1,0,0|3,0,0]=4 12209 B13R1.555 COCCCNC1CCCCC1C 2230a_100000211402_100000740836 [0,0,0,1,0,0|3,0,0]=4 12210 B13R1.555 COCCCNC1CCCCC1C 269862a_100150723488_100000210921 [0,0,0,1,0,0|3,0,0]=4 12211 B13R1.555 COCCCNC1CCCCC1C 270004a_100150723488_100000210921 [0,0,0,1,0,0|3,0,0]=4 12212 B13R1.555 COCCCNC1CCCCC1C 34a_100000211402_100000740836 [0,0,0,1,0,0|3,0,0]=4 12213 B13R1.555 COCCCNC1CCCCC1F 34a_100150723488_100015423560 [0,0,0,1,0,0|3,0,0]=4 12214 B13R1.555 COCCCNC1CCCCC1O 34a_100150723488_100000038908 [0,0,0,1,0,0|2,0,0]=3 12215 B13R1.555 COCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000740836 [0,0,0,1,0,0|3,0,0]=4 12216 B13R1.555 COCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000740836 [0,0,0,1,0,0|3,0,0]=4 12217 B13R1.555 COCCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100000740836 [0,0,0,1,0,0|3,0,0]=4 12218 B13R1.555 COCCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000740836 [0,0,0,1,0,0|3,0,0]=4 12219 B13R1.555 COCCCOC1CCCCC1C 34a_100000211207_100000740836 [0,0,0,1,0,0|3,0,0]=4 12220 B13R1.555 COCCCOC1CCCCC1C 7a_100000211207_100000740836 [0,0,0,1,0,0|3,0,0]=4 12221 B13R1.555 COCCCOC1CCCCC1Cl 34a_100000038908_100000740836 [0,0,0,1,0,0|3,0,0]=4 12222 B13R1.555 COCCCOC1CCCCC1Cl 7a_100000038908_100000740836 [0,0,0,1,0,0|3,0,0]=4 12223 B13R1.555 COCCCOC1CCCCC1F 34a_100000740835_100015423560 [0,0,0,1,0,0|3,0,0]=4 12224 B13R1.555 COCCCOC1CCCCC1O 34a_100000740835_100000038908 [0,0,0,1,0,0|2,0,0]=3 12225 B13R1.555 COCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000740836 [0,0,0,1,0,0|3,0,0]=4 12226 B13R1.555 COCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000740836 [0,0,0,1,0,0|3,0,0]=4 12227 B13R1.555 COCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000740836 [0,0,0,1,0,0|3,0,0]=4 12228 B13R1.555 COCCCSC1CCCCC1F 62a_100000709357_100015423560 [0,0,0,1,0,0|3,0,0]=4 12229 B13R1.555 COCCCSC1CCCCC1F 62a_100015423560_100000709357 [0,0,0,1,0,0|3,0,0]=4 12230 B13R1.555 COCCCSC1CCCCC1O 62a_100000038908_100000709357 [0,0,0,1,0,0|2,0,0]=3 12231 B13R1.555 COCCCSC1CCCCC1O 62a_100000709357_100000038908 [0,0,0,1,0,0|2,0,0]=3 12232 B13R1.555 COCCNCC1CCCCC1O 34a_100011216029_100011201679 [0,0,0,1,0,0|2,0,0]=3 12233 B13R1.555 CSCCCNC1CCCCC1C 269862a_100000749238_100000210921 [0,0,0,1,0,0|3,0,0]=4 12234 B13R1.555 CSCCCNC1CCCCC1C 270004a_100000749238_100000210921 [0,0,0,1,0,0|3,0,0]=4 12235 B13R1.555 CSCCCOC1CCCCC1F 34a_100000690336_100015423560 [0,0,0,1,0,0|3,0,0]=4 12236 B13R1.555 CSCCCOC1CCCCC1O 34a_100000690336_100000038908 [0,0,0,1,0,0|2,0,0]=3 12237 B13R1.555 CSCCNCC1CCCCC1O 34a_100011216029_100000212216 [0,0,0,1,0,0|2,0,0]=3 12238 B13R1.555 C[C@H]1COCCN1CCCCCF 2230a_100009815349_100000729378 [0,0,0,1,0,0|3,0,0]=4 12239 B13R1.555 C[C@H]1COCCN1CCCCCF 269982a_100009815349_100000729378 [0,0,0,1,0,0|3,0,0]=4 12240 B13R1.555 C[C@H]1COCCN1CCCCCF 34a_100009815349_100000729378 [0,0,0,1,0,0|3,0,0]=4 12241 B13R1.555 C[C@H]1COCCN1CCCCCO 2230a_100009815349_100000746330 [0,0,0,1,0,0|2,0,0]=3 12242 B13R1.555 C[C@H]1COCCN1CCCCCO 269982a_100009815349_100000746330 [0,0,0,1,0,0|2,0,0]=3 12243 B13R1.555 C[C@H]1COCCN1CCCCCO 34a_100009815349_100000746330 [0,0,0,1,0,0|2,0,0]=3 12244 B13R1.555 C[C@H]1COCCN1CCOCCO 2230a_100009815349_100011215305 [0,0,0,1,0,0|3,0,0]=4 12245 B13R1.555 C[C@H]1COCCN1CCOCCO 269982a_100009815349_100011215305 [0,0,0,1,0,0|3,0,0]=4 12246 B13R1.555 C[C@H]1COCCN1CCOCCO 34a_100009815349_100000692535 [0,0,0,1,0,0|3,0,0]=4 12247 B13R1.555 FC1CCCCC1OCCCCBr 34a_100011216708_100015423560 [0,0,0,1,0,0|3,0,0]=4 12248 B13R1.555 FC1CCCCC1OCCCCCl 34a_100000210776_100015423560 [0,0,0,1,0,0|3,0,0]=4 12249 B13R1.555 FC1CCCCC1OCCCCI 34a_200012148704_100015423560 [0,0,0,1,0,0|3,0,0]=4 12250 B13R1.555 FCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000729493 [0,0,0,1,0,0|3,0,0]=4 12251 B13R1.555 FCCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000729493 [0,0,0,1,0,0|3,0,0]=4 12252 B13R1.555 FCCCCOC1CCCCC1Cl 34a_100000038908_100000729493 [0,0,0,1,0,0|3,0,0]=4 12253 B13R1.555 FCCCCOC1CCCCC1Cl 7a_100000038908_100000729493 [0,0,0,1,0,0|3,0,0]=4 12254 B13R1.555 FCCCCOC1CCCCC1F 34a_100011995726_100015423560 [0,0,0,1,0,0|3,0,0]=4 12255 B13R1.555 FCCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000729493 [0,0,0,1,0,0|3,0,0]=4 12256 B13R1.555 FCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000729493 [0,0,0,1,0,0|3,0,0]=4 12257 B13R1.555 FCCCCSC1CCCCC1F 62a_100000729493_100015423560 [0,0,0,1,0,0|3,0,0]=4 12258 B13R1.555 FCCCCSC1CCCCC1F 62a_100015423560_100000729493 [0,0,0,1,0,0|3,0,0]=4 12259 B13R1.555 N#CCCCSC1CCCCC1O 62a_100000038908_100000687738 [0,0,0,1,0,0|2,0,1]=4 12260 B13R1.555 N#CCCCSC1CCCCC1O 62a_100000687738_100000038908 [0,0,0,1,0,0|2,0,1]=4 12261 B13R1.555 NC1CCOCC1COCCCO 34a_214813039666_100000230001 [0,0,0,1,0,0|3,0,0]=4 12262 B13R1.555 NCCCCOC1CCCCC1F 34a_100000750430_100015423560 [0,0,0,1,0,0|3,0,0]=4 12263 B13R1.555 NCCCCOC1CCCCC1O 34a_100000750430_100000038908 [0,0,0,1,0,0|2,0,0]=3 12264 B13R1.555 N[C@@H]1CCCC[C@@H]1OCCCCF 34a_100015191688_100000729493 [0,0,0,1,0,0|3,0,0]=4 12265 B13R1.555 N[C@@H]1CCCC[C@@H]1OCCCCO 34a_100015191688_100011216708 [0,0,0,1,0,0|2,0,0]=3 12266 B13R1.555 N[C@@H]1CCOC[C@@H]1OCCCCO 34a_100016994285_100011216708 [0,0,0,1,0,0|3,0,0]=4 12267 B13R1.555 N[C@H]1COCC[C@@H]1OCCCCO 34a_100015739063_100011216708 [0,0,0,1,0,0|3,0,0]=4 12268 B13R1.555 O=C1CCCCC1COCCCO 34a_100009861125_100000230001 [0,0,0,1,0,0|2,0,1]=4 12269 B13R1.555 O=C1CCCCC1COCCCO 7a_100009861125_100011215043 [0,0,0,1,0,0|2,0,1]=4 12270 B13R1.555 O=C1CCCCC1NCCCCO 34a_100000750430_100000754470 [0,0,0,1,0,0|2,0,1]=4 12271 B13R1.555 O=C1CCCCC1OCCCCO 34a_100011214950_100011216708 [0,0,0,1,0,0|2,0,1]=4 12272 B13R1.555 O=C1CCCCC1SCCCCO 62a_100000204591_100000210776 [0,0,0,1,0,0|2,0,1]=4 12273 B13R1.555 O=C1CCCCC1SCCCCO 62a_100000210776_100000204591 [0,0,0,1,0,0|2,0,1]=4 12274 B13R1.555 O=CCCCSC1CCCCC1O 62a_100000038908_200011292268 [0,0,0,1,0,0|2,0,1]=4 12275 B13R1.555 O=CCCCSC1CCCCC1O 62a_200011292268_100000038908 [0,0,0,1,0,0|2,0,1]=4 12276 B13R1.555 OC1CCCCC1CNCCCF 34a_100011216029_100011934791 [0,0,0,1,0,0|2,0,0]=3 12277 B13R1.555 OC1CCCCC1OCCCCBr 34a_100011216708_100000038908 [0,0,0,1,0,0|2,0,0]=3 12278 B13R1.555 OC1CCCCC1OCCCCCl 34a_100000210776_100000038908 [0,0,0,1,0,0|2,0,0]=3 12279 B13R1.555 OC1CCCCC1OCCCCF 34a_100011995726_100000038908 [0,0,0,1,0,0|2,0,0]=3 12280 B13R1.555 OC1CCCCC1OCCCCI 34a_200012148704_100000038908 [0,0,0,1,0,0|2,0,0]=3 12281 B13R1.555 OC1CCCCC1SCCCCF 62a_100000038908_100000729493 [0,0,0,1,0,0|2,0,0]=3 12282 B13R1.555 OC1CCCCC1SCCCCF 62a_100000729493_100000038908 [0,0,0,1,0,0|2,0,0]=3 12283 B13R1.555 OCCCCNC1CCCCC1F 34a_100000750430_100015423560 [0,0,0,1,0,0|2,0,0]=3 12284 B13R1.555 OCCCCNC1CCCCC1O 34a_100000750430_100000038908 [0,0,0,1,0,0|2,0,0]=3 12285 B13R1.555 OCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000210776 [0,0,0,1,0,0|2,0,0]=3 12286 B13R1.555 OCCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100011216708 [0,0,0,1,0,0|2,0,0]=3 12287 B13R1.555 OCCCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100000210776 [0,0,0,1,0,0|3,0,0]=4 12288 B13R1.555 OCCCCN[C@H]1CCOC[C@@H]1F 2230a_100016994078_100000210776 [0,0,0,1,0,0|3,0,0]=4 12289 B13R1.555 OCCCCN[C@H]1CCOC[C@@H]1F 34a_100016994078_100011216708 [0,0,0,1,0,0|3,0,0]=4 12290 B13R1.555 OCCCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000210776 [0,0,0,1,0,0|3,0,0]=4 12291 B13R1.555 OCCCCOC1CCCCC1Cl 34a_100000038908_100011216708 [0,0,0,1,0,0|2,0,0]=3 12292 B13R1.555 OCCCCOC1CCCCC1Cl 7a_100000038908_100000210776 [0,0,0,1,0,0|2,0,0]=3 12293 B13R1.555 OCCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100011216708 [0,0,0,1,0,0|2,0,0]=3 12294 B13R1.555 OCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000210776 [0,0,0,1,0,0|2,0,0]=3 12295 B13R1.555 OCCCCO[C@@H]1CCNC[C@@H]1F 34a_200016994291_100011216708 [0,0,0,1,0,0|3,0,0]=4 12296 B13R1.555 OCCCCSC1CCCCC1F 62a_100000210776_100015423560 [0,0,0,1,0,0|2,0,0]=3 12297 B13R1.555 OCCCCSC1CCCCC1F 62a_100015423560_100000210776 [0,0,0,1,0,0|2,0,0]=3 12298 B13R1.555 OCCCCSC1CCCCC1O 62a_100000038908_100000210776 [0,0,0,1,0,0|2,0,0]=3 12299 B13R1.555 OCCCCSC1CCCCC1O 62a_100000210776_100000038908 [0,0,0,1,0,0|2,0,0]=3 12300 B13R1.555 OCCCNCC1CCCCC1O 34a_100011216029_100000230001 [0,0,0,1,0,0|2,0,0]=3 12301 B13R1.555 O[C@H]1CCOC[C@@H]1NCCCCF 2230a_100015739063_100000729493 [0,0,0,1,0,0|3,0,0]=4 12302 B13R1.555 O[C@H]1COCC[C@H]1NCCCCF 2230a_100016994285_100000729493 [0,0,0,1,0,0|3,0,0]=4 12303 B13R1.559 C#CCCCCCOCC1CC1C 34a_100000744939_100012094781 [0,0,0,1,0,0|2,0,1]=4 12304 B13R1.559 C#CCCCCCOCC1CC1C 7a_100000744939_100012094781 [0,0,0,1,0,0|2,0,1]=4 12305 B13R1.559 C=CCCCCCOCC1CC1C 34a_100000744939_100000700193 [0,0,0,1,0,0|2,0,1]=4 12306 B13R1.559 C=CCCCCCOCC1CC1C 7a_100000744939_100000700193 [0,0,0,1,0,0|2,0,1]=4 12307 B13R1.559 CC1CC1COCCCCCC#N 7a_100000744939_100009813376 [0,0,0,1,0,0|2,0,1]=4 12308 B13R1.559 CC1CC1COCCCCCC=O 7a_100000744939_100000139337 [0,0,0,1,0,0|1,0,2]=4 12309 B13R1.559 CC1CC1COCCCCCCF 34a_100000744939_100015922095 [0,0,0,1,0,0|2,0,0]=3 12310 B13R1.559 CC1CC1COCCCCCCF 7a_100000744939_100015922095 [0,0,0,1,0,0|2,0,0]=3 12311 B13R1.559 CC1CC1COCCCCCCO 34a_100000744939_100000766143 [0,0,0,1,0,0|1,0,0]=2 12312 B13R1.559 CC1CC1COCCCCCCO 7a_100000744939_100000766143 [0,0,0,1,0,0|1,0,0]=2 12313 B13R1.559 CCCCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100000210759 [0,0,0,1,0,0|2,0,0]=3 12314 B13R1.559 CCCCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100000210759 [0,0,0,1,0,0|2,0,0]=3 12315 B13R1.559 CCCCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100000210759 [0,0,0,1,0,0|2,0,0]=3 12316 B13R1.559 CCCCCCCOCC1CC1C 34a_100000744939_100000210614 [0,0,0,1,0,0|2,0,0]=3 12317 B13R1.559 CCCCCCCOCC1CC1C 7a_100000744939_100000210614 [0,0,0,1,0,0|2,0,0]=3 12318 B13R1.559 CCCCOCCOCC1CC1C 34a_100000744939_100000743108 [0,0,0,1,0,0|3,0,0]=4 12319 B13R1.559 CCCCOCCOCC1CC1C 7a_100000744939_100000743108 [0,0,0,1,0,0|3,0,0]=4 12320 B13R1.559 COCCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100011998445 [0,0,0,1,0,0|3,0,0]=4 12321 B13R1.559 COCCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100011998445 [0,0,0,1,0,0|3,0,0]=4 12322 B13R1.559 COCCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100011998445 [0,0,0,1,0,0|3,0,0]=4 12323 B13R1.559 OCCCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100000760002 [0,0,0,1,0,0|2,0,0]=3 12324 B13R1.559 OCCCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100000760002 [0,0,0,1,0,0|2,0,0]=3 12325 B13R1.559 OCCCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100000760002 [0,0,0,1,0,0|2,0,0]=3 12326 B13R1.560 BrCCCCCCCOC1CCC1 34a_100000760002_100000749161 [0,0,0,1,0,0|2,0,0]=3 12327 B13R1.560 BrCCCCCCCOC1COC1 34a_100000760002_100009818527 [0,0,0,1,0,0|3,0,0]=4 12328 B13R1.560 BrCCCCCCCOC1COC1 7a_100000760002_100009818527 [0,0,0,1,0,0|3,0,0]=4 12329 B13R1.560 BrCCCCCCOCC1CCC1 34a_100011215345_100000763275 [0,0,0,1,0,0|2,0,0]=3 12330 B13R1.560 BrCCCCCCOCC1CCC1 7a_100011215345_100000763275 [0,0,0,1,0,0|2,0,0]=3 12331 B13R1.560 BrCCCCCCOCC1CCO1 34a_100011215345_100000103362 [0,0,0,1,0,0|2,0,0]=3 12332 B13R1.560 BrCCCCCCOCC1CCO1 7a_100011215345_100000103362 [0,0,0,1,0,0|2,0,0]=3 12333 B13R1.560 BrCCCCCCOCC1COC1 34a_100011215345_100010264016 [0,0,0,1,0,0|3,0,0]=4 12334 B13R1.560 BrCCCCCCOCC1COC1 7a_100011215345_100010264016 [0,0,0,1,0,0|3,0,0]=4 12335 B13R1.560 C#CCCCCCCCN1CCC1 269982a_100000754969_100153394163 [0,0,0,1,0,0|2,0,1]=4 12336 B13R1.560 C#CCCCCCCNC1CCC1 2230a_100000749019_100012276617 [0,0,0,1,0,0|2,0,1]=4 12337 B13R1.560 C#CCCCCCCNC1CCC1 34a_100000749019_100012276617 [0,0,0,1,0,0|2,0,1]=4 12338 B13R1.560 C#CCCCCCCOC1CCC1 34a_100000748187_100012276617 [0,0,0,1,0,0|2,0,1]=4 12339 B13R1.560 C#CCCCCCCOC1CCC1 34a_100011217361_100000749161 [0,0,0,1,0,0|2,0,1]=4 12340 B13R1.560 C#CCCCCCCSC1CCC1 62a_100012276617_100000749161 [0,0,0,1,0,0|2,0,1]=4 12341 B13R1.560 C#CCCCCCNCC1CCC1 2230a_100000738700_100012094781 [0,0,0,1,0,0|2,0,1]=4 12342 B13R1.560 C#CCCCCCNCC1CCC1 34a_100000738700_100012094781 [0,0,0,1,0,0|2,0,1]=4 12343 B13R1.560 C#CCCCCCNC[C@@H]1CCO1 2230a_100020831831_100012094781 [0,0,0,1,0,0|1,0,2]=4 12344 B13R1.560 C#CCCCCCNC[C@@H]1CCO1 34a_100020831831_100012094781 [0,0,0,1,0,0|1,0,2]=4 12345 B13R1.560 C#CCCCCCOCC1CCC1 34a_100000760304_100012094781 [0,0,0,1,0,0|2,0,1]=4 12346 B13R1.560 C#CCCCCCOCC1CCC1 34a_100000766912_100000763275 [0,0,0,1,0,0|2,0,1]=4 12347 B13R1.560 C#CCCCCCOCC1CCC1 7a_100000766912_100000763275 [0,0,0,1,0,0|2,0,1]=4 12348 B13R1.560 C#CCCCCCOCC1CCO1 34a_100000039022_100012094781 [0,0,0,1,0,0|1,0,2]=4 12349 B13R1.560 C#CCCCCCOCC1CCO1 34a_100000766912_100000103362 [0,0,0,1,0,0|1,0,2]=4 12350 B13R1.560 C#CCCCCCOCC1CCO1 7a_100000766912_100000103362 [0,0,0,1,0,0|1,0,2]=4 12351 B13R1.560 C#CCCCCCSCC1CCC1 62a_100000763275_100012094781 [0,0,0,1,0,0|2,0,1]=4 12352 B13R1.560 C#CCCCCCSCC1CCC1 62a_100012094781_100000763275 [0,0,0,1,0,0|2,0,1]=4 12353 B13R1.560 C#CCCCCCSCC1CCO1 62a_100000103362_100012094781 [0,0,0,1,0,0|1,0,2]=4 12354 B13R1.560 C#CCCCCCSCC1CCO1 62a_100012094781_100000103362 [0,0,0,1,0,0|1,0,2]=4 12355 B13R1.560 C=CCCCCCCCN1CCC1 269982a_100000754969_100012355270 [0,0,0,1,0,0|2,0,1]=4 12356 B13R1.560 C=CCCCCCCNC1CCC1 2230a_100000749019_100011215473 [0,0,0,1,0,0|2,0,1]=4 12357 B13R1.560 C=CCCCCCCNC1CCC1 34a_100000749019_100011215473 [0,0,0,1,0,0|2,0,1]=4 12358 B13R1.560 C=CCCCCCCOC1CCC1 34a_100000748187_100011215473 [0,0,0,1,0,0|2,0,1]=4 12359 B13R1.560 C=CCCCCCCOC1CCC1 34a_200011216477_100000749161 [0,0,0,1,0,0|2,0,1]=4 12360 B13R1.560 C=CCCCCCCSC1CCC1 62a_100011215473_100000749161 [0,0,0,1,0,0|2,0,1]=4 12361 B13R1.560 C=CCCCCCNCC1CCC1 2230a_100000738700_100000700193 [0,0,0,1,0,0|2,0,1]=4 12362 B13R1.560 C=CCCCCCNCC1CCC1 34a_100000738700_100000700193 [0,0,0,1,0,0|2,0,1]=4 12363 B13R1.560 C=CCCCCCNC[C@@H]1CCO1 2230a_100020831831_100000700193 [0,0,0,1,0,0|1,0,2]=4 12364 B13R1.560 C=CCCCCCNC[C@@H]1CCO1 34a_100020831831_100000700193 [0,0,0,1,0,0|1,0,2]=4 12365 B13R1.560 C=CCCCCCOCC1CCC1 34a_100000760304_100000700193 [0,0,0,1,0,0|2,0,1]=4 12366 B13R1.560 C=CCCCCCOCC1CCC1 34a_100011216702_100000763275 [0,0,0,1,0,0|2,0,1]=4 12367 B13R1.560 C=CCCCCCOCC1CCC1 7a_100011216702_100000763275 [0,0,0,1,0,0|2,0,1]=4 12368 B13R1.560 C=CCCCCCOCC1CCO1 34a_100000039022_100000700193 [0,0,0,1,0,0|1,0,2]=4 12369 B13R1.560 C=CCCCCCOCC1CCO1 34a_100011216702_100000103362 [0,0,0,1,0,0|1,0,2]=4 12370 B13R1.560 C=CCCCCCOCC1CCO1 7a_100011216702_100000103362 [0,0,0,1,0,0|1,0,2]=4 12371 B13R1.560 C=CCCCCCSCC1CCC1 62a_100000700193_100000763275 [0,0,0,1,0,0|2,0,1]=4 12372 B13R1.560 C=CCCCCCSCC1CCC1 62a_100000763275_100000700193 [0,0,0,1,0,0|2,0,1]=4 12373 B13R1.560 C=CCCCCCSCC1CCO1 62a_100000103362_100000700193 [0,0,0,1,0,0|1,0,2]=4 12374 B13R1.560 C=CCCCCCSCC1CCO1 62a_100000700193_100000103362 [0,0,0,1,0,0|1,0,2]=4 12375 B13R1.560 CC/C=C/CCCOCC1CCO1 34a_100016287902_100000103362 [0,0,0,1,0,0|1,0,2]=4 12376 B13R1.560 CC/C=C/CCCOCC1CCO1 7a_100016287902_100000103362 [0,0,0,1,0,0|1,0,2]=4 12377 B13R1.560 CCCC#CCCOCC1CCO1 34a_100000042726_100000103362 [0,0,0,1,0,0|1,0,2]=4 12378 B13R1.560 CCCC#CCCOCC1CCO1 7a_100000042726_100000103362 [0,0,0,1,0,0|1,0,2]=4 12379 B13R1.560 CCCC/C=C/COCC1CCO1 34a_200016272032_100000103362 [0,0,0,1,0,0|1,0,2]=4 12380 B13R1.560 CCCC/C=C/COCC1CCO1 7a_200016272032_100000103362 [0,0,0,1,0,0|1,0,2]=4 12381 B13R1.560 CCCCC#CCOCC1CCO1 34a_200000034558_100000103362 [0,0,0,1,0,0|1,0,2]=4 12382 B13R1.560 CCCCC#CCOCC1CCO1 7a_200000034558_100000103362 [0,0,0,1,0,0|1,0,2]=4 12383 B13R1.560 CCCCCCCCCN1CCC1 269982a_100000754969_100000210670 [0,0,0,1,0,0|2,0,0]=3 12384 B13R1.560 CCCCCCCCNC1CCC1 2230a_100000749019_100000210759 [0,0,0,1,0,0|2,0,0]=3 12385 B13R1.560 CCCCCCCCNC1CCC1 270004a_100000229939_100000241760 [0,0,0,1,0,0|2,0,0]=3 12386 B13R1.560 CCCCCCCCNC1CCC1 34a_100000229939_100000749161 [0,0,0,1,0,0|2,0,0]=3 12387 B13R1.560 CCCCCCCCNC1CCC1 34a_100000749019_100000210759 [0,0,0,1,0,0|2,0,0]=3 12388 B13R1.560 CCCCCCCCNC1COC1 2230a_100016991112_100000210759 [0,0,0,1,0,0|3,0,0]=4 12389 B13R1.560 CCCCCCCCNC1COC1 34a_100000229939_100009818527 [0,0,0,1,0,0|3,0,0]=4 12390 B13R1.560 CCCCCCCCOC1CCC1 34a_100000210232_100000749161 [0,0,0,1,0,0|2,0,0]=3 12391 B13R1.560 CCCCCCCCOC1CCC1 34a_100000748187_100000210759 [0,0,0,1,0,0|2,0,0]=3 12392 B13R1.560 CCCCCCCCOC1COC1 34a_100000210232_100009818527 [0,0,0,1,0,0|3,0,0]=4 12393 B13R1.560 CCCCCCCCOC1COC1 7a_100000210232_100009818527 [0,0,0,1,0,0|3,0,0]=4 12394 B13R1.560 CCCCCCCCOC1CSC1 7a_100000072292_100000210759 [0,0,0,1,0,0|3,0,0]=4 12395 B13R1.560 CCCCCCCCSC1CCC1 62a_100000210759_100000749161 [0,0,0,1,0,0|2,0,0]=3 12396 B13R1.560 CCCCCCCCSC1COC1 62a_100000210759_100009818527 [0,0,0,1,0,0|3,0,0]=4 12397 B13R1.560 CCCCCCCNCC1CCC1 2230a_100000229938_100000763275 [0,0,0,1,0,0|2,0,0]=3 12398 B13R1.560 CCCCCCCNCC1CCC1 2230a_100000738700_100000210681 [0,0,0,1,0,0|2,0,0]=3 12399 B13R1.560 CCCCCCCNCC1CCC1 269862a_100000229938_100000753134 [0,0,0,1,0,0|2,0,0]=3 12400 B13R1.560 CCCCCCCNCC1CCC1 34a_100000738700_100000210614 [0,0,0,1,0,0|2,0,0]=3 12401 B13R1.560 CCCCCCCNCC1CCO1 2230a_100000229938_100000103362 [0,0,0,1,0,0|1,0,0]=2 12402 B13R1.560 CCCCCCCNCC1COC1 2230a_100000229938_100010264016 [0,0,0,1,0,0|3,0,0]=4 12403 B13R1.560 CCCCCCCNCC1COC1 2230a_100015281925_100000210681 [0,0,0,1,0,0|3,0,0]=4 12404 B13R1.560 CCCCCCCNCC1COC1 34a_100015281925_100000210614 [0,0,0,1,0,0|3,0,0]=4 12405 B13R1.560 CCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100000210681 [0,0,0,1,0,0|1,0,0]=2 12406 B13R1.560 CCCCCCCNC[C@@H]1CCO1 34a_100020831831_100000210614 [0,0,0,1,0,0|1,0,0]=2 12407 B13R1.560 CCCCCCCOCC1CCC1 34a_100000210272_100000763275 [0,0,0,1,0,0|2,0,0]=3 12408 B13R1.560 CCCCCCCOCC1CCC1 34a_100000760304_100000210614 [0,0,0,1,0,0|2,0,0]=3 12409 B13R1.560 CCCCCCCOCC1CCC1 7a_100000210272_100000763275 [0,0,0,1,0,0|2,0,0]=3 12410 B13R1.560 CCCCCCCOCC1CCO1 34a_100000039022_100000210614 [0,0,0,1,0,0|1,0,0]=2 12411 B13R1.560 CCCCCCCOCC1CCO1 34a_100000210272_100000103362 [0,0,0,1,0,0|1,0,0]=2 12412 B13R1.560 CCCCCCCOCC1CCO1 7a_100000210272_100000103362 [0,0,0,1,0,0|1,0,0]=2 12413 B13R1.560 CCCCCCCOCC1CNC1 34a_100016987283_100000210614 [0,0,0,1,0,0|3,0,0]=4 12414 B13R1.560 CCCCCCCOCC1COC1 34a_100000060846_100000210614 [0,0,0,1,0,0|3,0,0]=4 12415 B13R1.560 CCCCCCCOCC1COC1 34a_100000210272_100010264016 [0,0,0,1,0,0|3,0,0]=4 12416 B13R1.560 CCCCCCCOCC1COC1 7a_100000210272_100010264016 [0,0,0,1,0,0|3,0,0]=4 12417 B13R1.560 CCCCCCCSCC1CCC1 62a_100000210614_100000763275 [0,0,0,1,0,0|2,0,0]=3 12418 B13R1.560 CCCCCCCSCC1CCC1 62a_100000763275_100000210316 [0,0,0,1,0,0|2,0,0]=3 12419 B13R1.560 CCCCCCCSCC1CCO1 62a_100000103362_100000210316 [0,0,0,1,0,0|1,0,0]=2 12420 B13R1.560 CCCCCCCSCC1CCO1 62a_100000210614_100000103362 [0,0,0,1,0,0|1,0,0]=2 12421 B13R1.560 CCCCCCCSCC1COC1 62a_100000210614_100010264016 [0,0,0,1,0,0|3,0,0]=4 12422 B13R1.560 CCCCCCCSCC1COC1 62a_100010264016_100000210316 [0,0,0,1,0,0|3,0,0]=4 12423 B13R1.560 CCCCCCOCCC1COC1 34a_100009855314_100000210314 [0,0,0,1,0,0|3,0,0]=4 12424 B13R1.560 CCCCCNCCOC1CCC1 34a_100000224656_100000749161 [0,0,0,1,0,0|3,0,0]=4 12425 B13R1.560 CCCCCOCCOC1CCC1 34a_100011215259_100000749161 [0,0,0,1,0,0|3,0,0]=4 12426 B13R1.560 CCCCOCCCNC1CCC1 270004a_200000211371_100000241760 [0,0,0,1,0,0|3,0,0]=4 12427 B13R1.560 CCCCOCCCNC1CCC1 34a_200000211371_100000749161 [0,0,0,1,0,0|3,0,0]=4 12428 B13R1.560 CCCCOCCCOC1CCC1 34a_200011215613_100000749161 [0,0,0,1,0,0|3,0,0]=4 12429 B13R1.560 CCCCOCCNCC1CCC1 2230a_100000738700_100000743108 [0,0,0,1,0,0|3,0,0]=4 12430 B13R1.560 CCCCOCCNCC1CCC1 34a_100000738700_100000743108 [0,0,0,1,0,0|3,0,0]=4 12431 B13R1.560 CCCCOCCNC[C@@H]1CCO1 2230a_100020831831_100000743108 [0,0,0,1,0,0|2,0,0]=3 12432 B13R1.560 CCCCOCCNC[C@@H]1CCO1 34a_100020831831_100000743108 [0,0,0,1,0,0|2,0,0]=3 12433 B13R1.560 CCCCOCCOCC1CCC1 34a_100000210238_100000763275 [0,0,0,1,0,0|3,0,0]=4 12434 B13R1.560 CCCCOCCOCC1CCC1 34a_100000760304_100000743108 [0,0,0,1,0,0|3,0,0]=4 12435 B13R1.560 CCCCOCCOCC1CCC1 7a_100000210238_100000763275 [0,0,0,1,0,0|3,0,0]=4 12436 B13R1.560 CCCCOCCOCC1CCO1 34a_100000039022_100000743108 [0,0,0,1,0,0|2,0,0]=3 12437 B13R1.560 CCCCOCCOCC1CCO1 34a_100000210238_100000103362 [0,0,0,1,0,0|2,0,0]=3 12438 B13R1.560 CCCCOCCOCC1CCO1 7a_100000210238_100000103362 [0,0,0,1,0,0|2,0,0]=3 12439 B13R1.560 CCCCOCCSCC1CCC1 62a_100000743108_100000763275 [0,0,0,1,0,0|3,0,0]=4 12440 B13R1.560 CCCCOCCSCC1CCC1 62a_100000763275_100000743108 [0,0,0,1,0,0|3,0,0]=4 12441 B13R1.560 CCCCOCCSCC1CCO1 62a_100000103362_100000743108 [0,0,0,1,0,0|2,0,0]=3 12442 B13R1.560 CCCCOCCSCC1CCO1 62a_100000743108_100000103362 [0,0,0,1,0,0|2,0,0]=3 12443 B13R1.560 CCCCSCCNCC1CCC1 2230a_100025743550_100000763275 [0,0,0,1,0,0|3,0,0]=4 12444 B13R1.560 CCCCSCCNCC1CCC1 269862a_100025743550_100000753134 [0,0,0,1,0,0|3,0,0]=4 12445 B13R1.560 CCCCSCCNCC1CCO1 2230a_100025743550_100000103362 [0,0,0,1,0,0|2,0,0]=3 12446 B13R1.560 CCCCSCCOCC1CCC1 34a_200000230436_100000763275 [0,0,0,1,0,0|3,0,0]=4 12447 B13R1.560 CCCCSCCOCC1CCC1 7a_200000230436_100000763275 [0,0,0,1,0,0|3,0,0]=4 12448 B13R1.560 CCCCSCCOCC1CCO1 34a_200000230436_100000103362 [0,0,0,1,0,0|2,0,0]=3 12449 B13R1.560 CCCCSCCOCC1CCO1 7a_200000230436_100000103362 [0,0,0,1,0,0|2,0,0]=3 12450 B13R1.560 CCCOCCCNCC1CCC1 2230a_100011217757_100000763275 [0,0,0,1,0,0|3,0,0]=4 12451 B13R1.560 CCCOCCCNCC1CCC1 269862a_100011217757_100000753134 [0,0,0,1,0,0|3,0,0]=4 12452 B13R1.560 CCCOCCCNCC1CCC1 34a_100011217757_100000763275 [0,0,0,1,0,0|3,0,0]=4 12453 B13R1.560 CCCOCCCNCC1CCO1 2230a_100011217757_100000103362 [0,0,0,1,0,0|2,0,0]=3 12454 B13R1.560 CCCOCCCNCC1CCO1 34a_100011217757_100000103362 [0,0,0,1,0,0|2,0,0]=3 12455 B13R1.560 CNCCCCCOCC1CCC1 34a_100000722520_100000763275 [0,0,0,1,0,0|3,0,0]=4 12456 B13R1.560 CNCCCCCOCC1CCO1 34a_100000722520_100000103362 [0,0,0,1,0,0|2,0,0]=3 12457 B13R1.560 CNCCOCCOCC1CCO1 34a_100000228057_100000103362 [0,0,0,1,0,0|3,0,0]=4 12458 B13R1.560 COCCCCCCNC1CCC1 2230a_100000749019_100011998445 [0,0,0,1,0,0|3,0,0]=4 12459 B13R1.560 COCCCCCCNC1CCC1 34a_100000749019_100011998445 [0,0,0,1,0,0|3,0,0]=4 12460 B13R1.560 COCCCCCCOC1CCC1 34a_100000748187_100011998445 [0,0,0,1,0,0|3,0,0]=4 12461 B13R1.560 COCCCCCCOC1CCC1 34a_200012092642_100000749161 [0,0,0,1,0,0|3,0,0]=4 12462 B13R1.560 COCCCCCCSC1CCC1 62a_100011998445_100000749161 [0,0,0,1,0,0|3,0,0]=4 12463 B13R1.560 COCCCCCNCC1CCC1 2230a_100000747528_100000763275 [0,0,0,1,0,0|3,0,0]=4 12464 B13R1.560 COCCCCCNCC1CCC1 269862a_100000747528_100000753134 [0,0,0,1,0,0|3,0,0]=4 12465 B13R1.560 COCCCCCNCC1CCC1 34a_100000747528_100000763275 [0,0,0,1,0,0|3,0,0]=4 12466 B13R1.560 COCCCCCNCC1CCO1 2230a_100000747528_100000103362 [0,0,0,1,0,0|2,0,0]=3 12467 B13R1.560 COCCCCCNCC1CCO1 34a_100000747528_100000103362 [0,0,0,1,0,0|2,0,0]=3 12468 B13R1.560 COCCOCCNCC1CCO1 2230a_100000745349_100000103362 [0,0,0,1,0,0|3,0,0]=4 12469 B13R1.560 COCCOCCNCC1CCO1 34a_100000745349_100000103362 [0,0,0,1,0,0|3,0,0]=4 12470 B13R1.560 COCCOCCNC[C@@H]1CCO1 2230a_100020831831_100000695917 [0,0,0,1,0,0|3,0,0]=4 12471 B13R1.560 COCCOCCNC[C@@H]1CCO1 34a_100020831831_100000695917 [0,0,0,1,0,0|3,0,0]=4 12472 B13R1.560 COCCOCCOCC1CCO1 34a_100000039022_100000695917 [0,0,0,1,0,0|3,0,0]=4 12473 B13R1.560 COCCOCCOCC1CCO1 34a_100011215163_100000103362 [0,0,0,1,0,0|3,0,0]=4 12474 B13R1.560 COCCOCCOCC1CCO1 7a_100011215163_100000103362 [0,0,0,1,0,0|3,0,0]=4 12475 B13R1.560 COCCOCCSCC1CCO1 62a_100000103362_100000695917 [0,0,0,1,0,0|3,0,0]=4 12476 B13R1.560 COCCOCCSCC1CCO1 62a_100000695917_100000103362 [0,0,0,1,0,0|3,0,0]=4 12477 B13R1.560 ClCCCCCCOCC1CCC1 34a_100000766143_100000763275 [0,0,0,1,0,0|2,0,0]=3 12478 B13R1.560 ClCCCCCCOCC1CCC1 7a_100000766143_100000763275 [0,0,0,1,0,0|2,0,0]=3 12479 B13R1.560 ClCCCCCCOCC1CCO1 34a_100000766143_100000103362 [0,0,0,1,0,0|2,0,0]=3 12480 B13R1.560 ClCCCCCCOCC1CCO1 7a_100000766143_100000103362 [0,0,0,1,0,0|2,0,0]=3 12481 B13R1.560 ClCCCCCCOCC1COC1 34a_100000766143_100010264016 [0,0,0,1,0,0|3,0,0]=4 12482 B13R1.560 ClCCCCCCOCC1COC1 7a_100000766143_100010264016 [0,0,0,1,0,0|3,0,0]=4 12483 B13R1.560 FCCCCCCNCC1CCC1 2230a_100000738700_100015922095 [0,0,0,1,0,0|2,0,0]=3 12484 B13R1.560 FCCCCCCNCC1CCC1 34a_100000738700_100015922095 [0,0,0,1,0,0|2,0,0]=3 12485 B13R1.560 FCCCCCCNCC1COC1 2230a_100015281925_100015922095 [0,0,0,1,0,0|3,0,0]=4 12486 B13R1.560 FCCCCCCNCC1COC1 34a_100015281925_100015922095 [0,0,0,1,0,0|3,0,0]=4 12487 B13R1.560 FCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100015922095 [0,0,0,1,0,0|2,0,0]=3 12488 B13R1.560 FCCCCCCNC[C@@H]1CCO1 34a_100020831831_100015922095 [0,0,0,1,0,0|2,0,0]=3 12489 B13R1.560 FCCCCCCOCC1CCC1 34a_100000732779_100000763275 [0,0,0,1,0,0|2,0,0]=3 12490 B13R1.560 FCCCCCCOCC1CCC1 34a_100000760304_100015922095 [0,0,0,1,0,0|2,0,0]=3 12491 B13R1.560 FCCCCCCOCC1CCC1 7a_100000732779_100000763275 [0,0,0,1,0,0|2,0,0]=3 12492 B13R1.560 FCCCCCCOCC1CCO1 34a_100000039022_100015922095 [0,0,0,1,0,0|2,0,0]=3 12493 B13R1.560 FCCCCCCOCC1CCO1 34a_100000732779_100000103362 [0,0,0,1,0,0|2,0,0]=3 12494 B13R1.560 FCCCCCCOCC1CCO1 7a_100000732779_100000103362 [0,0,0,1,0,0|2,0,0]=3 12495 B13R1.560 FCCCCCCOCC1CNC1 34a_100016987283_100015922095 [0,0,0,1,0,0|3,0,0]=4 12496 B13R1.560 FCCCCCCOCC1COC1 34a_100000060846_100015922095 [0,0,0,1,0,0|3,0,0]=4 12497 B13R1.560 FCCCCCCOCC1COC1 34a_100000732779_100010264016 [0,0,0,1,0,0|3,0,0]=4 12498 B13R1.560 FCCCCCCOCC1COC1 7a_100000732779_100010264016 [0,0,0,1,0,0|3,0,0]=4 12499 B13R1.560 FCCCCCCSCC1CCC1 62a_100000763275_100015922095 [0,0,0,1,0,0|2,0,0]=3 12500 B13R1.560 FCCCCCCSCC1CCC1 62a_100015922095_100000763275 [0,0,0,1,0,0|2,0,0]=3 12501 B13R1.560 FCCCCCCSCC1CCO1 62a_100000103362_100015922095 [0,0,0,1,0,0|2,0,0]=3 12502 B13R1.560 FCCCCCCSCC1CCO1 62a_100015922095_100000103362 [0,0,0,1,0,0|2,0,0]=3 12503 B13R1.560 FCCCCCCSCC1COC1 62a_100010264016_100015922095 [0,0,0,1,0,0|3,0,0]=4 12504 B13R1.560 FCCCCCCSCC1COC1 62a_100015922095_100010264016 [0,0,0,1,0,0|3,0,0]=4 12505 B13R1.560 FCCCCCOCCC1COC1 34a_100009855314_100000729378 [0,0,0,1,0,0|3,0,0]=4 12506 B13R1.560 N#CCCCCCCNC1CCC1 2230a_100000749019_100009813337 [0,0,0,1,0,0|2,0,1]=4 12507 B13R1.560 N#CCCCCCCSC1CCC1 62a_100009813337_100000749161 [0,0,0,1,0,0|2,0,1]=4 12508 B13R1.560 N#CCCCCCNCC1CCC1 2230a_100000738700_100009813376 [0,0,0,1,0,0|2,0,1]=4 12509 B13R1.560 N#CCCCCCNC[C@@H]1CCO1 2230a_100020831831_100009813376 [0,0,0,1,0,0|2,0,1]=4 12510 B13R1.560 N#CCCCCCSCC1CCC1 62a_100000763275_100009813376 [0,0,0,1,0,0|2,0,1]=4 12511 B13R1.560 N#CCCCCCSCC1CCC1 62a_100009813376_100000763275 [0,0,0,1,0,0|2,0,1]=4 12512 B13R1.560 N#CCCCCCSCC1CCO1 62a_100000103362_100009813376 [0,0,0,1,0,0|2,0,1]=4 12513 B13R1.560 N#CCCCCCSCC1CCO1 62a_100009813376_100000103362 [0,0,0,1,0,0|2,0,1]=4 12514 B13R1.560 NCCCCCCCOC1CCC1 34a_100011996573_100000749161 [0,0,0,1,0,0|2,0,0]=3 12515 B13R1.560 NCCCCCCCOC1COC1 34a_100011996573_100009818527 [0,0,0,1,0,0|3,0,0]=4 12516 B13R1.560 NCCCCCCOCC1CCC1 34a_100000686447_100000763275 [0,0,0,1,0,0|2,0,0]=3 12517 B13R1.560 NCCCCCCOCC1CCO1 34a_100000686447_100000103362 [0,0,0,1,0,0|2,0,0]=3 12518 B13R1.560 NCCCCCCOCC1COC1 34a_100000686447_100010264016 [0,0,0,1,0,0|3,0,0]=4 12519 B13R1.560 NCCCOCCCOC1CCC1 34a_100011310245_100000749161 [0,0,0,1,0,0|3,0,0]=4 12520 B13R1.560 O=CCCCCCNCC1CCC1 2230a_100000738700_100000139337 [0,0,0,1,0,0|1,0,2]=4 12521 B13R1.560 O=CCCCCCNC[C@@H]1CCO1 2230a_100020831831_100000139337 [0,0,0,1,0,0|2,0,1]=4 12522 B13R1.560 O=CCCCCCSCC1CCC1 62a_100000139337_100000763275 [0,0,0,1,0,0|1,0,2]=4 12523 B13R1.560 O=CCCCCCSCC1CCC1 62a_100000763275_100000139337 [0,0,0,1,0,0|1,0,2]=4 12524 B13R1.560 O=CCCCCCSCC1CCO1 62a_100000103362_100000139337 [0,0,0,1,0,0|2,0,1]=4 12525 B13R1.560 O=CCCCCCSCC1CCO1 62a_100000139337_100000103362 [0,0,0,1,0,0|2,0,1]=4 12526 B13R1.560 OCCCCC=NNCC1CCC1 4a_200020586977_100000031955 [0,0,0,1,0,0|2,0,1]=4 12527 B13R1.560 OCCCCCCCCN1CCC1 269982a_100000754969_100000033203 [0,0,0,1,0,0|1,0,0]=2 12528 B13R1.560 OCCCCCCCNC1CCC1 2230a_100000749019_100000760002 [0,0,0,1,0,0|1,0,0]=2 12529 B13R1.560 OCCCCCCCNC1CCC1 270004a_100011996573_100000241760 [0,0,0,1,0,0|1,0,0]=2 12530 B13R1.560 OCCCCCCCNC1CCC1 34a_100000749019_100000760002 [0,0,0,1,0,0|1,0,0]=2 12531 B13R1.560 OCCCCCCCNC1CCC1 34a_100011996573_100000749161 [0,0,0,1,0,0|1,0,0]=2 12532 B13R1.560 OCCCCCCCNC1COC1 2230a_100016991112_100000760002 [0,0,0,1,0,0|2,0,0]=3 12533 B13R1.560 OCCCCCCCNC1COC1 34a_100011996573_100009818527 [0,0,0,1,0,0|2,0,0]=3 12534 B13R1.560 OCCCCCCCOC1CCC1 34a_100000748187_100000760002 [0,0,0,1,0,0|1,0,0]=2 12535 B13R1.560 OCCCCCCCOC1CSC1 7a_100000072292_100000760002 [0,0,0,1,0,0|2,0,0]=3 12536 B13R1.560 OCCCCCCCSC1CCC1 62a_100000760002_100000749161 [0,0,0,1,0,0|1,0,0]=2 12537 B13R1.560 OCCCCCCCSC1COC1 62a_100000760002_100009818527 [0,0,0,1,0,0|2,0,0]=3 12538 B13R1.560 OCCCCCCNCC1CCC1 2230a_100000686447_100000763275 [0,0,0,1,0,0|1,0,0]=2 12539 B13R1.560 OCCCCCCNCC1CCC1 2230a_100000738700_100000766143 [0,0,0,1,0,0|1,0,0]=2 12540 B13R1.560 OCCCCCCNCC1CCC1 269862a_100000686447_100000753134 [0,0,0,1,0,0|1,0,0]=2 12541 B13R1.560 OCCCCCCNCC1CCC1 34a_100000686447_100000763275 [0,0,0,1,0,0|1,0,0]=2 12542 B13R1.560 OCCCCCCNCC1CCC1 34a_100000738700_100000766143 [0,0,0,1,0,0|1,0,0]=2 12543 B13R1.560 OCCCCCCNCC1CCO1 2230a_100000686447_100000103362 [0,0,0,1,0,0|2,0,0]=3 12544 B13R1.560 OCCCCCCNCC1CCO1 34a_100000686447_100000103362 [0,0,0,1,0,0|2,0,0]=3 12545 B13R1.560 OCCCCCCNCC1COC1 2230a_100000686447_100010264016 [0,0,0,1,0,0|2,0,0]=3 12546 B13R1.560 OCCCCCCNCC1COC1 2230a_100015281925_100000766143 [0,0,0,1,0,0|2,0,0]=3 12547 B13R1.560 OCCCCCCNCC1COC1 34a_100000686447_100010264016 [0,0,0,1,0,0|2,0,0]=3 12548 B13R1.560 OCCCCCCNCC1COC1 34a_100015281925_100000766143 [0,0,0,1,0,0|2,0,0]=3 12549 B13R1.560 OCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100000766143 [0,0,0,1,0,0|2,0,0]=3 12550 B13R1.560 OCCCCCCNC[C@@H]1CCO1 34a_100020831831_100000766143 [0,0,0,1,0,0|2,0,0]=3 12551 B13R1.560 OCCCCCCOCC1CCC1 34a_100000760304_100000766143 [0,0,0,1,0,0|1,0,0]=2 12552 B13R1.560 OCCCCCCOCC1CCO1 34a_100000039022_100000766143 [0,0,0,1,0,0|2,0,0]=3 12553 B13R1.560 OCCCCCCOCC1CNC1 34a_100016987283_100000766143 [0,0,0,1,0,0|2,0,0]=3 12554 B13R1.560 OCCCCCCOCC1COC1 34a_100000060846_100000766143 [0,0,0,1,0,0|2,0,0]=3 12555 B13R1.560 OCCCCCCSCC1CCC1 62a_100000763275_100000766143 [0,0,0,1,0,0|1,0,0]=2 12556 B13R1.560 OCCCCCCSCC1CCC1 62a_100000766143_100000763275 [0,0,0,1,0,0|1,0,0]=2 12557 B13R1.560 OCCCCCCSCC1CCO1 62a_100000103362_100000766143 [0,0,0,1,0,0|2,0,0]=3 12558 B13R1.560 OCCCCCCSCC1CCO1 62a_100000766143_100000103362 [0,0,0,1,0,0|2,0,0]=3 12559 B13R1.560 OCCCCCCSCC1COC1 62a_100000766143_100010264016 [0,0,0,1,0,0|2,0,0]=3 12560 B13R1.560 OCCCCCCSCC1COC1 62a_100010264016_100000766143 [0,0,0,1,0,0|2,0,0]=3 12561 B13R1.560 OCCCCCOCCC1COC1 34a_100009855314_100000746330 [0,0,0,1,0,0|2,0,0]=3 12562 B13R1.560 OCCCOCCCNC1CCC1 270004a_100011310245_100000241760 [0,0,0,1,0,0|2,0,0]=3 12563 B13R1.560 OCCCOCCCNC1CCC1 34a_100011310245_100000749161 [0,0,0,1,0,0|2,0,0]=3 12564 B13R1.560 OCCCOCCCNC1COC1 34a_100011310245_100009818527 [0,0,0,1,0,0|3,0,0]=4 12565 B13R1.560 OCCOCCOCCC1COC1 34a_100009855314_100000692535 [0,0,0,1,0,0|3,0,0]=4 12566 B13R1.560 OCCOCCOCCN1CCC1 269982a_100000754969_100000032323 [0,0,0,1,0,0|3,0,0]=4 12567 B13R1.579 C=CCNC1CCCC1CCCC 270004a_100020586998_100000750825 [0,0,0,1,0,0|2,0,1]=4 12568 B13R1.579 CCCCC1C=CCN1CCCO 2230a_100015184376_100000230001 [0,0,0,1,0,0|1,0,2]=4 12569 B13R1.579 CCCCC1C=CCN1CCCO 269982a_100015184376_100011215043 [0,0,0,1,0,0|1,0,2]=4 12570 B13R1.579 CCCCC1C=CCN1CCCO 34a_100015184376_100000230001 [0,0,0,1,0,0|1,0,2]=4 12571 B13R1.579 CCCCC1CCCC1NCCC 269862a_100020643023_100000750825 [0,0,0,1,0,0|2,0,0]=3 12572 B13R1.579 CCCCC1CCCC1NCCC 270004a_100020643023_100000750825 [0,0,0,1,0,0|2,0,0]=3 12573 B13R1.579 CCCCC1CCCC1NCCF 269862a_100000724931_100000750825 [0,0,0,1,0,0|2,0,0]=3 12574 B13R1.579 CCCCC1CCCC1NCCO 269862a_100000210304_100000750825 [0,0,0,1,0,0|1,0,0]=2 12575 B13R1.579 CCCCC1CCCC1NCCO 270004a_100000210304_100000750825 [0,0,0,1,0,0|1,0,0]=2 12576 B13R1.579 CCCNC1CCCC1CCC#N 270004a_100020643023_100000073560 [0,0,0,1,0,0|2,0,1]=4 12577 B13R1.579 N#CCCC1CCCC1NCCO 270004a_100000210304_100000073560 [0,0,0,1,0,0|2,0,1]=4 12578 B13R1.654 C#CCCCCCN1CCC[C@@H]1C 2230a_100020605311_100012094781 [0,0,0,1,0,0|2,0,1]=4 12579 B13R1.654 C#CCCCCCN1CCC[C@@H]1C 269982a_100020605311_100012094781 [0,0,0,1,0,0|2,0,1]=4 12580 B13R1.654 C#CCCCCCN1CCC[C@H]1C 2230a_100015189458_100012094781 [0,0,0,1,0,0|2,0,1]=4 12581 B13R1.654 C#CCCCCCN1CCC[C@H]1C 269982a_100015189458_100012094781 [0,0,0,1,0,0|2,0,1]=4 12582 B13R1.654 C#CCCCCCN1CCC[C@H]1C 34a_100015189458_100012094781 [0,0,0,1,0,0|2,0,1]=4 12583 B13R1.654 C#CCCCCOC1CCCC1C 34a_100011216460_100010269958 [0,0,0,1,0,0|2,0,1]=4 12584 B13R1.654 C#CCCCCOC1CCCC1C 7a_100011216460_100010269958 [0,0,0,1,0,0|2,0,1]=4 12585 B13R1.654 C#CCCCCS[C@@H]1CCC[C@H]1O 62a_100010269958_200016002552 [0,0,0,1,0,0|1,0,2]=4 12586 B13R1.654 C#CCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100010269958 [0,0,0,1,0,0|1,0,2]=4 12587 B13R1.654 C=CCCCCCN1CCC[C@@H]1C 2230a_100020605311_100000700193 [0,0,0,1,0,0|2,0,1]=4 12588 B13R1.654 C=CCCCCCN1CCC[C@@H]1C 269982a_100020605311_100000700193 [0,0,0,1,0,0|2,0,1]=4 12589 B13R1.654 C=CCCCCCN1CCC[C@H]1C 2230a_100015189458_100000700193 [0,0,0,1,0,0|2,0,1]=4 12590 B13R1.654 C=CCCCCCN1CCC[C@H]1C 269982a_100015189458_100000700193 [0,0,0,1,0,0|2,0,1]=4 12591 B13R1.654 C=CCCCCCN1CCC[C@H]1C 34a_100015189458_100000700193 [0,0,0,1,0,0|2,0,1]=4 12592 B13R1.654 C=CCCCCNC1CCCC1C 269862a_100000703577_100000752053 [0,0,0,1,0,0|2,0,1]=4 12593 B13R1.654 C=CCCCCOC1CCCC1C 34a_100011216460_100011215482 [0,0,0,1,0,0|2,0,1]=4 12594 B13R1.654 C=CCCCCOC1CCCC1C 7a_100011216460_100011215482 [0,0,0,1,0,0|2,0,1]=4 12595 B13R1.654 C=CCCCCS[C@@H]1CCC[C@H]1O 62a_100011215482_200016002552 [0,0,0,1,0,0|1,0,2]=4 12596 B13R1.654 C=CCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100011215482 [0,0,0,1,0,0|1,0,2]=4 12597 B13R1.654 CC/C=C\CCS[C@@H]1CCC[C@H]1O 62a_100015370543_200016002552 [0,0,0,1,0,0|1,0,2]=4 12598 B13R1.654 CC/C=C\CCS[C@@H]1CCC[C@H]1O 62a_200016002552_100015370543 [0,0,0,1,0,0|1,0,2]=4 12599 B13R1.654 CC1CCCC1NCCCCCO 269862a_100000762737_100000752053 [0,0,0,1,0,0|1,0,0]=2 12600 B13R1.654 CC1CCCC1NCCOCCO 269862a_100000211614_100000752053 [0,0,0,1,0,0|2,0,0]=3 12601 B13R1.654 CC1CCCC1NCCSCCO 269862a_100011219999_100000752053 [0,0,0,1,0,0|2,0,0]=3 12602 B13R1.654 CC1CCCC1OCCCCC#N 7a_100011216460_100000211819 [0,0,0,1,0,0|2,0,1]=4 12603 B13R1.654 CC1CCCC1OCCCCC=O 7a_100011216460_100000139335 [0,0,0,1,0,0|1,0,2]=4 12604 B13R1.654 CC1CCCC1OCCCCCF 34a_100011216460_100000729378 [0,0,0,1,0,0|2,0,0]=3 12605 B13R1.654 CC1CCCC1OCCCCCF 7a_100011216460_100000729378 [0,0,0,1,0,0|2,0,0]=3 12606 B13R1.654 CC1CCCC1OCCCCCO 34a_100011216460_100000746330 [0,0,0,1,0,0|1,0,0]=2 12607 B13R1.654 CC1CCCC1OCCCCCO 7a_100011216460_100000746330 [0,0,0,1,0,0|1,0,0]=2 12608 B13R1.654 CC1CCCC1OCCOCCO 34a_100011216460_100000692535 [0,0,0,1,0,0|2,0,0]=3 12609 B13R1.654 CC1CCCC1OCCOCCO 7a_100011216460_100011215305 [0,0,0,1,0,0|2,0,0]=3 12610 B13R1.654 CC1OCCC1NCCCCCO 270004a_100000762737_100000691750 [0,0,0,1,0,0|2,0,0]=3 12611 B13R1.654 CC1OCCC1NCCOCCO 270004a_100000211614_100000691750 [0,0,0,1,0,0|3,0,0]=4 12612 B13R1.654 CC1OCCC1NCCSCCO 270004a_100011219999_100000691750 [0,0,0,1,0,0|3,0,0]=4 12613 B13R1.654 CC1SCCN1CCCCCCF 2230a_200011216479_100015922095 [0,0,0,1,0,0|3,0,0]=4 12614 B13R1.654 CC1SCCN1CCCCCCF 269982a_200011216479_100015922095 [0,0,0,1,0,0|3,0,0]=4 12615 B13R1.654 CC1SCCN1CCCCCCF 34a_200011216479_100015922095 [0,0,0,1,0,0|3,0,0]=4 12616 B13R1.654 CC1SCCN1CCCCCCO 2230a_200011216479_100000766143 [0,0,0,1,0,0|2,0,0]=3 12617 B13R1.654 CC1SCCN1CCCCCCO 269982a_200011216479_100000766143 [0,0,0,1,0,0|2,0,0]=3 12618 B13R1.654 CC1SCCN1CCCCCCO 34a_200011216479_100000766143 [0,0,0,1,0,0|2,0,0]=3 12619 B13R1.654 CCCCCCCN1CCC[C@@H]1C 2230a_100020605311_100000210681 [0,0,0,1,0,0|2,0,0]=3 12620 B13R1.654 CCCCCCCN1CCC[C@@H]1C 269982a_100020605311_100000210681 [0,0,0,1,0,0|2,0,0]=3 12621 B13R1.654 CCCCCCCN1CCC[C@H]1C 2230a_100015189458_100000210681 [0,0,0,1,0,0|2,0,0]=3 12622 B13R1.654 CCCCCCCN1CCC[C@H]1C 269982a_100015189458_100000210681 [0,0,0,1,0,0|2,0,0]=3 12623 B13R1.654 CCCCCCCN1CCC[C@H]1C 34a_100015189458_100000210614 [0,0,0,1,0,0|2,0,0]=3 12624 B13R1.654 CCCCCCCN1CCSC1C 2230a_200011216479_100000210681 [0,0,0,1,0,0|3,0,0]=4 12625 B13R1.654 CCCCCCCN1CCSC1C 269982a_200011216479_100000210681 [0,0,0,1,0,0|3,0,0]=4 12626 B13R1.654 CCCCCCCN1CCSC1C 34a_200011216479_100000210614 [0,0,0,1,0,0|3,0,0]=4 12627 B13R1.654 CCCCCCNC1CCCC1=O 2230a_100000210581_100000211823 [0,0,0,1,0,0|1,0,2]=4 12628 B13R1.654 CCCCCCNC1CCCC1C 269862a_100000210581_100000752053 [0,0,0,1,0,0|2,0,0]=3 12629 B13R1.654 CCCCCCNC1CCOC1C 270004a_100000210581_100000691750 [0,0,0,1,0,0|3,0,0]=4 12630 B13R1.654 CCCCCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100000210314 [0,0,0,1,0,0|2,0,0]=3 12631 B13R1.654 CCCCCCOC1CCCC1=O 34a_100000210259_100000709159 [0,0,0,1,0,0|1,0,2]=4 12632 B13R1.654 CCCCCCOC1CCCC1=O 34a_200000719330_100000210314 [0,0,0,1,0,0|1,0,2]=4 12633 B13R1.654 CCCCCCOC1CCCC1=O 7a_100000210259_100000211823 [0,0,0,1,0,0|1,0,2]=4 12634 B13R1.654 CCCCCCOC1CCCC1C 34a_100011216460_100000210314 [0,0,0,1,0,0|2,0,0]=3 12635 B13R1.654 CCCCCCOC1CCCC1C 7a_100011216460_100000210314 [0,0,0,1,0,0|2,0,0]=3 12636 B13R1.654 CCCCCCOC1COCC1O 34a_100000210259_200000725654 [0,0,0,1,0,0|2,0,0]=3 12637 B13R1.654 CCCCCCOC1COCC1O 7a_100000210259_200000725654 [0,0,0,1,0,0|2,0,0]=3 12638 B13R1.654 CCCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000210314 [0,0,0,1,0,0|2,0,0]=3 12639 B13R1.654 CCCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000210314 [0,0,0,1,0,0|2,0,0]=3 12640 B13R1.654 CCCCCCO[C@H]1CNC[C@H]1C 34a_200015306588_100000210314 [0,0,0,1,0,0|3,0,0]=4 12641 B13R1.654 CCCCCCO[C@H]1COC[C@@H]1N 34a_100015191717_100000210314 [0,0,0,1,0,0|3,0,0]=4 12642 B13R1.654 CCCCCCSC1CCCC1=O 62a_100000210314_100000211823 [0,0,0,1,0,0|1,0,2]=4 12643 B13R1.654 CCCCCCSC1CCCC1=O 62a_100000211823_100000210757 [0,0,0,1,0,0|1,0,2]=4 12644 B13R1.654 CCCCCCSC1COCC1O 62a_100000210314_200000725654 [0,0,0,1,0,0|2,0,0]=3 12645 B13R1.654 CCCCCCSC1COCC1O 62a_200000725654_100000210757 [0,0,0,1,0,0|2,0,0]=3 12646 B13R1.654 CCCCCCS[C@@H]1CCC[C@H]1O 62a_100000210314_200016002552 [0,0,0,1,0,0|1,0,0]=2 12647 B13R1.654 CCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000210757 [0,0,0,1,0,0|1,0,0]=2 12648 B13R1.654 CCCCCNN=C1CCCC1O 4a_100000694160_200000719330 [0,0,0,1,0,0|2,0,1]=4 12649 B13R1.654 CCCCCOCC1CCCN1C 34a_100000743107_100000718602 [0,0,0,1,0,0|3,0,0]=4 12650 B13R1.654 CCCCNCCC1CCCN1C 2230a_100000102301_100000005710 [0,0,0,1,0,0|3,0,0]=4 12651 B13R1.654 CCCCNCCC1CCCN1C 7a_106832991798_100000005710 [0,0,0,1,0,0|3,0,0]=4 12652 B13R1.654 CCCCOCCC1CCCN1C 34a_100000210227_100000005710 [0,0,0,1,0,0|3,0,0]=4 12653 B13R1.654 CCCCOCCC1CCCN1C 34a_100011215177_100000210210 [0,0,0,1,0,0|3,0,0]=4 12654 B13R1.654 CCCCOCCC1CCCN1C 7a_100000210227_100000005710 [0,0,0,1,0,0|3,0,0]=4 12655 B13R1.654 CCCCOCCC1CCCN1C 7a_100011215177_100000210211 [0,0,0,1,0,0|3,0,0]=4 12656 B13R1.654 CCCCOCCN1CCC[C@@H]1C 2230a_100020605311_100000743108 [0,0,0,1,0,0|3,0,0]=4 12657 B13R1.654 CCCCOCCN1CCC[C@@H]1C 269982a_100020605311_100000743108 [0,0,0,1,0,0|3,0,0]=4 12658 B13R1.654 CCCCOCCN1CCC[C@H]1C 2230a_100015189458_100000743108 [0,0,0,1,0,0|3,0,0]=4 12659 B13R1.654 CCCCOCCN1CCC[C@H]1C 269982a_100015189458_100000743108 [0,0,0,1,0,0|3,0,0]=4 12660 B13R1.654 CCCCOCCN1CCC[C@H]1C 34a_100015189458_100000743108 [0,0,0,1,0,0|3,0,0]=4 12661 B13R1.654 CCCCOCN[C@H]1COC[C@@H]1O 2230a_100015191717_100011995733 [0,0,0,1,0,0|3,0,0]=4 12662 B13R1.654 CCCCOCOC1CCCC1C 34a_100011216460_100011995733 [0,0,0,1,0,0|3,0,0]=4 12663 B13R1.654 CCCCOCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100011995733 [0,0,0,1,0,0|3,0,0]=4 12664 B13R1.654 CCCCOCO[C@H]1CCC[C@@H]1N 34a_100000748460_100011995733 [0,0,0,1,0,0|3,0,0]=4 12665 B13R1.654 CCCCOCSC1COCC1O 62a_100011995733_200000725654 [0,0,0,1,0,0|3,0,0]=4 12666 B13R1.654 CCCCOCSC1COCC1O 62a_200000725654_100011995733 [0,0,0,1,0,0|3,0,0]=4 12667 B13R1.654 CCCCOCS[C@@H]1CCC[C@H]1O 62a_100011995733_200016002552 [0,0,0,1,0,0|2,0,0]=3 12668 B13R1.654 CCCCOCS[C@@H]1CCC[C@H]1O 62a_200016002552_100011995733 [0,0,0,1,0,0|2,0,0]=3 12669 B13R1.654 CCCCSCCC1CCCN1C 62a_100000005710_100000210210 [0,0,0,1,0,0|3,0,0]=4 12670 B13R1.654 CCCCSCCC1CCCN1C 62a_100000210211_100000005710 [0,0,0,1,0,0|3,0,0]=4 12671 B13R1.654 CCCOCCNC1CCCC1C 269862a_100161115042_100000752053 [0,0,0,1,0,0|3,0,0]=4 12672 B13R1.654 CCCOCCNC1COCC1O 34a_100161115042_200000725654 [0,0,0,1,0,0|3,0,0]=4 12673 B13R1.654 CCCOCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100011215938 [0,0,0,1,0,0|3,0,0]=4 12674 B13R1.654 CCCOCCOC1CCCC1C 34a_100011216460_100011215938 [0,0,0,1,0,0|3,0,0]=4 12675 B13R1.654 CCCOCCOC1CCCC1C 7a_100011216460_100011215938 [0,0,0,1,0,0|3,0,0]=4 12676 B13R1.654 CCCOCCOC1COCC1O 34a_100000752267_200000725654 [0,0,0,1,0,0|3,0,0]=4 12677 B13R1.654 CCCOCCOC1COCC1O 7a_100000752267_200000725654 [0,0,0,1,0,0|3,0,0]=4 12678 B13R1.654 CCCOCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100011215938 [0,0,0,1,0,0|3,0,0]=4 12679 B13R1.654 CCCOCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100011215938 [0,0,0,1,0,0|3,0,0]=4 12680 B13R1.654 CCCOCCSC1COCC1O 62a_100011215938_200000725654 [0,0,0,1,0,0|3,0,0]=4 12681 B13R1.654 CCCOCCSC1COCC1O 62a_200000725654_100011215938 [0,0,0,1,0,0|3,0,0]=4 12682 B13R1.654 CCCOCCS[C@@H]1CCC[C@H]1O 62a_100011215938_200016002552 [0,0,0,1,0,0|2,0,0]=3 12683 B13R1.654 CCCOCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100011215938 [0,0,0,1,0,0|2,0,0]=3 12684 B13R1.654 CCCSCCNC1CCCC1C 269862a_100020603323_100000752053 [0,0,0,1,0,0|3,0,0]=4 12685 B13R1.654 CCCSCCOC1COCC1O 34a_200000230433_200000725654 [0,0,0,1,0,0|3,0,0]=4 12686 B13R1.654 CCCSCCOC1COCC1O 7a_200000230433_200000725654 [0,0,0,1,0,0|3,0,0]=4 12687 B13R1.654 CCOCCCNC1CCCC1C 269862a_100000210961_100000752053 [0,0,0,1,0,0|3,0,0]=4 12688 B13R1.654 CCOCCCNC1COCC1O 34a_100000210961_200000725654 [0,0,0,1,0,0|3,0,0]=4 12689 B13R1.654 CCOCCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100012232248 [0,0,0,1,0,0|3,0,0]=4 12690 B13R1.654 CCOCCCOC1CCCC1C 34a_100011216460_100012232248 [0,0,0,1,0,0|3,0,0]=4 12691 B13R1.654 CCOCCCOC1CCCC1C 7a_100011216460_100012232248 [0,0,0,1,0,0|3,0,0]=4 12692 B13R1.654 CCOCCCOC1COCC1O 34a_100000757476_200000725654 [0,0,0,1,0,0|3,0,0]=4 12693 B13R1.654 CCOCCCOC1COCC1O 7a_100000757476_200000725654 [0,0,0,1,0,0|3,0,0]=4 12694 B13R1.654 CCOCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100012232248 [0,0,0,1,0,0|3,0,0]=4 12695 B13R1.654 CCOCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100012232248 [0,0,0,1,0,0|3,0,0]=4 12696 B13R1.654 CCOCCCSC1COCC1O 62a_100012232248_200000725654 [0,0,0,1,0,0|3,0,0]=4 12697 B13R1.654 CCOCCCSC1COCC1O 62a_200000725654_100012232248 [0,0,0,1,0,0|3,0,0]=4 12698 B13R1.654 CCOCCCS[C@@H]1CCC[C@H]1O 62a_100012232248_200016002552 [0,0,0,1,0,0|2,0,0]=3 12699 B13R1.654 CCOCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100012232248 [0,0,0,1,0,0|2,0,0]=3 12700 B13R1.654 CCSCCCOC1COCC1O 34a_100011216438_200000725654 [0,0,0,1,0,0|3,0,0]=4 12701 B13R1.654 CCSCCCOC1COCC1O 7a_100011216438_200000725654 [0,0,0,1,0,0|3,0,0]=4 12702 B13R1.654 CN1CCCC1CCNCCCF 2230a_100015189416_100000005710 [0,0,0,1,0,0|3,0,0]=4 12703 B13R1.654 CN1CCCC1CCNCCCF 34a_100015189416_100000005710 [0,0,0,1,0,0|3,0,0]=4 12704 B13R1.654 CN1CCCC1CCOCCCBr 34a_100011217188_100000005710 [0,0,0,1,0,0|3,0,0]=4 12705 B13R1.654 CN1CCCC1CCOCCCCl 34a_100000230001_100000005710 [0,0,0,1,0,0|3,0,0]=4 12706 B13R1.654 CN1CCCC1CCOCCCF 34a_100000759539_100000005710 [0,0,0,1,0,0|3,0,0]=4 12707 B13R1.654 CN1CCCC1CCOCCCF 34a_100011215177_100011934791 [0,0,0,1,0,0|3,0,0]=4 12708 B13R1.654 CN1CCCC1CCOCCCF 7a_100011215177_100011934791 [0,0,0,1,0,0|3,0,0]=4 12709 B13R1.654 CN1CCCC1CCOCCCN 34a_100000182051_100000005710 [0,0,0,1,0,0|3,0,0]=4 12710 B13R1.654 CN1CCCC1CCOCCCO 34a_100011215177_100000230001 [0,0,0,1,0,0|2,0,0]=3 12711 B13R1.654 CN1CCCC1CCOCCCO 7a_100011215177_100011215043 [0,0,0,1,0,0|2,0,0]=3 12712 B13R1.654 CN1CCCC1CCSCCCF 62a_100000005710_100011934791 [0,0,0,1,0,0|3,0,0]=4 12713 B13R1.654 CN1CCCC1CCSCCCF 62a_100011934791_100000005710 [0,0,0,1,0,0|3,0,0]=4 12714 B13R1.654 CN1CCCC1CCSCCCO 62a_100000005710_100011215043 [0,0,0,1,0,0|2,0,0]=3 12715 B13R1.654 CN1CCCC1CCSCCCO 62a_100011215043_100000005710 [0,0,0,1,0,0|2,0,0]=3 12716 B13R1.654 CN1CCCC1COCCCCF 34a_100000743107_100000729493 [0,0,0,1,0,0|3,0,0]=4 12717 B13R1.654 CN1CCCC1COCCCCO 34a_100000743107_100011216708 [0,0,0,1,0,0|2,0,0]=3 12718 B13R1.654 COCCCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100000730899 [0,0,0,1,0,0|3,0,0]=4 12719 B13R1.654 COCCCCOC1CCCC1C 34a_100011216460_100000755781 [0,0,0,1,0,0|3,0,0]=4 12720 B13R1.654 COCCCCOC1CCCC1C 7a_100011216460_100000730899 [0,0,0,1,0,0|3,0,0]=4 12721 B13R1.654 COCCCCOC1COCC1O 34a_100000740925_200000725654 [0,0,0,1,0,0|3,0,0]=4 12722 B13R1.654 COCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000755781 [0,0,0,1,0,0|3,0,0]=4 12723 B13R1.654 COCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000755781 [0,0,0,1,0,0|3,0,0]=4 12724 B13R1.654 COCCCCSC1COCC1O 62a_100000730899_200000725654 [0,0,0,1,0,0|3,0,0]=4 12725 B13R1.654 COCCCCSC1COCC1O 62a_200000725654_100000730899 [0,0,0,1,0,0|3,0,0]=4 12726 B13R1.654 COCCCCS[C@@H]1CCC[C@H]1O 62a_100000730899_200016002552 [0,0,0,1,0,0|2,0,0]=3 12727 B13R1.654 COCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000730899 [0,0,0,1,0,0|2,0,0]=3 12728 B13R1.654 COCCOCS[C@@H]1CCC[C@H]1O 62a_100000231047_200016002552 [0,0,0,1,0,0|3,0,0]=4 12729 B13R1.654 COCCOCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000231047 [0,0,0,1,0,0|3,0,0]=4 12730 B13R1.654 CSCCCCOC1COCC1O 34a_100011217163_200000725654 [0,0,0,1,0,0|3,0,0]=4 12731 B13R1.654 CSCCCCOC1COCC1O 7a_100011217163_200000725654 [0,0,0,1,0,0|3,0,0]=4 12732 B13R1.654 C[C@@H]1CCCN1CCCCCC#N 2230a_100015189458_100009813376 [0,0,0,1,0,0|2,0,1]=4 12733 B13R1.654 C[C@@H]1CCCN1CCCCCC#N 269982a_100015189458_100009813376 [0,0,0,1,0,0|2,0,1]=4 12734 B13R1.654 C[C@@H]1CCCN1CCCCCC=O 2230a_100015189458_100000139337 [0,0,0,1,0,0|1,0,2]=4 12735 B13R1.654 C[C@@H]1CCCN1CCCCCC=O 269982a_100015189458_100000139337 [0,0,0,1,0,0|1,0,2]=4 12736 B13R1.654 C[C@@H]1CCCN1CCCCCCF 2230a_100015189458_100015922095 [0,0,0,1,0,0|2,0,0]=3 12737 B13R1.654 C[C@@H]1CCCN1CCCCCCF 269982a_100015189458_100015922095 [0,0,0,1,0,0|2,0,0]=3 12738 B13R1.654 C[C@@H]1CCCN1CCCCCCF 34a_100015189458_100015922095 [0,0,0,1,0,0|2,0,0]=3 12739 B13R1.654 C[C@@H]1CCCN1CCCCCCO 2230a_100015189458_100000766143 [0,0,0,1,0,0|1,0,0]=2 12740 B13R1.654 C[C@@H]1CCCN1CCCCCCO 269982a_100015189458_100000766143 [0,0,0,1,0,0|1,0,0]=2 12741 B13R1.654 C[C@@H]1CCCN1CCCCCCO 34a_100015189458_100000766143 [0,0,0,1,0,0|1,0,0]=2 12742 B13R1.654 C[C@@H]1CNC[C@@H]1OCCCCCF 34a_200015306588_100000729378 [0,0,0,1,0,0|3,0,0]=4 12743 B13R1.654 C[C@@H]1CNC[C@@H]1OCCCCCO 34a_200015306588_100000746330 [0,0,0,1,0,0|2,0,0]=3 12744 B13R1.654 C[C@@H]1CNC[C@@H]1OCCOCCO 34a_200015306588_100000692535 [0,0,0,1,0,0|3,0,0]=4 12745 B13R1.654 C[C@H]1CCCN1CCCCCC#N 2230a_100020605311_100009813376 [0,0,0,1,0,0|2,0,1]=4 12746 B13R1.654 C[C@H]1CCCN1CCCCCC#N 269982a_100020605311_100009813376 [0,0,0,1,0,0|2,0,1]=4 12747 B13R1.654 C[C@H]1CCCN1CCCCCC=O 2230a_100020605311_100000139337 [0,0,0,1,0,0|1,0,2]=4 12748 B13R1.654 C[C@H]1CCCN1CCCCCC=O 269982a_100020605311_100000139337 [0,0,0,1,0,0|1,0,2]=4 12749 B13R1.654 C[C@H]1CCCN1CCCCCCF 2230a_100020605311_100015922095 [0,0,0,1,0,0|2,0,0]=3 12750 B13R1.654 C[C@H]1CCCN1CCCCCCF 269982a_100020605311_100015922095 [0,0,0,1,0,0|2,0,0]=3 12751 B13R1.654 C[C@H]1CCCN1CCCCCCO 2230a_100020605311_100000766143 [0,0,0,1,0,0|1,0,0]=2 12752 B13R1.654 C[C@H]1CCCN1CCCCCCO 269982a_100020605311_100000766143 [0,0,0,1,0,0|1,0,0]=2 12753 B13R1.654 FCCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000729378 [0,0,0,1,0,0|3,0,0]=4 12754 B13R1.654 N#CCCCCS[C@@H]1CCC[C@H]1O 62a_100011219923_200016002552 [0,0,0,1,0,0|2,0,1]=4 12755 B13R1.654 N#CCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000211819 [0,0,0,1,0,0|2,0,1]=4 12756 B13R1.654 NCCCCCOC1COCC1O 34a_100000762737_200000725654 [0,0,0,1,0,0|3,0,0]=4 12757 B13R1.654 N[C@H]1CCC[C@@H]1OCCCCCF 34a_100000748460_100000729378 [0,0,0,1,0,0|3,0,0]=4 12758 B13R1.654 N[C@H]1CCC[C@@H]1OCCCCCO 34a_100000748460_100000746330 [0,0,0,1,0,0|2,0,0]=3 12759 B13R1.654 N[C@H]1CCC[C@@H]1OCCOCCO 34a_100000748460_100000692535 [0,0,0,1,0,0|3,0,0]=4 12760 B13R1.654 N[C@H]1COC[C@@H]1OCCCCCO 34a_100015191717_100000746330 [0,0,0,1,0,0|3,0,0]=4 12761 B13R1.654 O=C1CCCC1NCCCCCO 2230a_100000762737_100000211823 [0,0,0,1,0,0|2,0,1]=4 12762 B13R1.654 O=C1CCCC1NCCCCCO 34a_100000762737_100000709159 [0,0,0,1,0,0|2,0,1]=4 12763 B13R1.654 O=C1CCCC1OCCCCCO 34a_200000719330_100000746330 [0,0,0,1,0,0|2,0,1]=4 12764 B13R1.654 O=C1CCCC1SCCCCCO 62a_100000211823_100000746330 [0,0,0,1,0,0|2,0,1]=4 12765 B13R1.654 O=C1CCCC1SCCCCCO 62a_100000746330_100000211823 [0,0,0,1,0,0|2,0,1]=4 12766 B13R1.654 O=CCCCCS[C@@H]1CCC[C@H]1O 62a_100000139335_200016002552 [0,0,0,1,0,0|2,0,1]=4 12767 B13R1.654 O=CCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000139335 [0,0,0,1,0,0|2,0,1]=4 12768 B13R1.654 OC1COCC1OCCCCCBr 34a_100000746331_200000725654 [0,0,0,1,0,0|3,0,0]=4 12769 B13R1.654 OC1COCC1OCCCCCBr 7a_100000746331_200000725654 [0,0,0,1,0,0|3,0,0]=4 12770 B13R1.654 OC1COCC1OCCCCCCl 34a_100000746330_200000725654 [0,0,0,1,0,0|3,0,0]=4 12771 B13R1.654 OC1COCC1OCCCCCCl 7a_100000746330_200000725654 [0,0,0,1,0,0|3,0,0]=4 12772 B13R1.654 OC1COCC1OCCCCCI 34a_200012148887_200000725654 [0,0,0,1,0,0|3,0,0]=4 12773 B13R1.654 OC1COCC1OCCCCCI 7a_200012148887_200000725654 [0,0,0,1,0,0|3,0,0]=4 12774 B13R1.654 OC1COCC1SCCCCCF 62a_100000729378_200000725654 [0,0,0,1,0,0|3,0,0]=4 12775 B13R1.654 OC1COCC1SCCCCCF 62a_200000725654_100000729378 [0,0,0,1,0,0|3,0,0]=4 12776 B13R1.654 OCCCCCNC1COCC1O 34a_100000762737_200000725654 [0,0,0,1,0,0|3,0,0]=4 12777 B13R1.654 OCCCCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100000746330 [0,0,0,1,0,0|3,0,0]=4 12778 B13R1.654 OCCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000746330 [0,0,0,1,0,0|2,0,0]=3 12779 B13R1.654 OCCCCCSC1COCC1O 62a_100000746330_200000725654 [0,0,0,1,0,0|3,0,0]=4 12780 B13R1.654 OCCCCCSC1COCC1O 62a_200000725654_100000746330 [0,0,0,1,0,0|3,0,0]=4 12781 B13R1.654 OCCCCCS[C@@H]1CCC[C@H]1O 62a_100000746330_200016002552 [0,0,0,1,0,0|2,0,0]=3 12782 B13R1.654 OCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000746330 [0,0,0,1,0,0|2,0,0]=3 12783 B13R1.654 OCCOCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000692535 [0,0,0,1,0,0|3,0,0]=4 12784 B13R1.654 OCCOCCS[C@@H]1CCC[C@H]1O 62a_100011215305_200016002552 [0,0,0,1,0,0|3,0,0]=4 12785 B13R1.654 OCCOCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100011215305 [0,0,0,1,0,0|3,0,0]=4 12786 B13R1.654 O[C@@H]1CCC[C@H]1SCCCCCF 62a_100000729378_200016002552 [0,0,0,1,0,0|2,0,0]=3 12787 B13R1.654 O[C@@H]1CCC[C@H]1SCCCCCF 62a_200016002552_100000729378 [0,0,0,1,0,0|2,0,0]=3 12788 B13R1.654 O[C@H]1COC[C@@H]1NCCCCCF 2230a_100015191717_100000729378 [0,0,0,1,0,0|3,0,0]=4 12789 B13R1.659 BrCCCCCCCCOC1CC1 34a_100009813846_100000211595 [0,0,0,1,0,0|2,0,0]=3 12790 B13R1.659 BrCCCCCCCOCC1CC1 34a_100000760002_100000742324 [0,0,0,1,0,0|2,0,0]=3 12791 B13R1.659 BrCCCCCCCOCC1CC1 7a_100000760002_100000742324 [0,0,0,1,0,0|2,0,0]=3 12792 B13R1.659 BrCCCCCCCOCC1CO1 34a_100000760002_102125554688 [0,0,0,1,0,0|2,0,0]=3 12793 B13R1.659 BrCCCCCCCOCC1CO1 7a_100000760002_102125554688 [0,0,0,1,0,0|2,0,0]=3 12794 B13R1.659 BrCCCCCCCOCC1CS1 7a_100000760002_100000031435 [0,0,0,1,0,0|2,1,0]=4 12795 B13R1.659 BrCCCCCCCOC[C@@H]1CO1 7a_100000760002_100000745022 [0,0,0,1,0,0|2,0,0]=3 12796 B13R1.659 BrCCCCCCOCCC1CC1 34a_100011215345_100000694398 [0,0,0,1,0,0|2,0,0]=3 12797 B13R1.659 BrCCCCCCOCCC1CC1 7a_100011215345_100000764125 [0,0,0,1,0,0|2,0,0]=3 12798 B13R1.659 BrCCCCCCOCCC1CO1 34a_100011215345_100000732470 [0,0,0,1,0,0|2,0,0]=3 12799 B13R1.659 BrCCCCCCOCCC1CO1 7a_100011215345_100000732470 [0,0,0,1,0,0|2,0,0]=3 12800 B13R1.659 BrCCCCCOCCCC1CO1 34a_100000746331_100000733510 [0,0,0,1,0,0|2,0,0]=3 12801 B13R1.659 BrCCCCCOCCCC1CO1 7a_100000746331_100000733510 [0,0,0,1,0,0|2,0,0]=3 12802 B13R1.659 BrCCOCCOCCCC1CO1 34a_100000692535_100000733510 [0,0,0,1,0,0|3,0,0]=4 12803 B13R1.659 BrCCOCCOCCCC1CO1 7a_100000692535_100000733510 [0,0,0,1,0,0|3,0,0]=4 12804 B13R1.659 C#CCCCCCCCNC1CC1 34a_100000212008_100153394163 [0,0,0,1,0,0|2,0,1]=4 12805 B13R1.659 C#CCCCCCCCOC1CC1 34a_100000054614_100000211595 [0,0,0,1,0,0|2,0,1]=4 12806 B13R1.659 C#CCCCCCCCSC1CC1 62a_100153394163_100000211595 [0,0,0,1,0,0|2,0,1]=4 12807 B13R1.659 C#CCCCCCCNCC1CC1 2230a_100000735609_100012276617 [0,0,0,1,0,0|2,0,1]=4 12808 B13R1.659 C#CCCCCCCNCC1CC1 34a_100000735609_100012276617 [0,0,0,1,0,0|2,0,1]=4 12809 B13R1.659 C#CCCCCCCOCC1CC1 34a_100000211283_100012276617 [0,0,0,1,0,0|2,0,1]=4 12810 B13R1.659 C#CCCCCCCOCC1CC1 34a_100011217361_100000742324 [0,0,0,1,0,0|2,0,1]=4 12811 B13R1.659 C#CCCCCCCOCC1CC1 7a_100011217361_100000742324 [0,0,0,1,0,0|2,0,1]=4 12812 B13R1.659 C#CCCCCCCOCC1CO1 34a_100011217361_102125554688 [0,0,0,1,0,0|1,0,2]=4 12813 B13R1.659 C#CCCCCCCOCC1CO1 7a_100011217361_102125554688 [0,0,0,1,0,0|1,0,2]=4 12814 B13R1.659 C#CCCCCCCOC[C@@H]1CO1 34a_100000757423_100012276617 [0,0,0,1,0,0|1,0,2]=4 12815 B13R1.659 C#CCCCCCCOC[C@@H]1CO1 7a_100011217361_100000745022 [0,0,0,1,0,0|1,0,2]=4 12816 B13R1.659 C#CCCCCCCSCC1CC1 62a_100000756562_100012276617 [0,0,0,1,0,0|2,0,1]=4 12817 B13R1.659 C#CCCCCCCSCC1CC1 62a_100012276617_100000742324 [0,0,0,1,0,0|2,0,1]=4 12818 B13R1.659 C#CCCCCCCSCC1CO1 62a_100012276617_102125554688 [0,0,0,1,0,0|1,0,2]=4 12819 B13R1.659 C#CCCCCCCSCC1CO1 62a_102125554688_100012276617 [0,0,0,1,0,0|1,0,2]=4 12820 B13R1.659 C#CCCCCCCSC[C@@H]1CO1 62a_100000745022_100012276617 [0,0,0,1,0,0|1,0,2]=4 12821 B13R1.659 C#CCCCCCCSC[C@@H]1CO1 62a_100012276617_100000745022 [0,0,0,1,0,0|1,0,2]=4 12822 B13R1.659 C#CCCCCCNCCC1CC1 34a_100000764129_100012094781 [0,0,0,1,0,0|2,0,1]=4 12823 B13R1.659 C#CCCCCCOCCC1CC1 34a_100000754188_100012094781 [0,0,0,1,0,0|2,0,1]=4 12824 B13R1.659 C#CCCCCCOCCC1CC1 34a_100000766912_100000694398 [0,0,0,1,0,0|2,0,1]=4 12825 B13R1.659 C#CCCCCCOCCC1CC1 7a_100000754188_100012094781 [0,0,0,1,0,0|2,0,1]=4 12826 B13R1.659 C#CCCCCCOCCC1CC1 7a_100000766912_100000764125 [0,0,0,1,0,0|2,0,1]=4 12827 B13R1.659 C#CCCCCCOCCC1CO1 34a_100000766912_100000732470 [0,0,0,1,0,0|1,0,2]=4 12828 B13R1.659 C#CCCCCCOCCC1CO1 7a_100000766912_100000732470 [0,0,0,1,0,0|1,0,2]=4 12829 B13R1.659 C#CCCCCCOCC[C@@H]1CO1 34a_100009820653_100012094781 [0,0,0,1,0,0|1,0,2]=4 12830 B13R1.659 C#CCCCCCSCCC1CC1 62a_100000764125_100012094781 [0,0,0,1,0,0|2,0,1]=4 12831 B13R1.659 C#CCCCCCSCCC1CC1 62a_100012094781_100000764125 [0,0,0,1,0,0|2,0,1]=4 12832 B13R1.659 C#CCCCCCSCCC1CO1 62a_100000732470_100012094781 [0,0,0,1,0,0|1,0,2]=4 12833 B13R1.659 C#CCCCCCSCCC1CO1 62a_100012094781_100000732470 [0,0,0,1,0,0|1,0,2]=4 12834 B13R1.659 C#CCCCCNCCCC1CO1 2230a_100000706060_100000733510 [0,0,0,1,0,0|1,0,2]=4 12835 B13R1.659 C#CCCCCNCCCC1CO1 34a_100000706060_100000733510 [0,0,0,1,0,0|1,0,2]=4 12836 B13R1.659 C#CCCCCOCCCC1CO1 34a_100000766709_100000733510 [0,0,0,1,0,0|1,0,2]=4 12837 B13R1.659 C#CCCCCOCCCC1CO1 7a_100000766709_100000733510 [0,0,0,1,0,0|1,0,2]=4 12838 B13R1.659 C#CCCCCSCCCC1CO1 62a_100000733510_100010269958 [0,0,0,1,0,0|1,0,2]=4 12839 B13R1.659 C#CCCCCSCCCC1CO1 62a_100010269958_100000733510 [0,0,0,1,0,0|1,0,2]=4 12840 B13R1.659 C=CCCCCCCCNC1CC1 34a_100000212008_100012355270 [0,0,0,1,0,0|2,0,1]=4 12841 B13R1.659 C=CCCCCCCCOC1CC1 34a_100000730831_100000211595 [0,0,0,1,0,0|2,0,1]=4 12842 B13R1.659 C=CCCCCCCCSC1CC1 62a_100012355270_100000211595 [0,0,0,1,0,0|2,0,1]=4 12843 B13R1.659 C=CCCCCCCNCC1CC1 2230a_100000735609_100011215473 [0,0,0,1,0,0|2,0,1]=4 12844 B13R1.659 C=CCCCCCCNCC1CC1 34a_100000735609_100011215473 [0,0,0,1,0,0|2,0,1]=4 12845 B13R1.659 C=CCCCCCCOCC1CC1 34a_100000211283_100011215473 [0,0,0,1,0,0|2,0,1]=4 12846 B13R1.659 C=CCCCCCCOCC1CC1 34a_200011216477_100000742324 [0,0,0,1,0,0|2,0,1]=4 12847 B13R1.659 C=CCCCCCCOCC1CC1 7a_200011216477_100000742324 [0,0,0,1,0,0|2,0,1]=4 12848 B13R1.659 C=CCCCCCCOCC1CO1 34a_200011216477_102125554688 [0,0,0,1,0,0|1,0,2]=4 12849 B13R1.659 C=CCCCCCCOCC1CO1 7a_200011216477_102125554688 [0,0,0,1,0,0|1,0,2]=4 12850 B13R1.659 C=CCCCCCCOC[C@@H]1CO1 34a_100000757423_100011215473 [0,0,0,1,0,0|1,0,2]=4 12851 B13R1.659 C=CCCCCCCOC[C@@H]1CO1 7a_200011216477_100000745022 [0,0,0,1,0,0|1,0,2]=4 12852 B13R1.659 C=CCCCCCCSCC1CC1 62a_100000756562_100011215473 [0,0,0,1,0,0|2,0,1]=4 12853 B13R1.659 C=CCCCCCCSCC1CC1 62a_100011215473_100000742324 [0,0,0,1,0,0|2,0,1]=4 12854 B13R1.659 C=CCCCCCCSCC1CO1 62a_100011215473_102125554688 [0,0,0,1,0,0|1,0,2]=4 12855 B13R1.659 C=CCCCCCCSCC1CO1 62a_102125554688_100011215473 [0,0,0,1,0,0|1,0,2]=4 12856 B13R1.659 C=CCCCCCCSC[C@@H]1CO1 62a_100000745022_100011215473 [0,0,0,1,0,0|1,0,2]=4 12857 B13R1.659 C=CCCCCCCSC[C@@H]1CO1 62a_100011215473_100000745022 [0,0,0,1,0,0|1,0,2]=4 12858 B13R1.659 C=CCCCCCNCCC1CC1 34a_100000764129_100000700193 [0,0,0,1,0,0|2,0,1]=4 12859 B13R1.659 C=CCCCCCOCCC1CC1 34a_100000754188_100000700193 [0,0,0,1,0,0|2,0,1]=4 12860 B13R1.659 C=CCCCCCOCCC1CC1 34a_100011216702_100000694398 [0,0,0,1,0,0|2,0,1]=4 12861 B13R1.659 C=CCCCCCOCCC1CC1 7a_100000754188_100000700193 [0,0,0,1,0,0|2,0,1]=4 12862 B13R1.659 C=CCCCCCOCCC1CC1 7a_100011216702_100000764125 [0,0,0,1,0,0|2,0,1]=4 12863 B13R1.659 C=CCCCCCOCCC1CO1 34a_100011216702_100000732470 [0,0,0,1,0,0|1,0,2]=4 12864 B13R1.659 C=CCCCCCOCCC1CO1 7a_100011216702_100000732470 [0,0,0,1,0,0|1,0,2]=4 12865 B13R1.659 C=CCCCCCOCC[C@@H]1CO1 34a_100009820653_100000700193 [0,0,0,1,0,0|1,0,2]=4 12866 B13R1.659 C=CCCCCCSCCC1CC1 62a_100000700193_100000764125 [0,0,0,1,0,0|2,0,1]=4 12867 B13R1.659 C=CCCCCCSCCC1CC1 62a_100000764125_100000700193 [0,0,0,1,0,0|2,0,1]=4 12868 B13R1.659 C=CCCCCCSCCC1CO1 62a_100000700193_100000732470 [0,0,0,1,0,0|1,0,2]=4 12869 B13R1.659 C=CCCCCCSCCC1CO1 62a_100000732470_100000700193 [0,0,0,1,0,0|1,0,2]=4 12870 B13R1.659 C=CCCCCNCCCC1CO1 2230a_100000703577_100000733510 [0,0,0,1,0,0|1,0,2]=4 12871 B13R1.659 C=CCCCCNCCCC1CO1 34a_100000703577_100000733510 [0,0,0,1,0,0|1,0,2]=4 12872 B13R1.659 C=CCCCCOCCCC1CO1 34a_100000766645_100000733510 [0,0,0,1,0,0|1,0,2]=4 12873 B13R1.659 C=CCCCCOCCCC1CO1 7a_100000766645_100000733510 [0,0,0,1,0,0|1,0,2]=4 12874 B13R1.659 C=CCCCCSCCCC1CO1 62a_100000733510_100011215482 [0,0,0,1,0,0|1,0,2]=4 12875 B13R1.659 C=CCCCCSCCCC1CO1 62a_100011215482_100000733510 [0,0,0,1,0,0|1,0,2]=4 12876 B13R1.659 CC/C=C/CCCOCCC1CO1 34a_100016287902_100000732470 [0,0,0,1,0,0|1,0,2]=4 12877 B13R1.659 CC/C=C/CCCOCCC1CO1 7a_100016287902_100000732470 [0,0,0,1,0,0|1,0,2]=4 12878 B13R1.659 CC/C=C\CCCCOCC1CO1 34a_100016287862_102125554688 [0,0,0,1,0,0|1,0,2]=4 12879 B13R1.659 CC/C=C\CCCCOCC1CO1 7a_100016287862_102125554688 [0,0,0,1,0,0|1,0,2]=4 12880 B13R1.659 CC/C=C\CCCCOC[C@@H]1CO1 7a_100016287862_100000745022 [0,0,0,1,0,0|1,0,2]=4 12881 B13R1.659 CC/C=C\CCOCCCC1CO1 34a_100016288707_100000733510 [0,0,0,1,0,0|1,0,2]=4 12882 B13R1.659 CC/C=C\CCOCCCC1CO1 7a_100016288707_100000733510 [0,0,0,1,0,0|1,0,2]=4 12883 B13R1.659 CC/C=C\CCSCCCC1CO1 62a_100000733510_100015370543 [0,0,0,1,0,0|1,0,2]=4 12884 B13R1.659 CC/C=C\CCSCCCC1CO1 62a_100015370543_100000733510 [0,0,0,1,0,0|1,0,2]=4 12885 B13R1.659 CC=CCCCOCCCC1CO1 34a_100020645299_100000733510 [0,0,0,1,0,0|1,0,2]=4 12886 B13R1.659 CCC#CCCOCCCC1CO1 34a_100000036655_100000733510 [0,0,0,1,0,0|1,0,2]=4 12887 B13R1.659 CCC#CCCOCCCC1CO1 7a_100000036655_100000733510 [0,0,0,1,0,0|1,0,2]=4 12888 B13R1.659 CCC/C=C/COCCCC1CO1 34a_100016278788_100000733510 [0,0,0,1,0,0|1,0,2]=4 12889 B13R1.659 CCC/C=C/COCCCC1CO1 7a_100016278788_100000733510 [0,0,0,1,0,0|1,0,2]=4 12890 B13R1.659 CCCC#CCCOCCC1CO1 34a_100000042726_100000732470 [0,0,0,1,0,0|1,0,2]=4 12891 B13R1.659 CCCC#CCCOCCC1CO1 7a_100000042726_100000732470 [0,0,0,1,0,0|1,0,2]=4 12892 B13R1.659 CCCC#CCOCCCC1CO1 34a_100000034806_100000733510 [0,0,0,1,0,0|1,0,2]=4 12893 B13R1.659 CCCC#CCOCCCC1CO1 7a_100000034806_100000733510 [0,0,0,1,0,0|1,0,2]=4 12894 B13R1.659 CCCC/C=C/COCCC1CO1 34a_200016272032_100000732470 [0,0,0,1,0,0|1,0,2]=4 12895 B13R1.659 CCCC/C=C/COCCC1CO1 7a_200016272032_100000732470 [0,0,0,1,0,0|1,0,2]=4 12896 B13R1.659 CCCC/C=C\CCOCC1CO1 34a_200016286491_102125554688 [0,0,0,1,0,0|1,0,2]=4 12897 B13R1.659 CCCC/C=C\CCOCC1CO1 7a_200016286491_102125554688 [0,0,0,1,0,0|1,0,2]=4 12898 B13R1.659 CCCC/C=C\CCOC[C@@H]1CO1 7a_200016286491_100000745022 [0,0,0,1,0,0|1,0,2]=4 12899 B13R1.659 CCCCC#CCCOCC1CO1 34a_100000037610_102125554688 [0,0,0,1,0,0|1,0,2]=4 12900 B13R1.659 CCCCC#CCCOCC1CO1 7a_100000037610_102125554688 [0,0,0,1,0,0|1,0,2]=4 12901 B13R1.659 CCCCC#CCCOC[C@@H]1CO1 7a_100000037610_100000745022 [0,0,0,1,0,0|1,0,2]=4 12902 B13R1.659 CCCCC#CCOCCC1CO1 34a_200000034558_100000732470 [0,0,0,1,0,0|1,0,2]=4 12903 B13R1.659 CCCCC#CCOCCC1CO1 7a_200000034558_100000732470 [0,0,0,1,0,0|1,0,2]=4 12904 B13R1.659 CCCCC/C=C/COCC1CO1 34a_100016258190_102125554688 [0,0,0,1,0,0|1,0,2]=4 12905 B13R1.659 CCCCC/C=C/COCC1CO1 7a_100016258190_102125554688 [0,0,0,1,0,0|1,0,2]=4 12906 B13R1.659 CCCCC/C=C/COC[C@@H]1CO1 7a_100016258190_100000745022 [0,0,0,1,0,0|1,0,2]=4 12907 B13R1.659 CCCCCC#CCOCC1CO1 34a_200000033628_102125554688 [0,0,0,1,0,0|1,0,2]=4 12908 B13R1.659 CCCCCC#CCOCC1CO1 7a_200000033628_102125554688 [0,0,0,1,0,0|1,0,2]=4 12909 B13R1.659 CCCCCC#CCOC[C@@H]1CO1 34a_100000757423_100009816472 [0,0,0,1,0,0|1,0,2]=4 12910 B13R1.659 CCCCCC#CCOC[C@@H]1CO1 7a_200000033628_100000745022 [0,0,0,1,0,0|1,0,2]=4 12911 B13R1.659 CCCCCC#CCSCC1CO1 62a_100009816472_102125554688 [0,0,0,1,0,0|1,0,2]=4 12912 B13R1.659 CCCCCC#CCSCC1CO1 62a_102125554688_100009816472 [0,0,0,1,0,0|1,0,2]=4 12913 B13R1.659 CCCCCC#CCSC[C@@H]1CO1 62a_100000745022_100009816472 [0,0,0,1,0,0|1,0,2]=4 12914 B13R1.659 CCCCCC#CCSC[C@@H]1CO1 62a_100009816472_100000745022 [0,0,0,1,0,0|1,0,2]=4 12915 B13R1.659 CCCCCCCCCNC1CC1 34a_100000212008_100011214924 [0,0,0,1,0,0|2,0,0]=3 12916 B13R1.659 CCCCCCCCCNC1CC1 34a_100000212291_100000211595 [0,0,0,1,0,0|2,0,0]=3 12917 B13R1.659 CCCCCCCCCOC1CC1 34a_100000210712_100000211595 [0,0,0,1,0,0|2,0,0]=3 12918 B13R1.659 CCCCCCCCNCC1CC1 2230a_100000229939_100000742324 [0,0,0,1,0,0|2,0,0]=3 12919 B13R1.659 CCCCCCCCNCC1CC1 2230a_100000735609_100000210759 [0,0,0,1,0,0|2,0,0]=3 12920 B13R1.659 CCCCCCCCNCC1CC1 269862a_100000229939_100000741477 [0,0,0,1,0,0|2,0,0]=3 12921 B13R1.659 CCCCCCCCNCC1CC1 34a_100000229939_100000742324 [0,0,0,1,0,0|2,0,0]=3 12922 B13R1.659 CCCCCCCCNCC1CC1 34a_100000735609_100000210759 [0,0,0,1,0,0|2,0,0]=3 12923 B13R1.659 CCCCCCCCNCC1CO1 2230a_100000229939_100011216344 [0,0,0,1,0,0|1,0,0]=2 12924 B13R1.659 CCCCCCCCNCC1CO1 34a_100000229939_102125554688 [0,0,0,1,0,0|1,0,0]=2 12925 B13R1.659 CCCCCCCCOCC1CC1 34a_100000210232_100000742324 [0,0,0,1,0,0|2,0,0]=3 12926 B13R1.659 CCCCCCCCOCC1CC1 34a_100000211283_100000210759 [0,0,0,1,0,0|2,0,0]=3 12927 B13R1.659 CCCCCCCCOCC1CC1 7a_100000210232_100000742324 [0,0,0,1,0,0|2,0,0]=3 12928 B13R1.659 CCCCCCCCOCC1CO1 34a_100000210232_102125554688 [0,0,0,1,0,0|1,0,0]=2 12929 B13R1.659 CCCCCCCCOCC1CO1 7a_100000210232_102125554688 [0,0,0,1,0,0|1,0,0]=2 12930 B13R1.659 CCCCCCCCOCC1CS1 7a_100000210232_100000031435 [0,0,0,1,0,0|1,1,0]=3 12931 B13R1.659 CCCCCCCCOC[C@@H]1CO1 34a_100000757423_100000210759 [0,0,0,1,0,0|1,0,0]=2 12932 B13R1.659 CCCCCCCCOC[C@@H]1CO1 7a_100000210232_100000745022 [0,0,0,1,0,0|1,0,0]=2 12933 B13R1.659 CCCCCCCCSCC1CC1 62a_100000210759_100000742324 [0,0,0,1,0,0|2,0,0]=3 12934 B13R1.659 CCCCCCCCSCC1CC1 62a_100000756562_100000210317 [0,0,0,1,0,0|2,0,0]=3 12935 B13R1.659 CCCCCCCCSCC1CO1 62a_100000210759_102125554688 [0,0,0,1,0,0|1,0,0]=2 12936 B13R1.659 CCCCCCCCSCC1CO1 62a_102125554688_100000210317 [0,0,0,1,0,0|1,0,0]=2 12937 B13R1.659 CCCCCCCCSCC1CS1 62a_100000031435_100000210317 [0,0,0,1,0,0|1,1,0]=3 12938 B13R1.659 CCCCCCCCSCC1CS1 62a_100000210759_100000031435 [0,0,0,1,0,0|1,1,0]=3 12939 B13R1.659 CCCCCCCCSC[C@@H]1CO1 62a_100000210759_100000745022 [0,0,0,1,0,0|1,0,0]=2 12940 B13R1.659 CCCCCCCCSC[C@@H]1CO1 62a_100000745022_100000210317 [0,0,0,1,0,0|1,0,0]=2 12941 B13R1.659 CCCCCCCNCCC1CC1 2230a_100000229938_100000694398 [0,0,0,1,0,0|2,0,0]=3 12942 B13R1.659 CCCCCCCNCCC1CC1 34a_100000764129_100000210614 [0,0,0,1,0,0|2,0,0]=3 12943 B13R1.659 CCCCCCCNCCC1CO1 2230a_100000229938_100000732470 [0,0,0,1,0,0|1,0,0]=2 12944 B13R1.659 CCCCCCCOCCC1CC1 34a_100000210272_100000694398 [0,0,0,1,0,0|2,0,0]=3 12945 B13R1.659 CCCCCCCOCCC1CC1 34a_100000754188_100000210614 [0,0,0,1,0,0|2,0,0]=3 12946 B13R1.659 CCCCCCCOCCC1CC1 7a_100000210272_100000764125 [0,0,0,1,0,0|2,0,0]=3 12947 B13R1.659 CCCCCCCOCCC1CC1 7a_100000754188_100000210614 [0,0,0,1,0,0|2,0,0]=3 12948 B13R1.659 CCCCCCCOCCC1CO1 34a_100000210272_100000732470 [0,0,0,1,0,0|1,0,0]=2 12949 B13R1.659 CCCCCCCOCCC1CO1 7a_100000210272_100000732470 [0,0,0,1,0,0|1,0,0]=2 12950 B13R1.659 CCCCCCCOCC[C@@H]1CO1 34a_100009820653_100000210614 [0,0,0,1,0,0|1,0,0]=2 12951 B13R1.659 CCCCCCCSCCC1CC1 62a_100000210614_100000764125 [0,0,0,1,0,0|2,0,0]=3 12952 B13R1.659 CCCCCCCSCCC1CC1 62a_100000764125_100000210316 [0,0,0,1,0,0|2,0,0]=3 12953 B13R1.659 CCCCCCCSCCC1CO1 62a_100000210614_100000732470 [0,0,0,1,0,0|1,0,0]=2 12954 B13R1.659 CCCCCCCSCCC1CO1 62a_100000732470_100000210316 [0,0,0,1,0,0|1,0,0]=2 12955 B13R1.659 CCCCCCNCCCC1CO1 2230a_100000210581_100000733510 [0,0,0,1,0,0|1,0,0]=2 12956 B13R1.659 CCCCCCOCCCC1CO1 34a_100000210259_100000733510 [0,0,0,1,0,0|1,0,0]=2 12957 B13R1.659 CCCCCCOCCCC1CO1 7a_100000210259_100000733510 [0,0,0,1,0,0|1,0,0]=2 12958 B13R1.659 CCCCCCOCCNC1CC1 34a_100000738766_100000210314 [0,0,0,1,0,0|3,0,0]=4 12959 B13R1.659 CCCCCCOCCOC1CC1 34a_100000691444_100000211595 [0,0,0,1,0,0|3,0,0]=4 12960 B13R1.659 CCCCCCSCCCC1CO1 62a_100000210314_100000733510 [0,0,0,1,0,0|1,0,0]=2 12961 B13R1.659 CCCCCCSCCCC1CO1 62a_100000733510_100000210757 [0,0,0,1,0,0|1,0,0]=2 12962 B13R1.659 CCCCCNCCOCC1CC1 34a_100000224656_100000742324 [0,0,0,1,0,0|3,0,0]=4 12963 B13R1.659 CCCCCNCCOCC1CO1 34a_100000224656_102125554688 [0,0,0,1,0,0|2,0,0]=3 12964 B13R1.659 CCCCCOCCOCC1CC1 34a_100011215259_100000742324 [0,0,0,1,0,0|3,0,0]=4 12965 B13R1.659 CCCCCOCCOCC1CC1 7a_100011215259_100000742324 [0,0,0,1,0,0|3,0,0]=4 12966 B13R1.659 CCCCCOCCOCC1CO1 34a_100011215259_102125554688 [0,0,0,1,0,0|2,0,0]=3 12967 B13R1.659 CCCCCOCCOCC1CO1 7a_100011215259_102125554688 [0,0,0,1,0,0|2,0,0]=3 12968 B13R1.659 CCCCCOCCOCC1CS1 7a_100011215259_100000031435 [0,0,0,1,0,0|2,1,0]=4 12969 B13R1.659 CCCCCOCCOC[C@@H]1CO1 7a_100011215259_100000745022 [0,0,0,1,0,0|2,0,0]=3 12970 B13R1.659 CCCCNCCCCOC1CC1 34a_200011216965_100000211595 [0,0,0,1,0,0|3,0,0]=4 12971 B13R1.659 CCCCOCCCCOC1CC1 34a_200000760531_100000211595 [0,0,0,1,0,0|3,0,0]=4 12972 B13R1.659 CCCCOCCCNCC1CC1 2230a_200000211371_100000742324 [0,0,0,1,0,0|3,0,0]=4 12973 B13R1.659 CCCCOCCCNCC1CC1 269862a_200000211371_100000741477 [0,0,0,1,0,0|3,0,0]=4 12974 B13R1.659 CCCCOCCCNCC1CC1 34a_200000211371_100000742324 [0,0,0,1,0,0|3,0,0]=4 12975 B13R1.659 CCCCOCCCNCC1CO1 2230a_200000211371_100011216344 [0,0,0,1,0,0|2,0,0]=3 12976 B13R1.659 CCCCOCCCNCC1CO1 34a_200000211371_102125554688 [0,0,0,1,0,0|2,0,0]=3 12977 B13R1.659 CCCCOCCCOCC1CC1 34a_200011215613_100000742324 [0,0,0,1,0,0|3,0,0]=4 12978 B13R1.659 CCCCOCCCOCC1CC1 7a_200011215613_100000742324 [0,0,0,1,0,0|3,0,0]=4 12979 B13R1.659 CCCCOCCCOCC1CO1 34a_200011215613_102125554688 [0,0,0,1,0,0|2,0,0]=3 12980 B13R1.659 CCCCOCCCOCC1CO1 7a_200011215613_102125554688 [0,0,0,1,0,0|2,0,0]=3 12981 B13R1.659 CCCCOCCCOCC1CS1 7a_200011215613_100000031435 [0,0,0,1,0,0|2,1,0]=4 12982 B13R1.659 CCCCOCCCOC[C@@H]1CO1 7a_200011215613_100000745022 [0,0,0,1,0,0|2,0,0]=3 12983 B13R1.659 CCCCOCCNCCC1CC1 34a_100000764129_100000743108 [0,0,0,1,0,0|3,0,0]=4 12984 B13R1.659 CCCCOCCOCCC1CC1 34a_100000210238_100000694398 [0,0,0,1,0,0|3,0,0]=4 12985 B13R1.659 CCCCOCCOCCC1CC1 34a_100000754188_100000743108 [0,0,0,1,0,0|3,0,0]=4 12986 B13R1.659 CCCCOCCOCCC1CC1 7a_100000210238_100000764125 [0,0,0,1,0,0|3,0,0]=4 12987 B13R1.659 CCCCOCCOCCC1CC1 7a_100000754188_100000743108 [0,0,0,1,0,0|3,0,0]=4 12988 B13R1.659 CCCCOCCOCCC1CO1 34a_100000210238_100000732470 [0,0,0,1,0,0|2,0,0]=3 12989 B13R1.659 CCCCOCCOCCC1CO1 7a_100000210238_100000732470 [0,0,0,1,0,0|2,0,0]=3 12990 B13R1.659 CCCCOCCOCC[C@@H]1CO1 34a_100009820653_100000743108 [0,0,0,1,0,0|2,0,0]=3 12991 B13R1.659 CCCCOCCSCCC1CC1 62a_100000743108_100000764125 [0,0,0,1,0,0|3,0,0]=4 12992 B13R1.659 CCCCOCCSCCC1CC1 62a_100000764125_100000743108 [0,0,0,1,0,0|3,0,0]=4 12993 B13R1.659 CCCCOCCSCCC1CO1 62a_100000732470_100000743108 [0,0,0,1,0,0|2,0,0]=3 12994 B13R1.659 CCCCOCCSCCC1CO1 62a_100000743108_100000732470 [0,0,0,1,0,0|2,0,0]=3 12995 B13R1.659 CCCCOCSCCCC1CO1 62a_100000733510_100011995733 [0,0,0,1,0,0|2,0,0]=3 12996 B13R1.659 CCCCOCSCCCC1CO1 62a_100011995733_100000733510 [0,0,0,1,0,0|2,0,0]=3 12997 B13R1.659 CCCCSCCNCCC1CC1 2230a_100025743550_100000694398 [0,0,0,1,0,0|3,0,0]=4 12998 B13R1.659 CCCCSCCNCCC1CO1 2230a_100025743550_100000732470 [0,0,0,1,0,0|2,0,0]=3 12999 B13R1.659 CCCCSCCOCCC1CC1 34a_200000230436_100000694398 [0,0,0,1,0,0|3,0,0]=4 13000 B13R1.659 CCCCSCCOCCC1CC1 7a_200000230436_100000764125 [0,0,0,1,0,0|3,0,0]=4 13001 B13R1.659 CCCCSCCOCCC1CO1 34a_200000230436_100000732470 [0,0,0,1,0,0|2,0,0]=3 13002 B13R1.659 CCCCSCCOCCC1CO1 7a_200000230436_100000732470 [0,0,0,1,0,0|2,0,0]=3 13003 B13R1.659 CCCOCCCCOCC1CO1 34a_100010889290_100000210303 [0,0,0,1,0,0|2,0,0]=3 13004 B13R1.659 CCCOCCCCOCC1CO1 7a_100010889290_100000210303 [0,0,0,1,0,0|2,0,0]=3 13005 B13R1.659 CCCOCCCNCCC1CC1 2230a_100011217757_100000694398 [0,0,0,1,0,0|3,0,0]=4 13006 B13R1.659 CCCOCCCNCCC1CC1 34a_100011217757_100000694398 [0,0,0,1,0,0|3,0,0]=4 13007 B13R1.659 CCCOCCCNCCC1CO1 2230a_100011217757_100000732470 [0,0,0,1,0,0|2,0,0]=3 13008 B13R1.659 CCCOCCCNCCC1CO1 34a_100011217757_100000732470 [0,0,0,1,0,0|2,0,0]=3 13009 B13R1.659 CCCOCCNCCCC1CO1 2230a_100161115042_100000733510 [0,0,0,1,0,0|2,0,0]=3 13010 B13R1.659 CCCOCCNCCCC1CO1 34a_100161115042_100000733510 [0,0,0,1,0,0|2,0,0]=3 13011 B13R1.659 CCCOCCOCCCC1CO1 34a_100000752267_100000733510 [0,0,0,1,0,0|2,0,0]=3 13012 B13R1.659 CCCOCCOCCCC1CO1 7a_100000752267_100000733510 [0,0,0,1,0,0|2,0,0]=3 13013 B13R1.659 CCCOCCSCCCC1CO1 62a_100000733510_100011215938 [0,0,0,1,0,0|2,0,0]=3 13014 B13R1.659 CCCOCCSCCCC1CO1 62a_100011215938_100000733510 [0,0,0,1,0,0|2,0,0]=3 13015 B13R1.659 CCCSCCNCCCC1CO1 2230a_100020603323_100000733510 [0,0,0,1,0,0|2,0,0]=3 13016 B13R1.659 CCCSCCOCCCC1CO1 34a_200000230433_100000733510 [0,0,0,1,0,0|2,0,0]=3 13017 B13R1.659 CCCSCCOCCCC1CO1 7a_200000230433_100000733510 [0,0,0,1,0,0|2,0,0]=3 13018 B13R1.659 CCOCCCNCCCC1CO1 2230a_100000210961_100000733510 [0,0,0,1,0,0|2,0,0]=3 13019 B13R1.659 CCOCCCNCCCC1CO1 34a_100000210961_100000733510 [0,0,0,1,0,0|2,0,0]=3 13020 B13R1.659 CCOCCCOCCCC1CO1 34a_100000757476_100000733510 [0,0,0,1,0,0|2,0,0]=3 13021 B13R1.659 CCOCCCOCCCC1CO1 7a_100000757476_100000733510 [0,0,0,1,0,0|2,0,0]=3 13022 B13R1.659 CCOCCCSCCCC1CO1 62a_100000733510_100012232248 [0,0,0,1,0,0|2,0,0]=3 13023 B13R1.659 CCOCCCSCCCC1CO1 62a_100012232248_100000733510 [0,0,0,1,0,0|2,0,0]=3 13024 B13R1.659 CCOCCOCCNCC1CO1 2230a_100102712874_100011216344 [0,0,0,1,0,0|3,0,0]=4 13025 B13R1.659 CCOCCOCCNCC1CO1 34a_100102712874_102125554688 [0,0,0,1,0,0|3,0,0]=4 13026 B13R1.659 CCOCCOCCOCC1CO1 34a_100000210240_102125554688 [0,0,0,1,0,0|3,0,0]=4 13027 B13R1.659 CCOCCOCCOCC1CO1 7a_100000210240_102125554688 [0,0,0,1,0,0|3,0,0]=4 13028 B13R1.659 CCOCCOCCOC[C@@H]1CO1 34a_100000757423_100011211534 [0,0,0,1,0,0|3,0,0]=4 13029 B13R1.659 CCOCCOCCOC[C@@H]1CO1 7a_100000210240_100000745022 [0,0,0,1,0,0|3,0,0]=4 13030 B13R1.659 CCOCCOCCSCC1CO1 62a_100011211534_102125554688 [0,0,0,1,0,0|3,0,0]=4 13031 B13R1.659 CCOCCOCCSCC1CO1 62a_102125554688_100011211534 [0,0,0,1,0,0|3,0,0]=4 13032 B13R1.659 CCOCCOCCSC[C@@H]1CO1 62a_100000745022_100011211534 [0,0,0,1,0,0|3,0,0]=4 13033 B13R1.659 CCOCCOCCSC[C@@H]1CO1 62a_100011211534_100000745022 [0,0,0,1,0,0|3,0,0]=4 13034 B13R1.659 CCSCCCOCCCC1CO1 34a_100011216438_100000733510 [0,0,0,1,0,0|2,0,0]=3 13035 B13R1.659 CCSCCCOCCCC1CO1 7a_100011216438_100000733510 [0,0,0,1,0,0|2,0,0]=3 13036 B13R1.659 CNCCCCCOCCC1CC1 34a_100000722520_100000694398 [0,0,0,1,0,0|3,0,0]=4 13037 B13R1.659 CNCCCCCOCCC1CO1 34a_100000722520_100000732470 [0,0,0,1,0,0|2,0,0]=3 13038 B13R1.659 CNCCOCCOCCC1CO1 34a_100000228057_100000732470 [0,0,0,1,0,0|3,0,0]=4 13039 B13R1.659 COCCCCCCNCC1CC1 2230a_100000735609_100011998445 [0,0,0,1,0,0|3,0,0]=4 13040 B13R1.659 COCCCCCCNCC1CC1 34a_100000735609_100011998445 [0,0,0,1,0,0|3,0,0]=4 13041 B13R1.659 COCCCCCCOCC1CC1 34a_100000211283_100011998445 [0,0,0,1,0,0|3,0,0]=4 13042 B13R1.659 COCCCCCCOCC1CC1 34a_200012092642_100000742324 [0,0,0,1,0,0|3,0,0]=4 13043 B13R1.659 COCCCCCCOCC1CC1 7a_200012092642_100000742324 [0,0,0,1,0,0|3,0,0]=4 13044 B13R1.659 COCCCCCCOCC1CO1 34a_200012092642_102125554688 [0,0,0,1,0,0|2,0,0]=3 13045 B13R1.659 COCCCCCCOCC1CO1 7a_200012092642_102125554688 [0,0,0,1,0,0|2,0,0]=3 13046 B13R1.659 COCCCCCCOCC1CS1 7a_200012092642_100000031435 [0,0,0,1,0,0|2,1,0]=4 13047 B13R1.659 COCCCCCCOC[C@@H]1CO1 34a_100000757423_100011998445 [0,0,0,1,0,0|2,0,0]=3 13048 B13R1.659 COCCCCCCOC[C@@H]1CO1 7a_200012092642_100000745022 [0,0,0,1,0,0|2,0,0]=3 13049 B13R1.659 COCCCCCCSCC1CC1 62a_100000756562_100011998445 [0,0,0,1,0,0|3,0,0]=4 13050 B13R1.659 COCCCCCCSCC1CC1 62a_100011998445_100000742324 [0,0,0,1,0,0|3,0,0]=4 13051 B13R1.659 COCCCCCCSCC1CO1 62a_100011998445_102125554688 [0,0,0,1,0,0|2,0,0]=3 13052 B13R1.659 COCCCCCCSCC1CO1 62a_102125554688_100011998445 [0,0,0,1,0,0|2,0,0]=3 13053 B13R1.659 COCCCCCCSCC1CS1 62a_100000031435_100011998445 [0,0,0,1,0,0|2,1,0]=4 13054 B13R1.659 COCCCCCCSCC1CS1 62a_100011998445_100000031435 [0,0,0,1,0,0|2,1,0]=4 13055 B13R1.659 COCCCCCCSC[C@@H]1CO1 62a_100000745022_100011998445 [0,0,0,1,0,0|2,0,0]=3 13056 B13R1.659 COCCCCCCSC[C@@H]1CO1 62a_100011998445_100000745022 [0,0,0,1,0,0|2,0,0]=3 13057 B13R1.659 COCCCCCNCCC1CC1 2230a_100000747528_100000694398 [0,0,0,1,0,0|3,0,0]=4 13058 B13R1.659 COCCCCCNCCC1CC1 34a_100000747528_100000694398 [0,0,0,1,0,0|3,0,0]=4 13059 B13R1.659 COCCCCCNCCC1CO1 2230a_100000747528_100000732470 [0,0,0,1,0,0|2,0,0]=3 13060 B13R1.659 COCCCCCNCCC1CO1 34a_100000747528_100000732470 [0,0,0,1,0,0|2,0,0]=3 13061 B13R1.659 COCCCCOCCCC1CO1 34a_100000740925_100000733510 [0,0,0,1,0,0|2,0,0]=3 13062 B13R1.659 COCCCCSCCCC1CO1 62a_100000730899_100000733510 [0,0,0,1,0,0|2,0,0]=3 13063 B13R1.659 COCCCCSCCCC1CO1 62a_100000733510_100000730899 [0,0,0,1,0,0|2,0,0]=3 13064 B13R1.659 COCCOCCCNCC1CO1 2230a_100000206027_100011216344 [0,0,0,1,0,0|3,0,0]=4 13065 B13R1.659 COCCOCCCNCC1CO1 34a_100000206027_102125554688 [0,0,0,1,0,0|3,0,0]=4 13066 B13R1.659 COCCOCCCOC[C@@H]1CO1 34a_100000757423_100011216529 [0,0,0,1,0,0|3,0,0]=4 13067 B13R1.659 COCCOCCCSCC1CO1 62a_100011216529_102125554688 [0,0,0,1,0,0|3,0,0]=4 13068 B13R1.659 COCCOCCCSCC1CO1 62a_102125554688_100011216529 [0,0,0,1,0,0|3,0,0]=4 13069 B13R1.659 COCCOCCCSC[C@@H]1CO1 62a_100000745022_100011216529 [0,0,0,1,0,0|3,0,0]=4 13070 B13R1.659 COCCOCCCSC[C@@H]1CO1 62a_100011216529_100000745022 [0,0,0,1,0,0|3,0,0]=4 13071 B13R1.659 COCCOCCNCCC1CO1 2230a_100000745349_100000732470 [0,0,0,1,0,0|3,0,0]=4 13072 B13R1.659 COCCOCCNCCC1CO1 34a_100000745349_100000732470 [0,0,0,1,0,0|3,0,0]=4 13073 B13R1.659 COCCOCCOCCC1CO1 34a_100011215163_100000732470 [0,0,0,1,0,0|3,0,0]=4 13074 B13R1.659 COCCOCCOCCC1CO1 7a_100011215163_100000732470 [0,0,0,1,0,0|3,0,0]=4 13075 B13R1.659 COCCOCCOCC[C@@H]1CO1 34a_100009820653_100000695917 [0,0,0,1,0,0|3,0,0]=4 13076 B13R1.659 COCCOCCSCCC1CO1 62a_100000695917_100000732470 [0,0,0,1,0,0|3,0,0]=4 13077 B13R1.659 COCCOCCSCCC1CO1 62a_100000732470_100000695917 [0,0,0,1,0,0|3,0,0]=4 13078 B13R1.659 COCCOCSCCCC1CO1 62a_100000231047_100000733510 [0,0,0,1,0,0|3,0,0]=4 13079 B13R1.659 COCCOCSCCCC1CO1 62a_100000733510_100000231047 [0,0,0,1,0,0|3,0,0]=4 13080 B13R1.659 CSCCCCOCCCC1CO1 34a_100011217163_100000733510 [0,0,0,1,0,0|2,0,0]=3 13081 B13R1.659 CSCCCCOCCCC1CO1 7a_100011217163_100000733510 [0,0,0,1,0,0|2,0,0]=3 13082 B13R1.659 CSCOCCCCOCC1CO1 34a_100010889290_100011218213 [0,0,0,1,0,0|3,0,0]=4 13083 B13R1.659 ClCCCCCCCCOC1CC1 34a_100000033203_100000211595 [0,0,0,1,0,0|2,0,0]=3 13084 B13R1.659 ClCCCCCCOCCC1CC1 34a_100000766143_100000694398 [0,0,0,1,0,0|2,0,0]=3 13085 B13R1.659 ClCCCCCCOCCC1CC1 7a_100000766143_100000764125 [0,0,0,1,0,0|2,0,0]=3 13086 B13R1.659 ClCCCCCCOCCC1CO1 34a_100000766143_100000732470 [0,0,0,1,0,0|2,0,0]=3 13087 B13R1.659 ClCCCCCCOCCC1CO1 7a_100000766143_100000732470 [0,0,0,1,0,0|2,0,0]=3 13088 B13R1.659 ClCCCCCOCCCC1CO1 34a_100000746330_100000733510 [0,0,0,1,0,0|2,0,0]=3 13089 B13R1.659 ClCCCCCOCCCC1CO1 7a_100000746330_100000733510 [0,0,0,1,0,0|2,0,0]=3 13090 B13R1.659 ClCCOCCOCCCC1CO1 34a_100011215305_100000733510 [0,0,0,1,0,0|3,0,0]=4 13091 B13R1.659 ClCCOCCOCCCC1CO1 7a_100011215305_100000733510 [0,0,0,1,0,0|3,0,0]=4 13092 B13R1.659 FCCCCCCNCCC1CC1 34a_100000764129_100015922095 [0,0,0,1,0,0|2,0,0]=3 13093 B13R1.659 FCCCCCCOCCC1CC1 34a_100000732779_100000694398 [0,0,0,1,0,0|2,0,0]=3 13094 B13R1.659 FCCCCCCOCCC1CC1 34a_100000754188_100015922095 [0,0,0,1,0,0|2,0,0]=3 13095 B13R1.659 FCCCCCCOCCC1CC1 7a_100000732779_100000764125 [0,0,0,1,0,0|2,0,0]=3 13096 B13R1.659 FCCCCCCOCCC1CC1 7a_100000754188_100015922095 [0,0,0,1,0,0|2,0,0]=3 13097 B13R1.659 FCCCCCCOCCC1CO1 34a_100000732779_100000732470 [0,0,0,1,0,0|2,0,0]=3 13098 B13R1.659 FCCCCCCOCCC1CO1 7a_100000732779_100000732470 [0,0,0,1,0,0|2,0,0]=3 13099 B13R1.659 FCCCCCCOCC[C@@H]1CO1 34a_100009820653_100015922095 [0,0,0,1,0,0|2,0,0]=3 13100 B13R1.659 FCCCCCCSCCC1CC1 62a_100000764125_100015922095 [0,0,0,1,0,0|2,0,0]=3 13101 B13R1.659 FCCCCCCSCCC1CC1 62a_100015922095_100000764125 [0,0,0,1,0,0|2,0,0]=3 13102 B13R1.659 FCCCCCCSCCC1CO1 62a_100000732470_100015922095 [0,0,0,1,0,0|2,0,0]=3 13103 B13R1.659 FCCCCCCSCCC1CO1 62a_100015922095_100000732470 [0,0,0,1,0,0|2,0,0]=3 13104 B13R1.659 FCCCCCOCCNC1CC1 34a_100000738766_100000729378 [0,0,0,1,0,0|3,0,0]=4 13105 B13R1.659 FCCCCCSCCCC1CO1 62a_100000729378_100000733510 [0,0,0,1,0,0|2,0,0]=3 13106 B13R1.659 FCCCCCSCCCC1CO1 62a_100000733510_100000729378 [0,0,0,1,0,0|2,0,0]=3 13107 B13R1.659 FCCOCCCCOCC1CO1 34a_100010889290_100011217306 [0,0,0,1,0,0|3,0,0]=4 13108 B13R1.659 FCCOCCCCOCC1CO1 7a_100010889290_100011217306 [0,0,0,1,0,0|3,0,0]=4 13109 B13R1.659 FCCOCCOCCCC1CO1 34a_200015357709_100000733510 [0,0,0,1,0,0|3,0,0]=4 13110 B13R1.659 FCCOCCOCCCC1CO1 7a_200015357709_100000733510 [0,0,0,1,0,0|3,0,0]=4 13111 B13R1.659 ICCCCCOCCCC1CO1 34a_200012148887_100000733510 [0,0,0,1,0,0|2,0,0]=3 13112 B13R1.659 ICCCCCOCCCC1CO1 7a_200012148887_100000733510 [0,0,0,1,0,0|2,0,0]=3 13113 B13R1.659 ICCOCCOCCCC1CO1 34a_100012149058_100000733510 [0,0,0,1,0,0|3,0,0]=4 13114 B13R1.659 ICCOCCOCCCC1CO1 7a_100012149058_100000733510 [0,0,0,1,0,0|3,0,0]=4 13115 B13R1.659 N#CCCCCCCNCC1CC1 2230a_100000735609_100009813337 [0,0,0,1,0,0|2,0,1]=4 13116 B13R1.659 N#CCCCCCCSCC1CC1 62a_100000756562_100009813337 [0,0,0,1,0,0|2,0,1]=4 13117 B13R1.659 N#CCCCCCCSCC1CC1 62a_100009813337_100000742324 [0,0,0,1,0,0|2,0,1]=4 13118 B13R1.659 N#CCCCCCCSCC1CO1 62a_100009813337_102125554688 [0,0,0,1,0,0|2,0,1]=4 13119 B13R1.659 N#CCCCCCCSCC1CO1 62a_102125554688_100009813337 [0,0,0,1,0,0|2,0,1]=4 13120 B13R1.659 N#CCCCCCCSC[C@@H]1CO1 62a_100000745022_100009813337 [0,0,0,1,0,0|2,0,1]=4 13121 B13R1.659 N#CCCCCCCSC[C@@H]1CO1 62a_100009813337_100000745022 [0,0,0,1,0,0|2,0,1]=4 13122 B13R1.659 N#CCCCCCOCCC1CC1 7a_100000754188_100009813376 [0,0,0,1,0,0|2,0,1]=4 13123 B13R1.659 N#CCCCCCSCCC1CC1 62a_100000764125_100009813376 [0,0,0,1,0,0|2,0,1]=4 13124 B13R1.659 N#CCCCCCSCCC1CC1 62a_100009813376_100000764125 [0,0,0,1,0,0|2,0,1]=4 13125 B13R1.659 N#CCCCCCSCCC1CO1 62a_100000732470_100009813376 [0,0,0,1,0,0|2,0,1]=4 13126 B13R1.659 N#CCCCCCSCCC1CO1 62a_100009813376_100000732470 [0,0,0,1,0,0|2,0,1]=4 13127 B13R1.659 N#CCCCCSCCCC1CO1 62a_100000733510_100000211819 [0,0,0,1,0,0|2,0,1]=4 13128 B13R1.659 N#CCCCCSCCCC1CO1 62a_100011219923_100000733510 [0,0,0,1,0,0|2,0,1]=4 13129 B13R1.659 NCCCCCCCCOC1CC1 34a_102515433106_100000211595 [0,0,0,1,0,0|2,0,0]=3 13130 B13R1.659 NCCCCCCCOCC1CC1 34a_100011996573_100000742324 [0,0,0,1,0,0|2,0,0]=3 13131 B13R1.659 NCCCCCCCOCC1CO1 34a_100011996573_102125554688 [0,0,0,1,0,0|2,0,0]=3 13132 B13R1.659 NCCCCCCOCCC1CC1 34a_100000686447_100000694398 [0,0,0,1,0,0|2,0,0]=3 13133 B13R1.659 NCCCCCCOCCC1CO1 34a_100000686447_100000732470 [0,0,0,1,0,0|2,0,0]=3 13134 B13R1.659 NCCCCCOCCCC1CO1 34a_100000762737_100000733510 [0,0,0,1,0,0|2,0,0]=3 13135 B13R1.659 NCCCOCCCOCC1CC1 34a_100011310245_100000742324 [0,0,0,1,0,0|3,0,0]=4 13136 B13R1.659 NCCCOCCCOCC1CO1 34a_100011310245_102125554688 [0,0,0,1,0,0|3,0,0]=4 13137 B13R1.659 NCCNCCCCCOC1CC1 34a_103619048469_100000211595 [0,0,0,1,0,0|3,0,0]=4 13138 B13R1.659 NCCOCCOCCCC1CO1 34a_100000211614_100000733510 [0,0,0,1,0,0|3,0,0]=4 13139 B13R1.659 O=CCCCCCOCCC1CC1 7a_100000754188_100000139337 [0,0,0,1,0,0|1,0,2]=4 13140 B13R1.659 O=CCCCCCSCCC1CC1 62a_100000139337_100000764125 [0,0,0,1,0,0|1,0,2]=4 13141 B13R1.659 O=CCCCCCSCCC1CC1 62a_100000764125_100000139337 [0,0,0,1,0,0|1,0,2]=4 13142 B13R1.659 O=CCCCCCSCCC1CO1 62a_100000139337_100000732470 [0,0,0,1,0,0|2,0,1]=4 13143 B13R1.659 O=CCCCCCSCCC1CO1 62a_100000732470_100000139337 [0,0,0,1,0,0|2,0,1]=4 13144 B13R1.659 O=CCCCCSCCCC1CO1 62a_100000139335_100000733510 [0,0,0,1,0,0|2,0,1]=4 13145 B13R1.659 O=CCCCCSCCCC1CO1 62a_100000733510_100000139335 [0,0,0,1,0,0|2,0,1]=4 13146 B13R1.659 OCCCCCCCCNC1CC1 34a_100000212008_100000033203 [0,0,0,1,0,0|1,0,0]=2 13147 B13R1.659 OCCCCCCCCNC1CC1 34a_102515433106_100000211595 [0,0,0,1,0,0|1,0,0]=2 13148 B13R1.659 OCCCCCCCCSC1CC1 62a_100000033203_100000211595 [0,0,0,1,0,0|1,0,0]=2 13149 B13R1.659 OCCCCCCCNCC1CC1 2230a_100000735609_100000760002 [0,0,0,1,0,0|1,0,0]=2 13150 B13R1.659 OCCCCCCCNCC1CC1 2230a_100011996573_100000742324 [0,0,0,1,0,0|1,0,0]=2 13151 B13R1.659 OCCCCCCCNCC1CC1 269862a_100011996573_100000741477 [0,0,0,1,0,0|1,0,0]=2 13152 B13R1.659 OCCCCCCCNCC1CC1 34a_100000735609_100000760002 [0,0,0,1,0,0|1,0,0]=2 13153 B13R1.659 OCCCCCCCNCC1CC1 34a_100011996573_100000742324 [0,0,0,1,0,0|1,0,0]=2 13154 B13R1.659 OCCCCCCCNCC1CO1 2230a_100011996573_100011216344 [0,0,0,1,0,0|2,0,0]=3 13155 B13R1.659 OCCCCCCCNCC1CO1 34a_100011996573_102125554688 [0,0,0,1,0,0|2,0,0]=3 13156 B13R1.659 OCCCCCCCOCC1CC1 34a_100000211283_100000760002 [0,0,0,1,0,0|1,0,0]=2 13157 B13R1.659 OCCCCCCCOC[C@@H]1CO1 34a_100000757423_100000760002 [0,0,0,1,0,0|2,0,0]=3 13158 B13R1.659 OCCCCCCCSCC1CC1 62a_100000756562_100000760002 [0,0,0,1,0,0|1,0,0]=2 13159 B13R1.659 OCCCCCCCSCC1CC1 62a_100000760002_100000742324 [0,0,0,1,0,0|1,0,0]=2 13160 B13R1.659 OCCCCCCCSCC1CO1 62a_100000760002_102125554688 [0,0,0,1,0,0|2,0,0]=3 13161 B13R1.659 OCCCCCCCSCC1CO1 62a_102125554688_100000760002 [0,0,0,1,0,0|2,0,0]=3 13162 B13R1.659 OCCCCCCCSCC1CS1 62a_100000031435_100000760002 [0,0,0,1,0,0|2,0,0]=3 13163 B13R1.659 OCCCCCCCSCC1CS1 62a_100000760002_100000031435 [0,0,0,1,0,0|2,0,0]=3 13164 B13R1.659 OCCCCCCCSC[C@@H]1CO1 62a_100000745022_100000760002 [0,0,0,1,0,0|2,0,0]=3 13165 B13R1.659 OCCCCCCCSC[C@@H]1CO1 62a_100000760002_100000745022 [0,0,0,1,0,0|2,0,0]=3 13166 B13R1.659 OCCCCCCNCCC1CC1 2230a_100000686447_100000694398 [0,0,0,1,0,0|1,0,0]=2 13167 B13R1.659 OCCCCCCNCCC1CC1 34a_100000686447_100000694398 [0,0,0,1,0,0|1,0,0]=2 13168 B13R1.659 OCCCCCCNCCC1CC1 34a_100000764129_100000766143 [0,0,0,1,0,0|1,0,0]=2 13169 B13R1.659 OCCCCCCNCCC1CO1 2230a_100000686447_100000732470 [0,0,0,1,0,0|2,0,0]=3 13170 B13R1.659 OCCCCCCNCCC1CO1 34a_100000686447_100000732470 [0,0,0,1,0,0|2,0,0]=3 13171 B13R1.659 OCCCCCCOCCC1CC1 34a_100000754188_100000766143 [0,0,0,1,0,0|1,0,0]=2 13172 B13R1.659 OCCCCCCOCCC1CC1 7a_100000754188_100000766143 [0,0,0,1,0,0|1,0,0]=2 13173 B13R1.659 OCCCCCCOCC[C@@H]1CO1 34a_100009820653_100000766143 [0,0,0,1,0,0|2,0,0]=3 13174 B13R1.659 OCCCCCCSCCC1CC1 62a_100000764125_100000766143 [0,0,0,1,0,0|1,0,0]=2 13175 B13R1.659 OCCCCCCSCCC1CC1 62a_100000766143_100000764125 [0,0,0,1,0,0|1,0,0]=2 13176 B13R1.659 OCCCCCCSCCC1CO1 62a_100000732470_100000766143 [0,0,0,1,0,0|2,0,0]=3 13177 B13R1.659 OCCCCCCSCCC1CO1 62a_100000766143_100000732470 [0,0,0,1,0,0|2,0,0]=3 13178 B13R1.659 OCCCCCNCC#CC1CC1 2230a_100000762737_100009895102 [0,0,0,1,0,0|1,0,2]=4 13179 B13R1.659 OCCCCCNCC#CC1CC1 34a_100000762737_100009895102 [0,0,0,1,0,0|1,0,2]=4 13180 B13R1.659 OCCCCCNCCCC1CO1 2230a_100000762737_100000733510 [0,0,0,1,0,0|2,0,0]=3 13181 B13R1.659 OCCCCCNCCCC1CO1 34a_100000762737_100000733510 [0,0,0,1,0,0|2,0,0]=3 13182 B13R1.659 OCCCCCOCC#CC1CC1 34a_100000083941_100000746330 [0,0,0,1,0,0|1,0,2]=4 13183 B13R1.659 OCCCCCOCC#CC1CC1 7a_100000083941_100000746330 [0,0,0,1,0,0|1,0,2]=4 13184 B13R1.659 OCCCCCOCCNC1CC1 34a_100000738766_100000746330 [0,0,0,1,0,0|2,0,0]=3 13185 B13R1.659 OCCCCCSCC#CC1CC1 62a_100000746330_100009895102 [0,0,0,1,0,0|1,0,2]=4 13186 B13R1.659 OCCCCCSCC#CC1CC1 62a_100009895102_100000746330 [0,0,0,1,0,0|1,0,2]=4 13187 B13R1.659 OCCCCCSCCCC1CO1 62a_100000733510_100000746330 [0,0,0,1,0,0|2,0,0]=3 13188 B13R1.659 OCCCCCSCCCC1CO1 62a_100000746330_100000733510 [0,0,0,1,0,0|2,0,0]=3 13189 B13R1.659 OCCCOCCCNCC1CC1 2230a_100011310245_100000742324 [0,0,0,1,0,0|2,0,0]=3 13190 B13R1.659 OCCCOCCCNCC1CC1 269862a_100011310245_100000741477 [0,0,0,1,0,0|2,0,0]=3 13191 B13R1.659 OCCCOCCCNCC1CC1 34a_100011310245_100000742324 [0,0,0,1,0,0|2,0,0]=3 13192 B13R1.659 OCCCOCCCNCC1CO1 2230a_100011310245_100011216344 [0,0,0,1,0,0|3,0,0]=4 13193 B13R1.659 OCCCOCCCNCC1CO1 34a_100011310245_102125554688 [0,0,0,1,0,0|3,0,0]=4 13194 B13R1.659 OCCOCCCCOCC1CO1 34a_100010889290_100000211926 [0,0,0,1,0,0|3,0,0]=4 13195 B13R1.659 OCCOCCCCOCC1CO1 7a_100010889290_100000211926 [0,0,0,1,0,0|3,0,0]=4 13196 B13R1.659 OCCOCCNCCCC1CO1 2230a_100000211614_100000733510 [0,0,0,1,0,0|3,0,0]=4 13197 B13R1.659 OCCOCCNCCCC1CO1 34a_100000211614_100000733510 [0,0,0,1,0,0|3,0,0]=4 13198 B13R1.659 OCCOCCOCCNC1CC1 34a_100000212008_100000032323 [0,0,0,1,0,0|3,0,0]=4 13199 B13R1.659 OCCOCCOCCNC1CC1 34a_100000738766_100000692535 [0,0,0,1,0,0|3,0,0]=4 13200 B13R1.659 OCCOCCOCCNC1CC1 34a_100011998139_100000211595 [0,0,0,1,0,0|3,0,0]=4 13201 B13R1.659 OCCOCCOCCSC1CC1 62a_100000032323_100000211595 [0,0,0,1,0,0|3,0,0]=4 13202 B13R1.659 OCCOCCSCCCC1CO1 62a_100000733510_100011215305 [0,0,0,1,0,0|3,0,0]=4 13203 B13R1.659 OCCOCCSCCCC1CO1 62a_100011215305_100000733510 [0,0,0,1,0,0|3,0,0]=4 13204 B13R1.659 OCCSCCNCCCC1CO1 2230a_100011219999_100000733510 [0,0,0,1,0,0|3,0,0]=4 13205 B13R1.667 C#CCCCCCCN1CCC1C 269982a_100000755817_100012276617 [0,0,0,1,0,0|2,0,1]=4 13206 B13R1.667 C#CCCCCCCN1CCC1C 34a_100000755817_100012276617 [0,0,0,1,0,0|2,0,1]=4 13207 B13R1.667 C=CCCCCCCN1CCC1C 269982a_100000755817_100011215473 [0,0,0,1,0,0|2,0,1]=4 13208 B13R1.667 C=CCCCCCCN1CCC1C 34a_100000755817_100011215473 [0,0,0,1,0,0|2,0,1]=4 13209 B13R1.667 CC1CCN1CCCCCCC#N 269982a_100000755817_100009813337 [0,0,0,1,0,0|2,0,1]=4 13210 B13R1.667 CC1CCN1CCCCCCCO 269982a_100000755817_100000760002 [0,0,0,1,0,0|1,0,0]=2 13211 B13R1.667 CC1CCN1CCCCCCCO 34a_100000755817_100000760002 [0,0,0,1,0,0|1,0,0]=2 13212 B13R1.667 CCCCCCCCN1CCC1C 269982a_100000755817_100000210759 [0,0,0,1,0,0|2,0,0]=3 13213 B13R1.667 CCCCCCCCN1CCC1C 34a_100000755817_100000210759 [0,0,0,1,0,0|2,0,0]=3 13214 B13R1.667 CCCCCCCOC1CCC1=O 34a_100000210272_100009892977 [0,0,0,1,0,0|1,0,2]=4 13215 B13R1.667 CCCCCCCOC1CCC1=O 7a_100000210272_100009892977 [0,0,0,1,0,0|1,0,2]=4 13216 B13R1.667 CCCCCCCSC1CCC1=O 62a_100000210614_100009892977 [0,0,0,1,0,0|1,0,2]=4 13217 B13R1.667 CCCCCCCSC1CCC1=O 62a_100009892977_100000210316 [0,0,0,1,0,0|1,0,2]=4 13218 B13R1.667 CCCCCNCCC1CCC1=O 2230a_100000209983_200016118888 [0,0,0,1,0,0|1,0,2]=4 13219 B13R1.667 CCCCCOCCC1CCC1=O 7a_100000210253_200016118888 [0,0,0,1,0,0|1,0,2]=4 13220 B13R1.667 CCCCCSCCC1CCC1=O 62a_100000210326_200016118888 [0,0,0,1,0,0|1,0,2]=4 13221 B13R1.667 CCCCCSCCC1CCC1=O 62a_200016118888_100000210326 [0,0,0,1,0,0|1,0,2]=4 13222 B13R1.667 COCCCCCCN1CCC1C 269982a_100000755817_100011998445 [0,0,0,1,0,0|3,0,0]=4 13223 B13R1.667 COCCCCCCN1CCC1C 34a_100000755817_100011998445 [0,0,0,1,0,0|3,0,0]=4 13224 B13R1.667 O=C1CCC1CCNCCCCO 2230a_100000750430_200016118888 [0,0,0,1,0,0|2,0,1]=4 13225 B13R1.667 O=C1CCC1CCSCCCCO 62a_100000210776_200016118888 [0,0,0,1,0,0|2,0,1]=4 13226 B13R1.667 O=C1CCC1CCSCCCCO 62a_200016118888_100000210776 [0,0,0,1,0,0|2,0,1]=4 13227 B13R1.667 O=C1CCC1NCCCCCCO 34a_100000686447_100009892977 [0,0,0,1,0,0|2,0,1]=4 13228 B13R1.667 O=C1CCC1SCCCCCCO 62a_100000766143_100009892977 [0,0,0,1,0,0|2,0,1]=4 13229 B13R1.667 O=C1CCC1SCCCCCCO 62a_100009892977_100000766143 [0,0,0,1,0,0|2,0,1]=4 13230 B13R1.671 C=CCCNC1CCCC1CCC 269862a_100015191253_100000723119 [0,0,0,1,0,0|2,0,1]=4 13231 B13R1.671 C=CCCNC1CCCC1CCC 270004a_100015191253_100000723119 [0,0,0,1,0,0|2,0,1]=4 13232 B13R1.671 CCCC1CCCC1=NNCCO 4a_100000210001_100000723119 [0,0,0,1,0,0|2,0,1]=4 13233 B13R1.671 CCCC1CCCC1NCCC#N 270004a_100000720768_100000723119 [0,0,0,1,0,0|2,0,1]=4 13234 B13R1.671 CCCC1CCCC1NCCCF 269862a_100015189416_100000723119 [0,0,0,1,0,0|2,0,0]=3 13235 B13R1.671 CCCC1CCCC1NCCCF 270004a_100015189416_100000723119 [0,0,0,1,0,0|2,0,0]=3 13236 B13R1.671 CCCC1CCCC1NCCCO 269862a_100000182051_100000723119 [0,0,0,1,0,0|1,0,0]=2 13237 B13R1.671 CCCC1CCCC1NCCCO 270004a_100000182051_100000723119 [0,0,0,1,0,0|1,0,0]=2 13238 B13R1.671 CCCC1CCCC1NCCOC 269862a_100000209980_100000723119 [0,0,0,1,0,0|3,0,0]=4 13239 B13R1.671 CCCC1CCCC1NCCOC 270004a_100000209980_100000723119 [0,0,0,1,0,0|3,0,0]=4 13240 B13R1.671 CCCC1CCCC1NCCSC 269862a_100020590264_100000723119 [0,0,0,1,0,0|3,0,0]=4 13241 B13R1.671 CCCC1CCCC1NCCSC 270004a_100020590264_100000723119 [0,0,0,1,0,0|3,0,0]=4 13242 B13R1.671 CCCCCC1CCCC1NCC 269862a_100015525214_200000198059 [0,0,0,1,0,0|2,0,0]=3 13243 B13R1.671 CCCCCC1CCCC1NCC 270004a_100015525214_200000198059 [0,0,0,1,0,0|2,0,0]=3 13244 B13R1.671 CCCCCN1CCC[C@H]1COC 2230a_100020646714_100000210326 [0,0,0,1,0,0|3,0,0]=4 13245 B13R1.671 CCCCCN1CCC[C@H]1COC 269982a_100020646714_100000210215 [0,0,0,1,0,0|3,0,0]=4 13246 B13R1.671 CCCCCN1CCC[C@H]1COC 34a_100020646714_100000718602 [0,0,0,1,0,0|3,0,0]=4 13247 B13R1.671 CCCCNC1CCCC1CCC 269862a_100000102301_100000723119 [0,0,0,1,0,0|2,0,0]=3 13248 B13R1.671 CCCCNC1CCCC1CCC 270004a_100000102301_100000723119 [0,0,0,1,0,0|2,0,0]=3 13249 B13R1.671 CCCN1CCCC1COCCF 34a_200000694710_100011217306 [0,0,0,1,0,0|3,0,0]=4 13250 B13R1.671 CCCN1CCCC1COCCF 7a_200000694710_100011217306 [0,0,0,1,0,0|3,0,0]=4 13251 B13R1.671 CCCN1CCCC1COCCO 34a_200000694710_100000211926 [0,0,0,1,0,0|2,0,0]=3 13252 B13R1.671 CCCN1CCCC1COCCO 7a_200000694710_100000211926 [0,0,0,1,0,0|2,0,0]=3 13253 B13R1.671 CCCOCC1CCCN1CCC 34a_200000694710_100000210303 [0,0,0,1,0,0|3,0,0]=4 13254 B13R1.671 CCCOCC1CCCN1CCC 7a_200000694710_100000210303 [0,0,0,1,0,0|3,0,0]=4 13255 B13R1.671 COC[C@@H]1CCCN1CCCCF 2230a_100020646714_100000729493 [0,0,0,1,0,0|3,0,0]=4 13256 B13R1.671 COC[C@@H]1CCCN1CCCCF 269982a_100020646714_100000729493 [0,0,0,1,0,0|3,0,0]=4 13257 B13R1.671 COC[C@@H]1CCCN1CCCCF 34a_100020646714_100000729493 [0,0,0,1,0,0|3,0,0]=4 13258 B13R1.671 COC[C@@H]1CCCN1CCCCO 2230a_100020646714_100000210776 [0,0,0,1,0,0|2,0,0]=3 13259 B13R1.671 COC[C@@H]1CCCN1CCCCO 269982a_100020646714_100000210776 [0,0,0,1,0,0|2,0,0]=3 13260 B13R1.671 COC[C@@H]1CCCN1CCCCO 34a_100020646714_100011216708 [0,0,0,1,0,0|2,0,0]=3 13261 B13R1.1150 C#CCCCN1CCCCCCC1 2230a_100000211400_100000731252 [0,0,0,1,0,0|2,0,1]=4 13262 B13R1.1150 C#CCCCN1CCCCCCC1 269982a_100000211400_100011215417 [0,0,0,1,0,0|2,0,1]=4 13263 B13R1.1150 C#CCCCN1CCCCCCC1 34a_100000211400_100000695029 [0,0,0,1,0,0|2,0,1]=4 13264 B13R1.1150 C#CCCNC1CCCCCCC1 2230a_100000211152_100000688953 [0,0,0,1,0,0|2,0,1]=4 13265 B13R1.1150 C#CCCNC1CCCCCCC1 34a_100000211152_100000688953 [0,0,0,1,0,0|2,0,1]=4 13266 B13R1.1150 C#CCCOC1CCCCCCC1 34a_100000210054_100000688953 [0,0,0,1,0,0|2,0,1]=4 13267 B13R1.1150 C#CCCOC1CCCCCCC1 7a_100000210054_100000688953 [0,0,0,1,0,0|2,0,1]=4 13268 B13R1.1150 C#CCOCC1CCCCCCC1 34a_100011216312_100000184674 [0,0,0,1,0,0|2,0,1]=4 13269 B13R1.1150 C#CCOCC1CCCCCCC1 7a_100011216312_100000038162 [0,0,0,1,0,0|2,0,1]=4 13270 B13R1.1150 C=CCCCN1CCCCCCC1 2230a_100000211400_100011713584 [0,0,0,1,0,0|2,0,1]=4 13271 B13R1.1150 C=CCCCN1CCCCCCC1 269982a_100000211400_100000757094 [0,0,0,1,0,0|2,0,1]=4 13272 B13R1.1150 C=CCCCN1CCCCCCC1 34a_100000211400_100000757094 [0,0,0,1,0,0|2,0,1]=4 13273 B13R1.1150 C=CCCNC1CCCCCCC1 2230a_100000211152_100000754431 [0,0,0,1,0,0|2,0,1]=4 13274 B13R1.1150 C=CCCNC1CCCCCCC1 270004a_100015191253_100000210524 [0,0,0,1,0,0|2,0,1]=4 13275 B13R1.1150 C=CCCNC1CCCCCCC1 34a_100000211152_100000754431 [0,0,0,1,0,0|2,0,1]=4 13276 B13R1.1150 C=CCCOC1CCCCCCC1 34a_100000210054_100000754431 [0,0,0,1,0,0|2,0,1]=4 13277 B13R1.1150 C=CCCOC1CCCCCCC1 7a_100000210054_100000754431 [0,0,0,1,0,0|2,0,1]=4 13278 B13R1.1150 C=CCOCC1CCCCCCC1 34a_100011216312_100015514636 [0,0,0,1,0,0|2,0,1]=4 13279 B13R1.1150 C=CCOCC1CCCCCCC1 7a_100011216312_100015514636 [0,0,0,1,0,0|2,0,1]=4 13280 B13R1.1150 CCCCCN1CCCCCCC1 2230a_100000211400_100000210326 [0,0,0,1,0,0|2,0,0]=3 13281 B13R1.1150 CCCCCN1CCCCCCC1 269982a_100000211400_100000210215 [0,0,0,1,0,0|2,0,0]=3 13282 B13R1.1150 CCCCCN1CCCCCCC1 34a_100000211400_100000718602 [0,0,0,1,0,0|2,0,0]=3 13283 B13R1.1150 CCCCNC1CCCCCCC1 2230a_100000211152_100000210211 [0,0,0,1,0,0|2,0,0]=3 13284 B13R1.1150 CCCCNC1CCCCCCC1 270004a_100000102301_100000210524 [0,0,0,1,0,0|2,0,0]=3 13285 B13R1.1150 CCCCNC1CCCCCCC1 34a_100000211152_100000210210 [0,0,0,1,0,0|2,0,0]=3 13286 B13R1.1150 CCCCOC1C=CCCCCC1 34a_100000688657_100000210210 [0,0,0,1,0,0|2,0,1]=4 13287 B13R1.1150 CCCCOC1CCCCCCC1 34a_100000210054_100000210210 [0,0,0,1,0,0|2,0,0]=3 13288 B13R1.1150 CCCCOC1CCCCCCC1 7a_100000210054_100000210211 [0,0,0,1,0,0|2,0,0]=3 13289 B13R1.1150 CCCOCC1CCCCCCC1 34a_100011216312_100000210303 [0,0,0,1,0,0|2,0,0]=3 13290 B13R1.1150 CCCOCC1CCCCCCC1 7a_100011216312_100000210303 [0,0,0,1,0,0|2,0,0]=3 13291 B13R1.1150 CCNCCC1CCCCCCC1 2230a_100011532352_100000210202 [0,0,0,1,0,0|2,0,0]=3 13292 B13R1.1150 CCNCCC1CCCCCCC1 34a_100011532352_100000210202 [0,0,0,1,0,0|2,0,0]=3 13293 B13R1.1150 CCOCCN1CCCCCCC1 2230a_100000211400_100011215890 [0,0,0,1,0,0|3,0,0]=4 13294 B13R1.1150 CCOCCN1CCCCCCC1 269982a_100000211400_100011215890 [0,0,0,1,0,0|3,0,0]=4 13295 B13R1.1150 CCOCCN1CCCCCCC1 34a_100000211400_100000210147 [0,0,0,1,0,0|3,0,0]=4 13296 B13R1.1150 CCSCCN1CCCCCCC1 2230a_100000211400_100000757381 [0,0,0,1,0,0|3,0,0]=4 13297 B13R1.1150 CCSCCN1CCCCCCC1 269982a_100000211400_100000757381 [0,0,0,1,0,0|3,0,0]=4 13298 B13R1.1150 CCSCCN1CCCCCCC1 34a_100000211400_100000757381 [0,0,0,1,0,0|3,0,0]=4 13299 B13R1.1150 COCCCN1CCCCCCC1 2230a_100000211400_100000740836 [0,0,0,1,0,0|3,0,0]=4 13300 B13R1.1150 COCCCN1CCCCCCC1 269982a_100000211400_100000740836 [0,0,0,1,0,0|3,0,0]=4 13301 B13R1.1150 COCCCN1CCCCCCC1 34a_100000211400_100000740836 [0,0,0,1,0,0|3,0,0]=4 13302 B13R1.1150 COCCNC1CCCCCCC1 2230a_100000211152_100011201679 [0,0,0,1,0,0|3,0,0]=4 13303 B13R1.1150 COCCNC1CCCCCCC1 270004a_100000209980_100000210524 [0,0,0,1,0,0|3,0,0]=4 13304 B13R1.1150 COCCNC1CCCCCCC1 34a_100000211152_100011201679 [0,0,0,1,0,0|3,0,0]=4 13305 B13R1.1150 COCCOC1CCCCCCC1 34a_100000210054_100011201679 [0,0,0,1,0,0|3,0,0]=4 13306 B13R1.1150 COCCOC1CCCCCCC1 7a_100000210054_100000233755 [0,0,0,1,0,0|3,0,0]=4 13307 B13R1.1150 CSCCNC1CCCCCCC1 2230a_100000211152_100000751147 [0,0,0,1,0,0|3,0,0]=4 13308 B13R1.1150 CSCCNC1CCCCCCC1 270004a_100020590264_100000210524 [0,0,0,1,0,0|3,0,0]=4 13309 B13R1.1150 CSCCNC1CCCCCCC1 34a_100000211152_100000212216 [0,0,0,1,0,0|3,0,0]=4 13310 B13R1.1150 CSCCOC1CCCCCCC1 34a_100000210054_100000212216 [0,0,0,1,0,0|3,0,0]=4 13311 B13R1.1150 CSCCOC1CCCCCCC1 7a_100000210054_100000212216 [0,0,0,1,0,0|3,0,0]=4 13312 B13R1.1150 CSCOCC1CCCCCCC1 34a_100011216312_100011218213 [0,0,0,1,0,0|3,0,0]=4 13313 B13R1.1150 FCCCCN1CCCCCCC1 2230a_100000211400_100000729493 [0,0,0,1,0,0|2,0,0]=3 13314 B13R1.1150 FCCCCN1CCCCCCC1 269982a_100000211400_100000729493 [0,0,0,1,0,0|2,0,0]=3 13315 B13R1.1150 FCCCCN1CCCCCCC1 34a_100000211400_100000729493 [0,0,0,1,0,0|2,0,0]=3 13316 B13R1.1150 FCCCNC1CCCCCCC1 2230a_100000211152_100011934791 [0,0,0,1,0,0|2,0,0]=3 13317 B13R1.1150 FCCCNC1CCCCCCC1 270004a_100015189416_100000210524 [0,0,0,1,0,0|2,0,0]=3 13318 B13R1.1150 FCCCNC1CCCCCCC1 34a_100000211152_100011934791 [0,0,0,1,0,0|2,0,0]=3 13319 B13R1.1150 FCCCOC1CCCCCCC1 34a_100000210054_100011934791 [0,0,0,1,0,0|2,0,0]=3 13320 B13R1.1150 FCCCOC1CCCCCCC1 7a_100000210054_100011934791 [0,0,0,1,0,0|2,0,0]=3 13321 B13R1.1150 FCCOCC1CCCCCCC1 34a_100011216312_100011217306 [0,0,0,1,0,0|2,0,0]=3 13322 B13R1.1150 FCCOCC1CCCCCCC1 7a_100011216312_100011217306 [0,0,0,1,0,0|2,0,0]=3 13323 B13R1.1150 FCNCCC1CCCCCCC1 34a_100011532352_100015361967 [0,0,0,1,0,0|2,0,0]=3 13324 B13R1.1150 N#CCCCN1CCCCCCC1 2230a_100000211400_100000687738 [0,0,0,1,0,0|2,0,1]=4 13325 B13R1.1150 N#CCCCN1CCCCCCC1 269982a_100000211400_100000687738 [0,0,0,1,0,0|2,0,1]=4 13326 B13R1.1150 N#CCCNC1CCCCCCC1 2230a_100000211152_100011215226 [0,0,0,1,0,0|2,0,1]=4 13327 B13R1.1150 N#CCCNC1CCCCCCC1 270004a_100000720768_100000210524 [0,0,0,1,0,0|2,0,1]=4 13328 B13R1.1150 N#CCCOC1CCCCCCC1 7a_100000210054_100000184422 [0,0,0,1,0,0|2,0,1]=4 13329 B13R1.1150 N#CCOCC1CCCCCCC1 7a_100011216312_100011215382 [0,0,0,1,0,0|2,0,1]=4 13330 B13R1.1150 O=CCCCN1CCCCCCC1 2230a_100000211400_200011292268 [0,0,0,1,0,0|1,0,2]=4 13331 B13R1.1150 O=CCCCN1CCCCCCC1 269982a_100000211400_200011292268 [0,0,0,1,0,0|1,0,2]=4 13332 B13R1.1150 O=CCOCC1CCCCCCC1 34a_100011216312_200009817547 [0,0,0,1,0,0|1,0,2]=4 13333 B13R1.1150 O=CCOCC1CCCCCCC1 7a_100011216312_200015260668 [0,0,0,1,0,0|1,0,2]=4 13334 B13R1.1150 OCC#CCN1CCCCCCC1 2230a_100000211400_200000047223 [0,0,0,1,0,0|1,0,2]=4 13335 B13R1.1150 OCC#CCN1CCCCCCC1 34a_100000211400_200000047223 [0,0,0,1,0,0|1,0,2]=4 13336 B13R1.1150 OCCCCN1CCCCCCC1 2230a_100000211400_100000210776 [0,0,0,1,0,0|1,0,0]=2 13337 B13R1.1150 OCCCCN1CCCCCCC1 269982a_100000211400_100000210776 [0,0,0,1,0,0|1,0,0]=2 13338 B13R1.1150 OCCCCN1CCCCCCC1 34a_100000211400_100011216708 [0,0,0,1,0,0|1,0,0]=2 13339 B13R1.1150 OCCCNC1CCCCCCC1 2230a_100000211152_100000230001 [0,0,0,1,0,0|1,0,0]=2 13340 B13R1.1150 OCCCNC1CCCCCCC1 270004a_100000182051_100000210524 [0,0,0,1,0,0|1,0,0]=2 13341 B13R1.1150 OCCCNC1CCCCCCC1 34a_100000211152_100000230001 [0,0,0,1,0,0|1,0,0]=2 13342 B13R1.1150 OCCCOC1C=CCCCCC1 34a_100000688657_100000230001 [0,0,0,1,0,0|1,0,2]=4 13343 B13R1.1150 OCCCOC1CC/C=C\CCC1 34a_100016989180_100000230001 [0,0,0,1,0,0|1,0,2]=4 13344 B13R1.1150 OCCCOC1CCCCCCC1 34a_100000210054_100000230001 [0,0,0,1,0,0|1,0,0]=2 13345 B13R1.1150 OCCCOC1CCCCCCC1 7a_100000210054_100011215043 [0,0,0,1,0,0|1,0,0]=2 13346 B13R1.1150 OCCCSC1CC/C=C\CCC1 62a_100011215043_100021000466 [0,0,0,1,0,0|1,0,2]=4 13347 B13R1.1150 OCCCSC1CC/C=C\CCC1 62a_100021000466_100011215043 [0,0,0,1,0,0|1,0,2]=4 13348 B13R1.1150 OCCNCC1CC/C=C\CCC1 2230a_100102730862_100000211926 [0,0,0,1,0,0|1,0,2]=4 13349 B13R1.1150 OCCNCC1CC/C=C\CCC1 34a_100102730862_100000211926 [0,0,0,1,0,0|1,0,2]=4 13350 B13R1.1150 OCCNN=C1CCCCCCC1 4a_100000210001_100000210524 [0,0,0,1,0,0|2,0,1]=4 13351 B13R1.1150 OCCOCC1CCCCCCC1 34a_100011216312_100000211926 [0,0,0,1,0,0|1,0,0]=2 13352 B13R1.1150 OCCOCC1CCCCCCC1 7a_100011216312_100000211926 [0,0,0,1,0,0|1,0,0]=2 13353 B13R1.1887 BrCCCCOC1CCCCCC1 34a_100011216708_100011217769 [0,0,0,1,0,0|2,0,0]=3 13354 B13R1.1887 BrCCCOCC1CCCCCC1 34a_100011217188_200000696569 [0,0,0,1,0,0|2,0,0]=3 13355 B13R1.1887 C#CCCCCN1CCCCCC1 2230a_100000185865_100010269958 [0,0,0,1,0,0|2,0,1]=4 13356 B13R1.1887 C#CCCCCN1CCCCCC1 269982a_100000185865_100010269958 [0,0,0,1,0,0|2,0,1]=4 13357 B13R1.1887 C#CCCCCN1CCCCCC1 34a_100000185865_100010269958 [0,0,0,1,0,0|2,0,1]=4 13358 B13R1.1887 C#CCCCNC1CCCCCC1 2230a_100000210984_100000731252 [0,0,0,1,0,0|2,0,1]=4 13359 B13R1.1887 C#CCCCNC1CCCCCC1 270004a_100000718082_100000210131 [0,0,0,1,0,0|2,0,1]=4 13360 B13R1.1887 C#CCCCNC1CCCCCC1 34a_100000210984_100000695029 [0,0,0,1,0,0|2,0,1]=4 13361 B13R1.1887 C#CCCCNC1CCCCCC1 34a_100000718082_100011217769 [0,0,0,1,0,0|2,0,1]=4 13362 B13R1.1887 C#CCCCOC1CCCCCC1 34a_100000210887_100000695029 [0,0,0,1,0,0|2,0,1]=4 13363 B13R1.1887 C#CCCCOC1CCCCCC1 34a_100000215630_100011217769 [0,0,0,1,0,0|2,0,1]=4 13364 B13R1.1887 C#CCCCOC1CCCCCC1 7a_100000210887_100011215417 [0,0,0,1,0,0|2,0,1]=4 13365 B13R1.1887 C#CCCCSC1CCCCCC1 62a_100011215417_100011217769 [0,0,0,1,0,0|2,0,1]=4 13366 B13R1.1887 C#CCCCSC1CCCCCC1 62a_100011217769_100011215417 [0,0,0,1,0,0|2,0,1]=4 13367 B13R1.1887 C#CCCNCC1CCCCCC1 2230a_100015204231_100000688953 [0,0,0,1,0,0|2,0,1]=4 13368 B13R1.1887 C#CCCNCC1CCCCCC1 34a_100000755551_200000696569 [0,0,0,1,0,0|2,0,1]=4 13369 B13R1.1887 C#CCCNCC1CCCCCC1 34a_100015204231_100000688953 [0,0,0,1,0,0|2,0,1]=4 13370 B13R1.1887 C#CCCOCC1CCCCCC1 34a_100000699130_100000688953 [0,0,0,1,0,0|2,0,1]=4 13371 B13R1.1887 C#CCCOCC1CCCCCC1 34a_100011215631_200000696569 [0,0,0,1,0,0|2,0,1]=4 13372 B13R1.1887 C#CCCOCC1CCCCCC1 7a_100000699130_100000688953 [0,0,0,1,0,0|2,0,1]=4 13373 B13R1.1887 C#CCCSCC1CCCCCC1 62a_100000688953_200000696569 [0,0,0,1,0,0|2,0,1]=4 13374 B13R1.1887 C#CCCSCC1CCCCCC1 62a_200000696569_100000688953 [0,0,0,1,0,0|2,0,1]=4 13375 B13R1.1887 C#CCNCCC1CCCCCC1 2230a_100011532351_100000038162 [0,0,0,1,0,0|2,0,1]=4 13376 B13R1.1887 C#CCNCCC1CCCCCC1 34a_100011532351_100000184674 [0,0,0,1,0,0|2,0,1]=4 13377 B13R1.1887 C=CCCCCN1CCCCCC1 2230a_100000185865_100011215482 [0,0,0,1,0,0|2,0,1]=4 13378 B13R1.1887 C=CCCCCN1CCCCCC1 269982a_100000185865_100011215482 [0,0,0,1,0,0|2,0,1]=4 13379 B13R1.1887 C=CCCCCN1CCCCCC1 34a_100000185865_100011215482 [0,0,0,1,0,0|2,0,1]=4 13380 B13R1.1887 C=CCCCNC1CCCCCC1 2230a_100000210984_100011713584 [0,0,0,1,0,0|2,0,1]=4 13381 B13R1.1887 C=CCCCNC1CCCCCC1 270004a_100000700776_100000210131 [0,0,0,1,0,0|2,0,1]=4 13382 B13R1.1887 C=CCCCNC1CCCCCC1 34a_100000210984_100000757094 [0,0,0,1,0,0|2,0,1]=4 13383 B13R1.1887 C=CCCCNC1CCCCCC1 34a_100000700776_100011217769 [0,0,0,1,0,0|2,0,1]=4 13384 B13R1.1887 C=CCCCOC1CCCCCC1 34a_100000210887_100000757094 [0,0,0,1,0,0|2,0,1]=4 13385 B13R1.1887 C=CCCCOC1CCCCCC1 34a_100000758997_100011217769 [0,0,0,1,0,0|2,0,1]=4 13386 B13R1.1887 C=CCCCOC1CCCCCC1 7a_100000210887_100000757094 [0,0,0,1,0,0|2,0,1]=4 13387 B13R1.1887 C=CCCCSC1CCCCCC1 62a_100011217769_100000757094 [0,0,0,1,0,0|2,0,1]=4 13388 B13R1.1887 C=CCCCSC1CCCCCC1 62a_100011713584_100011217769 [0,0,0,1,0,0|2,0,1]=4 13389 B13R1.1887 C=CCCNCC1CCCCCC1 2230a_100015191253_200000696569 [0,0,0,1,0,0|2,0,1]=4 13390 B13R1.1887 C=CCCNCC1CCCCCC1 2230a_100015204231_100000754431 [0,0,0,1,0,0|2,0,1]=4 13391 B13R1.1887 C=CCCNCC1CCCCCC1 269862a_100015191253_200000763224 [0,0,0,1,0,0|2,0,1]=4 13392 B13R1.1887 C=CCCNCC1CCCCCC1 34a_100015204231_100000754431 [0,0,0,1,0,0|2,0,1]=4 13393 B13R1.1887 C=CCCOCC1CCCCCC1 34a_100000699130_100000754431 [0,0,0,1,0,0|2,0,1]=4 13394 B13R1.1887 C=CCCOCC1CCCCCC1 34a_100011205117_200000696569 [0,0,0,1,0,0|2,0,1]=4 13395 B13R1.1887 C=CCCOCC1CCCCCC1 7a_100000699130_100000754431 [0,0,0,1,0,0|2,0,1]=4 13396 B13R1.1887 C=CCCSCC1CCCCCC1 62a_100000754431_200000696569 [0,0,0,1,0,0|2,0,1]=4 13397 B13R1.1887 C=CCCSCC1CCCCCC1 62a_200000696569_100000754431 [0,0,0,1,0,0|2,0,1]=4 13398 B13R1.1887 C=CCNCCC1CCCCCC1 2230a_100011532351_100000210623 [0,0,0,1,0,0|2,0,1]=4 13399 B13R1.1887 C=CCNCCC1CCCCCC1 34a_100011532351_100015514636 [0,0,0,1,0,0|2,0,1]=4 13400 B13R1.1887 CCCCCCN1CCCCCC1 2230a_100000185865_100000210314 [0,0,0,1,0,0|2,0,0]=3 13401 B13R1.1887 CCCCCCN1CCCCCC1 269982a_100000185865_100000210757 [0,0,0,1,0,0|2,0,0]=3 13402 B13R1.1887 CCCCCCN1CCCCCC1 34a_100000185865_100000210314 [0,0,0,1,0,0|2,0,0]=3 13403 B13R1.1887 CCCCCCN1CCCOCC1 2230a_100000685342_100000210314 [0,0,0,1,0,0|3,0,0]=4 13404 B13R1.1887 CCCCCCN1CCCOCC1 269982a_100000685342_100000210757 [0,0,0,1,0,0|3,0,0]=4 13405 B13R1.1887 CCCCCCN1CCCOCC1 34a_100000685342_100000210314 [0,0,0,1,0,0|3,0,0]=4 13406 B13R1.1887 CCCCCNC1CCCCCC1 2230a_100000210984_100000210326 [0,0,0,1,0,0|2,0,0]=3 13407 B13R1.1887 CCCCCNC1CCCCCC1 270004a_100000209983_100000210131 [0,0,0,1,0,0|2,0,0]=3 13408 B13R1.1887 CCCCCNC1CCCCCC1 34a_100000210984_100000718602 [0,0,0,1,0,0|2,0,0]=3 13409 B13R1.1887 CCCCCNC1CCCNCC1 270004a_100000209983_100015187895 [0,0,0,1,0,0|3,0,0]=4 13410 B13R1.1887 CCCCCOC1CCCCCC1 34a_100000210253_100011217769 [0,0,0,1,0,0|2,0,0]=3 13411 B13R1.1887 CCCCCOC1CCCCCC1 34a_100000210887_100000718602 [0,0,0,1,0,0|2,0,0]=3 13412 B13R1.1887 CCCCCOC1CCCCCC1 7a_100000210887_100000210326 [0,0,0,1,0,0|2,0,0]=3 13413 B13R1.1887 CCCCCSC1CCCCCC1 62a_100000210326_100011217769 [0,0,0,1,0,0|2,0,0]=3 13414 B13R1.1887 CCCCCSC1CCCCCC1 62a_100011217769_100000210326 [0,0,0,1,0,0|2,0,0]=3 13415 B13R1.1887 CCCCNCC1CCCCCC1 2230a_100000102301_200000696569 [0,0,0,1,0,0|2,0,0]=3 13416 B13R1.1887 CCCCNCC1CCCCCC1 2230a_100015204231_100000210211 [0,0,0,1,0,0|2,0,0]=3 13417 B13R1.1887 CCCCNCC1CCCCCC1 269862a_100000102301_200000763224 [0,0,0,1,0,0|2,0,0]=3 13418 B13R1.1887 CCCCNCC1CCCCCC1 34a_100015204231_100000210210 [0,0,0,1,0,0|2,0,0]=3 13419 B13R1.1887 CCCCNCC1CCCCCC1 7a_106832991798_200000696569 [0,0,0,1,0,0|2,0,0]=3 13420 B13R1.1887 CCCCOCC1CCCCCC1 34a_100000210227_200000696569 [0,0,0,1,0,0|2,0,0]=3 13421 B13R1.1887 CCCCOCC1CCCCCC1 34a_100000699130_100000210210 [0,0,0,1,0,0|2,0,0]=3 13422 B13R1.1887 CCCCOCC1CCCCCC1 7a_100000210227_200000696569 [0,0,0,1,0,0|2,0,0]=3 13423 B13R1.1887 CCCCOCC1CCCCCC1 7a_100000699130_100000210211 [0,0,0,1,0,0|2,0,0]=3 13424 B13R1.1887 CCCCOCN1CCCCCC1 2230a_100000185865_100011995733 [0,0,0,1,0,0|3,0,0]=4 13425 B13R1.1887 CCCCOCN1CCCCCC1 269982a_100000185865_100011995733 [0,0,0,1,0,0|3,0,0]=4 13426 B13R1.1887 CCCCOCN1CCCCCC1 34a_100000185865_100011995733 [0,0,0,1,0,0|3,0,0]=4 13427 B13R1.1887 CCCCSCC1CCCCCC1 62a_100000210211_200000696569 [0,0,0,1,0,0|2,0,0]=3 13428 B13R1.1887 CCCCSCC1CCCCCC1 62a_200000696569_100000210210 [0,0,0,1,0,0|2,0,0]=3 13429 B13R1.1887 CCCNCCC1CCCCCC1 2230a_100011532351_100000210303 [0,0,0,1,0,0|2,0,0]=3 13430 B13R1.1887 CCCNCCC1CCCCCC1 34a_100011532351_100000210303 [0,0,0,1,0,0|2,0,0]=3 13431 B13R1.1887 CCCOCCN1CCCCCC1 2230a_100000185865_100011215938 [0,0,0,1,0,0|3,0,0]=4 13432 B13R1.1887 CCCOCCN1CCCCCC1 269982a_100000185865_100011215938 [0,0,0,1,0,0|3,0,0]=4 13433 B13R1.1887 CCCOCCN1CCCCCC1 34a_100000185865_100011215938 [0,0,0,1,0,0|3,0,0]=4 13434 B13R1.1887 CCCOCCN1CCCCCC1 34a_100000238007_100000210303 [0,0,0,1,0,0|3,0,0]=4 13435 B13R1.1887 CCCSCCN1CCCCCC1 62a_100000210303_100000722644 [0,0,0,1,0,0|3,0,0]=4 13436 B13R1.1887 CCCSCCN1CCCCCC1 62a_100000722644_100000210303 [0,0,0,1,0,0|3,0,0]=4 13437 B13R1.1887 CCOCCCN1CCCCCC1 2230a_100000185865_100012232248 [0,0,0,1,0,0|3,0,0]=4 13438 B13R1.1887 CCOCCCN1CCCCCC1 269982a_100000185865_100012232248 [0,0,0,1,0,0|3,0,0]=4 13439 B13R1.1887 CCOCCCN1CCCCCC1 34a_100000185865_100012232248 [0,0,0,1,0,0|3,0,0]=4 13440 B13R1.1887 CCOCCCN1CCCCCC1 34a_100102886287_100000210202 [0,0,0,1,0,0|3,0,0]=4 13441 B13R1.1887 CCOCCCN1CCCCCC1 7a_100102886287_100000210202 [0,0,0,1,0,0|3,0,0]=4 13442 B13R1.1887 CCOCCNC1CCCCCC1 2230a_100000210984_100011215890 [0,0,0,1,0,0|3,0,0]=4 13443 B13R1.1887 CCOCCNC1CCCCCC1 270004a_102516460346_100000210131 [0,0,0,1,0,0|3,0,0]=4 13444 B13R1.1887 CCOCCNC1CCCCCC1 34a_100000210984_100000210147 [0,0,0,1,0,0|3,0,0]=4 13445 B13R1.1887 CCOCCNC1CCCCCC1 34a_102516460346_100011217769 [0,0,0,1,0,0|3,0,0]=4 13446 B13R1.1887 CCOCCOC1CCCCCC1 34a_100000210136_100011217769 [0,0,0,1,0,0|3,0,0]=4 13447 B13R1.1887 CCOCCOC1CCCCCC1 34a_100000210887_100000210147 [0,0,0,1,0,0|3,0,0]=4 13448 B13R1.1887 CCOCCOC1CCCCCC1 7a_100000210887_100011215890 [0,0,0,1,0,0|3,0,0]=4 13449 B13R1.1887 CCOCCSC1CCCCCC1 62a_100000210147_100011217769 [0,0,0,1,0,0|3,0,0]=4 13450 B13R1.1887 CCOCCSC1CCCCCC1 62a_100011217769_100011215890 [0,0,0,1,0,0|3,0,0]=4 13451 B13R1.1887 CCOCSCC1CCCCCC1 62a_100000739092_200000696569 [0,0,0,1,0,0|3,0,0]=4 13452 B13R1.1887 CCOCSCC1CCCCCC1 62a_200000696569_100000739092 [0,0,0,1,0,0|3,0,0]=4 13453 B13R1.1887 CCSCCNC1CCCCCC1 2230a_100000210984_100000757381 [0,0,0,1,0,0|3,0,0]=4 13454 B13R1.1887 CCSCCNC1CCCCCC1 270004a_100000106463_100000210131 [0,0,0,1,0,0|3,0,0]=4 13455 B13R1.1887 CCSCCNC1CCCCCC1 34a_100000210984_100000757381 [0,0,0,1,0,0|3,0,0]=4 13456 B13R1.1887 CCSCCOC1CCCCCC1 34a_100000210887_100000757381 [0,0,0,1,0,0|3,0,0]=4 13457 B13R1.1887 CCSCCOC1CCCCCC1 34a_100000212035_100011217769 [0,0,0,1,0,0|3,0,0]=4 13458 B13R1.1887 CCSCCOC1CCCCCC1 7a_100000210887_100000757381 [0,0,0,1,0,0|3,0,0]=4 13459 B13R1.1887 CCSCCSC1CCCCCC1 62a_100000757381_100011217769 [0,0,0,1,0,0|3,0,0]=4 13460 B13R1.1887 CCSCCSC1CCCCCC1 62a_100011217769_100000757381 [0,0,0,1,0,0|3,0,0]=4 13461 B13R1.1887 CNCCCOC1CCCCCC1 34a_100000213112_100011217769 [0,0,0,1,0,0|3,0,0]=4 13462 B13R1.1887 COCCCCN1CCCCCC1 2230a_100000185865_100000730899 [0,0,0,1,0,0|3,0,0]=4 13463 B13R1.1887 COCCCCN1CCCCCC1 269982a_100000185865_100000730899 [0,0,0,1,0,0|3,0,0]=4 13464 B13R1.1887 COCCCCN1CCCCCC1 34a_100000185865_100000755781 [0,0,0,1,0,0|3,0,0]=4 13465 B13R1.1887 COCCCCN1CCCCCC1 34a_100011305542_200000210301 [0,0,0,1,0,0|3,0,0]=4 13466 B13R1.1887 COCCCNC1CCCCCC1 2230a_100000210984_100000740836 [0,0,0,1,0,0|3,0,0]=4 13467 B13R1.1887 COCCCNC1CCCCCC1 270004a_100150723488_100000210131 [0,0,0,1,0,0|3,0,0]=4 13468 B13R1.1887 COCCCNC1CCCCCC1 34a_100000210984_100000740836 [0,0,0,1,0,0|3,0,0]=4 13469 B13R1.1887 COCCCNC1CCCCCC1 34a_100150723488_100011217769 [0,0,0,1,0,0|3,0,0]=4 13470 B13R1.1887 COCCCOC1CCCCCC1 34a_100000210887_100000740836 [0,0,0,1,0,0|3,0,0]=4 13471 B13R1.1887 COCCCOC1CCCCCC1 34a_100000740835_100011217769 [0,0,0,1,0,0|3,0,0]=4 13472 B13R1.1887 COCCCOC1CCCCCC1 7a_100000210887_100000740836 [0,0,0,1,0,0|3,0,0]=4 13473 B13R1.1887 COCCCSC1CCCCCC1 62a_100000709357_100011217769 [0,0,0,1,0,0|3,0,0]=4 13474 B13R1.1887 COCCCSC1CCCCCC1 62a_100011217769_100000709357 [0,0,0,1,0,0|3,0,0]=4 13475 B13R1.1887 COCCNCC1CCCCCC1 2230a_100000209980_200000696569 [0,0,0,1,0,0|3,0,0]=4 13476 B13R1.1887 COCCNCC1CCCCCC1 2230a_100015204231_100011201679 [0,0,0,1,0,0|3,0,0]=4 13477 B13R1.1887 COCCNCC1CCCCCC1 269862a_100000209980_200000763224 [0,0,0,1,0,0|3,0,0]=4 13478 B13R1.1887 COCCNCC1CCCCCC1 34a_100015204231_100011201679 [0,0,0,1,0,0|3,0,0]=4 13479 B13R1.1887 COCCOCC1CCCCCC1 34a_100000210237_200000696569 [0,0,0,1,0,0|3,0,0]=4 13480 B13R1.1887 COCCOCC1CCCCCC1 34a_100000699130_100011201679 [0,0,0,1,0,0|3,0,0]=4 13481 B13R1.1887 COCCOCC1CCCCCC1 7a_100000699130_100000233755 [0,0,0,1,0,0|3,0,0]=4 13482 B13R1.1887 COCCSCC1CCCCCC1 62a_100000233755_200000696569 [0,0,0,1,0,0|3,0,0]=4 13483 B13R1.1887 COCCSCC1CCCCCC1 62a_200000696569_100000233755 [0,0,0,1,0,0|3,0,0]=4 13484 B13R1.1887 COCNCCC1CCCCCC1 2230a_100011532351_100000766300 [0,0,0,1,0,0|3,0,0]=4 13485 B13R1.1887 CSCCCNC1CCCCCC1 270004a_100000749238_100000210131 [0,0,0,1,0,0|3,0,0]=4 13486 B13R1.1887 CSCCCOC1CCCCCC1 34a_100000690336_100011217769 [0,0,0,1,0,0|3,0,0]=4 13487 B13R1.1887 CSCCNCC1CCCCCC1 2230a_100015204231_100000751147 [0,0,0,1,0,0|3,0,0]=4 13488 B13R1.1887 CSCCNCC1CCCCCC1 2230a_100020590264_200000696569 [0,0,0,1,0,0|3,0,0]=4 13489 B13R1.1887 CSCCNCC1CCCCCC1 269862a_100020590264_200000763224 [0,0,0,1,0,0|3,0,0]=4 13490 B13R1.1887 CSCCNCC1CCCCCC1 34a_100015204231_100000212216 [0,0,0,1,0,0|3,0,0]=4 13491 B13R1.1887 CSCCOCC1CCCCCC1 34a_100000230434_200000696569 [0,0,0,1,0,0|3,0,0]=4 13492 B13R1.1887 CSCCOCC1CCCCCC1 34a_100000699130_100000212216 [0,0,0,1,0,0|3,0,0]=4 13493 B13R1.1887 CSCCOCC1CCCCCC1 7a_100000230434_200000696569 [0,0,0,1,0,0|3,0,0]=4 13494 B13R1.1887 CSCCOCC1CCCCCC1 7a_100000699130_100000212216 [0,0,0,1,0,0|3,0,0]=4 13495 B13R1.1887 CSCCSCC1CCCCCC1 62a_100000212216_200000696569 [0,0,0,1,0,0|3,0,0]=4 13496 B13R1.1887 CSCCSCC1CCCCCC1 62a_200000696569_100000751147 [0,0,0,1,0,0|3,0,0]=4 13497 B13R1.1887 CSCNCCC1CCCCCC1 2230a_100011532351_100011218213 [0,0,0,1,0,0|3,0,0]=4 13498 B13R1.1887 CSCNCCC1CCCCCC1 34a_100011532351_100011218213 [0,0,0,1,0,0|3,0,0]=4 13499 B13R1.1887 ClCCCCOC1CCCCCC1 34a_100000210776_100011217769 [0,0,0,1,0,0|2,0,0]=3 13500 B13R1.1887 ClCCCOCC1CCCCCC1 34a_100000230001_200000696569 [0,0,0,1,0,0|2,0,0]=3 13501 B13R1.1887 FCCCCCN1CCCCCC1 2230a_100000185865_100000729378 [0,0,0,1,0,0|2,0,0]=3 13502 B13R1.1887 FCCCCCN1CCCCCC1 269982a_100000185865_100000729378 [0,0,0,1,0,0|2,0,0]=3 13503 B13R1.1887 FCCCCCN1CCCCCC1 34a_100000185865_100000729378 [0,0,0,1,0,0|2,0,0]=3 13504 B13R1.1887 FCCCCCN1CCCOCC1 2230a_100000685342_100000729378 [0,0,0,1,0,0|3,0,0]=4 13505 B13R1.1887 FCCCCCN1CCCOCC1 269982a_100000685342_100000729378 [0,0,0,1,0,0|3,0,0]=4 13506 B13R1.1887 FCCCCCN1CCCOCC1 34a_100000685342_100000729378 [0,0,0,1,0,0|3,0,0]=4 13507 B13R1.1887 FCCCCNC1CCCCCC1 2230a_100000210984_100000729493 [0,0,0,1,0,0|2,0,0]=3 13508 B13R1.1887 FCCCCNC1CCCCCC1 34a_100000210984_100000729493 [0,0,0,1,0,0|2,0,0]=3 13509 B13R1.1887 FCCCCOC1CCCCCC1 34a_100000210887_100000729493 [0,0,0,1,0,0|2,0,0]=3 13510 B13R1.1887 FCCCCOC1CCCCCC1 34a_100011995726_100011217769 [0,0,0,1,0,0|2,0,0]=3 13511 B13R1.1887 FCCCCOC1CCCCCC1 7a_100000210887_100000729493 [0,0,0,1,0,0|2,0,0]=3 13512 B13R1.1887 FCCCCSC1CCCCCC1 62a_100000729493_100011217769 [0,0,0,1,0,0|2,0,0]=3 13513 B13R1.1887 FCCCCSC1CCCCCC1 62a_100011217769_100000729493 [0,0,0,1,0,0|2,0,0]=3 13514 B13R1.1887 FCCCNCC1CCCCCC1 2230a_100015189416_200000696569 [0,0,0,1,0,0|2,0,0]=3 13515 B13R1.1887 FCCCNCC1CCCCCC1 2230a_100015204231_100011934791 [0,0,0,1,0,0|2,0,0]=3 13516 B13R1.1887 FCCCNCC1CCCCCC1 269862a_100015189416_200000763224 [0,0,0,1,0,0|2,0,0]=3 13517 B13R1.1887 FCCCNCC1CCCCCC1 34a_100015189416_200000696569 [0,0,0,1,0,0|2,0,0]=3 13518 B13R1.1887 FCCCNCC1CCCCCC1 34a_100015204231_100011934791 [0,0,0,1,0,0|2,0,0]=3 13519 B13R1.1887 FCCCOCC1CCCCCC1 34a_100000699130_100011934791 [0,0,0,1,0,0|2,0,0]=3 13520 B13R1.1887 FCCCOCC1CCCCCC1 34a_100000759539_200000696569 [0,0,0,1,0,0|2,0,0]=3 13521 B13R1.1887 FCCCOCC1CCCCCC1 7a_100000699130_100011934791 [0,0,0,1,0,0|2,0,0]=3 13522 B13R1.1887 FCCCSCC1CCCCCC1 62a_100011934791_200000696569 [0,0,0,1,0,0|2,0,0]=3 13523 B13R1.1887 FCCCSCC1CCCCCC1 62a_200000696569_100011934791 [0,0,0,1,0,0|2,0,0]=3 13524 B13R1.1887 FCCNCCC1CCCCCC1 2230a_100011532351_100011217306 [0,0,0,1,0,0|2,0,0]=3 13525 B13R1.1887 FCCNCCC1CCCCCC1 34a_100011532351_100011217306 [0,0,0,1,0,0|2,0,0]=3 13526 B13R1.1887 FCCOCCN1CCCCCC1 34a_100000238007_100011217306 [0,0,0,1,0,0|3,0,0]=4 13527 B13R1.1887 FCCSCCN1CCCCCC1 62a_100000722644_100011217306 [0,0,0,1,0,0|3,0,0]=4 13528 B13R1.1887 FCCSCCN1CCCCCC1 62a_100011217306_100000722644 [0,0,0,1,0,0|3,0,0]=4 13529 B13R1.1887 FCOCCCN1CCCCCC1 34a_100102886287_100015361967 [0,0,0,1,0,0|3,0,0]=4 13530 B13R1.1887 FCOCCCN1CCCCCC1 7a_100102886287_100015361967 [0,0,0,1,0,0|3,0,0]=4 13531 B13R1.1887 ICCCCOC1CCCCCC1 34a_200012148704_100011217769 [0,0,0,1,0,0|2,0,0]=3 13532 B13R1.1887 N#CCCCCN1CCCCCC1 2230a_100000185865_100000211819 [0,0,0,1,0,0|2,0,1]=4 13533 B13R1.1887 N#CCCCCN1CCCCCC1 269982a_100000185865_100011219923 [0,0,0,1,0,0|2,0,1]=4 13534 B13R1.1887 N#CCCCNC1CCCCCC1 2230a_100000210984_100000687738 [0,0,0,1,0,0|2,0,1]=4 13535 B13R1.1887 N#CCCCOC1CCCCCC1 7a_100000210887_100000687738 [0,0,0,1,0,0|2,0,1]=4 13536 B13R1.1887 N#CCCCSC1CCCCCC1 62a_100000687738_100011217769 [0,0,0,1,0,0|2,0,1]=4 13537 B13R1.1887 N#CCCCSC1CCCCCC1 62a_100011217769_100000687738 [0,0,0,1,0,0|2,0,1]=4 13538 B13R1.1887 N#CCCNCC1CCCCCC1 2230a_100015204231_100011215226 [0,0,0,1,0,0|2,0,1]=4 13539 B13R1.1887 N#CCCOCC1CCCCCC1 7a_100000699130_100000184422 [0,0,0,1,0,0|2,0,1]=4 13540 B13R1.1887 N#CCCSCC1CCCCCC1 62a_100011215226_200000696569 [0,0,0,1,0,0|2,0,1]=4 13541 B13R1.1887 N#CCCSCC1CCCCCC1 62a_200000696569_100011215226 [0,0,0,1,0,0|2,0,1]=4 13542 B13R1.1887 N#CCNCCC1CCCCCC1 2230a_100011532351_100011215382 [0,0,0,1,0,0|2,0,1]=4 13543 B13R1.1887 NCCCCOC1CCCCCC1 34a_100000750430_100011217769 [0,0,0,1,0,0|2,0,0]=3 13544 B13R1.1887 NCCCOCC1CCCCCC1 34a_100000182051_200000696569 [0,0,0,1,0,0|2,0,0]=3 13545 B13R1.1887 NOCCOCC1CCCCCC1 34a_100000700252_200000696569 [0,0,0,1,0,0|3,0,0]=4 13546 B13R1.1887 O=CCCCCN1CCCCCC1 2230a_100000185865_100000139335 [0,0,0,1,0,0|1,0,2]=4 13547 B13R1.1887 O=CCCCCN1CCCCCC1 269982a_100000185865_100000139335 [0,0,0,1,0,0|1,0,2]=4 13548 B13R1.1887 O=CCCCNC1CCCCCC1 2230a_100000210984_200011292268 [0,0,0,1,0,0|1,0,2]=4 13549 B13R1.1887 O=CCCCOC1CCCCCC1 7a_100000210887_200011292268 [0,0,0,1,0,0|1,0,2]=4 13550 B13R1.1887 O=CCCCSC1CCCCCC1 62a_100011217769_200011292268 [0,0,0,1,0,0|1,0,2]=4 13551 B13R1.1887 O=CCCCSC1CCCCCC1 62a_200011292268_100011217769 [0,0,0,1,0,0|1,0,2]=4 13552 B13R1.1887 O=CCNCCC1CCCCCC1 2230a_100011532351_200015260668 [0,0,0,1,0,0|1,0,2]=4 13553 B13R1.1887 O=CCNCCC1CCCCCC1 34a_100011532351_200009817547 [0,0,0,1,0,0|1,0,2]=4 13554 B13R1.1887 OCC#CCNC1CCCCCC1 2230a_100000210984_200000047223 [0,0,0,1,0,0|1,0,2]=4 13555 B13R1.1887 OCC#CCNC1CCCCCC1 34a_100000210984_200000047223 [0,0,0,1,0,0|1,0,2]=4 13556 B13R1.1887 OCC#CCOC1CCCCCC1 34a_100000210887_200000047223 [0,0,0,1,0,0|1,0,2]=4 13557 B13R1.1887 OCC#CCOC1CCCCCC1 7a_100000210887_200000047223 [0,0,0,1,0,0|1,0,2]=4 13558 B13R1.1887 OCC#CCSC1CCCCCC1 62a_100011217769_200000047223 [0,0,0,1,0,0|1,0,2]=4 13559 B13R1.1887 OCC#CCSC1CCCCCC1 62a_200000047223_100011217769 [0,0,0,1,0,0|1,0,2]=4 13560 B13R1.1887 OCCCCCN1CCCCCC1 2230a_100000185865_100000746330 [0,0,0,1,0,0|1,0,0]=2 13561 B13R1.1887 OCCCCCN1CCCCCC1 269982a_100000185865_100000746330 [0,0,0,1,0,0|1,0,0]=2 13562 B13R1.1887 OCCCCCN1CCCCCC1 34a_100000185865_100000746330 [0,0,0,1,0,0|1,0,0]=2 13563 B13R1.1887 OCCCCCN1CCCOCC1 2230a_100000685342_100000746330 [0,0,0,1,0,0|2,0,0]=3 13564 B13R1.1887 OCCCCCN1CCCOCC1 269982a_100000685342_100000746330 [0,0,0,1,0,0|2,0,0]=3 13565 B13R1.1887 OCCCCCN1CCCOCC1 34a_100000685342_100000746330 [0,0,0,1,0,0|2,0,0]=3 13566 B13R1.1887 OCCCCNC1CCCCCC1 2230a_100000210984_100000210776 [0,0,0,1,0,0|1,0,0]=2 13567 B13R1.1887 OCCCCNC1CCCCCC1 270004a_100000750430_100000210131 [0,0,0,1,0,0|1,0,0]=2 13568 B13R1.1887 OCCCCNC1CCCCCC1 34a_100000210984_100011216708 [0,0,0,1,0,0|1,0,0]=2 13569 B13R1.1887 OCCCCNC1CCCCCC1 34a_100000750430_100011217769 [0,0,0,1,0,0|1,0,0]=2 13570 B13R1.1887 OCCCCNC1CCCNCC1 270004a_100000750430_100015187895 [0,0,0,1,0,0|2,0,0]=3 13571 B13R1.1887 OCCCCNC1CSCCSC1 270004a_100000750430_100000068409 [0,0,0,1,0,0|3,0,0]=4 13572 B13R1.1887 OCCCCOC1CCCCCC1 34a_100000210887_100011216708 [0,0,0,1,0,0|1,0,0]=2 13573 B13R1.1887 OCCCCOC1CCCCCC1 7a_100000210887_100000210776 [0,0,0,1,0,0|1,0,0]=2 13574 B13R1.1887 OCCCCSC1CCCCCC1 62a_100000210776_100011217769 [0,0,0,1,0,0|1,0,0]=2 13575 B13R1.1887 OCCCCSC1CCCCCC1 62a_100011217769_100000210776 [0,0,0,1,0,0|1,0,0]=2 13576 B13R1.1887 OCCCNCC1CCCCCC1 2230a_100015204231_100000230001 [0,0,0,1,0,0|1,0,0]=2 13577 B13R1.1887 OCCCNCC1CCCCCC1 269862a_100000182051_200000763224 [0,0,0,1,0,0|1,0,0]=2 13578 B13R1.1887 OCCCNCC1CCCCCC1 34a_100015204231_100000230001 [0,0,0,1,0,0|1,0,0]=2 13579 B13R1.1887 OCCCOCC1CCCCCC1 34a_100000699130_100000230001 [0,0,0,1,0,0|1,0,0]=2 13580 B13R1.1887 OCCCOCC1CCCCCC1 7a_100000699130_100011215043 [0,0,0,1,0,0|1,0,0]=2 13581 B13R1.1887 OCCCOCC1CNCCOC1 34a_100103147999_100000230001 [0,0,0,1,0,0|3,0,0]=4 13582 B13R1.1887 OCCCSCC1CCCCCC1 62a_100011215043_200000696569 [0,0,0,1,0,0|1,0,0]=2 13583 B13R1.1887 OCCCSCC1CCCCCC1 62a_200000696569_100011215043 [0,0,0,1,0,0|1,0,0]=2 13584 B13R1.1887 OCCNCCC1CCCCCC1 2230a_100011532351_100000211926 [0,0,0,1,0,0|1,0,0]=2 13585 B13R1.1887 OCCNCCC1CCCCCC1 34a_100011532351_100000211926 [0,0,0,1,0,0|1,0,0]=2 13586 B13R1.1887 OCCNN=CC1CCCCCC1 4a_100000210001_200000763224 [0,0,0,1,0,0|2,0,1]=4 13587 B13R1.1887 OCCOCCN1CCCCCC1 2230a_100000185865_100011215305 [0,0,0,1,0,0|2,0,0]=3 13588 B13R1.1887 OCCOCCN1CCCCCC1 269982a_100000185865_100011215305 [0,0,0,1,0,0|2,0,0]=3 13589 B13R1.1887 OCCOCCN1CCCCCC1 34a_100000185865_100000692535 [0,0,0,1,0,0|2,0,0]=3 13590 B13R1.1887 OCCOCCN1CCCCCC1 34a_100000238007_100000211926 [0,0,0,1,0,0|2,0,0]=3 13591 B13R1.1887 OCCOCCN1CCCOCC1 2230a_100000685342_100011215305 [0,0,0,1,0,0|3,0,0]=4 13592 B13R1.1887 OCCOCCN1CCCOCC1 269982a_100000685342_100011215305 [0,0,0,1,0,0|3,0,0]=4 13593 B13R1.1887 OCCOCCN1CCCOCC1 34a_100000685342_100000692535 [0,0,0,1,0,0|3,0,0]=4 13594 B13R1.1887 OCCSCCN1CCCCCC1 62a_100000211926_100000722644 [0,0,0,1,0,0|2,0,0]=3 13595 B13R1.1887 OCCSCCN1CCCCCC1 62a_100000722644_100000211926 [0,0,0,1,0,0|2,0,0]=3 13596 B13R1.1887 [13CH3]OCCCCN1CCCCCC1 34a_100011305542_200025704644 [0,0,0,1,0,0|3,0,0]=4 13597 B10R0.71 CCCCCCCCCNC 2230a_100000212291_200000210301 [2,0,0,0,0,0|1,0,0]=3 13598 B10R0.71 CCCCCCCCCNC 2230a_106832991635_100011214924 [2,0,0,0,0,0|1,0,0]=3 13599 B10R0.71 CCCCCCCCCNC 34a_100000212291_200000210301 [2,0,0,0,0,0|1,0,0]=3 13600 B10R0.71 CCCCCCCCCNC 34a_100102657272_100011214924 [2,0,0,0,0,0|1,0,0]=3 13601 B10R0.71 CCCCCCCCCNC 7a_106832991635_100000210328 [2,0,0,0,0,0|1,0,0]=3 13602 B10R0.71 CCCCCCCCCN[13CH3] 2230a_100000212291_200025704644 [2,0,0,0,0,0|1,0,0]=3 13603 B10R0.71 CCCCCCCCCN[13CH3] 34a_100000212291_200025704644 [2,0,0,0,0,0|1,0,0]=3 13604 B10R0.71 CCCCCCCCCOC 34a_100000210712_200000210301 [2,0,0,0,0,0|1,0,0]=3 13605 B10R0.71 CCCCCCCCCOC 34a_100138415774_100011214924 [2,0,0,0,0,0|1,0,0]=3 13606 B10R0.71 CCCCCCCCCOC 7a_100000210712_200000210301 [2,0,0,0,0,0|1,0,0]=3 13607 B10R0.71 CCCCCCCCCO[13CH3] 34a_100000210712_200025704644 [2,0,0,0,0,0|1,0,0]=3 13608 B10R0.71 CCCCCCCCCO[13CH3] 7a_100000210712_200025704644 [2,0,0,0,0,0|1,0,0]=3 13609 B10R0.71 CCCCCCCCCSC 62a_200000210301_100000210670 [2,0,0,0,0,0|1,0,0]=3 13610 B10R0.71 CCCCCCCCCS[13CH3] 62a_200025704644_100000210670 [2,0,0,0,0,0|1,0,0]=3 13611 B10R0.71 CCCCCCCCNCC 2230a_100000229939_100000210202 [2,0,0,0,0,0|1,0,0]=3 13612 B10R0.71 CCCCCCCCNCC 2230a_100015525214_100000210759 [2,0,0,0,0,0|1,0,0]=3 13613 B10R0.71 CCCCCCCCNCC 34a_100000229939_100000210202 [2,0,0,0,0,0|1,0,0]=3 13614 B10R0.71 CCCCCCCCNCF 34a_100000229939_100015361967 [2,0,0,0,0,0|2,0,0]=4 13615 B10R0.71 CCCCCCCCOCC 34a_100000210232_100000210202 [2,0,0,0,0,0|1,0,0]=3 13616 B10R0.71 CCCCCCCCOCC 34a_100121572206_100000210759 [2,0,0,0,0,0|1,0,0]=3 13617 B10R0.71 CCCCCCCCOCC 7a_100000210232_100000210202 [2,0,0,0,0,0|1,0,0]=3 13618 B10R0.71 CCCCCCCCOCF 34a_100000210232_100015361967 [2,0,0,0,0,0|2,0,0]=4 13619 B10R0.71 CCCCCCCCOCF 7a_100000210232_100015361967 [2,0,0,0,0,0|2,0,0]=4 13620 B10R0.71 CCCCCCCCSCC 62a_100000210202_100000210317 [2,0,0,0,0,0|1,0,0]=3 13621 B10R0.71 CCCCCCCCSCC 62a_100000210759_100000210202 [2,0,0,0,0,0|1,0,0]=3 13622 B10R0.71 CCCCCCCCSCF 62a_100000210759_100015361967 [2,0,0,0,0,0|2,0,0]=4 13623 B10R0.71 CCCCCCCCSCF 62a_100015361967_100000210317 [2,0,0,0,0,0|2,0,0]=4 13624 B10R0.71 CCCCCCCNCCC 2230a_100000229938_100000210303 [2,0,0,0,0,0|1,0,0]=3 13625 B10R0.71 CCCCCCCNCCF 2230a_100000229938_100011217306 [2,0,0,0,0,0|2,0,0]=4 13626 B10R0.71 CCCCCCCNCCF 34a_100000724931_100000210614 [2,0,0,0,0,0|2,0,0]=4 13627 B10R0.71 CCCCCCCNCCO 2230a_100000229938_100000211926 [2,0,0,0,0,0|1,0,0]=3 13628 B10R0.71 CCCCCCCNCCO 2230a_100016997473_100000210681 [2,0,0,0,0,0|1,0,0]=3 13629 B10R0.71 CCCCCCCNCCO 34a_100016990907_100000210614 [2,0,0,0,0,0|1,0,0]=3 13630 B10R0.71 CCCCCCCNCOC 2230a_100000229938_100000766300 [2,0,0,0,0,0|2,0,0]=4 13631 B10R0.71 CCCCCCCNCSC 2230a_100000229938_100011218213 [2,0,0,0,0,0|2,0,0]=4 13632 B10R0.71 CCCCCCCOCCBr 34a_100000211926_100000210614 [2,0,0,0,0,0|2,0,0]=4 13633 B10R0.71 CCCCCCCOCCC 34a_100000210258_100000210614 [2,0,0,0,0,0|1,0,0]=3 13634 B10R0.71 CCCCCCCOCCC 34a_100000210272_100000210303 [2,0,0,0,0,0|1,0,0]=3 13635 B10R0.71 CCCCCCCOCCC 7a_100000210272_100000210303 [2,0,0,0,0,0|1,0,0]=3 13636 B10R0.71 CCCCCCCOCCF 34a_100000210272_100011217306 [2,0,0,0,0,0|2,0,0]=4 13637 B10R0.71 CCCCCCCOCCF 7a_100000210272_100011217306 [2,0,0,0,0,0|2,0,0]=4 13638 B10R0.71 CCCCCCCOCCN 34a_100000210304_100000210614 [2,0,0,0,0,0|2,0,0]=4 13639 B10R0.71 CCCCCCCOCCO 34a_100000210272_100000211926 [2,0,0,0,0,0|1,0,0]=3 13640 B10R0.71 CCCCCCCOCCO 7a_100000210272_100000211926 [2,0,0,0,0,0|1,0,0]=3 13641 B10R0.71 CCCCCCCOCSC 34a_100000210272_100011218213 [2,0,0,0,0,0|2,0,0]=4 13642 B10R0.71 CCCCCCCSCCC 62a_100000210303_100000210316 [2,0,0,0,0,0|1,0,0]=3 13643 B10R0.71 CCCCCCCSCCC 62a_100000210614_100000210303 [2,0,0,0,0,0|1,0,0]=3 13644 B10R0.71 CCCCCCCSCCF 62a_100000210614_100011217306 [2,0,0,0,0,0|2,0,0]=4 13645 B10R0.71 CCCCCCCSCCF 62a_100011217306_100000210316 [2,0,0,0,0,0|2,0,0]=4 13646 B10R0.71 CCCCCCCSCCO 62a_100000210614_100000211926 [2,0,0,0,0,0|1,0,0]=3 13647 B10R0.71 CCCCCCCSCCO 62a_100000211926_100000210316 [2,0,0,0,0,0|1,0,0]=3 13648 B10R0.71 CCCCCCCSCOC 62a_100000210614_100000766300 [2,0,0,0,0,0|2,0,0]=4 13649 B10R0.71 CCCCCCCSCOC 62a_100000766300_100000210316 [2,0,0,0,0,0|2,0,0]=4 13650 B10R0.71 CCCCCCCSCSC 62a_100000210614_100011218213 [2,0,0,0,0,0|2,0,0]=4 13651 B10R0.71 CCCCCCCSCSC 62a_100011218213_100000210316 [2,0,0,0,0,0|2,0,0]=4 13652 B10R0.71 CCCCCCNCCCC 2230a_100000102301_100000210314 [2,0,0,0,0,0|1,0,0]=3 13653 B10R0.71 CCCCCCNCCCC 2230a_100000210581_100000210211 [2,0,0,0,0,0|1,0,0]=3 13654 B10R0.71 CCCCCCNCCCC 7a_106832991798_100000210314 [2,0,0,0,0,0|1,0,0]=3 13655 B10R0.71 CCCCCCNCCCF 2230a_100000210581_100011934791 [2,0,0,0,0,0|2,0,0]=4 13656 B10R0.71 CCCCCCNCCCF 2230a_100015189416_100000210314 [2,0,0,0,0,0|2,0,0]=4 13657 B10R0.71 CCCCCCNCCCF 34a_100015189416_100000210314 [2,0,0,0,0,0|2,0,0]=4 13658 B10R0.71 CCCCCCNCCCO 2230a_100000210581_100000230001 [2,0,0,0,0,0|1,0,0]=3 13659 B10R0.71 CCCCCCNCCOC 2230a_100000209980_100000210314 [2,0,0,0,0,0|2,0,0]=4 13660 B10R0.71 CCCCCCNCCOC 2230a_100000210581_100011201679 [2,0,0,0,0,0|2,0,0]=4 13661 B10R0.71 CCCCCCNCCSC 2230a_100000210581_100000751147 [2,0,0,0,0,0|2,0,0]=4 13662 B10R0.71 CCCCCCNCCSC 2230a_100020590264_100000210314 [2,0,0,0,0,0|2,0,0]=4 13663 B10R0.71 CCCCCCOCCCBr 34a_100011217188_100000210314 [2,0,0,0,0,0|2,0,0]=4 13664 B10R0.71 CCCCCCOCCCC 34a_100000210227_100000210314 [2,0,0,0,0,0|1,0,0]=3 13665 B10R0.71 CCCCCCOCCCC 34a_100000210259_100000210210 [2,0,0,0,0,0|1,0,0]=3 13666 B10R0.71 CCCCCCOCCCC 7a_100000210227_100000210314 [2,0,0,0,0,0|1,0,0]=3 13667 B10R0.71 CCCCCCOCCCC 7a_100000210259_100000210211 [2,0,0,0,0,0|1,0,0]=3 13668 B10R0.71 CCCCCCOCCCCl 34a_100000230001_100000210314 [2,0,0,0,0,0|2,0,0]=4 13669 B10R0.71 CCCCCCOCCCF 34a_100000210259_100011934791 [2,0,0,0,0,0|2,0,0]=4 13670 B10R0.71 CCCCCCOCCCF 34a_100000759539_100000210314 [2,0,0,0,0,0|2,0,0]=4 13671 B10R0.71 CCCCCCOCCCF 7a_100000210259_100011934791 [2,0,0,0,0,0|2,0,0]=4 13672 B10R0.71 CCCCCCOCCCN 34a_100000182051_100000210314 [2,0,0,0,0,0|2,0,0]=4 13673 B10R0.71 CCCCCCOCCCO 34a_100000210259_100000230001 [2,0,0,0,0,0|1,0,0]=3 13674 B10R0.71 CCCCCCOCCCO 7a_100000210259_100011215043 [2,0,0,0,0,0|1,0,0]=3 13675 B10R0.71 CCCCCCOCCOC 34a_100000210237_100000210314 [2,0,0,0,0,0|2,0,0]=4 13676 B10R0.71 CCCCCCOCCOC 34a_100000210259_100011201679 [2,0,0,0,0,0|2,0,0]=4 13677 B10R0.71 CCCCCCOCCOC 34a_100000691444_200000210301 [2,0,0,0,0,0|2,0,0]=4 13678 B10R0.71 CCCCCCOCCOC 7a_100000210259_100000233755 [2,0,0,0,0,0|2,0,0]=4 13679 B10R0.71 CCCCCCOCCOC 7a_100000691444_200000210301 [2,0,0,0,0,0|2,0,0]=4 13680 B10R0.71 CCCCCCOCCO[13CH3] 34a_100000691444_200025704644 [2,0,0,0,0,0|2,0,0]=4 13681 B10R0.71 CCCCCCOCCO[13CH3] 7a_100000691444_200025704644 [2,0,0,0,0,0|2,0,0]=4 13682 B10R0.71 CCCCCCOCCSC 34a_100000210259_100000212216 [2,0,0,0,0,0|2,0,0]=4 13683 B10R0.71 CCCCCCOCCSC 34a_100000230434_100000210314 [2,0,0,0,0,0|2,0,0]=4 13684 B10R0.71 CCCCCCOCCSC 7a_100000210259_100000212216 [2,0,0,0,0,0|2,0,0]=4 13685 B10R0.71 CCCCCCOCCSC 7a_100000230434_100000210314 [2,0,0,0,0,0|2,0,0]=4 13686 B10R0.71 CCCCCCSCCCC 62a_100000210211_100000210757 [2,0,0,0,0,0|1,0,0]=3 13687 B10R0.71 CCCCCCSCCCC 62a_100000210314_100000210210 [2,0,0,0,0,0|1,0,0]=3 13688 B10R0.71 CCCCCCSCCCF 62a_100000210314_100011934791 [2,0,0,0,0,0|2,0,0]=4 13689 B10R0.71 CCCCCCSCCCF 62a_100011934791_100000210757 [2,0,0,0,0,0|2,0,0]=4 13690 B10R0.71 CCCCCCSCCCO 62a_100000210314_100011215043 [2,0,0,0,0,0|1,0,0]=3 13691 B10R0.71 CCCCCCSCCCO 62a_100011215043_100000210757 [2,0,0,0,0,0|1,0,0]=3 13692 B10R0.71 CCCCCCSCCOC 62a_100000210314_100000233755 [2,0,0,0,0,0|2,0,0]=4 13693 B10R0.71 CCCCCCSCCOC 62a_100000233755_100000210757 [2,0,0,0,0,0|2,0,0]=4 13694 B10R0.71 CCCCCCSCCSC 62a_100000210314_100000751147 [2,0,0,0,0,0|2,0,0]=4 13695 B10R0.71 CCCCCCSCCSC 62a_100000212216_100000210757 [2,0,0,0,0,0|2,0,0]=4 13696 B10R0.71 CCCCCCSCOCC 62a_100000210314_100000739092 [2,0,0,0,0,0|2,0,0]=4 13697 B10R0.71 CCCCCCSCOCC 62a_100000739092_100000210757 [2,0,0,0,0,0|2,0,0]=4 13698 B10R0.71 CCCCCNCCCCC 2230a_100000209983_100000210326 [2,0,0,0,0,0|1,0,0]=3 13699 B10R0.71 CCCCCNCCCCF 2230a_100000209983_100000729493 [2,0,0,0,0,0|2,0,0]=4 13700 B10R0.71 CCCCCNCCCCO 2230a_100000209983_100000210776 [2,0,0,0,0,0|1,0,0]=3 13701 B10R0.71 CCCCCNCCCCO 2230a_100000750430_100000210326 [2,0,0,0,0,0|1,0,0]=3 13702 B10R0.71 CCCCCNCCCCO 34a_100000750430_100000718602 [2,0,0,0,0,0|1,0,0]=3 13703 B10R0.71 CCCCCNCCCOC 2230a_100000209983_100000740836 [2,0,0,0,0,0|2,0,0]=4 13704 B10R0.71 CCCCCNCCCOC 34a_100150723488_100000718602 [2,0,0,0,0,0|2,0,0]=4 13705 B10R0.71 CCCCCNCCCSC 2230a_100000749238_100000210326 [2,0,0,0,0,0|2,0,0]=4 13706 B10R0.71 CCCCCNCCOCC 2230a_100000209983_100011215890 [2,0,0,0,0,0|2,0,0]=4 13707 B10R0.71 CCCCCNCCOCC 2230a_102516460346_100000210326 [2,0,0,0,0,0|2,0,0]=4 13708 B10R0.71 CCCCCNCCOCC 34a_100000224656_100000210202 [2,0,0,0,0,0|2,0,0]=4 13709 B10R0.71 CCCCCNCCOCC 34a_102516460346_100000718602 [2,0,0,0,0,0|2,0,0]=4 13710 B10R0.71 CCCCCNCCSCC 2230a_100000106463_100000210326 [2,0,0,0,0,0|2,0,0]=4 13711 B10R0.71 CCCCCNCCSCC 2230a_100000209983_100000757381 [2,0,0,0,0,0|2,0,0]=4 13712 B10R0.71 CCCCCOCCCCBr 34a_100011216708_100000718602 [2,0,0,0,0,0|2,0,0]=4 13713 B10R0.71 CCCCCOCCCCC 34a_100000210253_100000718602 [2,0,0,0,0,0|1,0,0]=3 13714 B10R0.71 CCCCCOCCCCC 7a_100000210253_100000210326 [2,0,0,0,0,0|1,0,0]=3 13715 B10R0.71 CCCCCOCCCCCl 34a_100000210776_100000718602 [2,0,0,0,0,0|2,0,0]=4 13716 B10R0.71 CCCCCOCCCCCl 7a_100000210776_100000210326 [2,0,0,0,0,0|2,0,0]=4 13717 B10R0.71 CCCCCOCCCCF 34a_100000210253_100000729493 [2,0,0,0,0,0|2,0,0]=4 13718 B10R0.71 CCCCCOCCCCF 34a_100011995726_100000718602 [2,0,0,0,0,0|2,0,0]=4 13719 B10R0.71 CCCCCOCCCCF 7a_100000210253_100000729493 [2,0,0,0,0,0|2,0,0]=4 13720 B10R0.71 CCCCCOCCCCF 7a_100011995726_100000210326 [2,0,0,0,0,0|2,0,0]=4 13721 B10R0.71 CCCCCOCCCCI 34a_200012148704_100000718602 [2,0,0,0,0,0|2,0,0]=4 13722 B10R0.71 CCCCCOCCCCN 34a_100000750430_100000718602 [2,0,0,0,0,0|2,0,0]=4 13723 B10R0.71 CCCCCOCCCCO 34a_100000210253_100011216708 [2,0,0,0,0,0|1,0,0]=3 13724 B10R0.71 CCCCCOCCCCO 7a_100000210253_100000210776 [2,0,0,0,0,0|1,0,0]=3 13725 B10R0.71 CCCCCOCCCNC 34a_100000213112_100000718602 [2,0,0,0,0,0|2,0,0]=4 13726 B10R0.71 CCCCCOCCCOC 34a_100000210253_100000740836 [2,0,0,0,0,0|2,0,0]=4 13727 B10R0.71 CCCCCOCCCOC 34a_100000740835_100000718602 [2,0,0,0,0,0|2,0,0]=4 13728 B10R0.71 CCCCCOCCCOC 7a_100000210253_100000740836 [2,0,0,0,0,0|2,0,0]=4 13729 B10R0.71 CCCCCOCCCSC 34a_100000690336_100000718602 [2,0,0,0,0,0|2,0,0]=4 13730 B10R0.71 CCCCCOCCCSC 7a_100000690336_100000210326 [2,0,0,0,0,0|2,0,0]=4 13731 B10R0.71 CCCCCOCCOCC 34a_100000210136_100000718602 [2,0,0,0,0,0|2,0,0]=4 13732 B10R0.71 CCCCCOCCOCC 34a_100000210253_100000210147 [2,0,0,0,0,0|2,0,0]=4 13733 B10R0.71 CCCCCOCCOCC 34a_100011215259_100000210202 [2,0,0,0,0,0|2,0,0]=4 13734 B10R0.71 CCCCCOCCOCC 7a_100000210136_100000210326 [2,0,0,0,0,0|2,0,0]=4 13735 B10R0.71 CCCCCOCCOCC 7a_100000210253_100011215890 [2,0,0,0,0,0|2,0,0]=4 13736 B10R0.71 CCCCCOCCOCC 7a_100011215259_100000210202 [2,0,0,0,0,0|2,0,0]=4 13737 B10R0.71 CCCCCOCCSCC 34a_100000210253_100000757381 [2,0,0,0,0,0|2,0,0]=4 13738 B10R0.71 CCCCCOCCSCC 34a_100000212035_100000718602 [2,0,0,0,0,0|2,0,0]=4 13739 B10R0.71 CCCCCOCCSCC 7a_100000210253_100000757381 [2,0,0,0,0,0|2,0,0]=4 13740 B10R0.71 CCCCCOCCSCC 7a_100000212035_100000210326 [2,0,0,0,0,0|2,0,0]=4 13741 B10R0.71 CCCCCSCCCCC 62a_100000210326_100000210326 [2,0,0,0,0,0|1,0,0]=3 13742 B10R0.71 CCCCCSCCCCF 62a_100000210326_100000729493 [2,0,0,0,0,0|2,0,0]=4 13743 B10R0.71 CCCCCSCCCCF 62a_100000729493_100000210326 [2,0,0,0,0,0|2,0,0]=4 13744 B10R0.71 CCCCCSCCCCO 62a_100000210326_100000210776 [2,0,0,0,0,0|1,0,0]=3 13745 B10R0.71 CCCCCSCCCCO 62a_100000210776_100000210326 [2,0,0,0,0,0|1,0,0]=3 13746 B10R0.71 CCCCCSCCCOC 62a_100000210326_100000709357 [2,0,0,0,0,0|2,0,0]=4 13747 B10R0.71 CCCCCSCCCOC 62a_100000709357_100000210326 [2,0,0,0,0,0|2,0,0]=4 13748 B10R0.71 CCCCCSCCOCC 62a_100000210147_100000210326 [2,0,0,0,0,0|2,0,0]=4 13749 B10R0.71 CCCCCSCCOCC 62a_100000210326_100011215890 [2,0,0,0,0,0|2,0,0]=4 13750 B10R0.71 CCCCCSCCSCC 62a_100000210326_100000757381 [2,0,0,0,0,0|2,0,0]=4 13751 B10R0.71 CCCCCSCCSCC 62a_100000757381_100000210326 [2,0,0,0,0,0|2,0,0]=4 13752 B10R0.71 CCCCNCCCCCF 2230a_100000102301_100000729378 [2,0,0,0,0,0|2,0,0]=4 13753 B10R0.71 CCCCNCCCCCF 7a_106832991798_100000729378 [2,0,0,0,0,0|2,0,0]=4 13754 B10R0.71 CCCCNCCCCCO 2230a_100000102301_100000746330 [2,0,0,0,0,0|1,0,0]=3 13755 B10R0.71 CCCCNCCCCCO 2230a_100000762737_100000210211 [2,0,0,0,0,0|1,0,0]=3 13756 B10R0.71 CCCCNCCCCCO 34a_100000762737_100000210210 [2,0,0,0,0,0|1,0,0]=3 13757 B10R0.71 CCCCNCCCCCO 7a_106832991798_100000746330 [2,0,0,0,0,0|1,0,0]=3 13758 B10R0.71 CCCCNCCCCOC 2230a_100000102301_100000730899 [2,0,0,0,0,0|2,0,0]=4 13759 B10R0.71 CCCCNCCCCOC 34a_200011216965_200000210301 [2,0,0,0,0,0|2,0,0]=4 13760 B10R0.71 CCCCNCCCCOC 7a_106832991798_100000730899 [2,0,0,0,0,0|2,0,0]=4 13761 B10R0.71 CCCCNCCCCO[13CH3] 34a_200011216965_200025704644 [2,0,0,0,0,0|2,0,0]=4 13762 B10R0.71 CCCCNCCCOCC 2230a_100000102301_100012232248 [2,0,0,0,0,0|2,0,0]=4 13763 B10R0.71 CCCCNCCCOCC 2230a_100000210961_100000210211 [2,0,0,0,0,0|2,0,0]=4 13764 B10R0.71 CCCCNCCCOCC 34a_100000210961_100000210210 [2,0,0,0,0,0|2,0,0]=4 13765 B10R0.71 CCCCNCCCOCC 7a_106832991798_100012232248 [2,0,0,0,0,0|2,0,0]=4 13766 B10R0.71 CCCCNCCOCCC 2230a_100000102301_100011215938 [2,0,0,0,0,0|2,0,0]=4 13767 B10R0.71 CCCCNCCOCCC 2230a_100161115042_100000210211 [2,0,0,0,0,0|2,0,0]=4 13768 B10R0.71 CCCCNCCOCCC 34a_100161115042_100000210210 [2,0,0,0,0,0|2,0,0]=4 13769 B10R0.71 CCCCNCCOCCC 7a_106832991798_100011215938 [2,0,0,0,0,0|2,0,0]=4 13770 B10R0.71 CCCCNCCOCCO 2230a_100000102301_100011215305 [2,0,0,0,0,0|2,0,0]=4 13771 B10R0.71 CCCCNCCOCCO 2230a_100000211614_100000210211 [2,0,0,0,0,0|2,0,0]=4 13772 B10R0.71 CCCCNCCOCCO 34a_100000211614_100000210210 [2,0,0,0,0,0|2,0,0]=4 13773 B10R0.71 CCCCNCCOCCO 7a_106832991798_100011215305 [2,0,0,0,0,0|2,0,0]=4 13774 B10R0.71 CCCCNCCSCCC 2230a_100020603323_100000210211 [2,0,0,0,0,0|2,0,0]=4 13775 B10R0.71 CCCCNCCSCCO 2230a_100011219999_100000210211 [2,0,0,0,0,0|2,0,0]=4 13776 B10R0.71 CCCCNCOCCCC 2230a_100000102301_100011995733 [2,0,0,0,0,0|2,0,0]=4 13777 B10R0.71 CCCCOCCCCCBr 34a_100000746331_100000210210 [2,0,0,0,0,0|2,0,0]=4 13778 B10R0.71 CCCCOCCCCCBr 7a_100000746331_100000210211 [2,0,0,0,0,0|2,0,0]=4 13779 B10R0.71 CCCCOCCCCCCl 34a_100000746330_100000210210 [2,0,0,0,0,0|2,0,0]=4 13780 B10R0.71 CCCCOCCCCCCl 7a_100000746330_100000210211 [2,0,0,0,0,0|2,0,0]=4 13781 B10R0.71 CCCCOCCCCCF 34a_100000210227_100000729378 [2,0,0,0,0,0|2,0,0]=4 13782 B10R0.71 CCCCOCCCCCF 7a_100000210227_100000729378 [2,0,0,0,0,0|2,0,0]=4 13783 B10R0.71 CCCCOCCCCCI 34a_200012148887_100000210210 [2,0,0,0,0,0|2,0,0]=4 13784 B10R0.71 CCCCOCCCCCI 7a_200012148887_100000210211 [2,0,0,0,0,0|2,0,0]=4 13785 B10R0.71 CCCCOCCCCCN 34a_100000762737_100000210210 [2,0,0,0,0,0|2,0,0]=4 13786 B10R0.71 CCCCOCCCCCO 34a_100000210227_100000746330 [2,0,0,0,0,0|1,0,0]=3 13787 B10R0.71 CCCCOCCCCCO 7a_100000210227_100000746330 [2,0,0,0,0,0|1,0,0]=3 13788 B10R0.71 CCCCOCCCCOC 34a_100000210227_100000755781 [2,0,0,0,0,0|2,0,0]=4 13789 B10R0.71 CCCCOCCCCOC 34a_100000740925_100000210210 [2,0,0,0,0,0|2,0,0]=4 13790 B10R0.71 CCCCOCCCCOC 34a_200000760531_200000210301 [2,0,0,0,0,0|2,0,0]=4 13791 B10R0.71 CCCCOCCCCOC 7a_100000210227_100000730899 [2,0,0,0,0,0|2,0,0]=4 13792 B10R0.71 CCCCOCCCCOC 7a_200000760531_200000210301 [2,0,0,0,0,0|2,0,0]=4 13793 B10R0.71 CCCCOCCCCO[13CH3] 34a_200000760531_200025704644 [2,0,0,0,0,0|2,0,0]=4 13794 B10R0.71 CCCCOCCCCO[13CH3] 7a_200000760531_200025704644 [2,0,0,0,0,0|2,0,0]=4 13795 B10R0.71 CCCCOCCCCSC 34a_100011217163_100000210210 [2,0,0,0,0,0|2,0,0]=4 13796 B10R0.71 CCCCOCCCCSC 7a_100011217163_100000210211 [2,0,0,0,0,0|2,0,0]=4 13797 B10R0.71 CCCCOCCCNCC 2230a_200000211371_100000210202 [2,0,0,0,0,0|2,0,0]=4 13798 B10R0.71 CCCCOCCCNCC 34a_200000211371_100000210202 [2,0,0,0,0,0|2,0,0]=4 13799 B10R0.71 CCCCOCCCOCC 34a_100000210227_100012232248 [2,0,0,0,0,0|2,0,0]=4 13800 B10R0.71 CCCCOCCCOCC 34a_100000757476_100000210210 [2,0,0,0,0,0|2,0,0]=4 13801 B10R0.71 CCCCOCCCOCC 34a_200011215613_100000210202 [2,0,0,0,0,0|2,0,0]=4 13802 B10R0.71 CCCCOCCCOCC 7a_100000210227_100012232248 [2,0,0,0,0,0|2,0,0]=4 13803 B10R0.71 CCCCOCCCOCC 7a_100000757476_100000210211 [2,0,0,0,0,0|2,0,0]=4 13804 B10R0.71 CCCCOCCCOCC 7a_200011215613_100000210202 [2,0,0,0,0,0|2,0,0]=4 13805 B10R0.71 CCCCOCCCSCC 34a_100011216438_100000210210 [2,0,0,0,0,0|2,0,0]=4 13806 B10R0.71 CCCCOCCCSCC 7a_100011216438_100000210211 [2,0,0,0,0,0|2,0,0]=4 13807 B10R0.71 CCCCOCCNCCO 2230a_100016997473_100000743108 [2,0,0,0,0,0|2,0,0]=4 13808 B10R0.71 CCCCOCCNCCO 34a_100016990907_100000743108 [2,0,0,0,0,0|2,0,0]=4 13809 B10R0.71 CCCCOCCOCCC 34a_100000210227_100011215938 [2,0,0,0,0,0|2,0,0]=4 13810 B10R0.71 CCCCOCCOCCC 34a_100000210238_100000210303 [2,0,0,0,0,0|2,0,0]=4 13811 B10R0.71 CCCCOCCOCCC 34a_100000210258_100000743108 [2,0,0,0,0,0|2,0,0]=4 13812 B10R0.71 CCCCOCCOCCC 34a_100000752267_100000210210 [2,0,0,0,0,0|2,0,0]=4 13813 B10R0.71 CCCCOCCOCCC 7a_100000210227_100011215938 [2,0,0,0,0,0|2,0,0]=4 13814 B10R0.71 CCCCOCCOCCC 7a_100000210238_100000210303 [2,0,0,0,0,0|2,0,0]=4 13815 B10R0.71 CCCCOCCOCCC 7a_100000752267_100000210211 [2,0,0,0,0,0|2,0,0]=4 13816 B10R0.71 CCCCOCCOCCO 34a_100000210227_100000692535 [2,0,0,0,0,0|2,0,0]=4 13817 B10R0.71 CCCCOCCOCCO 34a_100000210238_100000211926 [2,0,0,0,0,0|2,0,0]=4 13818 B10R0.71 CCCCOCCOCCO 7a_100000210227_100011215305 [2,0,0,0,0,0|2,0,0]=4 13819 B10R0.71 CCCCOCCOCCO 7a_100000210238_100000211926 [2,0,0,0,0,0|2,0,0]=4 13820 B10R0.71 CCCCOCCSCCC 34a_200000230433_100000210210 [2,0,0,0,0,0|2,0,0]=4 13821 B10R0.71 CCCCOCCSCCC 62a_100000210303_100000743108 [2,0,0,0,0,0|2,0,0]=4 13822 B10R0.71 CCCCOCCSCCC 62a_100000743108_100000210303 [2,0,0,0,0,0|2,0,0]=4 13823 B10R0.71 CCCCOCCSCCC 7a_200000230433_100000210211 [2,0,0,0,0,0|2,0,0]=4 13824 B10R0.71 CCCCOCCSCCO 62a_100000211926_100000743108 [2,0,0,0,0,0|2,0,0]=4 13825 B10R0.71 CCCCOCCSCCO 62a_100000743108_100000211926 [2,0,0,0,0,0|2,0,0]=4 13826 B10R0.71 CCCCOCOCCCC 34a_100000210227_100011995733 [2,0,0,0,0,0|2,0,0]=4 13827 B10R0.71 CCCCOCSCCCC 62a_100000210211_100011995733 [2,0,0,0,0,0|2,0,0]=4 13828 B10R0.71 CCCCOCSCCCC 62a_100011995733_100000210210 [2,0,0,0,0,0|2,0,0]=4 13829 B10R0.71 CCCCOCSCCCO 62a_100011215043_100011995733 [2,0,0,0,0,0|2,0,0]=4 13830 B10R0.71 CCCCOCSCCCO 62a_100011995733_100011215043 [2,0,0,0,0,0|2,0,0]=4 13831 B10R0.71 CCCCSCCCCCF 62a_100000210211_100000729378 [2,0,0,0,0,0|2,0,0]=4 13832 B10R0.71 CCCCSCCCCCF 62a_100000729378_100000210210 [2,0,0,0,0,0|2,0,0]=4 13833 B10R0.71 CCCCSCCCCCO 62a_100000210211_100000746330 [2,0,0,0,0,0|1,0,0]=3 13834 B10R0.71 CCCCSCCCCCO 62a_100000746330_100000210210 [2,0,0,0,0,0|1,0,0]=3 13835 B10R0.71 CCCCSCCCCOC 62a_100000210211_100000730899 [2,0,0,0,0,0|2,0,0]=4 13836 B10R0.71 CCCCSCCCCOC 62a_100000730899_100000210210 [2,0,0,0,0,0|2,0,0]=4 13837 B10R0.71 CCCCSCCCOCC 62a_100000210211_100012232248 [2,0,0,0,0,0|2,0,0]=4 13838 B10R0.71 CCCCSCCCOCC 62a_100012232248_100000210210 [2,0,0,0,0,0|2,0,0]=4 13839 B10R0.71 CCCCSCCNCCC 2230a_100025743550_100000210303 [2,0,0,0,0,0|2,0,0]=4 13840 B10R0.71 CCCCSCCNCCO 2230a_100025743550_100000211926 [2,0,0,0,0,0|2,0,0]=4 13841 B10R0.71 CCCCSCCOCCC 34a_200000230436_100000210303 [2,0,0,0,0,0|2,0,0]=4 13842 B10R0.71 CCCCSCCOCCC 62a_100000210211_100011215938 [2,0,0,0,0,0|2,0,0]=4 13843 B10R0.71 CCCCSCCOCCC 62a_100011215938_100000210210 [2,0,0,0,0,0|2,0,0]=4 13844 B10R0.71 CCCCSCCOCCC 7a_200000230436_100000210303 [2,0,0,0,0,0|2,0,0]=4 13845 B10R0.71 CCCCSCCOCCO 34a_200000230436_100000211926 [2,0,0,0,0,0|2,0,0]=4 13846 B10R0.71 CCCCSCCOCCO 62a_100000210211_100011215305 [2,0,0,0,0,0|2,0,0]=4 13847 B10R0.71 CCCCSCCOCCO 62a_100011215305_100000210210 [2,0,0,0,0,0|2,0,0]=4 13848 B10R0.71 CCCCSCCOCCO 7a_200000230436_100000211926 [2,0,0,0,0,0|2,0,0]=4 13849 B10R0.71 CCCNCCCCCCO 2230a_100000686447_100000210303 [2,0,0,0,0,0|1,0,0]=3 13850 B10R0.71 CCCNCCCCCCO 34a_100000686447_100000210303 [2,0,0,0,0,0|1,0,0]=3 13851 B10R0.71 CCCNCCCCCOC 2230a_100000747528_100000210303 [2,0,0,0,0,0|2,0,0]=4 13852 B10R0.71 CCCNCCCCCOC 34a_100000747528_100000210303 [2,0,0,0,0,0|2,0,0]=4 13853 B10R0.71 CCCNCCCOCCC 2230a_100011217757_100000210303 [2,0,0,0,0,0|2,0,0]=4 13854 B10R0.71 CCCNCCCOCCC 34a_100011217757_100000210303 [2,0,0,0,0,0|2,0,0]=4 13855 B10R0.71 CCCOCCCCCCBr 34a_100011215345_100000210303 [2,0,0,0,0,0|2,0,0]=4 13856 B10R0.71 CCCOCCCCCCBr 7a_100011215345_100000210303 [2,0,0,0,0,0|2,0,0]=4 13857 B10R0.71 CCCOCCCCCCCl 34a_100000766143_100000210303 [2,0,0,0,0,0|2,0,0]=4 13858 B10R0.71 CCCOCCCCCCCl 7a_100000766143_100000210303 [2,0,0,0,0,0|2,0,0]=4 13859 B10R0.71 CCCOCCCCCCF 34a_100000210258_100015922095 [2,0,0,0,0,0|2,0,0]=4 13860 B10R0.71 CCCOCCCCCCF 34a_100000732779_100000210303 [2,0,0,0,0,0|2,0,0]=4 13861 B10R0.71 CCCOCCCCCCF 7a_100000732779_100000210303 [2,0,0,0,0,0|2,0,0]=4 13862 B10R0.71 CCCOCCCCCCN 34a_100000686447_100000210303 [2,0,0,0,0,0|2,0,0]=4 13863 B10R0.71 CCCOCCCCCCO 34a_100000210258_100000766143 [2,0,0,0,0,0|1,0,0]=3 13864 B10R0.71 CCCOCCCCCNC 34a_100000722520_100000210303 [2,0,0,0,0,0|2,0,0]=4 13865 B10R0.71 CCCOCCCNCCO 2230a_100011217757_100000211926 [2,0,0,0,0,0|2,0,0]=4 13866 B10R0.71 CCCOCCCNCCO 34a_100011217757_100000211926 [2,0,0,0,0,0|2,0,0]=4 13867 B10R0.71 CCCOCCNCCCO 2230a_100161115042_100000230001 [2,0,0,0,0,0|2,0,0]=4 13868 B10R0.71 CCCOCCNCCCO 34a_100161115042_100000230001 [2,0,0,0,0,0|2,0,0]=4 13869 B10R0.71 CCCOCCOCCCO 34a_100000752267_100000230001 [2,0,0,0,0,0|2,0,0]=4 13870 B10R0.71 CCCOCCOCCCO 7a_100000752267_100011215043 [2,0,0,0,0,0|2,0,0]=4 13871 B10R0.71 CCCOCCSCCCO 62a_100011215043_100011215938 [2,0,0,0,0,0|2,0,0]=4 13872 B10R0.71 CCCOCCSCCCO 62a_100011215938_100011215043 [2,0,0,0,0,0|2,0,0]=4 13873 B10R0.71 CCCSCCCCCCF 62a_100000210303_100015922095 [2,0,0,0,0,0|2,0,0]=4 13874 B10R0.71 CCCSCCCCCCF 62a_100015922095_100000210303 [2,0,0,0,0,0|2,0,0]=4 13875 B10R0.71 CCCSCCCCCCO 62a_100000210303_100000766143 [2,0,0,0,0,0|1,0,0]=3 13876 B10R0.71 CCCSCCCCCCO 62a_100000766143_100000210303 [2,0,0,0,0,0|1,0,0]=3 13877 B10R0.71 CCCSCCNCCCO 2230a_100020603323_100000230001 [2,0,0,0,0,0|2,0,0]=4 13878 B10R0.71 CCCSCCOCCCO 34a_200000230433_100000230001 [2,0,0,0,0,0|2,0,0]=4 13879 B10R0.71 CCCSCCOCCCO 7a_200000230433_100011215043 [2,0,0,0,0,0|2,0,0]=4 13880 B10R0.71 CCNCCCCCCCO 2230a_100011996573_100000210202 [2,0,0,0,0,0|1,0,0]=3 13881 B10R0.71 CCNCCCCCCCO 2230a_100015525214_100000760002 [2,0,0,0,0,0|1,0,0]=3 13882 B10R0.71 CCNCCCCCCCO 34a_100011996573_100000210202 [2,0,0,0,0,0|1,0,0]=3 13883 B10R0.71 CCNCCCCCCOC 2230a_100015525214_100011998445 [2,0,0,0,0,0|2,0,0]=4 13884 B10R0.71 CCNCCCOCCCO 2230a_100011310245_100000210202 [2,0,0,0,0,0|2,0,0]=4 13885 B10R0.71 CCNCCCOCCCO 34a_100011310245_100000210202 [2,0,0,0,0,0|2,0,0]=4 13886 B10R0.71 CCOCCCCCCCBr 34a_100000760002_100000210202 [2,0,0,0,0,0|2,0,0]=4 13887 B10R0.71 CCOCCCCCCCBr 7a_100000760002_100000210202 [2,0,0,0,0,0|2,0,0]=4 13888 B10R0.71 CCOCCCCCCCN 34a_100011996573_100000210202 [2,0,0,0,0,0|2,0,0]=4 13889 B10R0.71 CCOCCCCCCCO 34a_100121572206_100000760002 [2,0,0,0,0,0|1,0,0]=3 13890 B10R0.71 CCOCCCCCCOC 34a_100121572206_100011998445 [2,0,0,0,0,0|2,0,0]=4 13891 B10R0.71 CCOCCCCCCOC 34a_200012092642_100000210202 [2,0,0,0,0,0|2,0,0]=4 13892 B10R0.71 CCOCCCCCCOC 7a_200012092642_100000210202 [2,0,0,0,0,0|2,0,0]=4 13893 B10R0.71 CCOCCCNCCCO 2230a_100000210961_100000230001 [2,0,0,0,0,0|2,0,0]=4 13894 B10R0.71 CCOCCCNCCCO 34a_100000210961_100000230001 [2,0,0,0,0,0|2,0,0]=4 13895 B10R0.71 CCOCCCOCCCO 34a_100000757476_100000230001 [2,0,0,0,0,0|2,0,0]=4 13896 B10R0.71 CCOCCCOCCCO 7a_100000757476_100011215043 [2,0,0,0,0,0|2,0,0]=4 13897 B10R0.71 CCOCCCSCCCO 62a_100011215043_100012232248 [2,0,0,0,0,0|2,0,0]=4 13898 B10R0.71 CCOCCCSCCCO 62a_100012232248_100011215043 [2,0,0,0,0,0|2,0,0]=4 13899 B10R0.71 CCOCCNCCCCO 2230a_100000750430_100011215890 [2,0,0,0,0,0|2,0,0]=4 13900 B10R0.71 CCOCCNCCCCO 2230a_102516460346_100000210776 [2,0,0,0,0,0|2,0,0]=4 13901 B10R0.71 CCOCCNCCCCO 34a_100000750430_100000210147 [2,0,0,0,0,0|2,0,0]=4 13902 B10R0.71 CCOCCNCCCCO 34a_102516460346_100011216708 [2,0,0,0,0,0|2,0,0]=4 13903 B10R0.71 CCOCCOCCCCO 34a_100000210136_100011216708 [2,0,0,0,0,0|2,0,0]=4 13904 B10R0.71 CCOCCOCCCCO 7a_100000210136_100000210776 [2,0,0,0,0,0|2,0,0]=4 13905 B10R0.71 CCOCCSCCCCO 62a_100000210147_100000210776 [2,0,0,0,0,0|2,0,0]=4 13906 B10R0.71 CCOCCSCCCCO 62a_100000210776_100011215890 [2,0,0,0,0,0|2,0,0]=4 13907 B10R0.71 CCOCSCCCCCO 62a_100000739092_100000746330 [2,0,0,0,0,0|2,0,0]=4 13908 B10R0.71 CCOCSCCCCCO 62a_100000746330_100000739092 [2,0,0,0,0,0|2,0,0]=4 13909 B10R0.71 CCSCCCCCCCO 62a_100000210202_100000760002 [2,0,0,0,0,0|1,0,0]=3 13910 B10R0.71 CCSCCCCCCCO 62a_100000760002_100000210202 [2,0,0,0,0,0|1,0,0]=3 13911 B10R0.71 CCSCCCCCCOC 62a_100000210202_100011998445 [2,0,0,0,0,0|2,0,0]=4 13912 B10R0.71 CCSCCCCCCOC 62a_100011998445_100000210202 [2,0,0,0,0,0|2,0,0]=4 13913 B10R0.71 CCSCCCOCCCO 34a_100011216438_100000230001 [2,0,0,0,0,0|2,0,0]=4 13914 B10R0.71 CCSCCCOCCCO 7a_100011216438_100011215043 [2,0,0,0,0,0|2,0,0]=4 13915 B10R0.71 CCSCCNCCCCO 2230a_100000106463_100000210776 [2,0,0,0,0,0|2,0,0]=4 13916 B10R0.71 CCSCCNCCCCO 2230a_100000750430_100000757381 [2,0,0,0,0,0|2,0,0]=4 13917 B10R0.71 CCSCCNCCCCO 34a_100000750430_100000757381 [2,0,0,0,0,0|2,0,0]=4 13918 B10R0.71 CCSCCOCCCCO 34a_100000212035_100011216708 [2,0,0,0,0,0|2,0,0]=4 13919 B10R0.71 CCSCCOCCCCO 7a_100000212035_100000210776 [2,0,0,0,0,0|2,0,0]=4 13920 B10R0.71 CCSCCSCCCCO 62a_100000210776_100000757381 [2,0,0,0,0,0|2,0,0]=4 13921 B10R0.71 CCSCCSCCCCO 62a_100000757381_100000210776 [2,0,0,0,0,0|2,0,0]=4 13922 B10R0.71 CNCCCCCCCCO 2230a_102515433106_200000210301 [2,0,0,0,0,0|1,0,0]=3 13923 B10R0.71 CNCCCCCCCCO 2230a_106832991635_100000033203 [2,0,0,0,0,0|1,0,0]=3 13924 B10R0.71 CNCCCCCCCCO 34a_100102657272_100000033203 [2,0,0,0,0,0|1,0,0]=3 13925 B10R0.71 CNCCCCCCCCO 34a_102515433106_200000210301 [2,0,0,0,0,0|1,0,0]=3 13926 B10R0.71 CNCCCCCCCCO 7a_106832991635_100000033203 [2,0,0,0,0,0|1,0,0]=3 13927 B10R0.71 CNCCCCCOCCO 34a_100000722520_100000211926 [2,0,0,0,0,0|2,0,0]=4 13928 B10R0.71 CNCCCOCCCCO 34a_100000213112_100011216708 [2,0,0,0,0,0|2,0,0]=4 13929 B10R0.71 COCCCCCCCCBr 34a_100009813846_200000210301 [2,0,0,0,0,0|2,0,0]=4 13930 B10R0.71 COCCCCCCCCBr 7a_100009813846_200000210301 [2,0,0,0,0,0|2,0,0]=4 13931 B10R0.71 COCCCCCCCCCl 34a_100000033203_200000210301 [2,0,0,0,0,0|2,0,0]=4 13932 B10R0.71 COCCCCCCCCCl 7a_100000033203_200000210301 [2,0,0,0,0,0|2,0,0]=4 13933 B10R0.71 COCCCCCCCCN 34a_102515433106_200000210301 [2,0,0,0,0,0|2,0,0]=4 13934 B10R0.71 COCCCCCCCCO 34a_100138415774_100000033203 [2,0,0,0,0,0|1,0,0]=3 13935 B10R0.71 COCCCCCNCCO 2230a_100000747528_100000211926 [2,0,0,0,0,0|2,0,0]=4 13936 B10R0.71 COCCCCCNCCO 34a_100000747528_100000211926 [2,0,0,0,0,0|2,0,0]=4 13937 B10R0.71 COCCCCOCCCO 34a_100000740925_100000230001 [2,0,0,0,0,0|2,0,0]=4 13938 B10R0.71 COCCCCSCCCO 62a_100000730899_100011215043 [2,0,0,0,0,0|2,0,0]=4 13939 B10R0.71 COCCCCSCCCO 62a_100011215043_100000730899 [2,0,0,0,0,0|2,0,0]=4 13940 B10R0.71 COCCCNCCCCO 2230a_100000750430_100000740836 [2,0,0,0,0,0|2,0,0]=4 13941 B10R0.71 COCCCNCCCCO 34a_100000750430_100000740836 [2,0,0,0,0,0|2,0,0]=4 13942 B10R0.71 COCCCNCCCCO 34a_100150723488_100011216708 [2,0,0,0,0,0|2,0,0]=4 13943 B10R0.71 COCCCOCCCCO 34a_100000740835_100011216708 [2,0,0,0,0,0|2,0,0]=4 13944 B10R0.71 COCCCSCCCCO 62a_100000210776_100000709357 [2,0,0,0,0,0|2,0,0]=4 13945 B10R0.71 COCCCSCCCCO 62a_100000709357_100000210776 [2,0,0,0,0,0|2,0,0]=4 13946 B10R0.71 COCCNCCCCCO 2230a_100000209980_100000746330 [2,0,0,0,0,0|2,0,0]=4 13947 B10R0.71 COCCNCCCCCO 2230a_100000762737_100011201679 [2,0,0,0,0,0|2,0,0]=4 13948 B10R0.71 COCCNCCCCCO 34a_100000762737_100011201679 [2,0,0,0,0,0|2,0,0]=4 13949 B10R0.71 COCCOCCCCCO 34a_100000210237_100000746330 [2,0,0,0,0,0|2,0,0]=4 13950 B10R0.71 COCCSCCCCCO 62a_100000233755_100000746330 [2,0,0,0,0,0|2,0,0]=4 13951 B10R0.71 COCCSCCCCCO 62a_100000746330_100000233755 [2,0,0,0,0,0|2,0,0]=4 13952 B10R0.71 COCNCCCCCCO 2230a_100000686447_100000766300 [2,0,0,0,0,0|2,0,0]=4 13953 B10R0.71 COCSCCCCCCO 62a_100000766143_100000766300 [2,0,0,0,0,0|2,0,0]=4 13954 B10R0.71 COCSCCCCCCO 62a_100000766300_100000766143 [2,0,0,0,0,0|2,0,0]=4 13955 B10R0.71 CSCCCCCCCCO 62a_100000033203_200000210301 [2,0,0,0,0,0|1,0,0]=3 13956 B10R0.71 CSCCCCCCCCO 62a_200000210301_100000033203 [2,0,0,0,0,0|1,0,0]=3 13957 B10R0.71 CSCCCCOCCCO 34a_100011217163_100000230001 [2,0,0,0,0,0|2,0,0]=4 13958 B10R0.71 CSCCCCOCCCO 7a_100011217163_100011215043 [2,0,0,0,0,0|2,0,0]=4 13959 B10R0.71 CSCCCNCCCCO 2230a_100000749238_100000210776 [2,0,0,0,0,0|2,0,0]=4 13960 B10R0.71 CSCCCOCCCCO 34a_100000690336_100011216708 [2,0,0,0,0,0|2,0,0]=4 13961 B10R0.71 CSCCCOCCCCO 7a_100000690336_100000210776 [2,0,0,0,0,0|2,0,0]=4 13962 B10R0.71 CSCCNCCCCCO 2230a_100000762737_100000751147 [2,0,0,0,0,0|2,0,0]=4 13963 B10R0.71 CSCCNCCCCCO 2230a_100020590264_100000746330 [2,0,0,0,0,0|2,0,0]=4 13964 B10R0.71 CSCCNCCCCCO 34a_100000762737_100000212216 [2,0,0,0,0,0|2,0,0]=4 13965 B10R0.71 CSCCOCCCCCO 34a_100000230434_100000746330 [2,0,0,0,0,0|2,0,0]=4 13966 B10R0.71 CSCCOCCCCCO 7a_100000230434_100000746330 [2,0,0,0,0,0|2,0,0]=4 13967 B10R0.71 CSCCSCCCCCO 62a_100000212216_100000746330 [2,0,0,0,0,0|2,0,0]=4 13968 B10R0.71 CSCCSCCCCCO 62a_100000746330_100000751147 [2,0,0,0,0,0|2,0,0]=4 13969 B10R0.71 CSCNCCCCCCO 2230a_100000686447_100011218213 [2,0,0,0,0,0|2,0,0]=4 13970 B10R0.71 CSCNCCCCCCO 34a_100000686447_100011218213 [2,0,0,0,0,0|2,0,0]=4 13971 B10R0.71 CSCSCCCCCCO 62a_100000766143_100011218213 [2,0,0,0,0,0|2,0,0]=4 13972 B10R0.71 CSCSCCCCCCO 62a_100011218213_100000766143 [2,0,0,0,0,0|2,0,0]=4 13973 B10R0.71 NCCCCCCOCCO 34a_100000686447_100000211926 [2,0,0,0,0,0|2,0,0]=4 13974 B10R0.71 NCCCCCOCCCO 34a_100000762737_100000230001 [2,0,0,0,0,0|2,0,0]=4 13975 B10R0.71 NCCCCOCCCCO 34a_100000750430_100011216708 [2,0,0,0,0,0|2,0,0]=4 13976 B10R0.71 NCCCOCCCCCO 34a_100000182051_100000746330 [2,0,0,0,0,0|2,0,0]=4 13977 B10R0.71 NCCOCCCCCCO 34a_100000210304_100000766143 [2,0,0,0,0,0|2,0,0]=4 13978 B10R0.71 OCCCCCCCNCF 34a_100011996573_100015361967 [2,0,0,0,0,0|2,0,0]=4 13979 B10R0.71 OCCCCCCCSCF 62a_100000760002_100015361967 [2,0,0,0,0,0|2,0,0]=4 13980 B10R0.71 OCCCCCCCSCF 62a_100015361967_100000760002 [2,0,0,0,0,0|2,0,0]=4 13981 B10R0.71 OCCCCCCNCCF 2230a_100000686447_100011217306 [2,0,0,0,0,0|2,0,0]=4 13982 B10R0.71 OCCCCCCNCCF 34a_100000686447_100011217306 [2,0,0,0,0,0|2,0,0]=4 13983 B10R0.71 OCCCCCCNCCF 34a_100000724931_100000766143 [2,0,0,0,0,0|2,0,0]=4 13984 B10R0.71 OCCCCCCNCCO 2230a_100000686447_100000211926 [2,0,0,0,0,0|2,0,0]=4 13985 B10R0.71 OCCCCCCNCCO 2230a_100016997473_100000766143 [2,0,0,0,0,0|2,0,0]=4 13986 B10R0.71 OCCCCCCNCCO 34a_100000686447_100000211926 [2,0,0,0,0,0|2,0,0]=4 13987 B10R0.71 OCCCCCCNCCO 34a_100016990907_100000766143 [2,0,0,0,0,0|2,0,0]=4 13988 B10R0.71 OCCCCCCOCCBr 34a_100000211926_100000766143 [2,0,0,0,0,0|2,0,0]=4 13989 B10R0.71 OCCCCCCSCCF 62a_100000766143_100011217306 [2,0,0,0,0,0|2,0,0]=4 13990 B10R0.71 OCCCCCCSCCF 62a_100011217306_100000766143 [2,0,0,0,0,0|2,0,0]=4 13991 B10R0.71 OCCCCCCSCCO 62a_100000211926_100000766143 [2,0,0,0,0,0|2,0,0]=4 13992 B10R0.71 OCCCCCCSCCO 62a_100000766143_100000211926 [2,0,0,0,0,0|2,0,0]=4 13993 B10R0.71 OCCCCCNCCCF 2230a_100000762737_100011934791 [2,0,0,0,0,0|2,0,0]=4 13994 B10R0.71 OCCCCCNCCCF 2230a_100015189416_100000746330 [2,0,0,0,0,0|2,0,0]=4 13995 B10R0.71 OCCCCCNCCCF 34a_100000762737_100011934791 [2,0,0,0,0,0|2,0,0]=4 13996 B10R0.71 OCCCCCNCCCF 34a_100015189416_100000746330 [2,0,0,0,0,0|2,0,0]=4 13997 B10R0.71 OCCCCCNCCCO 2230a_100000762737_100000230001 [2,0,0,0,0,0|2,0,0]=4 13998 B10R0.71 OCCCCCNCCCO 34a_100000762737_100000230001 [2,0,0,0,0,0|2,0,0]=4 13999 B10R0.71 OCCCCCOCCCBr 34a_100011217188_100000746330 [2,0,0,0,0,0|2,0,0]=4 14000 B10R0.71 OCCCCCOCCCCl 34a_100000230001_100000746330 [2,0,0,0,0,0|2,0,0]=4 14001 B10R0.71 OCCCCCOCCCF 34a_100000759539_100000746330 [2,0,0,0,0,0|2,0,0]=4 14002 B10R0.71 OCCCCCSCCCF 62a_100000746330_100011934791 [2,0,0,0,0,0|2,0,0]=4 14003 B10R0.71 OCCCCCSCCCF 62a_100011934791_100000746330 [2,0,0,0,0,0|2,0,0]=4 14004 B10R0.71 OCCCCCSCCCO 62a_100000746330_100011215043 [2,0,0,0,0,0|2,0,0]=4 14005 B10R0.71 OCCCCCSCCCO 62a_100011215043_100000746330 [2,0,0,0,0,0|2,0,0]=4 14006 B10R0.71 OCCCCNCCCCF 2230a_100000750430_100000729493 [2,0,0,0,0,0|2,0,0]=4 14007 B10R0.71 OCCCCNCCCCF 34a_100000750430_100000729493 [2,0,0,0,0,0|2,0,0]=4 14008 B10R0.71 OCCCCNCCCCO 2230a_100000750430_100000210776 [2,0,0,0,0,0|2,0,0]=4 14009 B10R0.71 OCCCCNCCCCO 34a_100000750430_100011216708 [2,0,0,0,0,0|2,0,0]=4 14010 B10R0.71 OCCCCOCCCCBr 34a_100011216708_100011216708 [2,0,0,0,0,0|2,0,0]=4 14011 B10R0.71 OCCCCOCCCCCl 34a_100000210776_100011216708 [2,0,0,0,0,0|2,0,0]=4 14012 B10R0.71 OCCCCOCCCCCl 7a_100000210776_100000210776 [2,0,0,0,0,0|2,0,0]=4 14013 B10R0.71 OCCCCOCCCCF 34a_100011995726_100011216708 [2,0,0,0,0,0|2,0,0]=4 14014 B10R0.71 OCCCCOCCCCF 7a_100011995726_100000210776 [2,0,0,0,0,0|2,0,0]=4 14015 B10R0.71 OCCCCOCCCCI 34a_200012148704_100011216708 [2,0,0,0,0,0|2,0,0]=4 14016 B10R0.71 OCCCCSCCCCF 62a_100000210776_100000729493 [2,0,0,0,0,0|2,0,0]=4 14017 B10R0.71 OCCCCSCCCCF 62a_100000729493_100000210776 [2,0,0,0,0,0|2,0,0]=4 14018 B10R0.71 OCCCCSCCCCO 62a_100000210776_100000210776 [2,0,0,0,0,0|2,0,0]=4 14019 B10R0.71 OCCCOCCCCCBr 34a_100000746331_100000230001 [2,0,0,0,0,0|2,0,0]=4 14020 B10R0.71 OCCCOCCCCCBr 7a_100000746331_100011215043 [2,0,0,0,0,0|2,0,0]=4 14021 B10R0.71 OCCCOCCCCCCl 34a_100000746330_100000230001 [2,0,0,0,0,0|2,0,0]=4 14022 B10R0.71 OCCCOCCCCCCl 7a_100000746330_100011215043 [2,0,0,0,0,0|2,0,0]=4 14023 B10R0.71 OCCCOCCCCCI 34a_200012148887_100000230001 [2,0,0,0,0,0|2,0,0]=4 14024 B10R0.71 OCCCOCCCCCI 7a_200012148887_100011215043 [2,0,0,0,0,0|2,0,0]=4 14025 B10R0.71 OCCCSCCCCCF 62a_100000729378_100011215043 [2,0,0,0,0,0|2,0,0]=4 14026 B10R0.71 OCCCSCCCCCF 62a_100011215043_100000729378 [2,0,0,0,0,0|2,0,0]=4 14027 B10R0.71 OCCNCCCCCCF 2230a_100016997473_100015922095 [2,0,0,0,0,0|2,0,0]=4 14028 B10R0.71 OCCNCCCCCCF 34a_100016990907_100015922095 [2,0,0,0,0,0|2,0,0]=4 14029 B10R0.71 OCCOCCCCCCBr 34a_100011215345_100000211926 [2,0,0,0,0,0|2,0,0]=4 14030 B10R0.71 OCCOCCCCCCBr 7a_100011215345_100000211926 [2,0,0,0,0,0|2,0,0]=4 14031 B10R0.71 OCCOCCCCCCCl 34a_100000766143_100000211926 [2,0,0,0,0,0|2,0,0]=4 14032 B10R0.71 OCCOCCCCCCCl 7a_100000766143_100000211926 [2,0,0,0,0,0|2,0,0]=4 14033 B10R0.71 OCCOCCCCCCF 34a_100000732779_100000211926 [2,0,0,0,0,0|2,0,0]=4 14034 B10R0.71 OCCOCCCCCCF 7a_100000732779_100000211926 [2,0,0,0,0,0|2,0,0]=4 14035 B10R0.71 OCCSCCCCCCF 62a_100000211926_100015922095 [2,0,0,0,0,0|2,0,0]=4 14036 B10R0.71 OCCSCCCCCCF 62a_100015922095_100000211926 [2,0,0,0,0,0|2,0,0]=4 14037 B10R0.71 [13CH3]NCCCCCCCCO 2230a_102515433106_200025704644 [2,0,0,0,0,0|1,0,0]=3 14038 B10R0.71 [13CH3]NCCCCCCCCO 34a_102515433106_200025704644 [2,0,0,0,0,0|1,0,0]=3 14039 B10R0.71 [13CH3]OCCCCCCCCBr 34a_100009813846_200025704644 [2,0,0,0,0,0|2,0,0]=4 14040 B10R0.71 [13CH3]OCCCCCCCCBr 7a_100009813846_200025704644 [2,0,0,0,0,0|2,0,0]=4 14041 B10R0.71 [13CH3]OCCCCCCCCCl 34a_100000033203_200025704644 [2,0,0,0,0,0|2,0,0]=4 14042 B10R0.71 [13CH3]OCCCCCCCCCl 7a_100000033203_200025704644 [2,0,0,0,0,0|2,0,0]=4 14043 B10R0.71 [13CH3]OCCCCCCCCN 34a_102515433106_200025704644 [2,0,0,0,0,0|2,0,0]=4 14044 B10R0.71 [13CH3]SCCCCCCCCO 62a_100000033203_200025704644 [2,0,0,0,0,0|1,0,0]=3 14045 B10R0.71 [13CH3]SCCCCCCCCO 62a_200025704644_100000033203 [2,0,0,0,0,0|1,0,0]=3 14046 B12R0.1 CC(CCBr)OCCCCCCO 34a_100012276601_100000766143 [1,1,0,0,0,0|2,0,0]=4 14047 B12R0.1 CC(CCN)COCCCCCO 34a_106354213184_100000746330 [1,1,0,0,0,0|2,0,0]=4 14048 B12R0.1 CC(CCO)NCCCCCCO 2230a_100000686447_100009893172 [1,1,0,0,0,0|2,0,0]=4 14049 B12R0.1 CC(CCO)NCCCCCCO 34a_100000686447_100009893172 [1,1,0,0,0,0|2,0,0]=4 14050 B12R0.1 CC(CCO)OCCCCCCBr 34a_100011215345_100009893172 [1,1,0,0,0,0|2,0,0]=4 14051 B12R0.1 CC(CCO)OCCCCCCBr 7a_100011215345_100009893172 [1,1,0,0,0,0|2,0,0]=4 14052 B12R0.1 CC(CCO)OCCCCCCCl 34a_100000766143_100009893172 [1,1,0,0,0,0|2,0,0]=4 14053 B12R0.1 CC(CCO)OCCCCCCCl 7a_100000766143_100009893172 [1,1,0,0,0,0|2,0,0]=4 14054 B12R0.1 CC(CCO)OCCCCCCF 34a_100000732779_100009893172 [1,1,0,0,0,0|2,0,0]=4 14055 B12R0.1 CC(CCO)OCCCCCCF 7a_100000732779_100009893172 [1,1,0,0,0,0|2,0,0]=4 14056 B12R0.1 CC(CCO)OCCCCCCN 34a_100000686447_100009893172 [1,1,0,0,0,0|2,0,0]=4 14057 B12R0.1 CC(CCO)SCCCCCCF 62a_100009893172_100015922095 [1,1,0,0,0,0|2,0,0]=4 14058 B12R0.1 CC(CCO)SCCCCCCF 62a_100015922095_100009893172 [1,1,0,0,0,0|2,0,0]=4 14059 B12R0.1 CC(CCO)SCCCCCCO 62a_100000766143_100009893172 [1,1,0,0,0,0|2,0,0]=4 14060 B12R0.1 CC(CCO)SCCCCCCO 62a_100009893172_100000766143 [1,1,0,0,0,0|2,0,0]=4 14061 B12R0.1 CCCC(=O)CCCCCCCO 1458a_100000211992_100000760002 [1,1,0,0,0,0|0,0,1]=3 14062 B12R0.1 CCCC(=O)CCCCCCCO 1458a_100011219782_100000210303 [1,1,0,0,0,0|0,0,1]=3 14063 B12R0.1 CCCC(=O)CCCCCCOC 1458a_100000211992_100011998445 [1,1,0,0,0,0|1,0,1]=4 14064 B12R0.1 CCCC(=O)CNCCCCCO 2230a_100000762737_100000747444 [1,1,0,0,0,0|1,0,1]=4 14065 B12R0.1 CCCC(=O)CSCCCCCO 62a_100000746330_100000747444 [1,1,0,0,0,0|1,0,1]=4 14066 B12R0.1 CCCC(=O)CSCCCCCO 62a_100000747444_100000746330 [1,1,0,0,0,0|1,0,1]=4 14067 B12R0.1 CCCC(=O)NCCCCCCO 240690a_100000686447_100000211992 [1,1,0,0,0,0|1,0,1]=4 14068 B12R0.1 CCCC(=O)NCCCCCCO 527a_100000686447_100000211992 [1,1,0,0,0,0|1,0,1]=4 14069 B12R0.1 CCCC(C)CCCOCCCF 34a_100011713154_100011934791 [1,1,0,0,0,0|2,0,0]=4 14070 B12R0.1 CCCC(C)CCCOCCCF 7a_100011713154_100011934791 [1,1,0,0,0,0|2,0,0]=4 14071 B12R0.1 CCCC(C)CCCOCCCO 34a_100011713154_100000230001 [1,1,0,0,0,0|1,0,0]=3 14072 B12R0.1 CCCC(C)CCCOCCCO 7a_100011713154_100011215043 [1,1,0,0,0,0|1,0,0]=3 14073 B12R0.1 CCCC(C)CCCOCCOC 34a_100011713154_100011201679 [1,1,0,0,0,0|2,0,0]=4 14074 B12R0.1 CCCC(C)CCCOCCOC 7a_100011713154_100000233755 [1,1,0,0,0,0|2,0,0]=4 14075 B12R0.1 CCCC(C)CCCOCCSC 34a_100011713154_100000212216 [1,1,0,0,0,0|2,0,0]=4 14076 B12R0.1 CCCC(C)CCCOCCSC 7a_100011713154_100000212216 [1,1,0,0,0,0|2,0,0]=4 14077 B12R0.1 CCCC(C)CCOCCCCF 34a_100011217855_100000729493 [1,1,0,0,0,0|2,0,0]=4 14078 B12R0.1 CCCC(C)CCOCCCCF 7a_100011217855_100000729493 [1,1,0,0,0,0|2,0,0]=4 14079 B12R0.1 CCCC(C)CCOCCCCO 34a_100011217855_100011216708 [1,1,0,0,0,0|1,0,0]=3 14080 B12R0.1 CCCC(C)CCOCCCCO 7a_100011217855_100000210776 [1,1,0,0,0,0|1,0,0]=3 14081 B12R0.1 CCCC(C)CCOCCCOC 34a_100011217855_100000740836 [1,1,0,0,0,0|2,0,0]=4 14082 B12R0.1 CCCC(C)CCOCCCOC 7a_100011217855_100000740836 [1,1,0,0,0,0|2,0,0]=4 14083 B12R0.1 CCCC(C)CCOCCOCC 34a_100011217855_100000210147 [1,1,0,0,0,0|2,0,0]=4 14084 B12R0.1 CCCC(C)CCOCCOCC 7a_100011217855_100011215890 [1,1,0,0,0,0|2,0,0]=4 14085 B12R0.1 CCCC(C)CCOCCSCC 34a_100011217855_100000757381 [1,1,0,0,0,0|2,0,0]=4 14086 B12R0.1 CCCC(C)CCOCCSCC 7a_100011217855_100000757381 [1,1,0,0,0,0|2,0,0]=4 14087 B12R0.1 CCCC(C)CNCCCCCO 2230a_100000762737_100011216630 [1,1,0,0,0,0|1,0,0]=3 14088 B12R0.1 CCCC(C)CNCCCCCO 270004a_100000762737_100000243154 [1,1,0,0,0,0|1,0,0]=3 14089 B12R0.1 CCCC(C)CNCCCCCO 34a_100000762737_100011216630 [1,1,0,0,0,0|1,0,0]=3 14090 B12R0.1 CCCC(C)CNCCCOCC 2230a_100000210961_100011216630 [1,1,0,0,0,0|2,0,0]=4 14091 B12R0.1 CCCC(C)CNCCCOCC 270004a_100000210961_100000243154 [1,1,0,0,0,0|2,0,0]=4 14092 B12R0.1 CCCC(C)CNCCCOCC 34a_100000210961_100011216630 [1,1,0,0,0,0|2,0,0]=4 14093 B12R0.1 CCCC(C)CNCCOCCO 2230a_100000211614_100011216630 [1,1,0,0,0,0|2,0,0]=4 14094 B12R0.1 CCCC(C)CNCCOCCO 270004a_100000211614_100000243154 [1,1,0,0,0,0|2,0,0]=4 14095 B12R0.1 CCCC(C)CNCCOCCO 34a_100000211614_100011216630 [1,1,0,0,0,0|2,0,0]=4 14096 B12R0.1 CCCC(C)CNCCSCCO 2230a_100011219999_100011216630 [1,1,0,0,0,0|2,0,0]=4 14097 B12R0.1 CCCC(C)CNCCSCCO 270004a_100011219999_100000243154 [1,1,0,0,0,0|2,0,0]=4 14098 B12R0.1 CCCC(C)COCCCCCBr 34a_100000746331_100011216630 [1,1,0,0,0,0|2,0,0]=4 14099 B12R0.1 CCCC(C)COCCCCCBr 7a_100000746331_100011216630 [1,1,0,0,0,0|2,0,0]=4 14100 B12R0.1 CCCC(C)COCCCCCCl 34a_100000746330_100011216630 [1,1,0,0,0,0|2,0,0]=4 14101 B12R0.1 CCCC(C)COCCCCCCl 7a_100000746330_100011216630 [1,1,0,0,0,0|2,0,0]=4 14102 B12R0.1 CCCC(C)COCCCCCF 34a_100000688023_100000729378 [1,1,0,0,0,0|2,0,0]=4 14103 B12R0.1 CCCC(C)COCCCCCF 7a_100000688023_100000729378 [1,1,0,0,0,0|2,0,0]=4 14104 B12R0.1 CCCC(C)COCCCCCI 34a_200012148887_100011216630 [1,1,0,0,0,0|2,0,0]=4 14105 B12R0.1 CCCC(C)COCCCCCI 7a_200012148887_100011216630 [1,1,0,0,0,0|2,0,0]=4 14106 B12R0.1 CCCC(C)COCCCCCN 34a_100000762737_100011216630 [1,1,0,0,0,0|2,0,0]=4 14107 B12R0.1 CCCC(C)COCCCCCO 34a_100000688023_100000746330 [1,1,0,0,0,0|1,0,0]=3 14108 B12R0.1 CCCC(C)COCCCCCO 7a_100000688023_100000746330 [1,1,0,0,0,0|1,0,0]=3 14109 B12R0.1 CCCC(C)COCCCCOC 34a_100000688023_100000755781 [1,1,0,0,0,0|2,0,0]=4 14110 B12R0.1 CCCC(C)COCCCCOC 34a_100000740925_100011216630 [1,1,0,0,0,0|2,0,0]=4 14111 B12R0.1 CCCC(C)COCCCCOC 7a_100000688023_100000730899 [1,1,0,0,0,0|2,0,0]=4 14112 B12R0.1 CCCC(C)COCCCCSC 34a_100011217163_100011216630 [1,1,0,0,0,0|2,0,0]=4 14113 B12R0.1 CCCC(C)COCCCCSC 7a_100011217163_100011216630 [1,1,0,0,0,0|2,0,0]=4 14114 B12R0.1 CCCC(C)COCCCOCC 34a_100000688023_100012232248 [1,1,0,0,0,0|2,0,0]=4 14115 B12R0.1 CCCC(C)COCCCOCC 34a_100000757476_100011216630 [1,1,0,0,0,0|2,0,0]=4 14116 B12R0.1 CCCC(C)COCCCOCC 7a_100000688023_100012232248 [1,1,0,0,0,0|2,0,0]=4 14117 B12R0.1 CCCC(C)COCCCOCC 7a_100000757476_100011216630 [1,1,0,0,0,0|2,0,0]=4 14118 B12R0.1 CCCC(C)COCCCSCC 34a_100011216438_100011216630 [1,1,0,0,0,0|2,0,0]=4 14119 B12R0.1 CCCC(C)COCCCSCC 7a_100011216438_100011216630 [1,1,0,0,0,0|2,0,0]=4 14120 B12R0.1 CCCC(C)COCCOCCO 34a_100000688023_100000692535 [1,1,0,0,0,0|2,0,0]=4 14121 B12R0.1 CCCC(C)COCCOCCO 7a_100000688023_100011215305 [1,1,0,0,0,0|2,0,0]=4 14122 B12R0.1 CCCC(C)CSCCCCCF 62a_100000729378_100011216630 [1,1,0,0,0,0|2,0,0]=4 14123 B12R0.1 CCCC(C)CSCCCCCF 62a_100011216630_100000729378 [1,1,0,0,0,0|2,0,0]=4 14124 B12R0.1 CCCC(C)CSCCCCCO 62a_100000746330_100011216630 [1,1,0,0,0,0|1,0,0]=3 14125 B12R0.1 CCCC(C)CSCCCCCO 62a_100011216630_100000746330 [1,1,0,0,0,0|1,0,0]=3 14126 B12R0.1 CCCC(C)CSCCCCOC 62a_100000730899_100011216630 [1,1,0,0,0,0|2,0,0]=4 14127 B12R0.1 CCCC(C)CSCCCCOC 62a_100011216630_100000730899 [1,1,0,0,0,0|2,0,0]=4 14128 B12R0.1 CCCC(C)CSCCCOCC 62a_100011216630_100012232248 [1,1,0,0,0,0|2,0,0]=4 14129 B12R0.1 CCCC(C)CSCCCOCC 62a_100012232248_100011216630 [1,1,0,0,0,0|2,0,0]=4 14130 B12R0.1 CCCC(C)CSCCOCCO 62a_100011215305_100011216630 [1,1,0,0,0,0|2,0,0]=4 14131 B12R0.1 CCCC(C)CSCCOCCO 62a_100011216630_100011215305 [1,1,0,0,0,0|2,0,0]=4 14132 B12R0.1 CCCC(C)NCCCCCCF 2230a_100000741246_100015922095 [1,1,0,0,0,0|2,0,0]=4 14133 B12R0.1 CCCC(C)NCCCCCCO 2230a_100000686447_100000766640 [1,1,0,0,0,0|1,0,0]=3 14134 B12R0.1 CCCC(C)NCCCCCCO 2230a_100000741246_100000766143 [1,1,0,0,0,0|1,0,0]=3 14135 B12R0.1 CCCC(C)NCCCCCCO 270004a_100000686447_100000211909 [1,1,0,0,0,0|1,0,0]=3 14136 B12R0.1 CCCC(C)NCCCCCCO 34a_100000686447_100000766640 [1,1,0,0,0,0|1,0,0]=3 14137 B12R0.1 CCCC(C)NCCCCCOC 2230a_100000747528_100000766640 [1,1,0,0,0,0|2,0,0]=4 14138 B12R0.1 CCCC(C)NCCCCCOC 270004a_100000747528_100000211909 [1,1,0,0,0,0|2,0,0]=4 14139 B12R0.1 CCCC(C)NCCCCCOC 34a_100000747528_100000766640 [1,1,0,0,0,0|2,0,0]=4 14140 B12R0.1 CCCC(C)OCCCCCCBr 34a_100011215345_100000766640 [1,1,0,0,0,0|2,0,0]=4 14141 B12R0.1 CCCC(C)OCCCCCCBr 7a_100011215345_100000766640 [1,1,0,0,0,0|2,0,0]=4 14142 B12R0.1 CCCC(C)OCCCCCCCl 34a_100000766143_100000766640 [1,1,0,0,0,0|2,0,0]=4 14143 B12R0.1 CCCC(C)OCCCCCCCl 7a_100000766143_100000766640 [1,1,0,0,0,0|2,0,0]=4 14144 B12R0.1 CCCC(C)OCCCCCCF 34a_100000732779_100000766640 [1,1,0,0,0,0|2,0,0]=4 14145 B12R0.1 CCCC(C)OCCCCCCF 34a_100000764384_100015922095 [1,1,0,0,0,0|2,0,0]=4 14146 B12R0.1 CCCC(C)OCCCCCCF 7a_100000732779_100000766640 [1,1,0,0,0,0|2,0,0]=4 14147 B12R0.1 CCCC(C)OCCCCCCF 7a_100000764384_100015922095 [1,1,0,0,0,0|2,0,0]=4 14148 B12R0.1 CCCC(C)OCCCCCCN 34a_100000686447_100000766640 [1,1,0,0,0,0|2,0,0]=4 14149 B12R0.1 CCCC(C)OCCCCCCO 34a_100000764384_100000766143 [1,1,0,0,0,0|1,0,0]=3 14150 B12R0.1 CCCC(C)OCCCCCCO 7a_100000764384_100000766143 [1,1,0,0,0,0|1,0,0]=3 14151 B12R0.1 CCCC(C)OCCCCCNC 34a_100000722520_100000766640 [1,1,0,0,0,0|2,0,0]=4 14152 B12R0.1 CCCC(C)SCCCCCCF 62a_100000766640_100015922095 [1,1,0,0,0,0|2,0,0]=4 14153 B12R0.1 CCCC(C)SCCCCCCF 62a_100015922095_100000766640 [1,1,0,0,0,0|2,0,0]=4 14154 B12R0.1 CCCC(C)SCCCCCCO 62a_100000766143_100000766640 [1,1,0,0,0,0|1,0,0]=3 14155 B12R0.1 CCCC(C)SCCCCCCO 62a_100000766640_100000766143 [1,1,0,0,0,0|1,0,0]=3 14156 B12R0.1 CCCCCCCCC(=O)CCC 1458a_100000210188_100000210303 [1,1,0,0,0,0|0,0,1]=3 14157 B12R0.1 CCCCCCCCC(=O)CCC 1458a_100000211992_100000210759 [1,1,0,0,0,0|0,0,1]=3 14158 B12R0.1 CCCCCCCCC(=O)CCF 1458a_100000210188_100011217306 [1,1,0,0,0,0|1,0,1]=4 14159 B12R0.1 CCCCCCCCC(=O)CCO 1458a_100000210188_100000211926 [1,1,0,0,0,0|0,0,1]=3 14160 B12R0.1 CCCCCCCCC(=O)CCO 1458a_100011216618_100000210759 [1,1,0,0,0,0|0,0,1]=3 14161 B12R0.1 CCCCCCCCC(=O)COC 1458a_100000210968_100000210759 [1,1,0,0,0,0|1,0,1]=4 14162 B12R0.1 CCCCCCCCC(=O)CSC 1458a_100000184570_100000210759 [1,1,0,0,0,0|1,0,1]=4 14163 B12R0.1 CCCCCCCCC(=O)NCC 11a_100015525214_100000210188 [1,1,0,0,0,0|1,0,1]=4 14164 B12R0.1 CCCCCCCCC(=O)NCC 240690a_100015525214_100000210188 [1,1,0,0,0,0|1,0,1]=4 14165 B12R0.1 CCCCCCCCC(=O)NCC 527a_100015525214_100000210188 [1,1,0,0,0,0|1,0,1]=4 14166 B12R0.1 CCCCCCCCC(C)CNC 270004a_106832991635_100011995885 [1,1,0,0,0,0|1,0,0]=3 14167 B12R0.1 CCCCCCCCC(C)COC 34a_200012125181_200000210301 [1,1,0,0,0,0|1,0,0]=3 14168 B12R0.1 CCCCCCCCC(C)COC 7a_200012125181_200000210301 [1,1,0,0,0,0|1,0,0]=3 14169 B12R0.1 CCCCCCCCC(C)CO[13CH3] 34a_200012125181_200025704644 [1,1,0,0,0,0|1,0,0]=3 14170 B12R0.1 CCCCCCCCC(C)CO[13CH3] 7a_200012125181_200025704644 [1,1,0,0,0,0|1,0,0]=3 14171 B12R0.1 CCCCCCCCC(C)NCC 270004a_100015525214_100011216694 [1,1,0,0,0,0|1,0,0]=3 14172 B12R0.1 CCCCCCCCC(C)OCC 34a_100000210740_100000210202 [1,1,0,0,0,0|1,0,0]=3 14173 B12R0.1 CCCCCCCCC(C)OCC 7a_100000210740_100000210202 [1,1,0,0,0,0|1,0,0]=3 14174 B12R0.1 CCCCCCCCC(C)OCF 34a_100000210740_100015361967 [1,1,0,0,0,0|2,0,0]=4 14175 B12R0.1 CCCCCCCCC(C)OCF 7a_100000210740_100015361967 [1,1,0,0,0,0|2,0,0]=4 14176 B12R0.1 CCCCCCCCN(C)CCC 2230a_100000207567_100000210303 [1,1,0,0,0,0|1,0,0]=3 14177 B12R0.1 CCCCCCCCN(C)CCC 2230a_100000747261_100000210759 [1,1,0,0,0,0|1,0,0]=3 14178 B12R0.1 CCCCCCCCN(C)CCC 269982a_100000207567_100000210303 [1,1,0,0,0,0|1,0,0]=3 14179 B12R0.1 CCCCCCCCN(C)CCC 269982a_100000747261_100000210759 [1,1,0,0,0,0|1,0,0]=3 14180 B12R0.1 CCCCCCCCN(C)CCF 2230a_100000207567_100011217306 [1,1,0,0,0,0|2,0,0]=4 14181 B12R0.1 CCCCCCCCN(C)CCF 269982a_100000207567_100011217306 [1,1,0,0,0,0|2,0,0]=4 14182 B12R0.1 CCCCCCCCN(C)CCO 2230a_100000207567_100000211926 [1,1,0,0,0,0|1,0,0]=3 14183 B12R0.1 CCCCCCCCN(C)CCO 2230a_100000210263_100000210759 [1,1,0,0,0,0|1,0,0]=3 14184 B12R0.1 CCCCCCCCN(C)CCO 269982a_100000207567_100000211926 [1,1,0,0,0,0|1,0,0]=3 14185 B12R0.1 CCCCCCCCN(C)CCO 269982a_100000210263_100000210759 [1,1,0,0,0,0|1,0,0]=3 14186 B12R0.1 CCCCCCCCN(C)COC 2230a_100000207567_100000766300 [1,1,0,0,0,0|2,0,0]=4 14187 B12R0.1 CCCCCCCCN(C)COC 269982a_100000207567_100000766300 [1,1,0,0,0,0|2,0,0]=4 14188 B12R0.1 CCCCCCCCN(C)CSC 2230a_100000207567_100011218213 [1,1,0,0,0,0|2,0,0]=4 14189 B12R0.1 CCCCCCCCN(C)CSC 269982a_100000207567_100011218213 [1,1,0,0,0,0|2,0,0]=4 14190 B12R0.1 CCCCCCCNC(=O)CCC 11a_100000229938_100000211992 [1,1,0,0,0,0|1,0,1]=4 14191 B12R0.1 CCCCCCCNC(=O)CCC 1626a_100000229938_100000211992 [1,1,0,0,0,0|1,0,1]=4 14192 B12R0.1 CCCCCCCNC(=O)CCC 240690a_100000229938_100000211992 [1,1,0,0,0,0|1,0,1]=4 14193 B12R0.1 CCCCCCCNC(=O)CCC 527a_100000229938_100000211992 [1,1,0,0,0,0|1,0,1]=4 14194 B12R0.1 CCCCCCCNC(=O)CCO 240690a_100000229938_100011216618 [1,1,0,0,0,0|1,0,1]=4 14195 B12R0.1 CCCCCCCNC(C)CCC 2230a_100000229938_100000766640 [1,1,0,0,0,0|1,0,0]=3 14196 B12R0.1 CCCCCCCNC(C)CCC 2230a_100000741246_100000210681 [1,1,0,0,0,0|1,0,0]=3 14197 B12R0.1 CCCCCCCNC(C)CCC 270004a_100000229938_100000211909 [1,1,0,0,0,0|1,0,0]=3 14198 B12R0.1 CCCCCCCNC(C)CCO 2230a_100000229938_100009893172 [1,1,0,0,0,0|1,0,0]=3 14199 B12R0.1 CCCCCCCNC(C)COC 2230a_100000229938_100000765312 [1,1,0,0,0,0|2,0,0]=4 14200 B12R0.1 CCCCCCCNC(C)COC 270004a_100000229938_100000749346 [1,1,0,0,0,0|2,0,0]=4 14201 B12R0.1 CCCCCCCNC(C)CSC 270004a_100000229938_100011216314 [1,1,0,0,0,0|2,0,0]=4 14202 B12R0.1 CCCCCCCN[C@H](C)CCO 2230a_100000706166_100000210681 [1,1,0,0,0,0|1,0,0]=3 14203 B12R0.1 CCCCCCCN[C@H](C)CCO 34a_100000706166_100000210614 [1,1,0,0,0,0|1,0,0]=3 14204 B12R0.1 CCCCCCCN[C@H](C)COC 2230a_100000764878_100000210681 [1,1,0,0,0,0|2,0,0]=4 14205 B12R0.1 CCCCCCCOC(C)CCBr 34a_100012276601_100000210614 [1,1,0,0,0,0|2,0,0]=4 14206 B12R0.1 CCCCCCCOC(C)CCC 34a_100000210272_100000766640 [1,1,0,0,0,0|1,0,0]=3 14207 B12R0.1 CCCCCCCOC(C)CCC 34a_100000764384_100000210614 [1,1,0,0,0,0|1,0,0]=3 14208 B12R0.1 CCCCCCCOC(C)CCC 7a_100000210272_100000766640 [1,1,0,0,0,0|1,0,0]=3 14209 B12R0.1 CCCCCCCOC(C)CCC 7a_100000764384_100000210614 [1,1,0,0,0,0|1,0,0]=3 14210 B12R0.1 CCCCCCCOC(C)CCO 34a_100000210272_100009893172 [1,1,0,0,0,0|1,0,0]=3 14211 B12R0.1 CCCCCCCOC(C)CCO 7a_100000210272_100009893172 [1,1,0,0,0,0|1,0,0]=3 14212 B12R0.1 CCCCCCCOC(C)COC 34a_100000210272_100000765312 [1,1,0,0,0,0|2,0,0]=4 14213 B12R0.1 CCCCCCCOC(C)COC 7a_100000210272_100000765312 [1,1,0,0,0,0|2,0,0]=4 14214 B12R0.1 CCCCCCCO[C@H](C)COC 34a_100011934205_100000210614 [1,1,0,0,0,0|2,0,0]=4 14215 B12R0.1 CCCCCCCSC(C)CCC 62a_100000210614_100000766640 [1,1,0,0,0,0|1,0,0]=3 14216 B12R0.1 CCCCCCCSC(C)CCC 62a_100000766640_100000210316 [1,1,0,0,0,0|1,0,0]=3 14217 B12R0.1 CCCCCCCSC(C)CCO 62a_100000210614_100009893172 [1,1,0,0,0,0|1,0,0]=3 14218 B12R0.1 CCCCCCCSC(C)CCO 62a_100009893172_100000210316 [1,1,0,0,0,0|1,0,0]=3 14219 B12R0.1 CCCCCCCSC(C)COC 62a_100000210614_100000765312 [1,1,0,0,0,0|2,0,0]=4 14220 B12R0.1 CCCCCCCSC(C)COC 62a_100000765312_100000210316 [1,1,0,0,0,0|2,0,0]=4 14221 B12R0.1 CCCCCCNCC(=O)CCC 2230a_100000210581_100000747444 [1,1,0,0,0,0|1,0,1]=4 14222 B12R0.1 CCCCCCNCC(C)CCC 2230a_100000210581_100011216630 [1,1,0,0,0,0|1,0,0]=3 14223 B12R0.1 CCCCCCNCC(C)CCC 270004a_100000210581_100000243154 [1,1,0,0,0,0|1,0,0]=3 14224 B12R0.1 CCCCCCNCC(O)COC 2230a_100000756049_100000210314 [1,1,0,0,0,0|2,0,0]=4 14225 B12R0.1 CCCCCCNCC(O)COC 34a_100000756049_100000210314 [1,1,0,0,0,0|2,0,0]=4 14226 B12R0.1 CCCCCCOCC(=O)CCC 7a_100000210259_100000747444 [1,1,0,0,0,0|1,0,1]=4 14227 B12R0.1 CCCCCCOCC(C)CCC 34a_100000210259_100011216630 [1,1,0,0,0,0|1,0,0]=3 14228 B12R0.1 CCCCCCOCC(C)CCC 34a_100000688023_100000210314 [1,1,0,0,0,0|1,0,0]=3 14229 B12R0.1 CCCCCCOCC(C)CCC 7a_100000210259_100011216630 [1,1,0,0,0,0|1,0,0]=3 14230 B12R0.1 CCCCCCOCC(C)CCC 7a_100000688023_100000210314 [1,1,0,0,0,0|1,0,0]=3 14231 B12R0.1 CCCCCCOCC(C)CCN 34a_106354213184_100000210314 [1,1,0,0,0,0|2,0,0]=4 14232 B12R0.1 CCCCCCOCC(N)COC 34a_100000724102_100000210314 [1,1,0,0,0,0|2,0,0]=4 14233 B12R0.1 CCCCCCOCC(O)COC 34a_100000210259_100011215053 [1,1,0,0,0,0|2,0,0]=4 14234 B12R0.1 CCCCCCOCC(O)COC 7a_100000210259_100011215053 [1,1,0,0,0,0|2,0,0]=4 14235 B12R0.1 CCCCCCOC[C@@H](N)CCC 34a_100000732646_100000210314 [1,1,0,0,0,0|1,0,0]=3 14236 B12R0.1 CCCCCCSCC(=O)CCC 62a_100000210314_100000747444 [1,1,0,0,0,0|1,0,1]=4 14237 B12R0.1 CCCCCCSCC(=O)CCC 62a_100000747444_100000210757 [1,1,0,0,0,0|1,0,1]=4 14238 B12R0.1 CCCCCCSCC(C)CCC 62a_100000210314_100011216630 [1,1,0,0,0,0|1,0,0]=3 14239 B12R0.1 CCCCCCSCC(C)CCC 62a_100011216630_100000210757 [1,1,0,0,0,0|1,0,0]=3 14240 B12R0.1 CCCCCCSCC(O)COC 62a_100000210314_100011215053 [1,1,0,0,0,0|2,0,0]=4 14241 B12R0.1 CCCCCCSCC(O)COC 62a_100011215053_100000210757 [1,1,0,0,0,0|2,0,0]=4 14242 B12R0.1 CCCCCOCCC(C)CCC 34a_100011217855_100000718602 [1,1,0,0,0,0|1,0,0]=3 14243 B12R0.1 CCCCCOCCC(C)CCC 7a_100011217855_100000210326 [1,1,0,0,0,0|1,0,0]=3 14244 B12R0.1 CCCCCOCC[C@@H](N)CCC 34a_100015193777_100000718602 [1,1,0,0,0,0|1,0,0]=3 14245 B12R0.1 CCCCOCCCC(C)CCC 34a_100011713154_100000210210 [1,1,0,0,0,0|1,0,0]=3 14246 B12R0.1 CCCCOCCCC(C)CCC 7a_100011713154_100000210211 [1,1,0,0,0,0|1,0,0]=3 14247 B12R0.1 CCCCOCCNC(C)CCC 2230a_100000741246_100000743108 [1,1,0,0,0,0|2,0,0]=4 14248 B12R0.1 CCCCOCCN[C@H](C)CCO 2230a_100000706166_100000743108 [1,1,0,0,0,0|2,0,0]=4 14249 B12R0.1 CCCCOCCN[C@H](C)CCO 34a_100000706166_100000743108 [1,1,0,0,0,0|2,0,0]=4 14250 B12R0.1 CCCCOCCOC(C)CCC 34a_100000210238_100000766640 [1,1,0,0,0,0|2,0,0]=4 14251 B12R0.1 CCCCOCCOC(C)CCC 34a_100000764384_100000743108 [1,1,0,0,0,0|2,0,0]=4 14252 B12R0.1 CCCCOCCOC(C)CCC 7a_100000210238_100000766640 [1,1,0,0,0,0|2,0,0]=4 14253 B12R0.1 CCCCOCCOC(C)CCC 7a_100000764384_100000743108 [1,1,0,0,0,0|2,0,0]=4 14254 B12R0.1 CCCCOCCOC(C)CCO 34a_100000210238_100009893172 [1,1,0,0,0,0|2,0,0]=4 14255 B12R0.1 CCCCOCCOC(C)CCO 7a_100000210238_100009893172 [1,1,0,0,0,0|2,0,0]=4 14256 B12R0.1 CCCCOCCSC(C)CCC 62a_100000743108_100000766640 [1,1,0,0,0,0|2,0,0]=4 14257 B12R0.1 CCCCOCCSC(C)CCC 62a_100000766640_100000743108 [1,1,0,0,0,0|2,0,0]=4 14258 B12R0.1 CCCCOCCSC(C)CCO 62a_100000743108_100009893172 [1,1,0,0,0,0|2,0,0]=4 14259 B12R0.1 CCCCOCCSC(C)CCO 62a_100009893172_100000743108 [1,1,0,0,0,0|2,0,0]=4 14260 B12R0.1 CCCCOCOCC(C)CCC 34a_100000688023_100011995733 [1,1,0,0,0,0|2,0,0]=4 14261 B12R0.1 CCCCOCOC[C@@H](N)CCC 34a_100000732646_100011995733 [1,1,0,0,0,0|2,0,0]=4 14262 B12R0.1 CCCCOCSCC(C)CCC 62a_100011216630_100011995733 [1,1,0,0,0,0|2,0,0]=4 14263 B12R0.1 CCCCOCSCC(C)CCC 62a_100011995733_100011216630 [1,1,0,0,0,0|2,0,0]=4 14264 B12R0.1 CCCCSCCNC(C)CCC 2230a_100025743550_100000766640 [1,1,0,0,0,0|2,0,0]=4 14265 B12R0.1 CCCCSCCNC(C)CCC 270004a_100025743550_100000211909 [1,1,0,0,0,0|2,0,0]=4 14266 B12R0.1 CCCCSCCNC(C)CCO 2230a_100025743550_100009893172 [1,1,0,0,0,0|2,0,0]=4 14267 B12R0.1 CCCCSCCOC(C)CCC 34a_200000230436_100000766640 [1,1,0,0,0,0|2,0,0]=4 14268 B12R0.1 CCCCSCCOC(C)CCC 7a_200000230436_100000766640 [1,1,0,0,0,0|2,0,0]=4 14269 B12R0.1 CCCCSCCOC(C)CCO 34a_200000230436_100009893172 [1,1,0,0,0,0|2,0,0]=4 14270 B12R0.1 CCCCSCCOC(C)CCO 7a_200000230436_100009893172 [1,1,0,0,0,0|2,0,0]=4 14271 B12R0.1 CCCN(C)CCCCCCCO 2230a_100000747261_100000760002 [1,1,0,0,0,0|1,0,0]=3 14272 B12R0.1 CCCN(C)CCCCCCCO 269982a_100000747261_100000760002 [1,1,0,0,0,0|1,0,0]=3 14273 B12R0.1 CCCN(C)CCCCCCOC 2230a_100000747261_100011998445 [1,1,0,0,0,0|2,0,0]=4 14274 B12R0.1 CCCN(C)CCCCCCOC 269982a_100000747261_100011998445 [1,1,0,0,0,0|2,0,0]=4 14275 B12R0.1 CCCOCCCNC(C)CCC 2230a_100011217757_100000766640 [1,1,0,0,0,0|2,0,0]=4 14276 B12R0.1 CCCOCCCNC(C)CCC 270004a_100011217757_100000211909 [1,1,0,0,0,0|2,0,0]=4 14277 B12R0.1 CCCOCCCNC(C)CCC 34a_100011217757_100000766640 [1,1,0,0,0,0|2,0,0]=4 14278 B12R0.1 CCCOCCCNC(C)CCO 2230a_100011217757_100009893172 [1,1,0,0,0,0|2,0,0]=4 14279 B12R0.1 CCCOCCCNC(C)CCO 34a_100011217757_100009893172 [1,1,0,0,0,0|2,0,0]=4 14280 B12R0.1 CCCOCCNCC(C)CCC 2230a_100161115042_100011216630 [1,1,0,0,0,0|2,0,0]=4 14281 B12R0.1 CCCOCCNCC(C)CCC 270004a_100161115042_100000243154 [1,1,0,0,0,0|2,0,0]=4 14282 B12R0.1 CCCOCCNCC(C)CCC 34a_100161115042_100011216630 [1,1,0,0,0,0|2,0,0]=4 14283 B12R0.1 CCCOCCOCC(C)CCC 34a_100000688023_100011215938 [1,1,0,0,0,0|2,0,0]=4 14284 B12R0.1 CCCOCCOCC(C)CCC 34a_100000752267_100011216630 [1,1,0,0,0,0|2,0,0]=4 14285 B12R0.1 CCCOCCOCC(C)CCC 7a_100000688023_100011215938 [1,1,0,0,0,0|2,0,0]=4 14286 B12R0.1 CCCOCCOCC(C)CCC 7a_100000752267_100011216630 [1,1,0,0,0,0|2,0,0]=4 14287 B12R0.1 CCCOCCOC[C@@H](N)CCC 34a_100000732646_100011215938 [1,1,0,0,0,0|2,0,0]=4 14288 B12R0.1 CCCOCCSCC(C)CCC 62a_100011215938_100011216630 [1,1,0,0,0,0|2,0,0]=4 14289 B12R0.1 CCCOCCSCC(C)CCC 62a_100011216630_100011215938 [1,1,0,0,0,0|2,0,0]=4 14290 B12R0.1 CCCSCCNCC(C)CCC 2230a_100020603323_100011216630 [1,1,0,0,0,0|2,0,0]=4 14291 B12R0.1 CCCSCCNCC(C)CCC 270004a_100020603323_100000243154 [1,1,0,0,0,0|2,0,0]=4 14292 B12R0.1 CCCSCCOCC(C)CCC 34a_200000230433_100011216630 [1,1,0,0,0,0|2,0,0]=4 14293 B12R0.1 CCCSCCOCC(C)CCC 7a_200000230433_100011216630 [1,1,0,0,0,0|2,0,0]=4 14294 B12R0.1 CCC[C@H](N)CCOCCCCF 34a_100015193777_100000729493 [1,1,0,0,0,0|2,0,0]=4 14295 B12R0.1 CCC[C@H](N)CCOCCCCO 34a_100015193777_100011216708 [1,1,0,0,0,0|1,0,0]=3 14296 B12R0.1 CCC[C@H](N)CCOCCCOC 34a_100015193777_100000740836 [1,1,0,0,0,0|2,0,0]=4 14297 B12R0.1 CCC[C@H](N)CCOCCOCC 34a_100015193777_100000210147 [1,1,0,0,0,0|2,0,0]=4 14298 B12R0.1 CCC[C@H](N)CCOCCSCC 34a_100015193777_100000757381 [1,1,0,0,0,0|2,0,0]=4 14299 B12R0.1 CCC[C@H](N)COCCCCCF 34a_100000732646_100000729378 [1,1,0,0,0,0|2,0,0]=4 14300 B12R0.1 CCC[C@H](N)COCCCCCO 34a_100000732646_100000746330 [1,1,0,0,0,0|1,0,0]=3 14301 B12R0.1 CCC[C@H](N)COCCCCOC 34a_100000732646_100000755781 [1,1,0,0,0,0|2,0,0]=4 14302 B12R0.1 CCC[C@H](N)COCCCOCC 34a_100000732646_100012232248 [1,1,0,0,0,0|2,0,0]=4 14303 B12R0.1 CCC[C@H](N)COCCOCCO 34a_100000732646_100000692535 [1,1,0,0,0,0|2,0,0]=4 14304 B12R0.1 CCNC(=O)CCCCCCCO 240690a_100015525214_100011219782 [1,1,0,0,0,0|1,0,1]=4 14305 B12R0.1 CN(CCO)CCCCCCCO 2230a_100000210263_100000760002 [1,1,0,0,0,0|2,0,0]=4 14306 B12R0.1 CN(CCO)CCCCCCCO 269982a_100000210263_100000760002 [1,1,0,0,0,0|2,0,0]=4 14307 B12R0.1 CNCCCCCOC(C)CCO 34a_100000722520_100009893172 [1,1,0,0,0,0|2,0,0]=4 14308 B12R0.1 COCC(=O)CCCCCCCO 1458a_100000210968_100000760002 [1,1,0,0,0,0|1,0,1]=4 14309 B12R0.1 COCC(C)NCCCCCCO 2230a_100000686447_100000765312 [1,1,0,0,0,0|2,0,0]=4 14310 B12R0.1 COCC(C)NCCCCCCO 270004a_100000686447_100000749346 [1,1,0,0,0,0|2,0,0]=4 14311 B12R0.1 COCC(C)NCCCCCCO 34a_100000686447_100000765312 [1,1,0,0,0,0|2,0,0]=4 14312 B12R0.1 COCC(C)SCCCCCCO 62a_100000765312_100000766143 [1,1,0,0,0,0|2,0,0]=4 14313 B12R0.1 COCC(C)SCCCCCCO 62a_100000766143_100000765312 [1,1,0,0,0,0|2,0,0]=4 14314 B12R0.1 COCC(N)COCCCCCO 34a_100000724102_100000746330 [1,1,0,0,0,0|2,0,0]=4 14315 B12R0.1 COCC(O)CNCCCCCO 2230a_100000756049_100000746330 [1,1,0,0,0,0|2,0,0]=4 14316 B12R0.1 COCC(O)CNCCCCCO 34a_100000756049_100000746330 [1,1,0,0,0,0|2,0,0]=4 14317 B12R0.1 COCC(O)CNCCCCCO 34a_100000762737_100011215053 [1,1,0,0,0,0|2,0,0]=4 14318 B12R0.1 COCC(O)CSCCCCCO 62a_100000746330_100011215053 [1,1,0,0,0,0|2,0,0]=4 14319 B12R0.1 COCC(O)CSCCCCCO 62a_100011215053_100000746330 [1,1,0,0,0,0|2,0,0]=4 14320 B12R0.1 COCCCCCCC(=O)CCO 1458a_100011216618_100011998445 [1,1,0,0,0,0|1,0,1]=4 14321 B12R0.1 COCCCCCCN(C)CCO 2230a_100000210263_100011998445 [1,1,0,0,0,0|2,0,0]=4 14322 B12R0.1 COCCCCCCN(C)CCO 269982a_100000210263_100011998445 [1,1,0,0,0,0|2,0,0]=4 14323 B12R0.1 COCCCCCNC(C)CCO 2230a_100000747528_100009893172 [1,1,0,0,0,0|2,0,0]=4 14324 B12R0.1 COCCCCCNC(C)CCO 34a_100000747528_100009893172 [1,1,0,0,0,0|2,0,0]=4 14325 B12R0.1 COC[C@@H](C)NCCCCCCO 2230a_100000764878_100000766143 [1,1,0,0,0,0|2,0,0]=4 14326 B12R0.1 COC[C@@H](C)OCCCCCCO 34a_100011934205_100000766143 [1,1,0,0,0,0|2,0,0]=4 14327 B12R0.1 CSCC(=O)CCCCCCCO 1458a_100000184570_100000760002 [1,1,0,0,0,0|1,0,1]=4 14328 B12R0.1 CSCC(C)NCCCCCCO 270004a_100000686447_100011216314 [1,1,0,0,0,0|2,0,0]=4 14329 B12R0.1 C[C@H](CCO)NCCCCCCF 2230a_100000706166_100015922095 [1,1,0,0,0,0|2,0,0]=4 14330 B12R0.1 C[C@H](CCO)NCCCCCCF 34a_100000706166_100015922095 [1,1,0,0,0,0|2,0,0]=4 14331 B12R0.1 C[C@H](CCO)NCCCCCCO 2230a_100000706166_100000766143 [1,1,0,0,0,0|2,0,0]=4 14332 B12R0.1 C[C@H](CCO)NCCCCCCO 34a_100000706166_100000766143 [1,1,0,0,0,0|2,0,0]=4 14333 B12R0.1 O=C(CCF)CCCCCCCO 1458a_100011219782_100011217306 [1,1,0,0,0,0|1,0,1]=4 14334 B12R0.1 O=C(CCO)CCCCCCCO 1458a_100011216618_100000760002 [1,1,0,0,0,0|1,0,1]=4 14335 B12R0.1 O=C(CCO)CCCCCCCO 1458a_100011219782_100000211926 [1,1,0,0,0,0|1,0,1]=4 14336 B12R0.47 CCCCCC(=O)CCCCCF 1458a_100000212188_100000729378 [1,1,0,0,0,0|1,0,1]=4 14337 B12R0.47 CCCCCC(=O)CCCCCO 1458a_100000212188_100000746330 [1,1,0,0,0,0|0,0,1]=3 14338 B12R0.47 CCCCCC(=O)CCCCCO 1458a_100102619762_100000210326 [1,1,0,0,0,0|0,0,1]=3 14339 B12R0.47 CCCCCC(=O)CCCCOC 1458a_100000212188_100000755781 [1,1,0,0,0,0|1,0,1]=4 14340 B12R0.47 CCCCCC(=O)CCCOCC 1458a_100000212188_100012232248 [1,1,0,0,0,0|1,0,1]=4 14341 B12R0.47 CCCCCC(=O)CCOCCC 1458a_100000212188_100011215938 [1,1,0,0,0,0|1,0,1]=4 14342 B12R0.47 CCCCCC(=O)CCOCCO 1458a_100000212188_100011215305 [1,1,0,0,0,0|1,0,1]=4 14343 B12R0.47 CCCCCC(=O)CCOCCO 1458a_100011229844_100000210326 [1,1,0,0,0,0|1,0,1]=4 14344 B12R0.47 CCCCCC(=O)CNCCCC 2230a_100000102301_200012276598 [1,1,0,0,0,0|1,0,1]=4 14345 B12R0.47 CCCCCC(=O)CNCCCC 7a_106832991798_200012276598 [1,1,0,0,0,0|1,0,1]=4 14346 B12R0.47 CCCCCC(=O)COCCCC 1458a_100000212188_100011995733 [1,1,0,0,0,0|1,0,1]=4 14347 B12R0.47 CCCCCC(=O)COCCCC 1458a_100000757543_100000210326 [1,1,0,0,0,0|1,0,1]=4 14348 B12R0.47 CCCCCC(=O)COCCCC 34a_100000210227_200012276598 [1,1,0,0,0,0|1,0,1]=4 14349 B12R0.47 CCCCCC(=O)COCCCC 7a_100000210227_200012276598 [1,1,0,0,0,0|1,0,1]=4 14350 B12R0.47 CCCCCC(=O)CSCCCC 1458a_100000191162_100000210326 [1,1,0,0,0,0|1,0,1]=4 14351 B12R0.47 CCCCCC(=O)CSCCCC 62a_100000210211_200012276598 [1,1,0,0,0,0|1,0,1]=4 14352 B12R0.47 CCCCCC(=O)CSCCCC 62a_200012276598_100000210210 [1,1,0,0,0,0|1,0,1]=4 14353 B12R0.47 CCCCCC(=O)CSCCCO 62a_100011215043_200012276598 [1,1,0,0,0,0|1,0,1]=4 14354 B12R0.47 CCCCCC(=O)CSCCCO 62a_200012276598_100011215043 [1,1,0,0,0,0|1,0,1]=4 14355 B12R0.47 CCCCCC(=O)NCCCCO 240690a_100000750430_100000212188 [1,1,0,0,0,0|1,0,1]=4 14356 B12R0.47 CCCCCC(=O)NCCCCO 527a_100000750430_100000212188 [1,1,0,0,0,0|1,0,1]=4 14357 B12R0.47 CCCCCC(C)NCCCCF 2230a_100000211957_100000729493 [1,1,0,0,0,0|2,0,0]=4 14358 B12R0.47 CCCCCC(C)NCCCCO 2230a_100000211957_100000210776 [1,1,0,0,0,0|1,0,0]=3 14359 B12R0.47 CCCCCC(C)NCCCCO 2230a_100000750430_200011218191 [1,1,0,0,0,0|1,0,0]=3 14360 B12R0.47 CCCCCC(C)NCCCCO 270004a_100000750430_100000211708 [1,1,0,0,0,0|1,0,0]=3 14361 B12R0.47 CCCCCC(C)NCCCCO 34a_100000750430_200011218191 [1,1,0,0,0,0|1,0,0]=3 14362 B12R0.47 CCCCCC(C)NCCCOC 2230a_100000211957_100000740836 [1,1,0,0,0,0|2,0,0]=4 14363 B12R0.47 CCCCCC(C)NCCCOC 270004a_100150723488_100000211708 [1,1,0,0,0,0|2,0,0]=4 14364 B12R0.47 CCCCCC(C)NCCCOC 34a_100150723488_200011218191 [1,1,0,0,0,0|2,0,0]=4 14365 B12R0.47 CCCCCC(C)NCCCSC 2230a_100000749238_200011218191 [1,1,0,0,0,0|2,0,0]=4 14366 B12R0.47 CCCCCC(C)NCCCSC 270004a_100000749238_100000211708 [1,1,0,0,0,0|2,0,0]=4 14367 B12R0.47 CCCCCC(C)NCCOCC 2230a_100000211957_100011215890 [1,1,0,0,0,0|2,0,0]=4 14368 B12R0.47 CCCCCC(C)NCCOCC 2230a_102516460346_200011218191 [1,1,0,0,0,0|2,0,0]=4 14369 B12R0.47 CCCCCC(C)NCCOCC 270004a_102516460346_100000211708 [1,1,0,0,0,0|2,0,0]=4 14370 B12R0.47 CCCCCC(C)NCCOCC 34a_102516460346_200011218191 [1,1,0,0,0,0|2,0,0]=4 14371 B12R0.47 CCCCCC(C)NCCSCC 2230a_100000106463_200011218191 [1,1,0,0,0,0|2,0,0]=4 14372 B12R0.47 CCCCCC(C)NCCSCC 2230a_100000211957_100000757381 [1,1,0,0,0,0|2,0,0]=4 14373 B12R0.47 CCCCCC(C)NCCSCC 270004a_100000106463_100000211708 [1,1,0,0,0,0|2,0,0]=4 14374 B12R0.47 CCCCCC(C)OCCCCBr 34a_100011216708_200011218191 [1,1,0,0,0,0|2,0,0]=4 14375 B12R0.47 CCCCCC(C)OCCCCCl 34a_100000210776_200011218191 [1,1,0,0,0,0|2,0,0]=4 14376 B12R0.47 CCCCCC(C)OCCCCCl 7a_100000210776_200011218191 [1,1,0,0,0,0|2,0,0]=4 14377 B12R0.47 CCCCCC(C)OCCCCF 34a_100011215632_100000729493 [1,1,0,0,0,0|2,0,0]=4 14378 B12R0.47 CCCCCC(C)OCCCCF 34a_100011995726_200011218191 [1,1,0,0,0,0|2,0,0]=4 14379 B12R0.47 CCCCCC(C)OCCCCF 7a_100011215632_100000729493 [1,1,0,0,0,0|2,0,0]=4 14380 B12R0.47 CCCCCC(C)OCCCCF 7a_100011995726_200011218191 [1,1,0,0,0,0|2,0,0]=4 14381 B12R0.47 CCCCCC(C)OCCCCI 34a_200012148704_200011218191 [1,1,0,0,0,0|2,0,0]=4 14382 B12R0.47 CCCCCC(C)OCCCCN 34a_100000750430_200011218191 [1,1,0,0,0,0|2,0,0]=4 14383 B12R0.47 CCCCCC(C)OCCCCO 34a_100011215632_100011216708 [1,1,0,0,0,0|1,0,0]=3 14384 B12R0.47 CCCCCC(C)OCCCCO 7a_100011215632_100000210776 [1,1,0,0,0,0|1,0,0]=3 14385 B12R0.47 CCCCCC(C)OCCCNC 34a_100000213112_200011218191 [1,1,0,0,0,0|2,0,0]=4 14386 B12R0.47 CCCCCC(C)OCCCOC 34a_100000740835_200011218191 [1,1,0,0,0,0|2,0,0]=4 14387 B12R0.47 CCCCCC(C)OCCCOC 34a_100011215632_100000740836 [1,1,0,0,0,0|2,0,0]=4 14388 B12R0.47 CCCCCC(C)OCCCOC 7a_100011215632_100000740836 [1,1,0,0,0,0|2,0,0]=4 14389 B12R0.47 CCCCCC(C)OCCCSC 34a_100000690336_200011218191 [1,1,0,0,0,0|2,0,0]=4 14390 B12R0.47 CCCCCC(C)OCCCSC 7a_100000690336_200011218191 [1,1,0,0,0,0|2,0,0]=4 14391 B12R0.47 CCCCCC(C)OCCOCC 34a_100000210136_200011218191 [1,1,0,0,0,0|2,0,0]=4 14392 B12R0.47 CCCCCC(C)OCCOCC 34a_100011215632_100000210147 [1,1,0,0,0,0|2,0,0]=4 14393 B12R0.47 CCCCCC(C)OCCOCC 7a_100000210136_200011218191 [1,1,0,0,0,0|2,0,0]=4 14394 B12R0.47 CCCCCC(C)OCCOCC 7a_100011215632_100011215890 [1,1,0,0,0,0|2,0,0]=4 14395 B12R0.47 CCCCCC(C)OCCSCC 34a_100000212035_200011218191 [1,1,0,0,0,0|2,0,0]=4 14396 B12R0.47 CCCCCC(C)OCCSCC 34a_100011215632_100000757381 [1,1,0,0,0,0|2,0,0]=4 14397 B12R0.47 CCCCCC(C)OCCSCC 7a_100000212035_200011218191 [1,1,0,0,0,0|2,0,0]=4 14398 B12R0.47 CCCCCC(C)OCCSCC 7a_100011215632_100000757381 [1,1,0,0,0,0|2,0,0]=4 14399 B12R0.47 CCCCCC(C)SCCCCF 62a_100000729493_200011218191 [1,1,0,0,0,0|2,0,0]=4 14400 B12R0.47 CCCCCC(C)SCCCCF 62a_200011218191_100000729493 [1,1,0,0,0,0|2,0,0]=4 14401 B12R0.47 CCCCCC(C)SCCCCO 62a_100000210776_200011218191 [1,1,0,0,0,0|1,0,0]=3 14402 B12R0.47 CCCCCC(C)SCCCCO 62a_200011218191_100000210776 [1,1,0,0,0,0|1,0,0]=3 14403 B12R0.47 CCCCCC(C)SCCCOC 62a_100000709357_200011218191 [1,1,0,0,0,0|2,0,0]=4 14404 B12R0.47 CCCCCC(C)SCCCOC 62a_200011218191_100000709357 [1,1,0,0,0,0|2,0,0]=4 14405 B12R0.47 CCCCCC(C)SCCOCC 62a_100000210147_200011218191 [1,1,0,0,0,0|2,0,0]=4 14406 B12R0.47 CCCCCC(C)SCCOCC 62a_200011218191_100011215890 [1,1,0,0,0,0|2,0,0]=4 14407 B12R0.47 CCCCCC(C)SCCSCC 62a_100000757381_200011218191 [1,1,0,0,0,0|2,0,0]=4 14408 B12R0.47 CCCCCC(C)SCCSCC 62a_200011218191_100000757381 [1,1,0,0,0,0|2,0,0]=4 14409 B12R0.47 CCCCCCC(=O)CCCCC 1458a_100000212188_100000210757 [1,1,0,0,0,0|0,0,1]=3 14410 B12R0.47 CCCCCCC(=O)CCCCC 1458a_100102632555_100000210326 [1,1,0,0,0,0|0,0,1]=3 14411 B12R0.47 CCCCCCC(=O)CCCCF 1458a_100102632555_100000729493 [1,1,0,0,0,0|1,0,1]=4 14412 B12R0.47 CCCCCCC(=O)CCCCO 1458a_100000695505_100000210757 [1,1,0,0,0,0|0,0,1]=3 14413 B12R0.47 CCCCCCC(=O)CCCCO 1458a_100102632555_100000210776 [1,1,0,0,0,0|0,0,1]=3 14414 B12R0.47 CCCCCCC(=O)CCCOC 1458a_100000741012_100000210757 [1,1,0,0,0,0|1,0,1]=4 14415 B12R0.47 CCCCCCC(=O)CCCOC 1458a_100102632555_100000740836 [1,1,0,0,0,0|1,0,1]=4 14416 B12R0.47 CCCCCCC(=O)CCCSC 1458a_100000173376_100000210757 [1,1,0,0,0,0|1,0,1]=4 14417 B12R0.47 CCCCCCC(=O)CCOCC 1458a_100000749530_100000210757 [1,1,0,0,0,0|1,0,1]=4 14418 B12R0.47 CCCCCCC(=O)CCOCC 1458a_100102632555_100011215890 [1,1,0,0,0,0|1,0,1]=4 14419 B12R0.47 CCCCCCC(=O)CCSCC 1458a_100000230768_100000210757 [1,1,0,0,0,0|1,0,1]=4 14420 B12R0.47 CCCCCCC(=O)CCSCC 1458a_100102632555_100000757381 [1,1,0,0,0,0|1,0,1]=4 14421 B12R0.47 CCCCCCC(=O)COCCC 1458a_100000745993_100000210757 [1,1,0,0,0,0|1,0,1]=4 14422 B12R0.47 CCCCCCC(=O)COCCO 1458a_100000708028_100000210757 [1,1,0,0,0,0|1,0,1]=4 14423 B12R0.47 CCCCCCC(=O)CSCCC 1458a_100000217233_100000210757 [1,1,0,0,0,0|1,0,1]=4 14424 B12R0.47 CCCCCCC(=O)NCCCC 11a_100000102301_100102632555 [1,1,0,0,0,0|1,0,1]=4 14425 B12R0.47 CCCCCCC(=O)NCCCC 1626a_100000102301_100102632555 [1,1,0,0,0,0|1,0,1]=4 14426 B12R0.47 CCCCCCC(=O)NCCCC 240690a_100000102301_100102632555 [1,1,0,0,0,0|1,0,1]=4 14427 B12R0.47 CCCCCCC(=O)NCCCC 527a_100000102301_100102632555 [1,1,0,0,0,0|1,0,1]=4 14428 B12R0.47 CCCCCCC(=O)NCCCO 240690a_100000182051_100102632555 [1,1,0,0,0,0|1,0,1]=4 14429 B12R0.47 CCCCCCC(=O)NCCCO 527a_100000182051_100102632555 [1,1,0,0,0,0|1,0,1]=4 14430 B12R0.47 CCCCCCC(C)CCOCC 34a_200011024964_100000210202 [1,1,0,0,0,0|1,0,0]=3 14431 B12R0.47 CCCCCCC(C)CCOCC 7a_200011024964_100000210202 [1,1,0,0,0,0|1,0,0]=3 14432 B12R0.47 CCCCCCC(C)CCOCF 34a_200011024964_100015361967 [1,1,0,0,0,0|2,0,0]=4 14433 B12R0.47 CCCCCCC(C)CCOCF 7a_200011024964_100015361967 [1,1,0,0,0,0|2,0,0]=4 14434 B12R0.47 CCCCCCC(C)NCCCC 2230a_100000102301_100011215978 [1,1,0,0,0,0|1,0,0]=3 14435 B12R0.47 CCCCCCC(C)NCCCC 2230a_100000210919_100000210211 [1,1,0,0,0,0|1,0,0]=3 14436 B12R0.47 CCCCCCC(C)NCCCC 270004a_100000102301_100000210826 [1,1,0,0,0,0|1,0,0]=3 14437 B12R0.47 CCCCCCC(C)NCCCC 34a_100000210919_100000210210 [1,1,0,0,0,0|1,0,0]=3 14438 B12R0.47 CCCCCCC(C)NCCCC 7a_106832991798_100011215978 [1,1,0,0,0,0|1,0,0]=3 14439 B12R0.47 CCCCCCC(C)NCCCF 2230a_100000210919_100011934791 [1,1,0,0,0,0|2,0,0]=4 14440 B12R0.47 CCCCCCC(C)NCCCF 2230a_100015189416_100011215978 [1,1,0,0,0,0|2,0,0]=4 14441 B12R0.47 CCCCCCC(C)NCCCF 270004a_100015189416_100000210826 [1,1,0,0,0,0|2,0,0]=4 14442 B12R0.47 CCCCCCC(C)NCCCF 34a_100000210919_100011934791 [1,1,0,0,0,0|2,0,0]=4 14443 B12R0.47 CCCCCCC(C)NCCCF 34a_100015189416_100011215978 [1,1,0,0,0,0|2,0,0]=4 14444 B12R0.47 CCCCCCC(C)NCCCO 2230a_100000210919_100000230001 [1,1,0,0,0,0|1,0,0]=3 14445 B12R0.47 CCCCCCC(C)NCCCO 270004a_100000182051_100000210826 [1,1,0,0,0,0|1,0,0]=3 14446 B12R0.47 CCCCCCC(C)NCCCO 34a_100000210919_100000230001 [1,1,0,0,0,0|1,0,0]=3 14447 B12R0.47 CCCCCCC(C)NCCOC 2230a_100000209980_100011215978 [1,1,0,0,0,0|2,0,0]=4 14448 B12R0.47 CCCCCCC(C)NCCOC 2230a_100000210919_100011201679 [1,1,0,0,0,0|2,0,0]=4 14449 B12R0.47 CCCCCCC(C)NCCOC 270004a_100000209980_100000210826 [1,1,0,0,0,0|2,0,0]=4 14450 B12R0.47 CCCCCCC(C)NCCOC 34a_100000210919_100011201679 [1,1,0,0,0,0|2,0,0]=4 14451 B12R0.47 CCCCCCC(C)NCCSC 2230a_100000210919_100000751147 [1,1,0,0,0,0|2,0,0]=4 14452 B12R0.47 CCCCCCC(C)NCCSC 2230a_100020590264_100011215978 [1,1,0,0,0,0|2,0,0]=4 14453 B12R0.47 CCCCCCC(C)NCCSC 270004a_100020590264_100000210826 [1,1,0,0,0,0|2,0,0]=4 14454 B12R0.47 CCCCCCC(C)NCCSC 34a_100000210919_100000212216 [1,1,0,0,0,0|2,0,0]=4 14455 B12R0.47 CCCCCCC(C)OCCCBr 34a_100011217188_100011215978 [1,1,0,0,0,0|2,0,0]=4 14456 B12R0.47 CCCCCCC(C)OCCCC 34a_100000210227_100011215978 [1,1,0,0,0,0|1,0,0]=3 14457 B12R0.47 CCCCCCC(C)OCCCC 34a_100000210265_100000210210 [1,1,0,0,0,0|1,0,0]=3 14458 B12R0.47 CCCCCCC(C)OCCCC 7a_100000210227_100011215978 [1,1,0,0,0,0|1,0,0]=3 14459 B12R0.47 CCCCCCC(C)OCCCC 7a_100000210265_100000210211 [1,1,0,0,0,0|1,0,0]=3 14460 B12R0.47 CCCCCCC(C)OCCCCl 34a_100000230001_100011215978 [1,1,0,0,0,0|2,0,0]=4 14461 B12R0.47 CCCCCCC(C)OCCCF 34a_100000210265_100011934791 [1,1,0,0,0,0|2,0,0]=4 14462 B12R0.47 CCCCCCC(C)OCCCF 34a_100000759539_100011215978 [1,1,0,0,0,0|2,0,0]=4 14463 B12R0.47 CCCCCCC(C)OCCCF 7a_100000210265_100011934791 [1,1,0,0,0,0|2,0,0]=4 14464 B12R0.47 CCCCCCC(C)OCCCN 34a_100000182051_100011215978 [1,1,0,0,0,0|2,0,0]=4 14465 B12R0.47 CCCCCCC(C)OCCCO 34a_100000210265_100000230001 [1,1,0,0,0,0|1,0,0]=3 14466 B12R0.47 CCCCCCC(C)OCCCO 7a_100000210265_100011215043 [1,1,0,0,0,0|1,0,0]=3 14467 B12R0.47 CCCCCCC(C)OCCOC 34a_100000210237_100011215978 [1,1,0,0,0,0|2,0,0]=4 14468 B12R0.47 CCCCCCC(C)OCCOC 34a_100000210265_100011201679 [1,1,0,0,0,0|2,0,0]=4 14469 B12R0.47 CCCCCCC(C)OCCOC 7a_100000210265_100000233755 [1,1,0,0,0,0|2,0,0]=4 14470 B12R0.47 CCCCCCC(C)OCCSC 34a_100000210265_100000212216 [1,1,0,0,0,0|2,0,0]=4 14471 B12R0.47 CCCCCCC(C)OCCSC 34a_100000230434_100011215978 [1,1,0,0,0,0|2,0,0]=4 14472 B12R0.47 CCCCCCC(C)OCCSC 7a_100000210265_100000212216 [1,1,0,0,0,0|2,0,0]=4 14473 B12R0.47 CCCCCCC(C)OCCSC 7a_100000230434_100011215978 [1,1,0,0,0,0|2,0,0]=4 14474 B12R0.47 CCCCCCC(C)SCCCC 62a_100000210211_100011215978 [1,1,0,0,0,0|1,0,0]=3 14475 B12R0.47 CCCCCCC(C)SCCCC 62a_100011215978_100000210210 [1,1,0,0,0,0|1,0,0]=3 14476 B12R0.47 CCCCCCC(C)SCCCF 62a_100011215978_100011934791 [1,1,0,0,0,0|2,0,0]=4 14477 B12R0.47 CCCCCCC(C)SCCCF 62a_100011934791_100011215978 [1,1,0,0,0,0|2,0,0]=4 14478 B12R0.47 CCCCCCC(C)SCCCO 62a_100011215043_100011215978 [1,1,0,0,0,0|1,0,0]=3 14479 B12R0.47 CCCCCCC(C)SCCCO 62a_100011215978_100011215043 [1,1,0,0,0,0|1,0,0]=3 14480 B12R0.47 CCCCCCC(C)SCCOC 62a_100000233755_100011215978 [1,1,0,0,0,0|2,0,0]=4 14481 B12R0.47 CCCCCCC(C)SCCOC 62a_100011215978_100000233755 [1,1,0,0,0,0|2,0,0]=4 14482 B12R0.47 CCCCCCC(C)SCCSC 62a_100000212216_100011215978 [1,1,0,0,0,0|2,0,0]=4 14483 B12R0.47 CCCCCCC(C)SCCSC 62a_100011215978_100000751147 [1,1,0,0,0,0|2,0,0]=4 14484 B12R0.47 CCCCCCC(C)SCOCC 62a_100000739092_100011215978 [1,1,0,0,0,0|2,0,0]=4 14485 B12R0.47 CCCCCCC(C)SCOCC 62a_100011215978_100000739092 [1,1,0,0,0,0|2,0,0]=4 14486 B12R0.47 CCCCCCN(C)CCCCC 2230a_100000223495_100000210314 [1,1,0,0,0,0|1,0,0]=3 14487 B12R0.47 CCCCCCN(C)CCCCC 2230a_106256046315_100000210326 [1,1,0,0,0,0|1,0,0]=3 14488 B12R0.47 CCCCCCN(C)CCCCC 269982a_100000223495_100000210757 [1,1,0,0,0,0|1,0,0]=3 14489 B12R0.47 CCCCCCN(C)CCCCC 269982a_106256046315_100000210215 [1,1,0,0,0,0|1,0,0]=3 14490 B12R0.47 CCCCCCN(C)CCCCF 2230a_106256046315_100000729493 [1,1,0,0,0,0|2,0,0]=4 14491 B12R0.47 CCCCCCN(C)CCCCF 269982a_106256046315_100000729493 [1,1,0,0,0,0|2,0,0]=4 14492 B12R0.47 CCCCCCN(C)CCCCO 2230a_100000717598_100000210314 [1,1,0,0,0,0|1,0,0]=3 14493 B12R0.47 CCCCCCN(C)CCCCO 2230a_106256046315_100000210776 [1,1,0,0,0,0|1,0,0]=3 14494 B12R0.47 CCCCCCN(C)CCCCO 269982a_100000717598_100000210757 [1,1,0,0,0,0|1,0,0]=3 14495 B12R0.47 CCCCCCN(C)CCCCO 269982a_106256046315_100000210776 [1,1,0,0,0,0|1,0,0]=3 14496 B12R0.47 CCCCCCN(C)CCCOC 2230a_100000224831_100000210314 [1,1,0,0,0,0|2,0,0]=4 14497 B12R0.47 CCCCCCN(C)CCCOC 2230a_106256046315_100000740836 [1,1,0,0,0,0|2,0,0]=4 14498 B12R0.47 CCCCCCN(C)CCCOC 269982a_100000224831_100000210757 [1,1,0,0,0,0|2,0,0]=4 14499 B12R0.47 CCCCCCN(C)CCCOC 269982a_106256046315_100000740836 [1,1,0,0,0,0|2,0,0]=4 14500 B12R0.47 CCCCCCN(C)CCOCC 2230a_106256046315_100011215890 [1,1,0,0,0,0|2,0,0]=4 14501 B12R0.47 CCCCCCN(C)CCOCC 269982a_106256046315_100011215890 [1,1,0,0,0,0|2,0,0]=4 14502 B12R0.47 CCCCCCN(C)CCSCC 2230a_106256046315_100000757381 [1,1,0,0,0,0|2,0,0]=4 14503 B12R0.47 CCCCCCN(C)CCSCC 269982a_106256046315_100000757381 [1,1,0,0,0,0|2,0,0]=4 14504 B12R0.47 CCCCCN(C)CCCCCF 2230a_100000223495_100000729378 [1,1,0,0,0,0|2,0,0]=4 14505 B12R0.47 CCCCCN(C)CCCCCF 269982a_100000223495_100000729378 [1,1,0,0,0,0|2,0,0]=4 14506 B12R0.47 CCCCCN(C)CCCCCO 2230a_100000223495_100000746330 [1,1,0,0,0,0|1,0,0]=3 14507 B12R0.47 CCCCCN(C)CCCCCO 2230a_100000722520_100000210326 [1,1,0,0,0,0|1,0,0]=3 14508 B12R0.47 CCCCCN(C)CCCCCO 269982a_100000223495_100000746330 [1,1,0,0,0,0|1,0,0]=3 14509 B12R0.47 CCCCCN(C)CCCCCO 269982a_100000722520_100000210215 [1,1,0,0,0,0|1,0,0]=3 14510 B12R0.47 CCCCCN(C)CCCCOC 2230a_100000223495_100000730899 [1,1,0,0,0,0|2,0,0]=4 14511 B12R0.47 CCCCCN(C)CCCCOC 269982a_100000223495_100000730899 [1,1,0,0,0,0|2,0,0]=4 14512 B12R0.47 CCCCCN(C)CCCOCC 2230a_100000223495_100012232248 [1,1,0,0,0,0|2,0,0]=4 14513 B12R0.47 CCCCCN(C)CCCOCC 269982a_100000223495_100012232248 [1,1,0,0,0,0|2,0,0]=4 14514 B12R0.47 CCCCCN(C)CCOCCC 2230a_100000223495_100011215938 [1,1,0,0,0,0|2,0,0]=4 14515 B12R0.47 CCCCCN(C)CCOCCC 269982a_100000223495_100011215938 [1,1,0,0,0,0|2,0,0]=4 14516 B12R0.47 CCCCCN(C)CCOCCO 2230a_100000223495_100011215305 [1,1,0,0,0,0|2,0,0]=4 14517 B12R0.47 CCCCCN(C)CCOCCO 2230a_100000228057_100000210326 [1,1,0,0,0,0|2,0,0]=4 14518 B12R0.47 CCCCCN(C)CCOCCO 269982a_100000223495_100011215305 [1,1,0,0,0,0|2,0,0]=4 14519 B12R0.47 CCCCCN(C)CCOCCO 269982a_100000228057_100000210215 [1,1,0,0,0,0|2,0,0]=4 14520 B12R0.47 CCCCCN(C)COCCCC 2230a_100000223495_100011995733 [1,1,0,0,0,0|2,0,0]=4 14521 B12R0.47 CCCCCN(C)COCCCC 269982a_100000223495_100011995733 [1,1,0,0,0,0|2,0,0]=4 14522 B12R0.47 CCCCCNC(=O)CCCCC 11a_100000209983_100000212188 [1,1,0,0,0,0|1,0,1]=4 14523 B12R0.47 CCCCCNC(=O)CCCCC 1626a_100000209983_100000212188 [1,1,0,0,0,0|1,0,1]=4 14524 B12R0.47 CCCCCNC(=O)CCCCC 240690a_100000209983_100000212188 [1,1,0,0,0,0|1,0,1]=4 14525 B12R0.47 CCCCCNC(=O)CCCCC 527a_100000209983_100000212188 [1,1,0,0,0,0|1,0,1]=4 14526 B12R0.47 CCCCCNC(=O)CCCCO 1626a_100000209983_100000695505 [1,1,0,0,0,0|1,0,1]=4 14527 B12R0.47 CCCCCNC(C)CCCCC 2230a_100000209983_200011218191 [1,1,0,0,0,0|1,0,0]=3 14528 B12R0.47 CCCCCNC(C)CCCCC 2230a_100000211957_100000210326 [1,1,0,0,0,0|1,0,0]=3 14529 B12R0.47 CCCCCNC(C)CCCCC 270004a_100000209983_100000211708 [1,1,0,0,0,0|1,0,0]=3 14530 B12R0.47 CCCCCNC(C)CCCSC 270004a_100000209983_100011399439 [1,1,0,0,0,0|2,0,0]=4 14531 B12R0.47 CCCCCNC(C)CCOCC 270004a_100000209983_200011216536 [1,1,0,0,0,0|2,0,0]=4 14532 B12R0.47 CCCCCNC(C)CSCCC 270004a_100000209983_100011343953 [1,1,0,0,0,0|2,0,0]=4 14533 B12R0.47 CCCCCOC(C)CCCCC 34a_100000210253_200011218191 [1,1,0,0,0,0|1,0,0]=3 14534 B12R0.47 CCCCCOC(C)CCCCC 34a_100011215632_100000718602 [1,1,0,0,0,0|1,0,0]=3 14535 B12R0.47 CCCCCOC(C)CCCCC 7a_100000210253_200011218191 [1,1,0,0,0,0|1,0,0]=3 14536 B12R0.47 CCCCCOC(C)CCCCC 7a_100011215632_100000210326 [1,1,0,0,0,0|1,0,0]=3 14537 B12R0.47 CCCCCOC(C)CCCOC 34a_200011539412_100000718602 [1,1,0,0,0,0|2,0,0]=4 14538 B12R0.47 CCCCCOC(C)CCCOC 7a_200011539412_100000210326 [1,1,0,0,0,0|2,0,0]=4 14539 B12R0.47 CCCCCSC(C)CCCCC 62a_100000210326_200011218191 [1,1,0,0,0,0|1,0,0]=3 14540 B12R0.47 CCCCCSC(C)CCCCC 62a_200011218191_100000210326 [1,1,0,0,0,0|1,0,0]=3 14541 B12R0.47 CCCCNC(=O)CCCCCO 240690a_100000102301_100102619762 [1,1,0,0,0,0|1,0,1]=4 14542 B12R0.47 CCCCOCC(=O)CCCCO 1458a_100000695505_100011995733 [1,1,0,0,0,0|1,0,1]=4 14543 B12R0.47 CCCCOCC(=O)CCCCO 1458a_100000757543_100000210776 [1,1,0,0,0,0|1,0,1]=4 14544 B12R0.47 CCCCOCC(C)OCCCC 34a_100011217071_100000210210 [1,1,0,0,0,0|2,0,0]=4 14545 B12R0.47 CCCCOCC(C)OCCCC 7a_100011217071_100000210211 [1,1,0,0,0,0|2,0,0]=4 14546 B12R0.47 CCCCOCC(C)OCCCO 34a_100011217071_100000230001 [1,1,0,0,0,0|2,0,0]=4 14547 B12R0.47 CCCCOCC(C)OCCCO 7a_100011217071_100011215043 [1,1,0,0,0,0|2,0,0]=4 14548 B12R0.47 CCCCOCN(C)CCCCO 2230a_100000717598_100011995733 [1,1,0,0,0,0|2,0,0]=4 14549 B12R0.47 CCCCOCN(C)CCCCO 269982a_100000717598_100011995733 [1,1,0,0,0,0|2,0,0]=4 14550 B12R0.47 CCCCOC[C@@H](N)CCCCN 34a_100016993712_100000210210 [1,1,0,0,0,0|2,0,0]=4 14551 B12R0.47 CCCCSCC(=O)CCCCO 1458a_100000191162_100000210776 [1,1,0,0,0,0|1,0,1]=4 14552 B12R0.47 CCCOCC(=O)CCCCCO 1458a_100000745993_100000746330 [1,1,0,0,0,0|1,0,1]=4 14553 B12R0.47 CCCOCCC(=O)CCCCO 1458a_100000695505_100011215938 [1,1,0,0,0,0|1,0,1]=4 14554 B12R0.47 CCCOCCN(C)CCCCO 2230a_100000717598_100011215938 [1,1,0,0,0,0|2,0,0]=4 14555 B12R0.47 CCCOCCN(C)CCCCO 269982a_100000717598_100011215938 [1,1,0,0,0,0|2,0,0]=4 14556 B12R0.47 CCCSCC(=O)CCCCCO 1458a_100000217233_100000746330 [1,1,0,0,0,0|1,0,1]=4 14557 B12R0.47 CCCSCC(C)NCCCCO 270004a_100000750430_100011343953 [1,1,0,0,0,0|2,0,0]=4 14558 B12R0.47 CCOCCC(=O)CCCCCO 1458a_100000749530_100000746330 [1,1,0,0,0,0|1,0,1]=4 14559 B12R0.47 CCOCCC(=O)CCCCCO 1458a_100102619762_100011215890 [1,1,0,0,0,0|1,0,1]=4 14560 B12R0.47 CCOCCC(C)NCCCCO 270004a_100000750430_200011216536 [1,1,0,0,0,0|2,0,0]=4 14561 B12R0.47 CCOCCCC(=O)CCCCO 1458a_100000695505_100012232248 [1,1,0,0,0,0|1,0,1]=4 14562 B12R0.47 CCOCCCN(C)CCCCO 2230a_100000717598_100012232248 [1,1,0,0,0,0|2,0,0]=4 14563 B12R0.47 CCOCCCN(C)CCCCO 269982a_100000717598_100012232248 [1,1,0,0,0,0|2,0,0]=4 14564 B12R0.47 CCOCCN(C)CCCCCO 2230a_100000722520_100011215890 [1,1,0,0,0,0|2,0,0]=4 14565 B12R0.47 CCOCCN(C)CCCCCO 269982a_100000722520_100011215890 [1,1,0,0,0,0|2,0,0]=4 14566 B12R0.47 CCSCCC(=O)CCCCCO 1458a_100000230768_100000746330 [1,1,0,0,0,0|1,0,1]=4 14567 B12R0.47 CCSCCC(=O)CCCCCO 1458a_100102619762_100000757381 [1,1,0,0,0,0|1,0,1]=4 14568 B12R0.47 CCSCCN(C)CCCCCO 2230a_100000722520_100000757381 [1,1,0,0,0,0|2,0,0]=4 14569 B12R0.47 CCSCCN(C)CCCCCO 269982a_100000722520_100000757381 [1,1,0,0,0,0|2,0,0]=4 14570 B12R0.47 CN(CCCCF)CCCCCO 2230a_100000722520_100000729493 [1,1,0,0,0,0|2,0,0]=4 14571 B12R0.47 CN(CCCCF)CCCCCO 269982a_100000722520_100000729493 [1,1,0,0,0,0|2,0,0]=4 14572 B12R0.47 CN(CCCCO)CCCCCF 2230a_100000717598_100000729378 [1,1,0,0,0,0|2,0,0]=4 14573 B12R0.47 CN(CCCCO)CCCCCF 269982a_100000717598_100000729378 [1,1,0,0,0,0|2,0,0]=4 14574 B12R0.47 CN(CCCCO)CCCCCO 2230a_100000717598_100000746330 [1,1,0,0,0,0|2,0,0]=4 14575 B12R0.47 CN(CCCCO)CCCCCO 2230a_100000722520_100000210776 [1,1,0,0,0,0|2,0,0]=4 14576 B12R0.47 CN(CCCCO)CCCCCO 269982a_100000717598_100000746330 [1,1,0,0,0,0|2,0,0]=4 14577 B12R0.47 CN(CCCCO)CCCCCO 269982a_100000722520_100000210776 [1,1,0,0,0,0|2,0,0]=4 14578 B12R0.47 COCCCC(=O)CCCCCO 1458a_100000741012_100000746330 [1,1,0,0,0,0|1,0,1]=4 14579 B12R0.47 COCCCC(=O)CCCCCO 1458a_100102619762_100000740836 [1,1,0,0,0,0|1,0,1]=4 14580 B12R0.47 COCCCC(C)OCCCCO 34a_200011539412_100011216708 [1,1,0,0,0,0|2,0,0]=4 14581 B12R0.47 COCCCC(C)OCCCCO 7a_200011539412_100000210776 [1,1,0,0,0,0|2,0,0]=4 14582 B12R0.47 COCCCCC(=O)CCCCO 1458a_100000695505_100000755781 [1,1,0,0,0,0|1,0,1]=4 14583 B12R0.47 COCCCCN(C)CCCCO 2230a_100000717598_100000730899 [1,1,0,0,0,0|2,0,0]=4 14584 B12R0.47 COCCCCN(C)CCCCO 269982a_100000717598_100000730899 [1,1,0,0,0,0|2,0,0]=4 14585 B12R0.47 COCCCN(C)CCCCCO 2230a_100000224831_100000746330 [1,1,0,0,0,0|2,0,0]=4 14586 B12R0.47 COCCCN(C)CCCCCO 2230a_100000722520_100000740836 [1,1,0,0,0,0|2,0,0]=4 14587 B12R0.47 COCCCN(C)CCCCCO 269982a_100000224831_100000746330 [1,1,0,0,0,0|2,0,0]=4 14588 B12R0.47 COCCCN(C)CCCCCO 269982a_100000722520_100000740836 [1,1,0,0,0,0|2,0,0]=4 14589 B12R0.47 CSCCCC(=O)CCCCCO 1458a_100000173376_100000746330 [1,1,0,0,0,0|1,0,1]=4 14590 B12R0.47 CSCCCC(C)NCCCCO 270004a_100000750430_100011399439 [1,1,0,0,0,0|2,0,0]=4 14591 B12R0.47 NCCCC[C@H](N)COCCCO 34a_100016993712_100000230001 [1,1,0,0,0,0|2,0,0]=4 14592 B12R0.47 O=C(CCCCF)CCCCCO 1458a_100102619762_100000729493 [1,1,0,0,0,0|1,0,1]=4 14593 B12R0.47 O=C(CCCCO)CCCCCF 1458a_100000695505_100000729378 [1,1,0,0,0,0|1,0,1]=4 14594 B12R0.47 O=C(CCCCO)CCCCCO 1458a_100000695505_100000746330 [1,1,0,0,0,0|1,0,1]=4 14595 B12R0.47 O=C(CCCCO)CCCCCO 1458a_100102619762_100000210776 [1,1,0,0,0,0|1,0,1]=4 14596 B12R0.206 CC(CCCCl)OCCCCCO 34a_200000718107_100000746330 [1,1,0,0,0,0|2,0,0]=4 14597 B12R0.206 CC(CCCCl)OCCCCCO 7a_200000718107_100000746330 [1,1,0,0,0,0|2,0,0]=4 14598 B12R0.206 CCCCC(=O)CCCCCCF 1458a_100000210183_100015922095 [1,1,0,0,0,0|1,0,1]=4 14599 B12R0.206 CCCCC(=O)CCCCCCO 1458a_100000210183_100000766143 [1,1,0,0,0,0|0,0,1]=3 14600 B12R0.206 CCCCC(=O)CCCCCCO 1458a_100011996774_100000210211 [1,1,0,0,0,0|0,0,1]=3 14601 B12R0.206 CCCCC(=O)CCCCCOC 1458a_100011935119_100000210211 [1,1,0,0,0,0|1,0,1]=4 14602 B12R0.206 CCCCC(=O)NCCCCCO 240690a_100000762737_100000210183 [1,1,0,0,0,0|1,0,1]=4 14603 B12R0.206 CCCCC(C)CCCCOCC 34a_200011021034_100000210202 [1,1,0,0,0,0|1,0,0]=3 14604 B12R0.206 CCCCC(C)CCCCOCC 7a_200011021034_100000210202 [1,1,0,0,0,0|1,0,0]=3 14605 B12R0.206 CCCCC(C)CCCCOCF 34a_200011021034_100015361967 [1,1,0,0,0,0|2,0,0]=4 14606 B12R0.206 CCCCC(C)CCCCOCF 7a_200011021034_100015361967 [1,1,0,0,0,0|2,0,0]=4 14607 B12R0.206 CCCCC(C)COCCCCF 34a_100011995851_100000729493 [1,1,0,0,0,0|2,0,0]=4 14608 B12R0.206 CCCCC(C)COCCCCF 7a_100011995851_100000729493 [1,1,0,0,0,0|2,0,0]=4 14609 B12R0.206 CCCCC(C)COCCCCO 34a_100011995851_100011216708 [1,1,0,0,0,0|1,0,0]=3 14610 B12R0.206 CCCCC(C)COCCCCO 7a_100011995851_100000210776 [1,1,0,0,0,0|1,0,0]=3 14611 B12R0.206 CCCCC(C)COCCCOC 34a_100011995851_100000740836 [1,1,0,0,0,0|2,0,0]=4 14612 B12R0.206 CCCCC(C)COCCCOC 7a_100011995851_100000740836 [1,1,0,0,0,0|2,0,0]=4 14613 B12R0.206 CCCCC(C)COCCOCC 34a_100011995851_100000210147 [1,1,0,0,0,0|2,0,0]=4 14614 B12R0.206 CCCCC(C)COCCOCC 7a_100011995851_100011215890 [1,1,0,0,0,0|2,0,0]=4 14615 B12R0.206 CCCCC(C)COCCSCC 34a_100011995851_100000757381 [1,1,0,0,0,0|2,0,0]=4 14616 B12R0.206 CCCCC(C)COCCSCC 7a_100011995851_100000757381 [1,1,0,0,0,0|2,0,0]=4 14617 B12R0.206 CCCCC(C)NCCCCCF 2230a_100000126638_100000729378 [1,1,0,0,0,0|2,0,0]=4 14618 B12R0.206 CCCCC(C)NCCCCCO 2230a_100000126638_100000746330 [1,1,0,0,0,0|1,0,0]=3 14619 B12R0.206 CCCCC(C)NCCCCCO 2230a_100000762737_200011215066 [1,1,0,0,0,0|1,0,0]=3 14620 B12R0.206 CCCCC(C)NCCCCCO 270004a_100000762737_100000210087 [1,1,0,0,0,0|1,0,0]=3 14621 B12R0.206 CCCCC(C)NCCCCCO 34a_100000762737_200011215066 [1,1,0,0,0,0|1,0,0]=3 14622 B12R0.206 CCCCC(C)NCCCCOC 2230a_100000126638_100000730899 [1,1,0,0,0,0|2,0,0]=4 14623 B12R0.206 CCCCC(C)NCCCOCC 2230a_100000126638_100012232248 [1,1,0,0,0,0|2,0,0]=4 14624 B12R0.206 CCCCC(C)NCCCOCC 2230a_100000210961_200011215066 [1,1,0,0,0,0|2,0,0]=4 14625 B12R0.206 CCCCC(C)NCCCOCC 270004a_100000210961_100000210087 [1,1,0,0,0,0|2,0,0]=4 14626 B12R0.206 CCCCC(C)NCCCOCC 34a_100000210961_200011215066 [1,1,0,0,0,0|2,0,0]=4 14627 B12R0.206 CCCCC(C)NCCOCCC 2230a_100000126638_100011215938 [1,1,0,0,0,0|2,0,0]=4 14628 B12R0.206 CCCCC(C)NCCOCCC 2230a_100161115042_200011215066 [1,1,0,0,0,0|2,0,0]=4 14629 B12R0.206 CCCCC(C)NCCOCCC 270004a_100161115042_100000210087 [1,1,0,0,0,0|2,0,0]=4 14630 B12R0.206 CCCCC(C)NCCOCCC 34a_100161115042_200011215066 [1,1,0,0,0,0|2,0,0]=4 14631 B12R0.206 CCCCC(C)NCCOCCO 2230a_100000126638_100011215305 [1,1,0,0,0,0|2,0,0]=4 14632 B12R0.206 CCCCC(C)NCCOCCO 2230a_100000211614_200011215066 [1,1,0,0,0,0|2,0,0]=4 14633 B12R0.206 CCCCC(C)NCCOCCO 270004a_100000211614_100000210087 [1,1,0,0,0,0|2,0,0]=4 14634 B12R0.206 CCCCC(C)NCCOCCO 34a_100000211614_200011215066 [1,1,0,0,0,0|2,0,0]=4 14635 B12R0.206 CCCCC(C)NCCSCCC 2230a_100020603323_200011215066 [1,1,0,0,0,0|2,0,0]=4 14636 B12R0.206 CCCCC(C)NCCSCCC 270004a_100020603323_100000210087 [1,1,0,0,0,0|2,0,0]=4 14637 B12R0.206 CCCCC(C)NCCSCCO 2230a_100011219999_200011215066 [1,1,0,0,0,0|2,0,0]=4 14638 B12R0.206 CCCCC(C)NCCSCCO 270004a_100011219999_100000210087 [1,1,0,0,0,0|2,0,0]=4 14639 B12R0.206 CCCCC(C)OCCCCCBr 34a_100000746331_200011215066 [1,1,0,0,0,0|2,0,0]=4 14640 B12R0.206 CCCCC(C)OCCCCCBr 7a_100000746331_200011215066 [1,1,0,0,0,0|2,0,0]=4 14641 B12R0.206 CCCCC(C)OCCCCCCl 34a_100000746330_200011215066 [1,1,0,0,0,0|2,0,0]=4 14642 B12R0.206 CCCCC(C)OCCCCCCl 7a_100000746330_200011215066 [1,1,0,0,0,0|2,0,0]=4 14643 B12R0.206 CCCCC(C)OCCCCCF 34a_100000687866_100000729378 [1,1,0,0,0,0|2,0,0]=4 14644 B12R0.206 CCCCC(C)OCCCCCF 7a_100000687866_100000729378 [1,1,0,0,0,0|2,0,0]=4 14645 B12R0.206 CCCCC(C)OCCCCCI 34a_200012148887_200011215066 [1,1,0,0,0,0|2,0,0]=4 14646 B12R0.206 CCCCC(C)OCCCCCI 7a_200012148887_200011215066 [1,1,0,0,0,0|2,0,0]=4 14647 B12R0.206 CCCCC(C)OCCCCCN 34a_100000762737_200011215066 [1,1,0,0,0,0|2,0,0]=4 14648 B12R0.206 CCCCC(C)OCCCCCO 34a_100000687866_100000746330 [1,1,0,0,0,0|1,0,0]=3 14649 B12R0.206 CCCCC(C)OCCCCCO 7a_100000687866_100000746330 [1,1,0,0,0,0|1,0,0]=3 14650 B12R0.206 CCCCC(C)OCCCCOC 34a_100000687866_100000755781 [1,1,0,0,0,0|2,0,0]=4 14651 B12R0.206 CCCCC(C)OCCCCOC 34a_100000740925_200011215066 [1,1,0,0,0,0|2,0,0]=4 14652 B12R0.206 CCCCC(C)OCCCCOC 7a_100000687866_100000730899 [1,1,0,0,0,0|2,0,0]=4 14653 B12R0.206 CCCCC(C)OCCCCSC 34a_100011217163_200011215066 [1,1,0,0,0,0|2,0,0]=4 14654 B12R0.206 CCCCC(C)OCCCCSC 7a_100011217163_200011215066 [1,1,0,0,0,0|2,0,0]=4 14655 B12R0.206 CCCCC(C)OCCCOCC 34a_100000687866_100012232248 [1,1,0,0,0,0|2,0,0]=4 14656 B12R0.206 CCCCC(C)OCCCOCC 34a_100000757476_200011215066 [1,1,0,0,0,0|2,0,0]=4 14657 B12R0.206 CCCCC(C)OCCCOCC 7a_100000687866_100012232248 [1,1,0,0,0,0|2,0,0]=4 14658 B12R0.206 CCCCC(C)OCCCOCC 7a_100000757476_200011215066 [1,1,0,0,0,0|2,0,0]=4 14659 B12R0.206 CCCCC(C)OCCCSCC 34a_100011216438_200011215066 [1,1,0,0,0,0|2,0,0]=4 14660 B12R0.206 CCCCC(C)OCCCSCC 7a_100011216438_200011215066 [1,1,0,0,0,0|2,0,0]=4 14661 B12R0.206 CCCCC(C)OCCOCCC 34a_100000687866_100011215938 [1,1,0,0,0,0|2,0,0]=4 14662 B12R0.206 CCCCC(C)OCCOCCC 34a_100000752267_200011215066 [1,1,0,0,0,0|2,0,0]=4 14663 B12R0.206 CCCCC(C)OCCOCCC 7a_100000687866_100011215938 [1,1,0,0,0,0|2,0,0]=4 14664 B12R0.206 CCCCC(C)OCCOCCC 7a_100000752267_200011215066 [1,1,0,0,0,0|2,0,0]=4 14665 B12R0.206 CCCCC(C)OCCOCCO 34a_100000687866_100000692535 [1,1,0,0,0,0|2,0,0]=4 14666 B12R0.206 CCCCC(C)OCCOCCO 7a_100000687866_100011215305 [1,1,0,0,0,0|2,0,0]=4 14667 B12R0.206 CCCCC(C)OCCSCCC 34a_200000230433_200011215066 [1,1,0,0,0,0|2,0,0]=4 14668 B12R0.206 CCCCC(C)OCCSCCC 7a_200000230433_200011215066 [1,1,0,0,0,0|2,0,0]=4 14669 B12R0.206 CCCCC(C)SCCCCCF 62a_100000729378_200011215066 [1,1,0,0,0,0|2,0,0]=4 14670 B12R0.206 CCCCC(C)SCCCCCF 62a_200011215066_100000729378 [1,1,0,0,0,0|2,0,0]=4 14671 B12R0.206 CCCCC(C)SCCCCCO 62a_100000746330_200011215066 [1,1,0,0,0,0|1,0,0]=3 14672 B12R0.206 CCCCC(C)SCCCCCO 62a_200011215066_100000746330 [1,1,0,0,0,0|1,0,0]=3 14673 B12R0.206 CCCCC(C)SCCCCOC 62a_100000730899_200011215066 [1,1,0,0,0,0|2,0,0]=4 14674 B12R0.206 CCCCC(C)SCCCCOC 62a_200011215066_100000730899 [1,1,0,0,0,0|2,0,0]=4 14675 B12R0.206 CCCCC(C)SCCCOCC 62a_100012232248_200011215066 [1,1,0,0,0,0|2,0,0]=4 14676 B12R0.206 CCCCC(C)SCCCOCC 62a_200011215066_100012232248 [1,1,0,0,0,0|2,0,0]=4 14677 B12R0.206 CCCCC(C)SCCOCCC 62a_100011215938_200011215066 [1,1,0,0,0,0|2,0,0]=4 14678 B12R0.206 CCCCC(C)SCCOCCC 62a_200011215066_100011215938 [1,1,0,0,0,0|2,0,0]=4 14679 B12R0.206 CCCCC(C)SCCOCCO 62a_100011215305_200011215066 [1,1,0,0,0,0|2,0,0]=4 14680 B12R0.206 CCCCC(C)SCCOCCO 62a_200011215066_100011215305 [1,1,0,0,0,0|2,0,0]=4 14681 B12R0.206 CCCCCCCC(=O)CCCC 1458a_100000210183_100000210614 [1,1,0,0,0,0|0,0,1]=3 14682 B12R0.206 CCCCCCCC(=O)CCCC 1458a_100000211969_100000210211 [1,1,0,0,0,0|0,0,1]=3 14683 B12R0.206 CCCCCCCC(=O)CCCF 1458a_100000211969_100011934791 [1,1,0,0,0,0|1,0,1]=4 14684 B12R0.206 CCCCCCCC(=O)CCCO 1458a_100000211969_100011215043 [1,1,0,0,0,0|0,0,1]=3 14685 B12R0.206 CCCCCCCC(=O)CCOC 1458a_100000211969_100000233755 [1,1,0,0,0,0|1,0,1]=4 14686 B12R0.206 CCCCCCCC(=O)CCOC 1458a_100000749529_100000210614 [1,1,0,0,0,0|1,0,1]=4 14687 B12R0.206 CCCCCCCC(=O)CCSC 1458a_100000174002_100000210614 [1,1,0,0,0,0|1,0,1]=4 14688 B12R0.206 CCCCCCCC(=O)CCSC 1458a_100000211969_100000751147 [1,1,0,0,0,0|1,0,1]=4 14689 B12R0.206 CCCCCCCC(=O)COCC 1458a_100000211967_100000210614 [1,1,0,0,0,0|1,0,1]=4 14690 B12R0.206 CCCCCCCC(=O)CSCC 1458a_100000230394_100000210614 [1,1,0,0,0,0|1,0,1]=4 14691 B12R0.206 CCCCCCCC(=O)NCCC 11a_100020643023_100000211969 [1,1,0,0,0,0|1,0,1]=4 14692 B12R0.206 CCCCCCCC(=O)NCCC 1626a_100020643023_100000211969 [1,1,0,0,0,0|1,0,1]=4 14693 B12R0.206 CCCCCCCC(=O)NCCC 240690a_100020643023_100000211969 [1,1,0,0,0,0|1,0,1]=4 14694 B12R0.206 CCCCCCCC(=O)NCCC 527a_100020643023_100000211969 [1,1,0,0,0,0|1,0,1]=4 14695 B12R0.206 CCCCCCCC(=O)NCCO 240690a_100000210304_100000211969 [1,1,0,0,0,0|1,0,1]=4 14696 B12R0.206 CCCCCCCC(=O)NCCO 527a_100000210304_100000211969 [1,1,0,0,0,0|1,0,1]=4 14697 B12R0.206 CCCCCCCC(C)NCCC 270004a_100020643023_100000210596 [1,1,0,0,0,0|1,0,0]=3 14698 B12R0.206 CCCCCCCC(C)NCCF 34a_100000724931_200011218727 [1,1,0,0,0,0|2,0,0]=4 14699 B12R0.206 CCCCCCCC(C)NCCO 2230a_100016997473_200011218727 [1,1,0,0,0,0|1,0,0]=3 14700 B12R0.206 CCCCCCCC(C)NCCO 270004a_100000210304_100000210596 [1,1,0,0,0,0|1,0,0]=3 14701 B12R0.206 CCCCCCCC(C)NCCO 34a_100016990907_200011218727 [1,1,0,0,0,0|1,0,0]=3 14702 B12R0.206 CCCCCCCC(C)OCCBr 34a_100000211926_200011218727 [1,1,0,0,0,0|2,0,0]=4 14703 B12R0.206 CCCCCCCC(C)OCCC 34a_100000210258_200011218727 [1,1,0,0,0,0|1,0,0]=3 14704 B12R0.206 CCCCCCCC(C)OCCC 34a_200011215852_100000210303 [1,1,0,0,0,0|1,0,0]=3 14705 B12R0.206 CCCCCCCC(C)OCCC 7a_200011215852_100000210303 [1,1,0,0,0,0|1,0,0]=3 14706 B12R0.206 CCCCCCCC(C)OCCF 34a_200011215852_100011217306 [1,1,0,0,0,0|2,0,0]=4 14707 B12R0.206 CCCCCCCC(C)OCCF 7a_200011215852_100011217306 [1,1,0,0,0,0|2,0,0]=4 14708 B12R0.206 CCCCCCCC(C)OCCN 34a_100000210304_200011218727 [1,1,0,0,0,0|2,0,0]=4 14709 B12R0.206 CCCCCCCC(C)OCCO 34a_200011215852_100000211926 [1,1,0,0,0,0|1,0,0]=3 14710 B12R0.206 CCCCCCCC(C)OCCO 7a_200011215852_100000211926 [1,1,0,0,0,0|1,0,0]=3 14711 B12R0.206 CCCCCCCC(C)OCSC 34a_200011215852_100011218213 [1,1,0,0,0,0|2,0,0]=4 14712 B12R0.206 CCCCCCCC(C)SCCC 62a_100000210303_200011218727 [1,1,0,0,0,0|1,0,0]=3 14713 B12R0.206 CCCCCCCC(C)SCCC 62a_200011218727_100000210303 [1,1,0,0,0,0|1,0,0]=3 14714 B12R0.206 CCCCCCCC(C)SCCF 62a_100011217306_200011218727 [1,1,0,0,0,0|2,0,0]=4 14715 B12R0.206 CCCCCCCC(C)SCCF 62a_200011218727_100011217306 [1,1,0,0,0,0|2,0,0]=4 14716 B12R0.206 CCCCCCCC(C)SCCO 62a_100000211926_200011218727 [1,1,0,0,0,0|1,0,0]=3 14717 B12R0.206 CCCCCCCC(C)SCCO 62a_200011218727_100000211926 [1,1,0,0,0,0|1,0,0]=3 14718 B12R0.206 CCCCCCCC(C)SCOC 62a_100000766300_200011218727 [1,1,0,0,0,0|2,0,0]=4 14719 B12R0.206 CCCCCCCC(C)SCOC 62a_200011218727_100000766300 [1,1,0,0,0,0|2,0,0]=4 14720 B12R0.206 CCCCCCCC(C)SCSC 62a_100011218213_200011218727 [1,1,0,0,0,0|2,0,0]=4 14721 B12R0.206 CCCCCCCC(C)SCSC 62a_200011218727_100011218213 [1,1,0,0,0,0|2,0,0]=4 14722 B12R0.206 CCCCCCCN(C)CCCC 2230a_100000207549_100000210681 [1,1,0,0,0,0|1,0,0]=3 14723 B12R0.206 CCCCCCCN(C)CCCC 2230a_100000228206_100000210211 [1,1,0,0,0,0|1,0,0]=3 14724 B12R0.206 CCCCCCCN(C)CCCC 269982a_100000207549_100000210681 [1,1,0,0,0,0|1,0,0]=3 14725 B12R0.206 CCCCCCCN(C)CCCC 269982a_100000228206_100000210211 [1,1,0,0,0,0|1,0,0]=3 14726 B12R0.206 CCCCCCCN(C)CCCF 2230a_100000228206_100011934791 [1,1,0,0,0,0|2,0,0]=4 14727 B12R0.206 CCCCCCCN(C)CCCF 269982a_100000228206_100011934791 [1,1,0,0,0,0|2,0,0]=4 14728 B12R0.206 CCCCCCCN(C)CCCO 2230a_100000213112_100000210681 [1,1,0,0,0,0|1,0,0]=3 14729 B12R0.206 CCCCCCCN(C)CCCO 2230a_100000228206_100000230001 [1,1,0,0,0,0|1,0,0]=3 14730 B12R0.206 CCCCCCCN(C)CCCO 269982a_100000213112_100000210681 [1,1,0,0,0,0|1,0,0]=3 14731 B12R0.206 CCCCCCCN(C)CCCO 269982a_100000228206_100011215043 [1,1,0,0,0,0|1,0,0]=3 14732 B12R0.206 CCCCCCCN(C)CCOC 2230a_100000228206_100011201679 [1,1,0,0,0,0|2,0,0]=4 14733 B12R0.206 CCCCCCCN(C)CCOC 2230a_100000743101_100000210681 [1,1,0,0,0,0|2,0,0]=4 14734 B12R0.206 CCCCCCCN(C)CCOC 269982a_100000228206_100000233755 [1,1,0,0,0,0|2,0,0]=4 14735 B12R0.206 CCCCCCCN(C)CCOC 269982a_100000743101_100000210681 [1,1,0,0,0,0|2,0,0]=4 14736 B12R0.206 CCCCCCCN(C)CCSC 2230a_100000228206_100000751147 [1,1,0,0,0,0|2,0,0]=4 14737 B12R0.206 CCCCCCCN(C)CCSC 2230a_100000686725_100000210681 [1,1,0,0,0,0|2,0,0]=4 14738 B12R0.206 CCCCCCCN(C)CCSC 269982a_100000228206_100000212216 [1,1,0,0,0,0|2,0,0]=4 14739 B12R0.206 CCCCCCCN(C)CCSC 269982a_100000686725_100000210681 [1,1,0,0,0,0|2,0,0]=4 14740 B12R0.206 CCCCCCCN(C)COCC 269982a_100000228206_100000739092 [1,1,0,0,0,0|2,0,0]=4 14741 B12R0.206 CCCCCCNC(=O)CCCC 11a_100000210581_100000210183 [1,1,0,0,0,0|1,0,1]=4 14742 B12R0.206 CCCCCCNC(=O)CCCC 1626a_100000210581_100000210183 [1,1,0,0,0,0|1,0,1]=4 14743 B12R0.206 CCCCCCNC(=O)CCCC 240690a_100000210581_100000210183 [1,1,0,0,0,0|1,0,1]=4 14744 B12R0.206 CCCCCCNC(=O)CCCC 527a_100000210581_100000210183 [1,1,0,0,0,0|1,0,1]=4 14745 B12R0.206 CCCCCCNC(C)CCCC 2230a_100000126638_100000210314 [1,1,0,0,0,0|1,0,0]=3 14746 B12R0.206 CCCCCCNC(C)CCCC 2230a_100000210581_200011215066 [1,1,0,0,0,0|1,0,0]=3 14747 B12R0.206 CCCCCCNC(C)CCCC 270004a_100000210581_100000210087 [1,1,0,0,0,0|1,0,0]=3 14748 B12R0.206 CCCCCCNC(C)CCOC 270004a_100000210581_100000742357 [1,1,0,0,0,0|2,0,0]=4 14749 B12R0.206 CCCCCCNC(C)CCSC 270004a_100000210581_100011217047 [1,1,0,0,0,0|2,0,0]=4 14750 B12R0.206 CCCCCCNC(C)CSCC 270004a_100000210581_200011216171 [1,1,0,0,0,0|2,0,0]=4 14751 B12R0.206 CCCCCCOC(C)CCCC 34a_100000210259_200011215066 [1,1,0,0,0,0|1,0,0]=3 14752 B12R0.206 CCCCCCOC(C)CCCC 34a_100000687866_100000210314 [1,1,0,0,0,0|1,0,0]=3 14753 B12R0.206 CCCCCCOC(C)CCCC 7a_100000210259_200011215066 [1,1,0,0,0,0|1,0,0]=3 14754 B12R0.206 CCCCCCOC(C)CCCC 7a_100000687866_100000210314 [1,1,0,0,0,0|1,0,0]=3 14755 B12R0.206 CCCCCCOC(C)CCCCl 34a_200000718107_100000210314 [1,1,0,0,0,0|2,0,0]=4 14756 B12R0.206 CCCCCCOC(C)CCCCl 7a_200000718107_100000210314 [1,1,0,0,0,0|2,0,0]=4 14757 B12R0.206 CCCCCCOC(C)COCC 34a_100000718985_100000210314 [1,1,0,0,0,0|2,0,0]=4 14758 B12R0.206 CCCCCCOC(C)COCC 7a_100000718985_100000210314 [1,1,0,0,0,0|2,0,0]=4 14759 B12R0.206 CCCCCCSC(C)CCCC 62a_100000210314_200011215066 [1,1,0,0,0,0|1,0,0]=3 14760 B12R0.206 CCCCCCSC(C)CCCC 62a_200011215066_100000210757 [1,1,0,0,0,0|1,0,0]=3 14761 B12R0.206 CCCCCNCC(C)OCCC 2230a_100015185124_100000210326 [1,1,0,0,0,0|2,0,0]=4 14762 B12R0.206 CCCCCNCC(C)OCCC 34a_100015185124_100000718602 [1,1,0,0,0,0|2,0,0]=4 14763 B12R0.206 CCCCCNCC(O)COCC 2230a_102515437182_100000210326 [1,1,0,0,0,0|2,0,0]=4 14764 B12R0.206 CCCCCNCC(O)COCC 34a_102515437182_100000718602 [1,1,0,0,0,0|2,0,0]=4 14765 B12R0.206 CCCCCNC[C@H](C)CCCO 2230a_100160569302_100000210326 [1,1,0,0,0,0|1,0,0]=3 14766 B12R0.206 CCCCCNC[C@H](C)CCCO 34a_100160569302_100000718602 [1,1,0,0,0,0|1,0,0]=3 14767 B12R0.206 CCCCCOCC(C)CCCC 34a_100011995851_100000718602 [1,1,0,0,0,0|1,0,0]=3 14768 B12R0.206 CCCCCOCC(C)CCCC 7a_100011995851_100000210326 [1,1,0,0,0,0|1,0,0]=3 14769 B12R0.206 CCCCCOC[C@@H](N)CCCC 34a_100011934283_100000718602 [1,1,0,0,0,0|1,0,0]=3 14770 B12R0.206 CCCCCOC[C@@H](N)CCSC 34a_100011827619_100000718602 [1,1,0,0,0,0|2,0,0]=4 14771 B12R0.206 CCCCN(C)CCCCCCF 2230a_100000207549_100015922095 [1,1,0,0,0,0|2,0,0]=4 14772 B12R0.206 CCCCN(C)CCCCCCF 269982a_100000207549_100015922095 [1,1,0,0,0,0|2,0,0]=4 14773 B12R0.206 CCCCN(C)CCCCCCO 2230a_100000207549_100000766143 [1,1,0,0,0,0|1,0,0]=3 14774 B12R0.206 CCCCN(C)CCCCCCO 269982a_100000207549_100000766143 [1,1,0,0,0,0|1,0,0]=3 14775 B12R0.206 CCCCOCCC(=O)CCCC 1458a_100000210183_100000743108 [1,1,0,0,0,0|1,0,1]=4 14776 B12R0.206 CCCCOCCN(C)CCCC 2230a_100000207549_100000743108 [1,1,0,0,0,0|2,0,0]=4 14777 B12R0.206 CCCCOCCN(C)CCCC 269982a_100000207549_100000743108 [1,1,0,0,0,0|2,0,0]=4 14778 B12R0.206 CCCCOCCN(C)CCCO 2230a_100000213112_100000743108 [1,1,0,0,0,0|2,0,0]=4 14779 B12R0.206 CCCCOCCN(C)CCCO 269982a_100000213112_100000743108 [1,1,0,0,0,0|2,0,0]=4 14780 B12R0.206 CCCCOCNC(C)CCCC 2230a_100000126638_100011995733 [1,1,0,0,0,0|2,0,0]=4 14781 B12R0.206 CCCCOCOC(C)CCCC 34a_100000687866_100011995733 [1,1,0,0,0,0|2,0,0]=4 14782 B12R0.206 CCCCOCSC(C)CCCC 62a_100011995733_200011215066 [1,1,0,0,0,0|2,0,0]=4 14783 B12R0.206 CCCCOCSC(C)CCCC 62a_200011215066_100011995733 [1,1,0,0,0,0|2,0,0]=4 14784 B12R0.206 CCCC[C@H](N)COCCCCF 34a_100011934283_100000729493 [1,1,0,0,0,0|2,0,0]=4 14785 B12R0.206 CCCC[C@H](N)COCCCCO 34a_100011934283_100011216708 [1,1,0,0,0,0|1,0,0]=3 14786 B12R0.206 CCCC[C@H](N)COCCCOC 34a_100011934283_100000740836 [1,1,0,0,0,0|2,0,0]=4 14787 B12R0.206 CCCC[C@H](N)COCCOCC 34a_100011934283_100000210147 [1,1,0,0,0,0|2,0,0]=4 14788 B12R0.206 CCCC[C@H](N)COCCSCC 34a_100011934283_100000757381 [1,1,0,0,0,0|2,0,0]=4 14789 B12R0.206 CCCNC(=O)CCCCCCO 240690a_100020643023_100011996774 [1,1,0,0,0,0|1,0,1]=4 14790 B12R0.206 CCCOC(C)CNCCCCO 2230a_100015185124_100000210776 [1,1,0,0,0,0|2,0,0]=4 14791 B12R0.206 CCCOC(C)CNCCCCO 34a_100015185124_100011216708 [1,1,0,0,0,0|2,0,0]=4 14792 B12R0.206 CCOCC(=O)CCCCCCO 1458a_100000211967_100000766143 [1,1,0,0,0,0|1,0,1]=4 14793 B12R0.206 CCOCC(C)OCCCCCO 34a_100000718985_100000746330 [1,1,0,0,0,0|2,0,0]=4 14794 B12R0.206 CCOCC(C)OCCCCCO 7a_100000718985_100000746330 [1,1,0,0,0,0|2,0,0]=4 14795 B12R0.206 CCOCC(O)CNCCCCO 2230a_102515437182_100000210776 [1,1,0,0,0,0|2,0,0]=4 14796 B12R0.206 CCOCC(O)CNCCCCO 34a_102515437182_100011216708 [1,1,0,0,0,0|2,0,0]=4 14797 B12R0.206 CCOCCNC[C@H](C)CCCO 2230a_100160569302_100011215890 [1,1,0,0,0,0|2,0,0]=4 14798 B12R0.206 CCOCCNC[C@H](C)CCCO 34a_100160569302_100000210147 [1,1,0,0,0,0|2,0,0]=4 14799 B12R0.206 CCSCC(=O)CCCCCCO 1458a_100000230394_100000766143 [1,1,0,0,0,0|1,0,1]=4 14800 B12R0.206 CCSCC(C)NCCCCCO 270004a_100000762737_200011216171 [1,1,0,0,0,0|2,0,0]=4 14801 B12R0.206 CCSCCNC[C@H](C)CCCO 2230a_100160569302_100000757381 [1,1,0,0,0,0|2,0,0]=4 14802 B12R0.206 CCSCCNC[C@H](C)CCCO 34a_100160569302_100000757381 [1,1,0,0,0,0|2,0,0]=4 14803 B12R0.206 CN(CCCO)CCCCCCF 2230a_100000213112_100015922095 [1,1,0,0,0,0|2,0,0]=4 14804 B12R0.206 CN(CCCO)CCCCCCF 269982a_100000213112_100015922095 [1,1,0,0,0,0|2,0,0]=4 14805 B12R0.206 CN(CCCO)CCCCCCO 2230a_100000213112_100000766143 [1,1,0,0,0,0|2,0,0]=4 14806 B12R0.206 CN(CCCO)CCCCCCO 269982a_100000213112_100000766143 [1,1,0,0,0,0|2,0,0]=4 14807 B12R0.206 COCCC(=O)CCCCCCO 1458a_100000749529_100000766143 [1,1,0,0,0,0|1,0,1]=4 14808 B12R0.206 COCCC(=O)CCCCCCO 1458a_100011996774_100000233755 [1,1,0,0,0,0|1,0,1]=4 14809 B12R0.206 COCCC(C)NCCCCCO 270004a_100000762737_100000742357 [1,1,0,0,0,0|2,0,0]=4 14810 B12R0.206 COCCCCCC(=O)CCCO 1458a_100011935119_100011215043 [1,1,0,0,0,0|1,0,1]=4 14811 B12R0.206 COCCCNC[C@H](C)CCCO 2230a_100160569302_100000740836 [1,1,0,0,0,0|2,0,0]=4 14812 B12R0.206 COCCCNC[C@H](C)CCCO 34a_100160569302_100000740836 [1,1,0,0,0,0|2,0,0]=4 14813 B12R0.206 COCCN(C)CCCCCCO 2230a_100000743101_100000766143 [1,1,0,0,0,0|2,0,0]=4 14814 B12R0.206 COCCN(C)CCCCCCO 269982a_100000743101_100000766143 [1,1,0,0,0,0|2,0,0]=4 14815 B12R0.206 CSCCC(=O)CCCCCCO 1458a_100000174002_100000766143 [1,1,0,0,0,0|1,0,1]=4 14816 B12R0.206 CSCCC(=O)CCCCCCO 1458a_100011996774_100000751147 [1,1,0,0,0,0|1,0,1]=4 14817 B12R0.206 CSCCC(C)NCCCCCO 270004a_100000762737_100011217047 [1,1,0,0,0,0|2,0,0]=4 14818 B12R0.206 CSCCN(C)CCCCCCO 2230a_100000686725_100000766143 [1,1,0,0,0,0|2,0,0]=4 14819 B12R0.206 CSCCN(C)CCCCCCO 269982a_100000686725_100000766143 [1,1,0,0,0,0|2,0,0]=4 14820 B12R0.206 CSCC[C@H](N)COCCCCO 34a_100011827619_100011216708 [1,1,0,0,0,0|2,0,0]=4 14821 B12R0.206 C[C@H](CCCO)CNCCCCF 2230a_100160569302_100000729493 [1,1,0,0,0,0|2,0,0]=4 14822 B12R0.206 C[C@H](CCCO)CNCCCCF 34a_100160569302_100000729493 [1,1,0,0,0,0|2,0,0]=4 14823 B12R0.206 C[C@H](CCCO)CNCCCCO 2230a_100160569302_100000210776 [1,1,0,0,0,0|2,0,0]=4 14824 B12R0.206 C[C@H](CCCO)CNCCCCO 34a_100160569302_100011216708 [1,1,0,0,0,0|2,0,0]=4 14825 B12R0.206 O=C(CCCF)CCCCCCO 1458a_100011996774_100011934791 [1,1,0,0,0,0|1,0,1]=4 14826 B12R0.206 O=C(CCCO)CCCCCCO 1458a_100011996774_100011215043 [1,1,0,0,0,0|1,0,1]=4 14827 B12R0.234 C=C(C)CCNCCCCCCC 2230a_100000229938_100000730704 [1,1,0,0,0,0|1,0,1]=4 14828 B12R0.234 C=C(C)CCNCCCCCCO 2230a_100000686447_100000730704 [1,1,0,0,0,0|1,0,1]=4 14829 B12R0.234 C=C(C)CCNCCCCCCO 34a_100000686447_100000730704 [1,1,0,0,0,0|1,0,1]=4 14830 B12R0.234 C=C(C)CCOCCCCCCC 34a_100000210272_100000730704 [1,1,0,0,0,0|1,0,1]=4 14831 B12R0.234 C=C(C)CCOCCCCCCC 34a_100000764851_100000210614 [1,1,0,0,0,0|1,0,1]=4 14832 B12R0.234 C=C(C)CCOCCCCCCC 7a_100000210272_100000730704 [1,1,0,0,0,0|1,0,1]=4 14833 B12R0.234 C=C(C)CCOCCCCCCO 34a_100000764851_100000766143 [1,1,0,0,0,0|1,0,1]=4 14834 B12R0.234 C=C(C)CCSCCCCCCC 62a_100000210614_100000730704 [1,1,0,0,0,0|1,0,1]=4 14835 B12R0.234 C=C(C)CCSCCCCCCC 62a_100000730704_100000210316 [1,1,0,0,0,0|1,0,1]=4 14836 B12R0.234 C=C(C)CCSCCCCCCO 62a_100000730704_100000766143 [1,1,0,0,0,0|1,0,1]=4 14837 B12R0.234 C=C(C)CCSCCCCCCO 62a_100000766143_100000730704 [1,1,0,0,0,0|1,0,1]=4 14838 B12R0.234 C=C(C)CNCCCCCCCC 2230a_100000229939_100000748629 [1,1,0,0,0,0|1,0,1]=4 14839 B12R0.234 C=C(C)CNCCCCCCCC 34a_100000229939_100000748629 [1,1,0,0,0,0|1,0,1]=4 14840 B12R0.234 C=C(C)CNCCCCCCCO 2230a_100011996573_100000748629 [1,1,0,0,0,0|1,0,1]=4 14841 B12R0.234 C=C(C)CNCCCCCCCO 34a_100011996573_100000748629 [1,1,0,0,0,0|1,0,1]=4 14842 B12R0.234 C=C(C)COCCCCCCCC 34a_100000210232_100000748629 [1,1,0,0,0,0|1,0,1]=4 14843 B12R0.234 C=C(C)COCCCCCCCC 34a_100000210245_100000210759 [1,1,0,0,0,0|1,0,1]=4 14844 B12R0.234 C=C(C)COCCCCCCCC 7a_100000210232_100000748629 [1,1,0,0,0,0|1,0,1]=4 14845 B12R0.234 C=C(C)COCCCCCCCO 34a_100000210245_100000760002 [1,1,0,0,0,0|1,0,1]=4 14846 B12R0.234 C=C(C)CSCCCCCCCC 62a_100000210759_100000211660 [1,1,0,0,0,0|1,0,1]=4 14847 B12R0.234 C=C(C)CSCCCCCCCC 62a_100000748629_100000210317 [1,1,0,0,0,0|1,0,1]=4 14848 B12R0.234 C=C(C)CSCCCCCCCO 62a_100000748629_100000760002 [1,1,0,0,0,0|1,0,1]=4 14849 B12R0.234 C=C(C)CSCCCCCCCO 62a_100000760002_100000211660 [1,1,0,0,0,0|1,0,1]=4 14850 B12R0.234 CC(=O)CCCCCCCCCF 1458a_200009909015_200000210301 [1,1,0,0,0,0|1,0,1]=4 14851 B12R0.234 CC(=O)CCCCCCCCCO 1458a_100000070787_100009813782 [1,1,0,0,0,0|0,0,1]=3 14852 B12R0.234 CC(=O)CCCCNCCCCO 34a_100000750430_100009817362 [1,1,0,0,0,0|1,0,1]=4 14853 B12R0.234 CC(=O)CCCCSCCCCO 62a_100000210776_100000735457 [1,1,0,0,0,0|1,0,1]=4 14854 B12R0.234 CC(=O)CCCCSCCCCO 62a_100000735457_100000210776 [1,1,0,0,0,0|1,0,1]=4 14855 B12R0.234 CC(=O)CCCNCCCCCO 34a_100000762737_100000685027 [1,1,0,0,0,0|1,0,1]=4 14856 B12R0.234 CC(=O)CCCOCCCCCO 34a_100000759063_100000746330 [1,1,0,0,0,0|1,0,1]=4 14857 B12R0.234 CC(=O)CCCOCCCCCO 7a_100000759063_100000746330 [1,1,0,0,0,0|1,0,1]=4 14858 B12R0.234 CC(=O)CCCSCCCCCO 62a_100000746330_100011215641 [1,1,0,0,0,0|1,0,1]=4 14859 B12R0.234 CC(=O)CCCSCCCCCO 62a_100011215641_100000746330 [1,1,0,0,0,0|1,0,1]=4 14860 B12R0.234 CC(=O)CCOCCCCCCO 34a_100000759926_100000766143 [1,1,0,0,0,0|1,0,1]=4 14861 B12R0.234 CC(=O)CCOCCCCCCO 7a_100000759926_100000766143 [1,1,0,0,0,0|1,0,1]=4 14862 B12R0.234 CC(=O)CCSCCCCCCO 62a_100000053229_100000766143 [1,1,0,0,0,0|1,0,1]=4 14863 B12R0.234 CC(=O)CCSCCCCCCO 62a_100000766143_100000053229 [1,1,0,0,0,0|1,0,1]=4 14864 B12R0.234 CC(=O)COCCCCCCCO 34a_100000211253_100000760002 [1,1,0,0,0,0|1,0,1]=4 14865 B12R0.234 CC(=O)NCCCCCCCCO 240690a_102515433106_100015343762 [1,1,0,0,0,0|1,0,1]=4 14866 B12R0.234 CC(Br)CCOCCCCCCF 34a_100009893172_100015922095 [1,1,0,0,0,0|2,0,0]=4 14867 B12R0.234 CC(Br)CCOCCCCCCO 34a_100009893172_100000766143 [1,1,0,0,0,0|1,0,0]=3 14868 B12R0.234 CC(Br)COCCCCCCCO 34a_100012180447_100000760002 [1,1,0,0,0,0|1,0,0]=3 14869 B12R0.234 CC(C)CCCCCCCOCF 34a_200000210741_100015361967 [1,1,0,0,0,0|2,0,0]=4 14870 B12R0.234 CC(C)CCCCCCCOCF 7a_200000210741_100015361967 [1,1,0,0,0,0|2,0,0]=4 14871 B12R0.234 CC(C)CCCCCCNCCF 2230a_100000211014_100011217306 [1,1,0,0,0,0|2,0,0]=4 14872 B12R0.234 CC(C)CCCCCCNCCF 34a_100000211014_100011217306 [1,1,0,0,0,0|2,0,0]=4 14873 B12R0.234 CC(C)CCCCCCNCCO 2230a_100000211014_100000211926 [1,1,0,0,0,0|1,0,0]=3 14874 B12R0.234 CC(C)CCCCCCNCCO 34a_100000211014_100000211926 [1,1,0,0,0,0|1,0,0]=3 14875 B12R0.234 CC(C)CCCCCNCCCF 2230a_100011290863_100011934791 [1,1,0,0,0,0|2,0,0]=4 14876 B12R0.234 CC(C)CCCCCNCCCF 2230a_100015189416_100000210682 [1,1,0,0,0,0|2,0,0]=4 14877 B12R0.234 CC(C)CCCCCNCCCF 34a_100011290863_100011934791 [1,1,0,0,0,0|2,0,0]=4 14878 B12R0.234 CC(C)CCCCCNCCCF 34a_100015189416_100000210682 [1,1,0,0,0,0|2,0,0]=4 14879 B12R0.234 CC(C)CCCCCNCCCO 2230a_100011290863_100000230001 [1,1,0,0,0,0|1,0,0]=3 14880 B12R0.234 CC(C)CCCCCNCCCO 34a_100011290863_100000230001 [1,1,0,0,0,0|1,0,0]=3 14881 B12R0.234 CC(C)CCCCCOCCCBr 34a_100011217188_100000210682 [1,1,0,0,0,0|2,0,0]=4 14882 B12R0.234 CC(C)CCCCCOCCCCl 34a_100000230001_100000210682 [1,1,0,0,0,0|2,0,0]=4 14883 B12R0.234 CC(C)CCCCCOCCCF 34a_100000759539_100000210682 [1,1,0,0,0,0|2,0,0]=4 14884 B12R0.234 CC(C)CCCCCOCCCF 34a_100011995859_100011934791 [1,1,0,0,0,0|2,0,0]=4 14885 B12R0.234 CC(C)CCCCCOCCCF 7a_100011995859_100011934791 [1,1,0,0,0,0|2,0,0]=4 14886 B12R0.234 CC(C)CCCCCOCCCN 34a_100000182051_100000210682 [1,1,0,0,0,0|2,0,0]=4 14887 B12R0.234 CC(C)CCCCCOCCCO 34a_100011995859_100000230001 [1,1,0,0,0,0|1,0,0]=3 14888 B12R0.234 CC(C)CCCCCOCCCO 7a_100011995859_100011215043 [1,1,0,0,0,0|1,0,0]=3 14889 B12R0.234 CC(C)CCCCCSCCCF 62a_100000210682_100011934791 [1,1,0,0,0,0|2,0,0]=4 14890 B12R0.234 CC(C)CCCCCSCCCF 62a_100011934791_100000210682 [1,1,0,0,0,0|2,0,0]=4 14891 B12R0.234 CC(C)CCCCCSCCCO 62a_100000210682_100011215043 [1,1,0,0,0,0|1,0,0]=3 14892 B12R0.234 CC(C)CCCCCSCCCO 62a_100011215043_100000210682 [1,1,0,0,0,0|1,0,0]=3 14893 B12R0.234 CC(C)CCCCNCCCCO 2230a_100000750430_100011216152 [1,1,0,0,0,0|1,0,0]=3 14894 B12R0.234 CC(C)CCCCNCCCCO 34a_100000750430_100011216152 [1,1,0,0,0,0|1,0,0]=3 14895 B12R0.234 CC(C)CCCCOCCCCBr 34a_100011216708_100011216152 [1,1,0,0,0,0|2,0,0]=4 14896 B12R0.234 CC(C)CCCCOCCCCCl 34a_100000210776_100011216152 [1,1,0,0,0,0|2,0,0]=4 14897 B12R0.234 CC(C)CCCCOCCCCCl 7a_100000210776_100011216152 [1,1,0,0,0,0|2,0,0]=4 14898 B12R0.234 CC(C)CCCCOCCCCF 34a_100011214890_100000729493 [1,1,0,0,0,0|2,0,0]=4 14899 B12R0.234 CC(C)CCCCOCCCCF 34a_100011995726_100011216152 [1,1,0,0,0,0|2,0,0]=4 14900 B12R0.234 CC(C)CCCCOCCCCF 7a_100011214890_100000729493 [1,1,0,0,0,0|2,0,0]=4 14901 B12R0.234 CC(C)CCCCOCCCCF 7a_100011995726_100011216152 [1,1,0,0,0,0|2,0,0]=4 14902 B12R0.234 CC(C)CCCCOCCCCI 34a_200012148704_100011216152 [1,1,0,0,0,0|2,0,0]=4 14903 B12R0.234 CC(C)CCCCOCCCCN 34a_100000750430_100011216152 [1,1,0,0,0,0|2,0,0]=4 14904 B12R0.234 CC(C)CCCCOCCCCO 34a_100011214890_100011216708 [1,1,0,0,0,0|1,0,0]=3 14905 B12R0.234 CC(C)CCCCOCCCCO 7a_100011214890_100000210776 [1,1,0,0,0,0|1,0,0]=3 14906 B12R0.234 CC(C)CCCCSCCCCF 62a_100000729493_100011216152 [1,1,0,0,0,0|2,0,0]=4 14907 B12R0.234 CC(C)CCCCSCCCCF 62a_100011216152_100000729493 [1,1,0,0,0,0|2,0,0]=4 14908 B12R0.234 CC(C)CCCCSCCCCO 62a_100000210776_100011216152 [1,1,0,0,0,0|1,0,0]=3 14909 B12R0.234 CC(C)CCCCSCCCCO 62a_100011216152_100000210776 [1,1,0,0,0,0|1,0,0]=3 14910 B12R0.234 CC(C)CCCNCCCCCF 2230a_200000737386_100000729378 [1,1,0,0,0,0|2,0,0]=4 14911 B12R0.234 CC(C)CCCNCCCCCF 34a_200000737386_100000729378 [1,1,0,0,0,0|2,0,0]=4 14912 B12R0.234 CC(C)CCCNCCCCCO 2230a_100000762737_100011214892 [1,1,0,0,0,0|1,0,0]=3 14913 B12R0.234 CC(C)CCCNCCCCCO 2230a_200000737386_100000746330 [1,1,0,0,0,0|1,0,0]=3 14914 B12R0.234 CC(C)CCCNCCCCCO 34a_100000762737_100011214892 [1,1,0,0,0,0|1,0,0]=3 14915 B12R0.234 CC(C)CCCNCCCCCO 34a_200000737386_100000746330 [1,1,0,0,0,0|1,0,0]=3 14916 B12R0.234 CC(C)CCCNCCOCCO 2230a_100000211614_100011214892 [1,1,0,0,0,0|2,0,0]=4 14917 B12R0.234 CC(C)CCCNCCOCCO 2230a_200000737386_100011215305 [1,1,0,0,0,0|2,0,0]=4 14918 B12R0.234 CC(C)CCCNCCOCCO 34a_100000211614_100011214892 [1,1,0,0,0,0|2,0,0]=4 14919 B12R0.234 CC(C)CCCNCCOCCO 34a_200000737386_100000692535 [1,1,0,0,0,0|2,0,0]=4 14920 B12R0.234 CC(C)CCCNCCSCCO 2230a_100011219999_100011214892 [1,1,0,0,0,0|2,0,0]=4 14921 B12R0.234 CC(C)CCCOCCCCCBr 34a_100000746331_100011214892 [1,1,0,0,0,0|2,0,0]=4 14922 B12R0.234 CC(C)CCCOCCCCCBr 7a_100000746331_100011214892 [1,1,0,0,0,0|2,0,0]=4 14923 B12R0.234 CC(C)CCCOCCCCCCl 34a_100000746330_100011214892 [1,1,0,0,0,0|2,0,0]=4 14924 B12R0.234 CC(C)CCCOCCCCCCl 7a_100000746330_100011214892 [1,1,0,0,0,0|2,0,0]=4 14925 B12R0.234 CC(C)CCCOCCCCCF 34a_100000210774_100000729378 [1,1,0,0,0,0|2,0,0]=4 14926 B12R0.234 CC(C)CCCOCCCCCF 7a_100000210774_100000729378 [1,1,0,0,0,0|2,0,0]=4 14927 B12R0.234 CC(C)CCCOCCCCCI 34a_200012148887_100011214892 [1,1,0,0,0,0|2,0,0]=4 14928 B12R0.234 CC(C)CCCOCCCCCI 7a_200012148887_100011214892 [1,1,0,0,0,0|2,0,0]=4 14929 B12R0.234 CC(C)CCCOCCCCCN 34a_100000762737_100011214892 [1,1,0,0,0,0|2,0,0]=4 14930 B12R0.234 CC(C)CCCOCCCCCO 34a_100000210774_100000746330 [1,1,0,0,0,0|1,0,0]=3 14931 B12R0.234 CC(C)CCCOCCCCCO 7a_100000210774_100000746330 [1,1,0,0,0,0|1,0,0]=3 14932 B12R0.234 CC(C)CCCOCCOCCO 34a_100000210774_100000692535 [1,1,0,0,0,0|2,0,0]=4 14933 B12R0.234 CC(C)CCCOCCOCCO 7a_100000210774_100011215305 [1,1,0,0,0,0|2,0,0]=4 14934 B12R0.234 CC(C)CCCSCCCCCF 62a_100000729378_100011214892 [1,1,0,0,0,0|2,0,0]=4 14935 B12R0.234 CC(C)CCCSCCCCCF 62a_100011214892_100000729378 [1,1,0,0,0,0|2,0,0]=4 14936 B12R0.234 CC(C)CCCSCCCCCO 62a_100000746330_100011214892 [1,1,0,0,0,0|1,0,0]=3 14937 B12R0.234 CC(C)CCCSCCCCCO 62a_100011214892_100000746330 [1,1,0,0,0,0|1,0,0]=3 14938 B12R0.234 CC(C)CCCSCCOCCO 62a_100011214892_100011215305 [1,1,0,0,0,0|2,0,0]=4 14939 B12R0.234 CC(C)CCCSCCOCCO 62a_100011215305_100011214892 [1,1,0,0,0,0|2,0,0]=4 14940 B12R0.234 CC(C)CCNCCCCCCO 2230a_100000686447_100000210312 [1,1,0,0,0,0|1,0,0]=3 14941 B12R0.234 CC(C)CCNCCCCCCO 269862a_100000686447_100000185833 [1,1,0,0,0,0|1,0,0]=3 14942 B12R0.234 CC(C)CCNCCCCCCO 34a_100000686447_100000210312 [1,1,0,0,0,0|1,0,0]=3 14943 B12R0.234 CC(C)CCOCCCCCCBr 34a_100011215345_100000210312 [1,1,0,0,0,0|2,0,0]=4 14944 B12R0.234 CC(C)CCOCCCCCCBr 7a_100011215345_100000210626 [1,1,0,0,0,0|2,0,0]=4 14945 B12R0.234 CC(C)CCOCCCCCCCl 34a_100000766143_100000210312 [1,1,0,0,0,0|2,0,0]=4 14946 B12R0.234 CC(C)CCOCCCCCCCl 7a_100000766143_100000210626 [1,1,0,0,0,0|2,0,0]=4 14947 B12R0.234 CC(C)CCOCCCCCCF 34a_100000210254_100015922095 [1,1,0,0,0,0|2,0,0]=4 14948 B12R0.234 CC(C)CCOCCCCCCF 34a_100000732779_100000210312 [1,1,0,0,0,0|2,0,0]=4 14949 B12R0.234 CC(C)CCOCCCCCCF 7a_100000210254_100015922095 [1,1,0,0,0,0|2,0,0]=4 14950 B12R0.234 CC(C)CCOCCCCCCF 7a_100000732779_100000210626 [1,1,0,0,0,0|2,0,0]=4 14951 B12R0.234 CC(C)CCOCCCCCCN 34a_100000686447_100000210312 [1,1,0,0,0,0|2,0,0]=4 14952 B12R0.234 CC(C)CCOCCCCCCO 34a_100000210254_100000766143 [1,1,0,0,0,0|1,0,0]=3 14953 B12R0.234 CC(C)CCOCCCCCCO 7a_100000210254_100000766143 [1,1,0,0,0,0|1,0,0]=3 14954 B12R0.234 CC(C)CCSCCCCCCF 62a_100000210312_100015922095 [1,1,0,0,0,0|2,0,0]=4 14955 B12R0.234 CC(C)CCSCCCCCCF 62a_100015922095_100000210312 [1,1,0,0,0,0|2,0,0]=4 14956 B12R0.234 CC(C)CCSCCCCCCO 62a_100000210312_100000766143 [1,1,0,0,0,0|1,0,0]=3 14957 B12R0.234 CC(C)CCSCCCCCCO 62a_100000766143_100000210312 [1,1,0,0,0,0|1,0,0]=3 14958 B12R0.234 CC(C)CNCCCCCCCO 2230a_100000210953_100000760002 [1,1,0,0,0,0|1,0,0]=3 14959 B12R0.234 CC(C)CNCCCCCCCO 2230a_100011996573_100000210760 [1,1,0,0,0,0|1,0,0]=3 14960 B12R0.234 CC(C)CNCCCCCCCO 270004a_100011996573_100000210432 [1,1,0,0,0,0|1,0,0]=3 14961 B12R0.234 CC(C)CNCCCCCCCO 34a_100000210953_100000760002 [1,1,0,0,0,0|1,0,0]=3 14962 B12R0.234 CC(C)CNCCCCCCCO 34a_100011996573_100000210624 [1,1,0,0,0,0|1,0,0]=3 14963 B12R0.234 CC(C)CNCCCOCCCO 2230a_100011310245_100000210760 [1,1,0,0,0,0|2,0,0]=4 14964 B12R0.234 CC(C)CNCCCOCCCO 270004a_100011310245_100000210432 [1,1,0,0,0,0|2,0,0]=4 14965 B12R0.234 CC(C)CNCCCOCCCO 34a_100011310245_100000210624 [1,1,0,0,0,0|2,0,0]=4 14966 B12R0.234 CC(C)CNCCOCCCCO 34a_100015185251_100011216708 [1,1,0,0,0,0|2,0,0]=4 14967 B12R0.234 CC(C)COCCCCCCCBr 34a_100000760002_100000210624 [1,1,0,0,0,0|2,0,0]=4 14968 B12R0.234 CC(C)COCCCCCCCBr 7a_100000760002_100000210760 [1,1,0,0,0,0|2,0,0]=4 14969 B12R0.234 CC(C)COCCCCCCCN 34a_100011996573_100000210624 [1,1,0,0,0,0|2,0,0]=4 14970 B12R0.234 CC(C)COCCCCCCCO 34a_100000210257_100000760002 [1,1,0,0,0,0|1,0,0]=3 14971 B12R0.234 CC(C)COCCCNCCCO 2230a_100000205972_100000230001 [1,1,0,0,0,0|2,0,0]=4 14972 B12R0.234 CC(C)COCCCNCCCO 34a_100000205972_100000230001 [1,1,0,0,0,0|2,0,0]=4 14973 B12R0.234 CC(C)COCCOCCCCO 34a_100000703358_100011216708 [1,1,0,0,0,0|2,0,0]=4 14974 B12R0.234 CC(C)COCCOCCCCO 7a_100000703358_100000210776 [1,1,0,0,0,0|2,0,0]=4 14975 B12R0.234 CC(C)CSCCCCCCCO 62a_100000210624_100000760002 [1,1,0,0,0,0|1,0,0]=3 14976 B12R0.234 CC(C)CSCCCCCCCO 62a_100000760002_100000210760 [1,1,0,0,0,0|1,0,0]=3 14977 B12R0.234 CC(C)CSCCOCCCCO 34a_200000230437_100011216708 [1,1,0,0,0,0|2,0,0]=4 14978 B12R0.234 CC(C)CSCCOCCCCO 7a_200000230437_100000210776 [1,1,0,0,0,0|2,0,0]=4 14979 B12R0.234 CC(C)NCCCCCCCCO 2230a_100138425928_100000033203 [1,1,0,0,0,0|1,0,0]=3 14980 B12R0.234 CC(C)NCCCCCCCCO 2230a_102515433106_100000210206 [1,1,0,0,0,0|1,0,0]=3 14981 B12R0.234 CC(C)NCCCCCCCCO 34a_100138425928_100000033203 [1,1,0,0,0,0|1,0,0]=3 14982 B12R0.234 CC(C)NCCCCCCCCO 34a_102515433106_100000210206 [1,1,0,0,0,0|1,0,0]=3 14983 B12R0.234 CC(C)NCCCCCOCCO 34a_100011629493_100000211926 [1,1,0,0,0,0|2,0,0]=4 14984 B12R0.234 CC(C)NCCCCOCCCO 34a_100011521146_100000230001 [1,1,0,0,0,0|2,0,0]=4 14985 B12R0.234 CC(C)NCCCOCCCCO 34a_100000182298_100011216708 [1,1,0,0,0,0|2,0,0]=4 14986 B12R0.234 CC(C)NCCOCCCCCO 34a_100000224655_100000746330 [1,1,0,0,0,0|2,0,0]=4 14987 B12R0.234 CC(C)OCCCCCCCCBr 34a_100009813846_100000210206 [1,1,0,0,0,0|2,0,0]=4 14988 B12R0.234 CC(C)OCCCCCCCCBr 7a_100009813846_100000210206 [1,1,0,0,0,0|2,0,0]=4 14989 B12R0.234 CC(C)OCCCCCCCCCl 34a_100000033203_100000210206 [1,1,0,0,0,0|2,0,0]=4 14990 B12R0.234 CC(C)OCCCCCCCCCl 7a_100000033203_100000210206 [1,1,0,0,0,0|2,0,0]=4 14991 B12R0.234 CC(C)OCCCCCCCCN 34a_102515433106_100000210206 [1,1,0,0,0,0|2,0,0]=4 14992 B12R0.234 CC(C)OCCCCCCCCO 34a_100000212225_100000033203 [1,1,0,0,0,0|1,0,0]=3 14993 B12R0.234 CC(C)OCCCNCCCCO 2230a_100000737246_100000210776 [1,1,0,0,0,0|2,0,0]=4 14994 B12R0.234 CC(C)OCCCNCCCCO 34a_100000737246_100011216708 [1,1,0,0,0,0|2,0,0]=4 14995 B12R0.234 CC(C)OCCNCCCCCO 2230a_100000701111_100000746330 [1,1,0,0,0,0|2,0,0]=4 14996 B12R0.234 CC(C)OCCNCCCCCO 2230a_100000762737_100000211751 [1,1,0,0,0,0|2,0,0]=4 14997 B12R0.234 CC(C)OCCNCCCCCO 34a_100000701111_100000746330 [1,1,0,0,0,0|2,0,0]=4 14998 B12R0.234 CC(C)OCCNCCCCCO 34a_100000762737_100000211751 [1,1,0,0,0,0|2,0,0]=4 14999 B12R0.234 CC(C)OCCOCCCCCO 34a_100000211219_100000746330 [1,1,0,0,0,0|2,0,0]=4 15000 B12R0.234 CC(C)OCCOCCCCCO 7a_100000211219_100000746330 [1,1,0,0,0,0|2,0,0]=4 15001 B12R0.234 CC(C)OCCSCCCCCO 62a_100000211751_100000746330 [1,1,0,0,0,0|2,0,0]=4 15002 B12R0.234 CC(C)OCCSCCCCCO 62a_100000746330_100000211751 [1,1,0,0,0,0|2,0,0]=4 15003 B12R0.234 CC(C)OCNCCCCCCO 2230a_100000686447_100000709892 [1,1,0,0,0,0|2,0,0]=4 15004 B12R0.234 CC(C)OCNCCCCCCO 34a_100000686447_100000709892 [1,1,0,0,0,0|2,0,0]=4 15005 B12R0.234 CC(C)OCSCCCCCCO 62a_100000709892_100000766143 [1,1,0,0,0,0|2,0,0]=4 15006 B12R0.234 CC(C)OCSCCCCCCO 62a_100000766143_100000709892 [1,1,0,0,0,0|2,0,0]=4 15007 B12R0.234 CC(C)SCCCCCCCCO 62a_100000033203_100000210206 [1,1,0,0,0,0|1,0,0]=3 15008 B12R0.234 CC(C)SCCCCCCCCO 62a_100000210206_100000033203 [1,1,0,0,0,0|1,0,0]=3 15009 B12R0.234 CC(C)SCCNCCCCCO 2230a_100000731138_100000746330 [1,1,0,0,0,0|2,0,0]=4 15010 B12R0.234 CC(C)SCCNCCCCCO 2230a_100000762737_100000730970 [1,1,0,0,0,0|2,0,0]=4 15011 B12R0.234 CC(C)SCCNCCCCCO 34a_100000731138_100000746330 [1,1,0,0,0,0|2,0,0]=4 15012 B12R0.234 CC(C)SCCNCCCCCO 34a_100000762737_100000730970 [1,1,0,0,0,0|2,0,0]=4 15013 B12R0.234 CC(C)SCCOCCCCCO 34a_200011212901_100000746330 [1,1,0,0,0,0|2,0,0]=4 15014 B12R0.234 CC(C)SCCOCCCCCO 7a_200011212901_100000746330 [1,1,0,0,0,0|2,0,0]=4 15015 B12R0.234 CC(C)SCCSCCCCCO 62a_100000730970_100000746330 [1,1,0,0,0,0|2,0,0]=4 15016 B12R0.234 CC(C)SCCSCCCCCO 62a_100000746330_100000730970 [1,1,0,0,0,0|2,0,0]=4 15017 B12R0.234 CC(F)COCCCCCCCO 34a_100015925927_100000760002 [1,1,0,0,0,0|1,0,0]=3 15018 B12R0.234 CC(O)CCCNCCCCCO 2230a_100000762737_200000718107 [1,1,0,0,0,0|1,0,0]=3 15019 B12R0.234 CC(O)CCCNCCCCCO 34a_100000762737_200000718107 [1,1,0,0,0,0|1,0,0]=3 15020 B12R0.234 CC(O)CCCNCCOCCO 2230a_100000211614_200000718107 [1,1,0,0,0,0|2,0,0]=4 15021 B12R0.234 CC(O)CCCNCCOCCO 34a_100000211614_200000718107 [1,1,0,0,0,0|2,0,0]=4 15022 B12R0.234 CC(O)CCCNCCSCCO 2230a_100011219999_200000718107 [1,1,0,0,0,0|2,0,0]=4 15023 B12R0.234 CC(O)CCCOCCCCCBr 34a_100000746331_200000718107 [1,1,0,0,0,0|2,0,0]=4 15024 B12R0.234 CC(O)CCCOCCCCCBr 7a_100000746331_200000718107 [1,1,0,0,0,0|2,0,0]=4 15025 B12R0.234 CC(O)CCCOCCCCCCl 34a_100000746330_200000718107 [1,1,0,0,0,0|2,0,0]=4 15026 B12R0.234 CC(O)CCCOCCCCCCl 7a_100000746330_200000718107 [1,1,0,0,0,0|2,0,0]=4 15027 B12R0.234 CC(O)CCCOCCCCCI 34a_200012148887_200000718107 [1,1,0,0,0,0|2,0,0]=4 15028 B12R0.234 CC(O)CCCOCCCCCI 7a_200012148887_200000718107 [1,1,0,0,0,0|2,0,0]=4 15029 B12R0.234 CC(O)CCCOCCCCCN 34a_100000762737_200000718107 [1,1,0,0,0,0|2,0,0]=4 15030 B12R0.234 CC(O)CCCSCCCCCF 62a_100000729378_200000718107 [1,1,0,0,0,0|2,0,0]=4 15031 B12R0.234 CC(O)CCCSCCCCCF 62a_200000718107_100000729378 [1,1,0,0,0,0|2,0,0]=4 15032 B12R0.234 CC(O)CCCSCCCCCO 62a_100000746330_200000718107 [1,1,0,0,0,0|1,0,0]=3 15033 B12R0.234 CC(O)CCCSCCCCCO 62a_200000718107_100000746330 [1,1,0,0,0,0|1,0,0]=3 15034 B12R0.234 CC(O)CCCSCCOCCO 62a_100011215305_200000718107 [1,1,0,0,0,0|2,0,0]=4 15035 B12R0.234 CC(O)CCCSCCOCCO 62a_200000718107_100011215305 [1,1,0,0,0,0|2,0,0]=4 15036 B12R0.234 CC(O)CCNCCCCCCF 2230a_200000755665_100015922095 [1,1,0,0,0,0|2,0,0]=4 15037 B12R0.234 CC(O)CCNCCCCCCO 2230a_100000686447_100012276601 [1,1,0,0,0,0|1,0,0]=3 15038 B12R0.234 CC(O)CCNCCCCCCO 2230a_200000755665_100000766143 [1,1,0,0,0,0|1,0,0]=3 15039 B12R0.234 CC(O)CCNCCCCCCO 34a_100000686447_100012276601 [1,1,0,0,0,0|1,0,0]=3 15040 B12R0.234 CC(O)CCOCCCCCCBr 34a_100011215345_100012276601 [1,1,0,0,0,0|2,0,0]=4 15041 B12R0.234 CC(O)CCOCCCCCCBr 7a_100011215345_100012276601 [1,1,0,0,0,0|2,0,0]=4 15042 B12R0.234 CC(O)CCOCCCCCCCl 34a_100000766143_100012276601 [1,1,0,0,0,0|2,0,0]=4 15043 B12R0.234 CC(O)CCOCCCCCCCl 7a_100000766143_100012276601 [1,1,0,0,0,0|2,0,0]=4 15044 B12R0.234 CC(O)CCOCCCCCCF 34a_100000732779_100012276601 [1,1,0,0,0,0|2,0,0]=4 15045 B12R0.234 CC(O)CCOCCCCCCF 7a_100000732779_100012276601 [1,1,0,0,0,0|2,0,0]=4 15046 B12R0.234 CC(O)CCOCCCCCCN 34a_100000686447_100012276601 [1,1,0,0,0,0|2,0,0]=4 15047 B12R0.234 CC(O)CCSCCCCCCF 62a_100012276601_100015922095 [1,1,0,0,0,0|2,0,0]=4 15048 B12R0.234 CC(O)CCSCCCCCCF 62a_100015922095_100012276601 [1,1,0,0,0,0|2,0,0]=4 15049 B12R0.234 CC(O)CCSCCCCCCO 62a_100000766143_100012276601 [1,1,0,0,0,0|1,0,0]=3 15050 B12R0.234 CC(O)CCSCCCCCCO 62a_100012276601_100000766143 [1,1,0,0,0,0|1,0,0]=3 15051 B12R0.234 CC(O)CNCCCCCCCO 2230a_100000210904_100000760002 [1,1,0,0,0,0|1,0,0]=3 15052 B12R0.234 CC(O)CNCCCCCCCO 2230a_100011996573_100011218427 [1,1,0,0,0,0|1,0,0]=3 15053 B12R0.234 CC(O)CNCCCCCCCO 34a_100000210904_100000760002 [1,1,0,0,0,0|1,0,0]=3 15054 B12R0.234 CC(O)CNCCCCCCCO 34a_100011996573_100011218427 [1,1,0,0,0,0|1,0,0]=3 15055 B12R0.234 CC(O)CNCCCOCCCO 2230a_100011310245_100011218427 [1,1,0,0,0,0|2,0,0]=4 15056 B12R0.234 CC(O)CNCCCOCCCO 34a_100011310245_100011218427 [1,1,0,0,0,0|2,0,0]=4 15057 B12R0.234 CC(O)COCCCCCCCBr 34a_100000760002_100011218427 [1,1,0,0,0,0|2,0,0]=4 15058 B12R0.234 CC(O)COCCCCCCCBr 7a_100000760002_100011218427 [1,1,0,0,0,0|2,0,0]=4 15059 B12R0.234 CC(O)COCCCCCCCN 34a_100011996573_100011218427 [1,1,0,0,0,0|2,0,0]=4 15060 B12R0.234 CC(O)CSCCCCCCCO 62a_100000760002_100011218427 [1,1,0,0,0,0|1,0,0]=3 15061 B12R0.234 CC(O)CSCCCCCCCO 62a_100011218427_100000760002 [1,1,0,0,0,0|1,0,0]=3 15062 B12R0.234 CCCCCCCCCCC(=O)C 1458a_100000070787_100000210319 [1,1,0,0,0,0|0,0,1]=3 15063 B12R0.234 CCCCCCCCCCC(=O)C 1458a_100000210375_200000210301 [1,1,0,0,0,0|0,0,1]=3 15064 B12R0.234 CCCCCCCCCCC(=O)[13CH3] 1458a_100000210375_200025704644 [1,1,0,0,0,0|0,0,1]=3 15065 B12R0.234 CCCCCCCCCCN(C)C 2230a_100000207566_200000210301 [1,1,0,0,0,0|1,0,0]=3 15066 B12R0.234 CCCCCCCCCCN(C)C 2230a_100102631434_100000210320 [1,1,0,0,0,0|1,0,0]=3 15067 B12R0.234 CCCCCCCCCCN(C)C 269982a_100000207566_200000210301 [1,1,0,0,0,0|1,0,0]=3 15068 B12R0.234 CCCCCCCCCCN(C)C 269982a_100102631434_100000210320 [1,1,0,0,0,0|1,0,0]=3 15069 B12R0.234 CCCCCCCCCCN(C)[13CH3] 2230a_100000207566_200025704644 [1,1,0,0,0,0|1,0,0]=3 15070 B12R0.234 CCCCCCCCCCN(C)[13CH3] 269982a_100000207566_200025704644 [1,1,0,0,0,0|1,0,0]=3 15071 B12R0.234 CCCCCCCCCNC(=O)C 11a_100000212291_100015343762 [1,1,0,0,0,0|1,0,1]=4 15072 B12R0.234 CCCCCCCCCNC(=O)C 1626a_100000212291_100015343762 [1,1,0,0,0,0|1,0,1]=4 15073 B12R0.234 CCCCCCCCCNC(=O)C 240690a_100000212291_100015343762 [1,1,0,0,0,0|1,0,1]=4 15074 B12R0.234 CCCCCCCCCNC(=O)C 527a_100000212291_100103153847 [1,1,0,0,0,0|1,0,1]=4 15075 B12R0.234 CCCCCCCCCNC(C)C 2230a_100000212291_100000210206 [1,1,0,0,0,0|1,0,0]=3 15076 B12R0.234 CCCCCCCCCNC(C)C 2230a_100138425928_100011214924 [1,1,0,0,0,0|1,0,0]=3 15077 B12R0.234 CCCCCCCCCNC(C)C 34a_100000212291_100000210206 [1,1,0,0,0,0|1,0,0]=3 15078 B12R0.234 CCCCCCCCCNC(C)C 34a_100138425928_100011214924 [1,1,0,0,0,0|1,0,0]=3 15079 B12R0.234 CCCCCCCCCOC(C)C 34a_100000210712_100000210206 [1,1,0,0,0,0|1,0,0]=3 15080 B12R0.234 CCCCCCCCCOC(C)C 34a_100000212225_100011214924 [1,1,0,0,0,0|1,0,0]=3 15081 B12R0.234 CCCCCCCCCOC(C)C 7a_100000210712_100000210206 [1,1,0,0,0,0|1,0,0]=3 15082 B12R0.234 CCCCCCCCCSC(C)C 62a_100000210206_100000210670 [1,1,0,0,0,0|1,0,0]=3 15083 B12R0.234 CCCCCCCCNCC(=O)O 269956a_100016091260_100000210759 [1,1,0,0,0,0|1,0,1]=4 15084 B12R0.234 CCCCCCCCNCC(C)C 2230a_100000210953_100000210759 [1,1,0,0,0,0|1,0,0]=3 15085 B12R0.234 CCCCCCCCNCC(C)C 2230a_100000229939_100000210760 [1,1,0,0,0,0|1,0,0]=3 15086 B12R0.234 CCCCCCCCNCC(C)C 270004a_100000229939_100000210432 [1,1,0,0,0,0|1,0,0]=3 15087 B12R0.234 CCCCCCCCNCC(C)C 34a_100000210953_100000210759 [1,1,0,0,0,0|1,0,0]=3 15088 B12R0.234 CCCCCCCCNCC(C)C 34a_100000229939_100000210624 [1,1,0,0,0,0|1,0,0]=3 15089 B12R0.234 CCCCCCCCNCC(C)O 2230a_100000210904_100000210759 [1,1,0,0,0,0|1,0,0]=3 15090 B12R0.234 CCCCCCCCNCC(C)O 2230a_100000229939_100011218427 [1,1,0,0,0,0|1,0,0]=3 15091 B12R0.234 CCCCCCCCNCC(C)O 34a_100000210904_100000210759 [1,1,0,0,0,0|1,0,0]=3 15092 B12R0.234 CCCCCCCCNCC(C)O 34a_100000229939_100011218427 [1,1,0,0,0,0|1,0,0]=3 15093 B12R0.234 CCCCCCCCNCC(F)F 2230a_100000229939_100011934356 [1,1,0,0,0,0|2,0,0]=4 15094 B12R0.234 CCCCCCCCNCC(F)F 34a_100000229939_100011934356 [1,1,0,0,0,0|2,0,0]=4 15095 B12R0.234 CCCCCCCCNCC(F)F 34a_100000765723_100000210759 [1,1,0,0,0,0|2,0,0]=4 15096 B12R0.234 CCCCCCCCNC[C@@H](C)O 2230a_100000229939_100009817552 [1,1,0,0,0,0|1,0,0]=3 15097 B12R0.234 CCCCCCCCNC[C@@H](C)O 34a_100000229939_100009817552 [1,1,0,0,0,0|1,0,0]=3 15098 B12R0.234 CCCCCCCCOCC(=O)C 1458a_100000759886_200000210301 [1,1,0,0,0,0|1,0,1]=4 15099 B12R0.234 CCCCCCCCOCC(=O)C 34a_100000211253_100000210759 [1,1,0,0,0,0|1,0,1]=4 15100 B12R0.234 CCCCCCCCOCC(=O)[13CH3] 1458a_100000759886_200025704644 [1,1,0,0,0,0|1,0,1]=4 15101 B12R0.234 CCCCCCCCOCC(C)Br 34a_100012180447_100000210759 [1,1,0,0,0,0|1,0,0]=3 15102 B12R0.234 CCCCCCCCOCC(C)C 34a_100000210232_100000210624 [1,1,0,0,0,0|1,0,0]=3 15103 B12R0.234 CCCCCCCCOCC(C)C 34a_100000210257_100000210759 [1,1,0,0,0,0|1,0,0]=3 15104 B12R0.234 CCCCCCCCOCC(C)C 7a_100000210232_100000210760 [1,1,0,0,0,0|1,0,0]=3 15105 B12R0.234 CCCCCCCCOCC(C)F 34a_100015925927_100000210759 [1,1,0,0,0,0|1,0,0]=3 15106 B12R0.234 CCCCCCCCOCC(C)O 34a_100000210232_100011218427 [1,1,0,0,0,0|1,0,0]=3 15107 B12R0.234 CCCCCCCCOCC(C)O 7a_100000210232_100011218427 [1,1,0,0,0,0|1,0,0]=3 15108 B12R0.234 CCCCCCCCOCC(F)F 34a_100000210232_100011934356 [1,1,0,0,0,0|2,0,0]=4 15109 B12R0.234 CCCCCCCCOCC(F)F 34a_100000743014_100000210759 [1,1,0,0,0,0|2,0,0]=4 15110 B12R0.234 CCCCCCCCOCC(F)F 7a_100000210232_100011934356 [1,1,0,0,0,0|2,0,0]=4 15111 B12R0.234 CCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100000210759 [1,1,0,0,0,0|1,0,0]=3 15112 B12R0.234 CCCCCCCCOC[C@@H](C)N 34a_100000737577_100000210759 [1,1,0,0,0,0|1,0,0]=3 15113 B12R0.234 CCCCCCCCOC[C@@H](C)O 34a_100000210232_100009817552 [1,1,0,0,0,0|1,0,0]=3 15114 B12R0.234 CCCCCCCCOC[C@@H](C)O 7a_100000210232_100009817552 [1,1,0,0,0,0|1,0,0]=3 15115 B12R0.234 CCCCCCCCSCC(C)C 62a_100000210624_100000210317 [1,1,0,0,0,0|1,0,0]=3 15116 B12R0.234 CCCCCCCCSCC(C)C 62a_100000210759_100000210760 [1,1,0,0,0,0|1,0,0]=3 15117 B12R0.234 CCCCCCCCSCC(C)O 62a_100000210759_100011218427 [1,1,0,0,0,0|1,0,0]=3 15118 B12R0.234 CCCCCCCCSCC(C)O 62a_100011218427_100000210317 [1,1,0,0,0,0|1,0,0]=3 15119 B12R0.234 CCCCCCCCSCC(F)F 62a_100000210759_100011934356 [1,1,0,0,0,0|2,0,0]=4 15120 B12R0.234 CCCCCCCCSCC(F)F 62a_100011934356_100000210317 [1,1,0,0,0,0|2,0,0]=4 15121 B12R0.234 CCCCCCCCSC[C@@H](C)O 62a_100000210759_100009817552 [1,1,0,0,0,0|1,0,0]=3 15122 B12R0.234 CCCCCCCCSC[C@@H](C)O 62a_100009817552_100000210317 [1,1,0,0,0,0|1,0,0]=3 15123 B12R0.234 CCCCCCCNCCC(C)C 2230a_100000229938_100000210312 [1,1,0,0,0,0|1,0,0]=3 15124 B12R0.234 CCCCCCCNCCC(C)C 269862a_100000229938_100000185833 [1,1,0,0,0,0|1,0,0]=3 15125 B12R0.234 CCCCCCCNCCC(C)O 2230a_100000229938_100012276601 [1,1,0,0,0,0|1,0,0]=3 15126 B12R0.234 CCCCCCCNCCC(C)O 2230a_200000755665_100000210681 [1,1,0,0,0,0|1,0,0]=3 15127 B12R0.234 CCCCCCCNCOC(C)C 2230a_100000229938_100000709892 [1,1,0,0,0,0|2,0,0]=4 15128 B12R0.234 CCCCCCCOCCC(=O)C 34a_100000759926_100000210614 [1,1,0,0,0,0|1,0,1]=4 15129 B12R0.234 CCCCCCCOCCC(=O)C 7a_100000210272_100000053229 [1,1,0,0,0,0|1,0,1]=4 15130 B12R0.234 CCCCCCCOCCC(=O)C 7a_100000759926_100000210614 [1,1,0,0,0,0|1,0,1]=4 15131 B12R0.234 CCCCCCCOCCC(C)Br 34a_100009893172_100000210614 [1,1,0,0,0,0|1,0,0]=3 15132 B12R0.234 CCCCCCCOCCC(C)C 34a_100000210254_100000210614 [1,1,0,0,0,0|1,0,0]=3 15133 B12R0.234 CCCCCCCOCCC(C)C 34a_100000210272_100000210312 [1,1,0,0,0,0|1,0,0]=3 15134 B12R0.234 CCCCCCCOCCC(C)C 7a_100000210254_100000210614 [1,1,0,0,0,0|1,0,0]=3 15135 B12R0.234 CCCCCCCOCCC(C)C 7a_100000210272_100000210626 [1,1,0,0,0,0|1,0,0]=3 15136 B12R0.234 CCCCCCCOCCC(C)O 34a_100000210272_100012276601 [1,1,0,0,0,0|1,0,0]=3 15137 B12R0.234 CCCCCCCOCCC(C)O 7a_100000210272_100012276601 [1,1,0,0,0,0|1,0,0]=3 15138 B12R0.234 CCCCCCCOCCC(F)F 34a_100103093639_100000210614 [1,1,0,0,0,0|2,0,0]=4 15139 B12R0.234 CCCCCCCOCCN(C)C 7a_100000210272_100000755713 [1,1,0,0,0,0|2,0,0]=4 15140 B12R0.234 CCCCCCCOCC[C@@H](C)N 34a_100000706166_100000210614 [1,1,0,0,0,0|1,0,0]=3 15141 B12R0.234 CCCCCCCOCOC(C)C 34a_100000210272_100000709892 [1,1,0,0,0,0|2,0,0]=4 15142 B12R0.234 CCCCCCCSCCC(=O)C 62a_100000053229_100000210316 [1,1,0,0,0,0|1,0,1]=4 15143 B12R0.234 CCCCCCCSCCC(=O)C 62a_100000210614_100000053229 [1,1,0,0,0,0|1,0,1]=4 15144 B12R0.234 CCCCCCCSCCC(C)C 62a_100000210312_100000210316 [1,1,0,0,0,0|1,0,0]=3 15145 B12R0.234 CCCCCCCSCCC(C)C 62a_100000210614_100000210312 [1,1,0,0,0,0|1,0,0]=3 15146 B12R0.234 CCCCCCCSCCC(C)O 62a_100000210614_100012276601 [1,1,0,0,0,0|1,0,0]=3 15147 B12R0.234 CCCCCCCSCCC(C)O 62a_100012276601_100000210316 [1,1,0,0,0,0|1,0,0]=3 15148 B12R0.234 CCCCCCCSCCN(C)C 62a_100000210614_100000755713 [1,1,0,0,0,0|2,0,0]=4 15149 B12R0.234 CCCCCCCSCOC(C)C 62a_100000210614_100000709892 [1,1,0,0,0,0|2,0,0]=4 15150 B12R0.234 CCCCCCCSCOC(C)C 62a_100000709892_100000210316 [1,1,0,0,0,0|2,0,0]=4 15151 B12R0.234 CCCCCCNCCCC(C)C 2230a_100000210581_100011214892 [1,1,0,0,0,0|1,0,0]=3 15152 B12R0.234 CCCCCCNCCCC(C)C 2230a_200000737386_100000210314 [1,1,0,0,0,0|1,0,0]=3 15153 B12R0.234 CCCCCCNCCCC(C)C 34a_200000737386_100000210314 [1,1,0,0,0,0|1,0,0]=3 15154 B12R0.234 CCCCCCNCCCC(C)O 2230a_100000210581_200000718107 [1,1,0,0,0,0|1,0,0]=3 15155 B12R0.234 CCCCCCNCCCS(=O)C 2230a_200000753449_100000210314 [1,1,0,0,0,0|2,0,0]=4 15156 B12R0.234 CCCCCCNCCOC(C)C 2230a_100000210581_100000211751 [1,1,0,0,0,0|2,0,0]=4 15157 B12R0.234 CCCCCCNCCOC(C)C 2230a_100000701111_100000210314 [1,1,0,0,0,0|2,0,0]=4 15158 B12R0.234 CCCCCCNCCOC(C)C 34a_100000701111_100000210314 [1,1,0,0,0,0|2,0,0]=4 15159 B12R0.234 CCCCCCNCCSC(C)C 2230a_100000210581_100000730970 [1,1,0,0,0,0|2,0,0]=4 15160 B12R0.234 CCCCCCNCCSC(C)C 2230a_100000731138_100000210314 [1,1,0,0,0,0|2,0,0]=4 15161 B12R0.234 CCCCCCNCCSC(C)C 34a_100000731138_100000210314 [1,1,0,0,0,0|2,0,0]=4 15162 B12R0.234 CCCCCCOCCCC(=O)C 34a_100000210259_100000685027 [1,1,0,0,0,0|1,0,1]=4 15163 B12R0.234 CCCCCCOCCCC(=O)C 34a_100000759063_100000210314 [1,1,0,0,0,0|1,0,1]=4 15164 B12R0.234 CCCCCCOCCCC(=O)C 7a_100000210259_100011215641 [1,1,0,0,0,0|1,0,1]=4 15165 B12R0.234 CCCCCCOCCCC(=O)C 7a_100000759063_100000210314 [1,1,0,0,0,0|1,0,1]=4 15166 B12R0.234 CCCCCCOCCCC(C)C 34a_100000210259_100011214892 [1,1,0,0,0,0|1,0,0]=3 15167 B12R0.234 CCCCCCOCCCC(C)C 34a_100000210774_100000210314 [1,1,0,0,0,0|1,0,0]=3 15168 B12R0.234 CCCCCCOCCCC(C)C 7a_100000210259_100011214892 [1,1,0,0,0,0|1,0,0]=3 15169 B12R0.234 CCCCCCOCCCC(C)C 7a_100000210774_100000210314 [1,1,0,0,0,0|1,0,0]=3 15170 B12R0.234 CCCCCCOCCCC(C)O 34a_100000210259_200000718107 [1,1,0,0,0,0|1,0,0]=3 15171 B12R0.234 CCCCCCOCCCC(C)O 7a_100000210259_200000718107 [1,1,0,0,0,0|1,0,0]=3 15172 B12R0.234 CCCCCCOCCCN(C)C 7a_100000210259_100000757444 [1,1,0,0,0,0|2,0,0]=4 15173 B12R0.234 CCCCCCOCCNC(C)C 34a_100000224655_100000210314 [1,1,0,0,0,0|2,0,0]=4 15174 B12R0.234 CCCCCCOCCOC(C)C 34a_100000210259_100000211751 [1,1,0,0,0,0|2,0,0]=4 15175 B12R0.234 CCCCCCOCCOC(C)C 34a_100000211219_100000210314 [1,1,0,0,0,0|2,0,0]=4 15176 B12R0.234 CCCCCCOCCOC(C)C 34a_100000691444_100000210206 [1,1,0,0,0,0|2,0,0]=4 15177 B12R0.234 CCCCCCOCCOC(C)C 7a_100000210259_100000211751 [1,1,0,0,0,0|2,0,0]=4 15178 B12R0.234 CCCCCCOCCOC(C)C 7a_100000211219_100000210314 [1,1,0,0,0,0|2,0,0]=4 15179 B12R0.234 CCCCCCOCCOC(C)C 7a_100000691444_100000210206 [1,1,0,0,0,0|2,0,0]=4 15180 B12R0.234 CCCCCCOCCSC(C)C 34a_100000210259_100000730970 [1,1,0,0,0,0|2,0,0]=4 15181 B12R0.234 CCCCCCOCCSC(C)C 34a_200011212901_100000210314 [1,1,0,0,0,0|2,0,0]=4 15182 B12R0.234 CCCCCCOCCSC(C)C 7a_100000210259_100000730970 [1,1,0,0,0,0|2,0,0]=4 15183 B12R0.234 CCCCCCOCCSC(C)C 7a_200011212901_100000210314 [1,1,0,0,0,0|2,0,0]=4 15184 B12R0.234 CCCCCCSCCCC(=O)C 62a_100000210314_100011215641 [1,1,0,0,0,0|1,0,1]=4 15185 B12R0.234 CCCCCCSCCCC(=O)C 62a_100011215641_100000210757 [1,1,0,0,0,0|1,0,1]=4 15186 B12R0.234 CCCCCCSCCCC(C)C 62a_100000210314_100011214892 [1,1,0,0,0,0|1,0,0]=3 15187 B12R0.234 CCCCCCSCCCC(C)C 62a_100011214892_100000210757 [1,1,0,0,0,0|1,0,0]=3 15188 B12R0.234 CCCCCCSCCCC(C)O 62a_100000210314_200000718107 [1,1,0,0,0,0|1,0,0]=3 15189 B12R0.234 CCCCCCSCCCC(C)O 62a_200000718107_100000210757 [1,1,0,0,0,0|1,0,0]=3 15190 B12R0.234 CCCCCCSCCCN(C)C 62a_100000210314_100000757444 [1,1,0,0,0,0|2,0,0]=4 15191 B12R0.234 CCCCCCSCCOC(C)C 62a_100000210314_100000211751 [1,1,0,0,0,0|2,0,0]=4 15192 B12R0.234 CCCCCCSCCOC(C)C 62a_100000211751_100000210757 [1,1,0,0,0,0|2,0,0]=4 15193 B12R0.234 CCCCCCSCCSC(C)C 62a_100000210314_100000730970 [1,1,0,0,0,0|2,0,0]=4 15194 B12R0.234 CCCCCCSCCSC(C)C 62a_100000730970_100000210757 [1,1,0,0,0,0|2,0,0]=4 15195 B12R0.234 CCCCCNCCCCB(O)O 2230a_100000209983_200009817182 [1,1,0,0,0,0|2,0,0]=4 15196 B12R0.234 CCCCCNCCCCC(C)C 2230a_100000209983_100011216152 [1,1,0,0,0,0|1,0,0]=3 15197 B12R0.234 CCCCCNCCCOC(C)C 2230a_100000737246_100000210326 [1,1,0,0,0,0|2,0,0]=4 15198 B12R0.234 CCCCCNCCCOC(C)C 34a_100000737246_100000718602 [1,1,0,0,0,0|2,0,0]=4 15199 B12R0.234 CCCCCNCCOCC(C)C 34a_100000224656_100000210624 [1,1,0,0,0,0|2,0,0]=4 15200 B12R0.234 CCCCCNCCOCC(C)O 34a_100000224656_100011218427 [1,1,0,0,0,0|2,0,0]=4 15201 B12R0.234 CCCCCNCCOC[C@@H](C)O 34a_100000224656_100009817552 [1,1,0,0,0,0|2,0,0]=4 15202 B12R0.234 CCCCCOCCCCB(O)O 34a_100000210253_200009817182 [1,1,0,0,0,0|2,0,0]=4 15203 B12R0.234 CCCCCOCCCCB(O)O 7a_100000210253_200009817182 [1,1,0,0,0,0|2,0,0]=4 15204 B12R0.234 CCCCCOCCCCC(=O)C 34a_100000210253_100009817362 [1,1,0,0,0,0|1,0,1]=4 15205 B12R0.234 CCCCCOCCCCC(=O)C 7a_100000210253_100000735457 [1,1,0,0,0,0|1,0,1]=4 15206 B12R0.234 CCCCCOCCCCC(C)C 34a_100000210253_100011216152 [1,1,0,0,0,0|1,0,0]=3 15207 B12R0.234 CCCCCOCCCCC(C)C 34a_100011214890_100000718602 [1,1,0,0,0,0|1,0,0]=3 15208 B12R0.234 CCCCCOCCCCC(C)C 7a_100000210253_100011216152 [1,1,0,0,0,0|1,0,0]=3 15209 B12R0.234 CCCCCOCCCCC(C)C 7a_100011214890_100000210326 [1,1,0,0,0,0|1,0,0]=3 15210 B12R0.234 CCCCCOCCCNC(C)C 34a_100000182298_100000718602 [1,1,0,0,0,0|2,0,0]=4 15211 B12R0.234 CCCCCOCCNCC(C)C 34a_100015185251_100000718602 [1,1,0,0,0,0|2,0,0]=4 15212 B12R0.234 CCCCCOCCOCC(C)C 34a_100000703358_100000718602 [1,1,0,0,0,0|2,0,0]=4 15213 B12R0.234 CCCCCOCCOCC(C)C 34a_100011215259_100000210624 [1,1,0,0,0,0|2,0,0]=4 15214 B12R0.234 CCCCCOCCOCC(C)C 7a_100000703358_100000210326 [1,1,0,0,0,0|2,0,0]=4 15215 B12R0.234 CCCCCOCCOCC(C)C 7a_100011215259_100000210760 [1,1,0,0,0,0|2,0,0]=4 15216 B12R0.234 CCCCCOCCOCC(C)O 34a_100011215259_100011218427 [1,1,0,0,0,0|2,0,0]=4 15217 B12R0.234 CCCCCOCCOCC(C)O 7a_100011215259_100011218427 [1,1,0,0,0,0|2,0,0]=4 15218 B12R0.234 CCCCCOCCOC[C@@H](C)O 34a_100011215259_100009817552 [1,1,0,0,0,0|2,0,0]=4 15219 B12R0.234 CCCCCOCCOC[C@@H](C)O 7a_100011215259_100009817552 [1,1,0,0,0,0|2,0,0]=4 15220 B12R0.234 CCCCCOCCSCC(C)C 34a_200000230437_100000718602 [1,1,0,0,0,0|2,0,0]=4 15221 B12R0.234 CCCCCOCCSCC(C)C 7a_200000230437_100000210326 [1,1,0,0,0,0|2,0,0]=4 15222 B12R0.234 CCCCCSCCCCB(O)O 62a_100000210326_200009817182 [1,1,0,0,0,0|2,0,0]=4 15223 B12R0.234 CCCCCSCCCCB(O)O 62a_200009817182_100000210326 [1,1,0,0,0,0|2,0,0]=4 15224 B12R0.234 CCCCCSCCCCC(=O)C 62a_100000210326_100000735457 [1,1,0,0,0,0|1,0,1]=4 15225 B12R0.234 CCCCCSCCCCC(=O)C 62a_100000735457_100000210326 [1,1,0,0,0,0|1,0,1]=4 15226 B12R0.234 CCCCCSCCCCC(C)C 62a_100000210326_100011216152 [1,1,0,0,0,0|1,0,0]=3 15227 B12R0.234 CCCCCSCCCCC(C)C 62a_100011216152_100000210326 [1,1,0,0,0,0|1,0,0]=3 15228 B12R0.234 CCCCCSCCCCN(C)C 62a_100000210326_100000690147 [1,1,0,0,0,0|2,0,0]=4 15229 B12R0.234 CCCCNCCCCCB(O)O 2230a_100000102301_200009817188 [1,1,0,0,0,0|2,0,0]=4 15230 B12R0.234 CCCCNCCCCCB(O)O 7a_106832991798_200009817188 [1,1,0,0,0,0|2,0,0]=4 15231 B12R0.234 CCCCNCCCCCC(C)C 2230a_100000102301_100000210682 [1,1,0,0,0,0|1,0,0]=3 15232 B12R0.234 CCCCNCCCCCC(C)C 2230a_100011290863_100000210211 [1,1,0,0,0,0|1,0,0]=3 15233 B12R0.234 CCCCNCCCCCC(C)C 34a_100011290863_100000210210 [1,1,0,0,0,0|1,0,0]=3 15234 B12R0.234 CCCCNCCCCCC(C)C 7a_106832991798_100000210682 [1,1,0,0,0,0|1,0,0]=3 15235 B12R0.234 CCCCNCCCCOC(C)C 34a_200011216965_100000210206 [1,1,0,0,0,0|2,0,0]=4 15236 B12R0.234 CCCCNCCCOCC(C)C 2230a_100000205972_100000210211 [1,1,0,0,0,0|2,0,0]=4 15237 B12R0.234 CCCCNCCCOCC(C)C 34a_100000205972_100000210210 [1,1,0,0,0,0|2,0,0]=4 15238 B12R0.234 CCCCOCCCCCB(O)O 34a_100000210227_200009817188 [1,1,0,0,0,0|2,0,0]=4 15239 B12R0.234 CCCCOCCCCCB(O)O 7a_100000210227_200009817188 [1,1,0,0,0,0|2,0,0]=4 15240 B12R0.234 CCCCOCCCCCC(C)C 34a_100000210227_100000210682 [1,1,0,0,0,0|1,0,0]=3 15241 B12R0.234 CCCCOCCCCCC(C)C 34a_100011995859_100000210210 [1,1,0,0,0,0|1,0,0]=3 15242 B12R0.234 CCCCOCCCCCC(C)C 7a_100000210227_100000210682 [1,1,0,0,0,0|1,0,0]=3 15243 B12R0.234 CCCCOCCCCCC(C)C 7a_100011995859_100000210211 [1,1,0,0,0,0|1,0,0]=3 15244 B12R0.234 CCCCOCCCCNC(C)C 34a_100011521146_100000210210 [1,1,0,0,0,0|2,0,0]=4 15245 B12R0.234 CCCCOCCCCOC(C)C 34a_200000760531_100000210206 [1,1,0,0,0,0|2,0,0]=4 15246 B12R0.234 CCCCOCCCCOC(C)C 7a_200000760531_100000210206 [1,1,0,0,0,0|2,0,0]=4 15247 B12R0.234 CCCCOCCCNCC(C)C 2230a_200000211371_100000210760 [1,1,0,0,0,0|2,0,0]=4 15248 B12R0.234 CCCCOCCCNCC(C)C 270004a_200000211371_100000210432 [1,1,0,0,0,0|2,0,0]=4 15249 B12R0.234 CCCCOCCCNCC(C)C 34a_200000211371_100000210624 [1,1,0,0,0,0|2,0,0]=4 15250 B12R0.234 CCCCOCCCNCC(C)O 2230a_200000211371_100011218427 [1,1,0,0,0,0|2,0,0]=4 15251 B12R0.234 CCCCOCCCNCC(C)O 34a_200000211371_100011218427 [1,1,0,0,0,0|2,0,0]=4 15252 B12R0.234 CCCCOCCCNC[C@@H](C)O 2230a_200000211371_100009817552 [1,1,0,0,0,0|2,0,0]=4 15253 B12R0.234 CCCCOCCCNC[C@@H](C)O 34a_200000211371_100009817552 [1,1,0,0,0,0|2,0,0]=4 15254 B12R0.234 CCCCOCCCOCC(C)C 34a_200011215613_100000210624 [1,1,0,0,0,0|2,0,0]=4 15255 B12R0.234 CCCCOCCCOCC(C)C 7a_200011215613_100000210760 [1,1,0,0,0,0|2,0,0]=4 15256 B12R0.234 CCCCOCCCOCC(C)O 34a_200011215613_100011218427 [1,1,0,0,0,0|2,0,0]=4 15257 B12R0.234 CCCCOCCCOCC(C)O 7a_200011215613_100011218427 [1,1,0,0,0,0|2,0,0]=4 15258 B12R0.234 CCCCOCCCOC[C@@H](C)O 34a_200011215613_100009817552 [1,1,0,0,0,0|2,0,0]=4 15259 B12R0.234 CCCCOCCCOC[C@@H](C)O 7a_200011215613_100009817552 [1,1,0,0,0,0|2,0,0]=4 15260 B12R0.234 CCCCOCCNCCC(C)O 2230a_200000755665_100000743108 [1,1,0,0,0,0|2,0,0]=4 15261 B12R0.234 CCCCOCCOCCC(C)Br 34a_100009893172_100000743108 [1,1,0,0,0,0|2,0,0]=4 15262 B12R0.234 CCCCOCCOCCC(C)C 34a_100000210238_100000210312 [1,1,0,0,0,0|2,0,0]=4 15263 B12R0.234 CCCCOCCOCCC(C)C 34a_100000210254_100000743108 [1,1,0,0,0,0|2,0,0]=4 15264 B12R0.234 CCCCOCCOCCC(C)C 7a_100000210238_100000210626 [1,1,0,0,0,0|2,0,0]=4 15265 B12R0.234 CCCCOCCOCCC(C)C 7a_100000210254_100000743108 [1,1,0,0,0,0|2,0,0]=4 15266 B12R0.234 CCCCOCCOCCC(C)O 34a_100000210238_100012276601 [1,1,0,0,0,0|2,0,0]=4 15267 B12R0.234 CCCCOCCOCCC(C)O 7a_100000210238_100012276601 [1,1,0,0,0,0|2,0,0]=4 15268 B12R0.234 CCCCOCCOCC[C@@H](C)N 34a_100000706166_100000743108 [1,1,0,0,0,0|2,0,0]=4 15269 B12R0.234 CCCCOCCSCCC(C)C 62a_100000210312_100000743108 [1,1,0,0,0,0|2,0,0]=4 15270 B12R0.234 CCCCOCCSCCC(C)C 62a_100000743108_100000210312 [1,1,0,0,0,0|2,0,0]=4 15271 B12R0.234 CCCCOCCSCCC(C)O 62a_100000743108_100012276601 [1,1,0,0,0,0|2,0,0]=4 15272 B12R0.234 CCCCOCCSCCC(C)O 62a_100012276601_100000743108 [1,1,0,0,0,0|2,0,0]=4 15273 B12R0.234 CCCCOCNCCCC(C)C 2230a_200000737386_100011995733 [1,1,0,0,0,0|2,0,0]=4 15274 B12R0.234 CCCCOCNCCCC(C)C 34a_200000737386_100011995733 [1,1,0,0,0,0|2,0,0]=4 15275 B12R0.234 CCCCOCOCCCC(C)C 34a_100000210774_100011995733 [1,1,0,0,0,0|2,0,0]=4 15276 B12R0.234 CCCCOCSCCCC(C)C 62a_100011214892_100011995733 [1,1,0,0,0,0|2,0,0]=4 15277 B12R0.234 CCCCOCSCCCC(C)C 62a_100011995733_100011214892 [1,1,0,0,0,0|2,0,0]=4 15278 B12R0.234 CCCCOCSCCCC(C)O 62a_100011995733_200000718107 [1,1,0,0,0,0|2,0,0]=4 15279 B12R0.234 CCCCOCSCCCC(C)O 62a_200000718107_100011995733 [1,1,0,0,0,0|2,0,0]=4 15280 B12R0.234 CCCCSCCCCCB(O)O 62a_100000210211_200009817188 [1,1,0,0,0,0|2,0,0]=4 15281 B12R0.234 CCCCSCCCCCB(O)O 62a_200009817188_100000210210 [1,1,0,0,0,0|2,0,0]=4 15282 B12R0.234 CCCCSCCCCCC(C)C 62a_100000210211_100000210682 [1,1,0,0,0,0|1,0,0]=3 15283 B12R0.234 CCCCSCCCCCC(C)C 62a_100000210682_100000210210 [1,1,0,0,0,0|1,0,0]=3 15284 B12R0.234 CCCCSCCNCCC(C)C 2230a_100025743550_100000210312 [1,1,0,0,0,0|2,0,0]=4 15285 B12R0.234 CCCCSCCNCCC(C)C 269862a_100025743550_100000185833 [1,1,0,0,0,0|2,0,0]=4 15286 B12R0.234 CCCCSCCNCCC(C)O 2230a_100025743550_100012276601 [1,1,0,0,0,0|2,0,0]=4 15287 B12R0.234 CCCCSCCOCCC(C)C 34a_200000230436_100000210312 [1,1,0,0,0,0|2,0,0]=4 15288 B12R0.234 CCCCSCCOCCC(C)C 7a_200000230436_100000210626 [1,1,0,0,0,0|2,0,0]=4 15289 B12R0.234 CCCCSCCOCCC(C)O 34a_200000230436_100012276601 [1,1,0,0,0,0|2,0,0]=4 15290 B12R0.234 CCCCSCCOCCC(C)O 7a_200000230436_100012276601 [1,1,0,0,0,0|2,0,0]=4 15291 B12R0.234 CCCNCCCCCCC(C)C 2230a_100000211014_100000210303 [1,1,0,0,0,0|1,0,0]=3 15292 B12R0.234 CCCNCCCCCCC(C)C 34a_100000211014_100000210303 [1,1,0,0,0,0|1,0,0]=3 15293 B12R0.234 CCCOCCCCCCB(O)O 34a_100000210258_100009817187 [1,1,0,0,0,0|2,0,0]=4 15294 B12R0.234 CCCOCCCCCNC(C)C 34a_100011629493_100000210303 [1,1,0,0,0,0|2,0,0]=4 15295 B12R0.234 CCCOCCCNCCC(C)C 2230a_100011217757_100000210312 [1,1,0,0,0,0|2,0,0]=4 15296 B12R0.234 CCCOCCCNCCC(C)C 269862a_100011217757_100000185833 [1,1,0,0,0,0|2,0,0]=4 15297 B12R0.234 CCCOCCCNCCC(C)C 34a_100011217757_100000210312 [1,1,0,0,0,0|2,0,0]=4 15298 B12R0.234 CCCOCCCNCCC(C)O 2230a_100011217757_100012276601 [1,1,0,0,0,0|2,0,0]=4 15299 B12R0.234 CCCOCCCNCCC(C)O 34a_100011217757_100012276601 [1,1,0,0,0,0|2,0,0]=4 15300 B12R0.234 CCCOCCNCCCC(C)C 2230a_100161115042_100011214892 [1,1,0,0,0,0|2,0,0]=4 15301 B12R0.234 CCCOCCNCCCC(C)C 2230a_200000737386_100011215938 [1,1,0,0,0,0|2,0,0]=4 15302 B12R0.234 CCCOCCNCCCC(C)C 34a_100161115042_100011214892 [1,1,0,0,0,0|2,0,0]=4 15303 B12R0.234 CCCOCCNCCCC(C)C 34a_200000737386_100011215938 [1,1,0,0,0,0|2,0,0]=4 15304 B12R0.234 CCCOCCNCCCC(C)O 2230a_100161115042_200000718107 [1,1,0,0,0,0|2,0,0]=4 15305 B12R0.234 CCCOCCNCCCC(C)O 34a_100161115042_200000718107 [1,1,0,0,0,0|2,0,0]=4 15306 B12R0.234 CCCOCCOCCCC(C)C 34a_100000210774_100011215938 [1,1,0,0,0,0|2,0,0]=4 15307 B12R0.234 CCCOCCOCCCC(C)C 34a_100000752267_100011214892 [1,1,0,0,0,0|2,0,0]=4 15308 B12R0.234 CCCOCCOCCCC(C)C 7a_100000210774_100011215938 [1,1,0,0,0,0|2,0,0]=4 15309 B12R0.234 CCCOCCOCCCC(C)C 7a_100000752267_100011214892 [1,1,0,0,0,0|2,0,0]=4 15310 B12R0.234 CCCOCCOCCCC(C)O 34a_100000752267_200000718107 [1,1,0,0,0,0|2,0,0]=4 15311 B12R0.234 CCCOCCOCCCC(C)O 7a_100000752267_200000718107 [1,1,0,0,0,0|2,0,0]=4 15312 B12R0.234 CCCOCCSCCCC(C)C 62a_100011214892_100011215938 [1,1,0,0,0,0|2,0,0]=4 15313 B12R0.234 CCCOCCSCCCC(C)C 62a_100011215938_100011214892 [1,1,0,0,0,0|2,0,0]=4 15314 B12R0.234 CCCOCCSCCCC(C)O 62a_100011215938_200000718107 [1,1,0,0,0,0|2,0,0]=4 15315 B12R0.234 CCCOCCSCCCC(C)O 62a_200000718107_100011215938 [1,1,0,0,0,0|2,0,0]=4 15316 B12R0.234 CCCSCCCCCCB(O)O 62a_100000210303_100009817187 [1,1,0,0,0,0|2,0,0]=4 15317 B12R0.234 CCCSCCCCCCB(O)O 62a_100009817187_100000210303 [1,1,0,0,0,0|2,0,0]=4 15318 B12R0.234 CCCSCCNCCCC(C)C 2230a_100020603323_100011214892 [1,1,0,0,0,0|2,0,0]=4 15319 B12R0.234 CCCSCCNCCCC(C)O 2230a_100020603323_200000718107 [1,1,0,0,0,0|2,0,0]=4 15320 B12R0.234 CCCSCCOCCCC(C)C 34a_200000230433_100011214892 [1,1,0,0,0,0|2,0,0]=4 15321 B12R0.234 CCCSCCOCCCC(C)C 7a_200000230433_100011214892 [1,1,0,0,0,0|2,0,0]=4 15322 B12R0.234 CCCSCCOCCCC(C)O 34a_200000230433_200000718107 [1,1,0,0,0,0|2,0,0]=4 15323 B12R0.234 CCCSCCOCCCC(C)O 7a_200000230433_200000718107 [1,1,0,0,0,0|2,0,0]=4 15324 B12R0.234 CCOCCCCCCCC(C)C 34a_200000210741_100000210202 [1,1,0,0,0,0|1,0,0]=3 15325 B12R0.234 CCOCCCCCCCC(C)C 7a_200000210741_100000210202 [1,1,0,0,0,0|1,0,0]=3 15326 B12R0.234 CCOCCCNCCCC(C)C 2230a_100000210961_100011214892 [1,1,0,0,0,0|2,0,0]=4 15327 B12R0.234 CCOCCCNCCCC(C)C 2230a_200000737386_100012232248 [1,1,0,0,0,0|2,0,0]=4 15328 B12R0.234 CCOCCCNCCCC(C)C 34a_100000210961_100011214892 [1,1,0,0,0,0|2,0,0]=4 15329 B12R0.234 CCOCCCNCCCC(C)C 34a_200000737386_100012232248 [1,1,0,0,0,0|2,0,0]=4 15330 B12R0.234 CCOCCCNCCCC(C)O 2230a_100000210961_200000718107 [1,1,0,0,0,0|2,0,0]=4 15331 B12R0.234 CCOCCCNCCCC(C)O 34a_100000210961_200000718107 [1,1,0,0,0,0|2,0,0]=4 15332 B12R0.234 CCOCCCOCCCC(C)C 34a_100000210774_100012232248 [1,1,0,0,0,0|2,0,0]=4 15333 B12R0.234 CCOCCCOCCCC(C)C 34a_100000757476_100011214892 [1,1,0,0,0,0|2,0,0]=4 15334 B12R0.234 CCOCCCOCCCC(C)C 7a_100000210774_100012232248 [1,1,0,0,0,0|2,0,0]=4 15335 B12R0.234 CCOCCCOCCCC(C)C 7a_100000757476_100011214892 [1,1,0,0,0,0|2,0,0]=4 15336 B12R0.234 CCOCCCOCCCC(C)O 34a_100000757476_200000718107 [1,1,0,0,0,0|2,0,0]=4 15337 B12R0.234 CCOCCCOCCCC(C)O 7a_100000757476_200000718107 [1,1,0,0,0,0|2,0,0]=4 15338 B12R0.234 CCOCCCSCCCC(C)C 62a_100011214892_100012232248 [1,1,0,0,0,0|2,0,0]=4 15339 B12R0.234 CCOCCCSCCCC(C)C 62a_100012232248_100011214892 [1,1,0,0,0,0|2,0,0]=4 15340 B12R0.234 CCOCCCSCCCC(C)O 62a_100012232248_200000718107 [1,1,0,0,0,0|2,0,0]=4 15341 B12R0.234 CCOCCCSCCCC(C)O 62a_200000718107_100012232248 [1,1,0,0,0,0|2,0,0]=4 15342 B12R0.234 CCOCCNCCCCC(C)C 2230a_102516460346_100011216152 [1,1,0,0,0,0|2,0,0]=4 15343 B12R0.234 CCOCCNCCCCC(C)C 34a_102516460346_100011216152 [1,1,0,0,0,0|2,0,0]=4 15344 B12R0.234 CCOCCOCCCCC(C)C 34a_100000210136_100011216152 [1,1,0,0,0,0|2,0,0]=4 15345 B12R0.234 CCOCCOCCCCC(C)C 34a_100011214890_100000210147 [1,1,0,0,0,0|2,0,0]=4 15346 B12R0.234 CCOCCOCCCCC(C)C 7a_100000210136_100011216152 [1,1,0,0,0,0|2,0,0]=4 15347 B12R0.234 CCOCCOCCCCC(C)C 7a_100011214890_100011215890 [1,1,0,0,0,0|2,0,0]=4 15348 B12R0.234 CCOCCSCCCCC(C)C 62a_100000210147_100011216152 [1,1,0,0,0,0|2,0,0]=4 15349 B12R0.234 CCOCCSCCCCC(C)C 62a_100011216152_100011215890 [1,1,0,0,0,0|2,0,0]=4 15350 B12R0.234 CCOCSCCCCCC(C)C 62a_100000210682_100000739092 [1,1,0,0,0,0|2,0,0]=4 15351 B12R0.234 CCOCSCCCCCC(C)C 62a_100000739092_100000210682 [1,1,0,0,0,0|2,0,0]=4 15352 B12R0.234 CCSCCCOCCCC(C)C 34a_100011216438_100011214892 [1,1,0,0,0,0|2,0,0]=4 15353 B12R0.234 CCSCCCOCCCC(C)C 7a_100011216438_100011214892 [1,1,0,0,0,0|2,0,0]=4 15354 B12R0.234 CCSCCCOCCCC(C)O 34a_100011216438_200000718107 [1,1,0,0,0,0|2,0,0]=4 15355 B12R0.234 CCSCCCOCCCC(C)O 7a_100011216438_200000718107 [1,1,0,0,0,0|2,0,0]=4 15356 B12R0.234 CCSCCNCCCCC(C)C 2230a_100000106463_100011216152 [1,1,0,0,0,0|2,0,0]=4 15357 B12R0.234 CCSCCOCCCCC(C)C 34a_100000212035_100011216152 [1,1,0,0,0,0|2,0,0]=4 15358 B12R0.234 CCSCCOCCCCC(C)C 34a_100011214890_100000757381 [1,1,0,0,0,0|2,0,0]=4 15359 B12R0.234 CCSCCOCCCCC(C)C 7a_100000212035_100011216152 [1,1,0,0,0,0|2,0,0]=4 15360 B12R0.234 CCSCCOCCCCC(C)C 7a_100011214890_100000757381 [1,1,0,0,0,0|2,0,0]=4 15361 B12R0.234 CCSCCSCCCCC(C)C 62a_100000757381_100011216152 [1,1,0,0,0,0|2,0,0]=4 15362 B12R0.234 CCSCCSCCCCC(C)C 62a_100011216152_100000757381 [1,1,0,0,0,0|2,0,0]=4 15363 B12R0.234 CN(C)CCCCCCCCCO 2230a_100102631434_100009813782 [1,1,0,0,0,0|1,0,0]=3 15364 B12R0.234 CN(C)CCCCCCCCCO 269982a_100102631434_100009813782 [1,1,0,0,0,0|1,0,0]=3 15365 B12R0.234 CN(C)CCCCSCCCCO 62a_100000210776_100000690147 [1,1,0,0,0,0|2,0,0]=4 15366 B12R0.234 CN(C)CCCSCCCCCO 62a_100000746330_100000757444 [1,1,0,0,0,0|2,0,0]=4 15367 B12R0.234 CN(C)CCSCCCCCCO 62a_100000766143_100000755713 [1,1,0,0,0,0|2,0,0]=4 15368 B12R0.234 CNCCCCCOCCC(C)C 34a_100000722520_100000210312 [1,1,0,0,0,0|2,0,0]=4 15369 B12R0.234 CNCCCCCOCCC(C)O 34a_100000722520_100012276601 [1,1,0,0,0,0|2,0,0]=4 15370 B12R0.234 CNCCCOCCCCC(C)C 34a_100000213112_100011216152 [1,1,0,0,0,0|2,0,0]=4 15371 B12R0.234 COCCCCCCNCC(C)C 2230a_100000210953_100011998445 [1,1,0,0,0,0|2,0,0]=4 15372 B12R0.234 COCCCCCCNCC(C)C 34a_100000210953_100011998445 [1,1,0,0,0,0|2,0,0]=4 15373 B12R0.234 COCCCCCCNCC(C)O 2230a_100000210904_100011998445 [1,1,0,0,0,0|2,0,0]=4 15374 B12R0.234 COCCCCCCNCC(C)O 34a_100000210904_100011998445 [1,1,0,0,0,0|2,0,0]=4 15375 B12R0.234 COCCCCCCOCC(C)Br 34a_100012180447_100011998445 [1,1,0,0,0,0|2,0,0]=4 15376 B12R0.234 COCCCCCCOCC(C)C 34a_100000210257_100011998445 [1,1,0,0,0,0|2,0,0]=4 15377 B12R0.234 COCCCCCCOCC(C)C 34a_200012092642_100000210624 [1,1,0,0,0,0|2,0,0]=4 15378 B12R0.234 COCCCCCCOCC(C)C 7a_200012092642_100000210760 [1,1,0,0,0,0|2,0,0]=4 15379 B12R0.234 COCCCCCCOCC(C)F 34a_100015925927_100011998445 [1,1,0,0,0,0|2,0,0]=4 15380 B12R0.234 COCCCCCCOCC(C)O 34a_200012092642_100011218427 [1,1,0,0,0,0|2,0,0]=4 15381 B12R0.234 COCCCCCCOCC(C)O 7a_200012092642_100011218427 [1,1,0,0,0,0|2,0,0]=4 15382 B12R0.234 COCCCCCCOC[C@@H](C)Cl 34a_100016084084_100011998445 [1,1,0,0,0,0|2,0,0]=4 15383 B12R0.234 COCCCCCCOC[C@@H](C)N 34a_100000737577_100011998445 [1,1,0,0,0,0|2,0,0]=4 15384 B12R0.234 COCCCCCCOC[C@@H](C)O 34a_200012092642_100009817552 [1,1,0,0,0,0|2,0,0]=4 15385 B12R0.234 COCCCCCCOC[C@@H](C)O 7a_200012092642_100009817552 [1,1,0,0,0,0|2,0,0]=4 15386 B12R0.234 COCCCCCCSCC(C)C 62a_100000210624_100011998445 [1,1,0,0,0,0|2,0,0]=4 15387 B12R0.234 COCCCCCCSCC(C)C 62a_100011998445_100000210760 [1,1,0,0,0,0|2,0,0]=4 15388 B12R0.234 COCCCCCCSCC(C)O 62a_100011218427_100011998445 [1,1,0,0,0,0|2,0,0]=4 15389 B12R0.234 COCCCCCCSCC(C)O 62a_100011998445_100011218427 [1,1,0,0,0,0|2,0,0]=4 15390 B12R0.234 COCCCCCCSC[C@@H](C)O 62a_100009817552_100011998445 [1,1,0,0,0,0|2,0,0]=4 15391 B12R0.234 COCCCCCCSC[C@@H](C)O 62a_100011998445_100009817552 [1,1,0,0,0,0|2,0,0]=4 15392 B12R0.234 COCCCCCNCCC(C)C 2230a_100000747528_100000210312 [1,1,0,0,0,0|2,0,0]=4 15393 B12R0.234 COCCCCCNCCC(C)C 269862a_100000747528_100000185833 [1,1,0,0,0,0|2,0,0]=4 15394 B12R0.234 COCCCCCNCCC(C)C 34a_100000747528_100000210312 [1,1,0,0,0,0|2,0,0]=4 15395 B12R0.234 COCCCCCNCCC(C)O 2230a_100000747528_100012276601 [1,1,0,0,0,0|2,0,0]=4 15396 B12R0.234 COCCCCCNCCC(C)O 34a_100000747528_100012276601 [1,1,0,0,0,0|2,0,0]=4 15397 B12R0.234 COCCCCNCCCC(C)C 2230a_200000737386_100000730899 [1,1,0,0,0,0|2,0,0]=4 15398 B12R0.234 COCCCCNCCCC(C)C 34a_200000737386_100000755781 [1,1,0,0,0,0|2,0,0]=4 15399 B12R0.234 COCCCCOCCCC(C)C 34a_100000210774_100000755781 [1,1,0,0,0,0|2,0,0]=4 15400 B12R0.234 COCCCCOCCCC(C)C 34a_100000740925_100011214892 [1,1,0,0,0,0|2,0,0]=4 15401 B12R0.234 COCCCCOCCCC(C)C 7a_100000210774_100000730899 [1,1,0,0,0,0|2,0,0]=4 15402 B12R0.234 COCCCCOCCCC(C)O 34a_100000740925_200000718107 [1,1,0,0,0,0|2,0,0]=4 15403 B12R0.234 COCCCCSCCCC(C)C 62a_100000730899_100011214892 [1,1,0,0,0,0|2,0,0]=4 15404 B12R0.234 COCCCCSCCCC(C)C 62a_100011214892_100000730899 [1,1,0,0,0,0|2,0,0]=4 15405 B12R0.234 COCCCCSCCCC(C)O 62a_100000730899_200000718107 [1,1,0,0,0,0|2,0,0]=4 15406 B12R0.234 COCCCCSCCCC(C)O 62a_200000718107_100000730899 [1,1,0,0,0,0|2,0,0]=4 15407 B12R0.234 COCCCNCCCCC(C)C 34a_100150723488_100011216152 [1,1,0,0,0,0|2,0,0]=4 15408 B12R0.234 COCCCOCCCCC(C)C 34a_100000740835_100011216152 [1,1,0,0,0,0|2,0,0]=4 15409 B12R0.234 COCCCOCCCCC(C)C 34a_100011214890_100000740836 [1,1,0,0,0,0|2,0,0]=4 15410 B12R0.234 COCCCOCCCCC(C)C 7a_100011214890_100000740836 [1,1,0,0,0,0|2,0,0]=4 15411 B12R0.234 COCCCSCCCCC(C)C 62a_100000709357_100011216152 [1,1,0,0,0,0|2,0,0]=4 15412 B12R0.234 COCCCSCCCCC(C)C 62a_100011216152_100000709357 [1,1,0,0,0,0|2,0,0]=4 15413 B12R0.234 COCCNCCCCCC(C)C 2230a_100000209980_100000210682 [1,1,0,0,0,0|2,0,0]=4 15414 B12R0.234 COCCNCCCCCC(C)C 2230a_100011290863_100011201679 [1,1,0,0,0,0|2,0,0]=4 15415 B12R0.234 COCCNCCCCCC(C)C 34a_100011290863_100011201679 [1,1,0,0,0,0|2,0,0]=4 15416 B12R0.234 COCCOCCCCCC(C)C 34a_100000210237_100000210682 [1,1,0,0,0,0|2,0,0]=4 15417 B12R0.234 COCCOCCCCCC(C)C 34a_100011995859_100011201679 [1,1,0,0,0,0|2,0,0]=4 15418 B12R0.234 COCCOCCCCCC(C)C 7a_100011995859_100000233755 [1,1,0,0,0,0|2,0,0]=4 15419 B12R0.234 COCCSCCCCCC(C)C 62a_100000210682_100000233755 [1,1,0,0,0,0|2,0,0]=4 15420 B12R0.234 COCCSCCCCCC(C)C 62a_100000233755_100000210682 [1,1,0,0,0,0|2,0,0]=4 15421 B12R0.234 COCNCCCCCCC(C)C 2230a_100000211014_100000766300 [1,1,0,0,0,0|2,0,0]=4 15422 B12R0.234 CS(=O)CCCNCCCCCO 2230a_200000753449_100000746330 [1,1,0,0,0,0|2,0,0]=4 15423 B12R0.234 CSCCCCOCCCC(C)C 34a_100011217163_100011214892 [1,1,0,0,0,0|2,0,0]=4 15424 B12R0.234 CSCCCCOCCCC(C)C 7a_100011217163_100011214892 [1,1,0,0,0,0|2,0,0]=4 15425 B12R0.234 CSCCCCOCCCC(C)O 34a_100011217163_200000718107 [1,1,0,0,0,0|2,0,0]=4 15426 B12R0.234 CSCCCCOCCCC(C)O 7a_100011217163_200000718107 [1,1,0,0,0,0|2,0,0]=4 15427 B12R0.234 CSCCCNCCCCC(C)C 2230a_100000749238_100011216152 [1,1,0,0,0,0|2,0,0]=4 15428 B12R0.234 CSCCCOCCCCC(C)C 34a_100000690336_100011216152 [1,1,0,0,0,0|2,0,0]=4 15429 B12R0.234 CSCCCOCCCCC(C)C 7a_100000690336_100011216152 [1,1,0,0,0,0|2,0,0]=4 15430 B12R0.234 CSCCNCCCCCC(C)C 2230a_100011290863_100000751147 [1,1,0,0,0,0|2,0,0]=4 15431 B12R0.234 CSCCNCCCCCC(C)C 2230a_100020590264_100000210682 [1,1,0,0,0,0|2,0,0]=4 15432 B12R0.234 CSCCNCCCCCC(C)C 34a_100011290863_100000212216 [1,1,0,0,0,0|2,0,0]=4 15433 B12R0.234 CSCCOCCCCCC(C)C 34a_100000230434_100000210682 [1,1,0,0,0,0|2,0,0]=4 15434 B12R0.234 CSCCOCCCCCC(C)C 34a_100011995859_100000212216 [1,1,0,0,0,0|2,0,0]=4 15435 B12R0.234 CSCCOCCCCCC(C)C 7a_100000230434_100000210682 [1,1,0,0,0,0|2,0,0]=4 15436 B12R0.234 CSCCOCCCCCC(C)C 7a_100011995859_100000212216 [1,1,0,0,0,0|2,0,0]=4 15437 B12R0.234 CSCCSCCCCCC(C)C 62a_100000210682_100000751147 [1,1,0,0,0,0|2,0,0]=4 15438 B12R0.234 CSCCSCCCCCC(C)C 62a_100000212216_100000210682 [1,1,0,0,0,0|2,0,0]=4 15439 B12R0.234 CSCNCCCCCCC(C)C 2230a_100000211014_100011218213 [1,1,0,0,0,0|2,0,0]=4 15440 B12R0.234 CSCNCCCCCCC(C)C 34a_100000211014_100011218213 [1,1,0,0,0,0|2,0,0]=4 15441 B12R0.234 C[C@@H](Cl)COCCCCCCCO 34a_100016084084_100000760002 [1,1,0,0,0,0|1,0,0]=3 15442 B12R0.234 C[C@@H](N)CCOCCCCCCF 34a_100000706166_100015922095 [1,1,0,0,0,0|2,0,0]=4 15443 B12R0.234 C[C@@H](N)CCOCCCCCCO 34a_100000706166_100000766143 [1,1,0,0,0,0|1,0,0]=3 15444 B12R0.234 C[C@@H](N)COCCCCCCCO 34a_100000737577_100000760002 [1,1,0,0,0,0|1,0,0]=3 15445 B12R0.234 C[C@@H](O)CNCCCCCCCO 2230a_100011996573_100009817552 [1,1,0,0,0,0|1,0,0]=3 15446 B12R0.234 C[C@@H](O)CNCCCCCCCO 34a_100011996573_100009817552 [1,1,0,0,0,0|1,0,0]=3 15447 B12R0.234 C[C@@H](O)CNCCCOCCCO 2230a_100011310245_100009817552 [1,1,0,0,0,0|2,0,0]=4 15448 B12R0.234 C[C@@H](O)CNCCCOCCCO 34a_100011310245_100009817552 [1,1,0,0,0,0|2,0,0]=4 15449 B12R0.234 C[C@@H](O)COCCCCCCCBr 34a_100000760002_100009817552 [1,1,0,0,0,0|2,0,0]=4 15450 B12R0.234 C[C@@H](O)COCCCCCCCBr 7a_100000760002_100009817552 [1,1,0,0,0,0|2,0,0]=4 15451 B12R0.234 C[C@@H](O)COCCCCCCCN 34a_100011996573_100009817552 [1,1,0,0,0,0|2,0,0]=4 15452 B12R0.234 C[C@@H](O)CSCCCCCCCO 62a_100000760002_100009817552 [1,1,0,0,0,0|1,0,0]=3 15453 B12R0.234 C[C@@H](O)CSCCCCCCCO 62a_100009817552_100000760002 [1,1,0,0,0,0|1,0,0]=3 15454 B12R0.234 OCCCCCCCNCC(F)F 2230a_100011996573_100011934356 [1,1,0,0,0,0|2,0,0]=4 15455 B12R0.234 OCCCCCCCNCC(F)F 34a_100000765723_100000760002 [1,1,0,0,0,0|2,0,0]=4 15456 B12R0.234 OCCCCCCCNCC(F)F 34a_100011996573_100011934356 [1,1,0,0,0,0|2,0,0]=4 15457 B12R0.234 OCCCCCCCOCC(F)F 34a_100000743014_100000760002 [1,1,0,0,0,0|2,0,0]=4 15458 B12R0.234 OCCCCCCCSCC(F)F 62a_100000760002_100011934356 [1,1,0,0,0,0|2,0,0]=4 15459 B12R0.234 OCCCCCCCSCC(F)F 62a_100011934356_100000760002 [1,1,0,0,0,0|2,0,0]=4 15460 B12R0.234 OCCCCCCOCCC(F)F 34a_100103093639_100000766143 [1,1,0,0,0,0|2,0,0]=4 15461 B12R0.234 [13CH3]C(=O)CCCCCCCCCF 1458a_200009909015_200025704644 [1,1,0,0,0,0|1,0,1]=4 15462 B12R0.248 CC(CF)OCCCCCCCO 34a_100016041109_100000760002 [1,1,0,0,0,0|2,0,0]=4 15463 B12R0.248 CC(CF)OCCCCCCCO 7a_100016041109_100000760002 [1,1,0,0,0,0|2,0,0]=4 15464 B12R0.248 CC(CN)COCCCCCCO 34a_100000744482_100000766143 [1,1,0,0,0,0|2,0,0]=4 15465 B12R0.248 CC(CN)OCCCCCCCO 34a_100000210904_100000760002 [1,1,0,0,0,0|2,0,0]=4 15466 B12R0.248 CC(CO)CCNCCCCCF 2230a_106354213184_100000729378 [1,1,0,0,0,0|2,0,0]=4 15467 B12R0.248 CC(CO)CCNCCCCCF 34a_106354213184_100000729378 [1,1,0,0,0,0|2,0,0]=4 15468 B12R0.248 CC(CO)CCNCCCCCO 2230a_106354213184_100000746330 [1,1,0,0,0,0|2,0,0]=4 15469 B12R0.248 CC(CO)CCNCCCCCO 34a_106354213184_100000746330 [1,1,0,0,0,0|2,0,0]=4 15470 B12R0.248 CC(CO)CNCCCCCCF 34a_100000744482_100015922095 [1,1,0,0,0,0|2,0,0]=4 15471 B12R0.248 CC(CO)CNCCCCCCO 34a_100000744482_100000766143 [1,1,0,0,0,0|2,0,0]=4 15472 B12R0.248 CC(CO)NCCCCCCCO 2230a_100011996573_100012180447 [1,1,0,0,0,0|2,0,0]=4 15473 B12R0.248 CC(CO)NCCCCCCCO 34a_100011996573_100012180447 [1,1,0,0,0,0|2,0,0]=4 15474 B12R0.248 CC(CO)OCCCCCCCBr 34a_100000760002_100012180447 [1,1,0,0,0,0|2,0,0]=4 15475 B12R0.248 CC(CO)OCCCCCCCBr 7a_100000760002_100012180447 [1,1,0,0,0,0|2,0,0]=4 15476 B12R0.248 CC(CO)OCCCCCCCN 34a_100011996573_100012180447 [1,1,0,0,0,0|2,0,0]=4 15477 B12R0.248 CC(CO)SCCCCCCCO 62a_100012180447_100000760002 [1,1,0,0,0,0|2,0,0]=4 15478 B12R0.248 CCC(=O)CCCCCCCCO 1458a_100000210414_100000033203 [1,1,0,0,0,0|0,0,1]=3 15479 B12R0.248 CCC(=O)COCCCCCCO 34a_100000725409_100000766143 [1,1,0,0,0,0|1,0,1]=4 15480 B12R0.248 CCC(=O)CSCCCCCCO 62a_100000747405_100000766143 [1,1,0,0,0,0|1,0,1]=4 15481 B12R0.248 CCC(=O)CSCCCCCCO 62a_100000766143_100000747405 [1,1,0,0,0,0|1,0,1]=4 15482 B12R0.248 CCC(=O)NCCCCCCCO 240690a_100011996573_100000210414 [1,1,0,0,0,0|1,0,1]=4 15483 B12R0.248 CCC(C)CCCCCOCCF 7a_200000035636_100011217306 [1,1,0,0,0,0|2,0,0]=4 15484 B12R0.248 CCC(C)CCCCCOCCO 7a_200000035636_100000211926 [1,1,0,0,0,0|1,0,0]=3 15485 B12R0.248 CCC(C)CCCOCCCCF 7a_100011216074_100000729493 [1,1,0,0,0,0|2,0,0]=4 15486 B12R0.248 CCC(C)CCCOCCCCO 7a_100011216074_100000210776 [1,1,0,0,0,0|1,0,0]=3 15487 B12R0.248 CCC(C)CCCOCCCOC 7a_100011216074_100000740836 [1,1,0,0,0,0|2,0,0]=4 15488 B12R0.248 CCC(C)CCNCCCCCF 2230a_100020591266_100000729378 [1,1,0,0,0,0|2,0,0]=4 15489 B12R0.248 CCC(C)CCNCCCCCO 2230a_100020591266_100000746330 [1,1,0,0,0,0|1,0,0]=3 15490 B12R0.248 CCC(C)CCNCCCCOC 2230a_100020591266_100000730899 [1,1,0,0,0,0|2,0,0]=4 15491 B12R0.248 CCC(C)CCNCCOCCO 2230a_100020591266_100011215305 [1,1,0,0,0,0|2,0,0]=4 15492 B12R0.248 CCC(C)CCOCCCCCF 7a_100011215188_100000729378 [1,1,0,0,0,0|2,0,0]=4 15493 B12R0.248 CCC(C)CCOCCCCCO 7a_100011215188_100000746330 [1,1,0,0,0,0|1,0,0]=3 15494 B12R0.248 CCC(C)CCOCCCCOC 7a_100011215188_100000730899 [1,1,0,0,0,0|2,0,0]=4 15495 B12R0.248 CCC(C)CCOCCOCCO 7a_100011215188_100011215305 [1,1,0,0,0,0|2,0,0]=4 15496 B12R0.248 CCC(C)CNCCCCCCF 2230a_100020588543_100015922095 [1,1,0,0,0,0|2,0,0]=4 15497 B12R0.248 CCC(C)CNCCCCCCO 2230a_100000686447_100000748023 [1,1,0,0,0,0|1,0,0]=3 15498 B12R0.248 CCC(C)CNCCCCCCO 2230a_100020588543_100000766143 [1,1,0,0,0,0|1,0,0]=3 15499 B12R0.248 CCC(C)CNCCCCCCO 270004a_100000686447_100000243153 [1,1,0,0,0,0|1,0,0]=3 15500 B12R0.248 CCC(C)CNCCCCCCO 34a_100000686447_100000748023 [1,1,0,0,0,0|1,0,0]=3 15501 B12R0.248 CCC(C)CNCCCCCOC 2230a_100000747528_100000748023 [1,1,0,0,0,0|2,0,0]=4 15502 B12R0.248 CCC(C)CNCCCCCOC 270004a_100000747528_100000243153 [1,1,0,0,0,0|2,0,0]=4 15503 B12R0.248 CCC(C)CNCCCCCOC 34a_100000747528_100000748023 [1,1,0,0,0,0|2,0,0]=4 15504 B12R0.248 CCC(C)COCCCCCCBr 34a_100011215345_100000748023 [1,1,0,0,0,0|2,0,0]=4 15505 B12R0.248 CCC(C)COCCCCCCBr 7a_100011215345_100000748023 [1,1,0,0,0,0|2,0,0]=4 15506 B12R0.248 CCC(C)COCCCCCCCl 34a_100000766143_100000748023 [1,1,0,0,0,0|2,0,0]=4 15507 B12R0.248 CCC(C)COCCCCCCCl 7a_100000766143_100000748023 [1,1,0,0,0,0|2,0,0]=4 15508 B12R0.248 CCC(C)COCCCCCCF 34a_100000732779_100000748023 [1,1,0,0,0,0|2,0,0]=4 15509 B12R0.248 CCC(C)COCCCCCCF 7a_100000732779_100000748023 [1,1,0,0,0,0|2,0,0]=4 15510 B12R0.248 CCC(C)COCCCCCCN 34a_100000686447_100000748023 [1,1,0,0,0,0|2,0,0]=4 15511 B12R0.248 CCC(C)COCCCCCNC 34a_100000722520_100000748023 [1,1,0,0,0,0|2,0,0]=4 15512 B12R0.248 CCC(C)CSCCCCCCF 62a_100000748023_100015922095 [1,1,0,0,0,0|2,0,0]=4 15513 B12R0.248 CCC(C)CSCCCCCCF 62a_100015922095_100000748023 [1,1,0,0,0,0|2,0,0]=4 15514 B12R0.248 CCC(C)CSCCCCCCO 62a_100000748023_100000766143 [1,1,0,0,0,0|1,0,0]=3 15515 B12R0.248 CCC(C)CSCCCCCCO 62a_100000766143_100000748023 [1,1,0,0,0,0|1,0,0]=3 15516 B12R0.248 CCC(C)NCCCCCCCO 2230a_100000209981_100000760002 [1,1,0,0,0,0|1,0,0]=3 15517 B12R0.248 CCC(C)NCCCCCCCO 2230a_100011996573_100000758301 [1,1,0,0,0,0|1,0,0]=3 15518 B12R0.248 CCC(C)NCCCCCCCO 34a_100011996573_100011215416 [1,1,0,0,0,0|1,0,0]=3 15519 B12R0.248 CCC(C)NCCCCCCOC 2230a_100000209981_100011998445 [1,1,0,0,0,0|2,0,0]=4 15520 B12R0.248 CCC(C)NCCCOCCCO 2230a_100011310245_100000758301 [1,1,0,0,0,0|2,0,0]=4 15521 B12R0.248 CCC(C)NCCCOCCCO 34a_100011310245_100011215416 [1,1,0,0,0,0|2,0,0]=4 15522 B12R0.248 CCC(C)OCCCCCCCBr 34a_100000760002_100011215416 [1,1,0,0,0,0|2,0,0]=4 15523 B12R0.248 CCC(C)OCCCCCCCBr 7a_100000760002_100000758301 [1,1,0,0,0,0|2,0,0]=4 15524 B12R0.248 CCC(C)OCCCCCCCN 34a_100011996573_100011215416 [1,1,0,0,0,0|2,0,0]=4 15525 B12R0.248 CCC(C)OCCCCCCCO 7a_100000210228_100000760002 [1,1,0,0,0,0|1,0,0]=3 15526 B12R0.248 CCC(C)OCCCCCCOC 34a_200012092642_100011215416 [1,1,0,0,0,0|2,0,0]=4 15527 B12R0.248 CCC(C)OCCCCCCOC 7a_100000210228_100011998445 [1,1,0,0,0,0|2,0,0]=4 15528 B12R0.248 CCC(C)OCCCCCCOC 7a_200012092642_100000758301 [1,1,0,0,0,0|2,0,0]=4 15529 B12R0.248 CCC(C)SCCCCCCCO 62a_100000758301_100000760002 [1,1,0,0,0,0|1,0,0]=3 15530 B12R0.248 CCC(C)SCCCCCCCO 62a_100000760002_100000758301 [1,1,0,0,0,0|1,0,0]=3 15531 B12R0.248 CCC(C)SCCCCCCOC 62a_100000758301_100011998445 [1,1,0,0,0,0|2,0,0]=4 15532 B12R0.248 CCC(C)SCCCCCCOC 62a_100011998445_100000758301 [1,1,0,0,0,0|2,0,0]=4 15533 B12R0.248 CCC(O)CNCCCCCCF 2230a_100011218483_100015922095 [1,1,0,0,0,0|2,0,0]=4 15534 B12R0.248 CCC(O)CNCCCCCCO 2230a_100000686447_100011218378 [1,1,0,0,0,0|1,0,0]=3 15535 B12R0.248 CCC(O)CNCCCCCCO 2230a_100011218483_100000766143 [1,1,0,0,0,0|1,0,0]=3 15536 B12R0.248 CCC(O)CNCCCCCCO 34a_100000686447_100011218378 [1,1,0,0,0,0|1,0,0]=3 15537 B12R0.248 CCC(O)CNCCCCCOC 2230a_100000747528_100011218378 [1,1,0,0,0,0|2,0,0]=4 15538 B12R0.248 CCC(O)CNCCCCCOC 34a_100000747528_100011218378 [1,1,0,0,0,0|2,0,0]=4 15539 B12R0.248 CCC(O)COCCCCCCBr 34a_100011215345_100011218378 [1,1,0,0,0,0|2,0,0]=4 15540 B12R0.248 CCC(O)COCCCCCCBr 7a_100011215345_100011218378 [1,1,0,0,0,0|2,0,0]=4 15541 B12R0.248 CCC(O)COCCCCCCCl 34a_100000766143_100011218378 [1,1,0,0,0,0|2,0,0]=4 15542 B12R0.248 CCC(O)COCCCCCCCl 7a_100000766143_100011218378 [1,1,0,0,0,0|2,0,0]=4 15543 B12R0.248 CCC(O)COCCCCCCF 34a_100000732779_100011218378 [1,1,0,0,0,0|2,0,0]=4 15544 B12R0.248 CCC(O)COCCCCCCF 7a_100000732779_100011218378 [1,1,0,0,0,0|2,0,0]=4 15545 B12R0.248 CCC(O)COCCCCCCN 34a_100000686447_100011218378 [1,1,0,0,0,0|2,0,0]=4 15546 B12R0.248 CCC(O)COCCCCCNC 34a_100000722520_100011218378 [1,1,0,0,0,0|2,0,0]=4 15547 B12R0.248 CCC(O)CSCCCCCCF 62a_100011218378_100015922095 [1,1,0,0,0,0|2,0,0]=4 15548 B12R0.248 CCC(O)CSCCCCCCF 62a_100015922095_100011218378 [1,1,0,0,0,0|2,0,0]=4 15549 B12R0.248 CCC(O)CSCCCCCCO 62a_100000766143_100011218378 [1,1,0,0,0,0|1,0,0]=3 15550 B12R0.248 CCC(O)CSCCCCCCO 62a_100011218378_100000766143 [1,1,0,0,0,0|1,0,0]=3 15551 B12R0.248 CCCCCCCCCC(=O)CC 1458a_100000210414_100000210670 [1,1,0,0,0,0|0,0,1]=3 15552 B12R0.248 CCCCCCCCCC(=O)CC 1458a_100000210558_100000210202 [1,1,0,0,0,0|0,0,1]=3 15553 B12R0.248 CCCCCCCCCC(=O)CF 1458a_100000210558_100015361967 [1,1,0,0,0,0|1,0,1]=4 15554 B12R0.248 CCCCCCCCCC(=O)CO 1458a_100000210174_100000210670 [1,1,0,0,0,0|0,0,1]=3 15555 B12R0.248 CCCCCCCCCC(=O)NC 11a_106832991635_100000210558 [1,1,0,0,0,0|1,0,1]=4 15556 B12R0.248 CCCCCCCCCC(=O)NC 1626a_100102657272_100000210558 [1,1,0,0,0,0|1,0,1]=4 15557 B12R0.248 CCCCCCCCCC(=O)NC 240690a_100102657272_100000210558 [1,1,0,0,0,0|1,0,1]=4 15558 B12R0.248 CCCCCCCCCC(=O)NC 527a_100102657272_100000210558 [1,1,0,0,0,0|1,0,1]=4 15559 B12R0.248 CCCCCCCCCC(C)NC 270004a_106832991635_100011215753 [1,1,0,0,0,0|1,0,0]=3 15560 B12R0.248 CCCCCCCCCC(C)OC 34a_100011218016_200000210301 [1,1,0,0,0,0|1,0,0]=3 15561 B12R0.248 CCCCCCCCCC(C)OC 7a_100011218016_200000210301 [1,1,0,0,0,0|1,0,0]=3 15562 B12R0.248 CCCCCCCCCC(C)O[13CH3] 34a_100011218016_200025704644 [1,1,0,0,0,0|1,0,0]=3 15563 B12R0.248 CCCCCCCCCC(C)O[13CH3] 7a_100011218016_200025704644 [1,1,0,0,0,0|1,0,0]=3 15564 B12R0.248 CCCCCCCCCN(C)CC 2230a_100000225621_100011214924 [1,1,0,0,0,0|1,0,0]=3 15565 B12R0.248 CCCCCCCCCN(C)CC 2230a_100000232482_100000210202 [1,1,0,0,0,0|1,0,0]=3 15566 B12R0.248 CCCCCCCCCN(C)CC 269982a_100000225621_100000210670 [1,1,0,0,0,0|1,0,0]=3 15567 B12R0.248 CCCCCCCCCN(C)CC 269982a_100000232482_100000204670 [1,1,0,0,0,0|1,0,0]=3 15568 B12R0.248 CCCCCCCCCN(C)CF 269982a_100000232482_100015361967 [1,1,0,0,0,0|2,0,0]=4 15569 B12R0.248 CCCCCCCCNC(=O)CC 11a_100000229939_100000210414 [1,1,0,0,0,0|1,0,1]=4 15570 B12R0.248 CCCCCCCCNC(=O)CC 1626a_100000229939_100000210414 [1,1,0,0,0,0|1,0,1]=4 15571 B12R0.248 CCCCCCCCNC(=O)CC 240690a_100000229939_100000210414 [1,1,0,0,0,0|1,0,1]=4 15572 B12R0.248 CCCCCCCCNC(=O)CC 527a_100000229939_100000210414 [1,1,0,0,0,0|1,0,1]=4 15573 B12R0.248 CCCCCCCCNC(=O)CO 240690a_100000229939_100000210174 [1,1,0,0,0,0|1,0,1]=4 15574 B12R0.248 CCCCCCCCNC(=O)CO 527a_100000229939_100000210174 [1,1,0,0,0,0|1,0,1]=4 15575 B12R0.248 CCCCCCCCNC(C)CC 2230a_100000209981_100000210759 [1,1,0,0,0,0|1,0,0]=3 15576 B12R0.248 CCCCCCCCNC(C)CC 2230a_100000229939_100000758301 [1,1,0,0,0,0|1,0,0]=3 15577 B12R0.248 CCCCCCCCNC(C)CC 34a_100000229939_100011215416 [1,1,0,0,0,0|1,0,0]=3 15578 B12R0.248 CCCCCCCCNC(C)CO 2230a_100000229939_100012180447 [1,1,0,0,0,0|1,0,0]=3 15579 B12R0.248 CCCCCCCCNC(C)CO 34a_100000229939_100012180447 [1,1,0,0,0,0|1,0,0]=3 15580 B12R0.248 CCCCCCCCN[C@H](C)CO 2230a_100000737577_100000210759 [1,1,0,0,0,0|1,0,0]=3 15581 B12R0.248 CCCCCCCCOC(C)CC 34a_100000210232_100011215416 [1,1,0,0,0,0|1,0,0]=3 15582 B12R0.248 CCCCCCCCOC(C)CC 7a_100000210228_100000210759 [1,1,0,0,0,0|1,0,0]=3 15583 B12R0.248 CCCCCCCCOC(C)CC 7a_100000210232_100000758301 [1,1,0,0,0,0|1,0,0]=3 15584 B12R0.248 CCCCCCCCOC(C)CF 34a_100016041109_100000210759 [1,1,0,0,0,0|2,0,0]=4 15585 B12R0.248 CCCCCCCCOC(C)CF 7a_100016041109_100000210759 [1,1,0,0,0,0|2,0,0]=4 15586 B12R0.248 CCCCCCCCOC(C)CN 34a_100000210904_100000210759 [1,1,0,0,0,0|2,0,0]=4 15587 B12R0.248 CCCCCCCCOC(C)CO 34a_100000210232_100012180447 [1,1,0,0,0,0|1,0,0]=3 15588 B12R0.248 CCCCCCCCOC(C)CO 7a_100000210232_100012180447 [1,1,0,0,0,0|1,0,0]=3 15589 B12R0.248 CCCCCCCCSC(C)CC 62a_100000210759_100000758301 [1,1,0,0,0,0|1,0,0]=3 15590 B12R0.248 CCCCCCCCSC(C)CC 62a_100000758301_100000210317 [1,1,0,0,0,0|1,0,0]=3 15591 B12R0.248 CCCCCCCCSC(C)CO 62a_100012180447_100000210317 [1,1,0,0,0,0|1,0,0]=3 15592 B12R0.248 CCCCCCCCSC(C)OC 62a_100000210759_100009879195 [1,1,0,0,0,0|2,0,0]=4 15593 B12R0.248 CCCCCCCCSC(C)OC 62a_100009879195_100000210317 [1,1,0,0,0,0|2,0,0]=4 15594 B12R0.248 CCCCCCCCS[C@H](C)CO 62a_100000210759_100016084084 [1,1,0,0,0,0|1,0,0]=3 15595 B12R0.248 CCCCCCCCS[C@H](C)CO 62a_100016084084_100000210317 [1,1,0,0,0,0|1,0,0]=3 15596 B12R0.248 CCCCCCCNCC(C)CC 2230a_100000229938_100000748023 [1,1,0,0,0,0|1,0,0]=3 15597 B12R0.248 CCCCCCCNCC(C)CC 2230a_100020588543_100000210681 [1,1,0,0,0,0|1,0,0]=3 15598 B12R0.248 CCCCCCCNCC(C)CC 270004a_100000229938_100000243153 [1,1,0,0,0,0|1,0,0]=3 15599 B12R0.248 CCCCCCCNCC(C)CO 34a_100000744482_100000210614 [1,1,0,0,0,0|1,0,0]=3 15600 B12R0.248 CCCCCCCNCC(O)CC 2230a_100000229938_100011218378 [1,1,0,0,0,0|1,0,0]=3 15601 B12R0.248 CCCCCCCNCC(O)CC 2230a_100011218483_100000210681 [1,1,0,0,0,0|1,0,0]=3 15602 B12R0.248 CCCCCCCNCC(O)CO 2230a_100000229938_100011219619 [1,1,0,0,0,0|1,0,0]=3 15603 B12R0.248 CCCCCCCNC[C@@H](C)CC 2230a_100000229938_100009816398 [1,1,0,0,0,0|1,0,0]=3 15604 B12R0.248 CCCCCCCNC[C@@H](C)CO 2230a_100000229938_100000059175 [1,1,0,0,0,0|1,0,0]=3 15605 B12R0.248 CCCCCCCNC[C@@H](C)OC 2230a_100020591295_100000210681 [1,1,0,0,0,0|2,0,0]=4 15606 B12R0.248 CCCCCCCNC[C@@H](F)CO 34a_100015665980_100000210614 [1,1,0,0,0,0|1,0,0]=3 15607 B12R0.248 CCCCCCCNC[C@@H](O)CF 2230a_100000229938_100015614560 [1,1,0,0,0,0|2,0,0]=4 15608 B12R0.248 CCCCCCCNC[C@@H](O)CO 2230a_100000229938_100009815848 [1,1,0,0,0,0|1,0,0]=3 15609 B12R0.248 CCCCCCCNC[C@H](O)CO 2230a_100020644852_100000210681 [1,1,0,0,0,0|1,0,0]=3 15610 B12R0.248 CCCCCCCOCC(=O)CC 34a_100000725409_100000210614 [1,1,0,0,0,0|1,0,1]=4 15611 B12R0.248 CCCCCCCOCC(=O)CC 7a_100000210272_100000747405 [1,1,0,0,0,0|1,0,1]=4 15612 B12R0.248 CCCCCCCOCC(C)CC 34a_100000210272_100000748023 [1,1,0,0,0,0|1,0,0]=3 15613 B12R0.248 CCCCCCCOCC(C)CC 7a_100000210272_100000748023 [1,1,0,0,0,0|1,0,0]=3 15614 B12R0.248 CCCCCCCOCC(C)CN 34a_100000744482_100000210614 [1,1,0,0,0,0|2,0,0]=4 15615 B12R0.248 CCCCCCCOCC(C)OC 34a_100000690652_100000210614 [1,1,0,0,0,0|2,0,0]=4 15616 B12R0.248 CCCCCCCOCC(Cl)CCl 34a_100000033668_100000210614 [1,1,0,0,0,0|2,0,0]=4 15617 B12R0.248 CCCCCCCOCC(O)CC 34a_100000210272_100011218378 [1,1,0,0,0,0|1,0,0]=3 15618 B12R0.248 CCCCCCCOCC(O)CC 7a_100000210272_100011218378 [1,1,0,0,0,0|1,0,0]=3 15619 B12R0.248 CCCCCCCOCC(O)CO 34a_100000210272_100011219619 [1,1,0,0,0,0|1,0,0]=3 15620 B12R0.248 CCCCCCCOCC(O)CO 7a_100000210272_100011219619 [1,1,0,0,0,0|1,0,0]=3 15621 B12R0.248 CCCCCCCOC[C@@H](C)CC 34a_100000210272_100009816398 [1,1,0,0,0,0|1,0,0]=3 15622 B12R0.248 CCCCCCCOC[C@@H](C)CC 7a_100000210272_100009816398 [1,1,0,0,0,0|1,0,0]=3 15623 B12R0.248 CCCCCCCOC[C@@H](C)CC 7a_100009816381_100000210614 [1,1,0,0,0,0|1,0,0]=3 15624 B12R0.248 CCCCCCCOC[C@@H](C)CO 34a_100000210272_100000059175 [1,1,0,0,0,0|1,0,0]=3 15625 B12R0.248 CCCCCCCOC[C@@H](C)CO 7a_100000210272_100000059175 [1,1,0,0,0,0|1,0,0]=3 15626 B12R0.248 CCCCCCCOC[C@@H](O)CF 34a_100000210272_100015614560 [1,1,0,0,0,0|2,0,0]=4 15627 B12R0.248 CCCCCCCOC[C@@H](O)CF 7a_100000210272_100015614560 [1,1,0,0,0,0|2,0,0]=4 15628 B12R0.248 CCCCCCCOC[C@@H](O)CO 34a_100000210272_100009815848 [1,1,0,0,0,0|1,0,0]=3 15629 B12R0.248 CCCCCCCOC[C@@H](O)CO 7a_100000210272_100009815848 [1,1,0,0,0,0|1,0,0]=3 15630 B12R0.248 CCCCCCCOC[C@H](F)CN 34a_100015665980_100000210614 [1,1,0,0,0,0|2,0,0]=4 15631 B12R0.248 CCCCCCCSCC(=O)CC 62a_100000210614_100000747405 [1,1,0,0,0,0|1,0,1]=4 15632 B12R0.248 CCCCCCCSCC(=O)CC 62a_100000747405_100000210316 [1,1,0,0,0,0|1,0,1]=4 15633 B12R0.248 CCCCCCCSCC(C)CC 62a_100000210614_100000748023 [1,1,0,0,0,0|1,0,0]=3 15634 B12R0.248 CCCCCCCSCC(C)CC 62a_100000748023_100000210316 [1,1,0,0,0,0|1,0,0]=3 15635 B12R0.248 CCCCCCCSCC(O)CC 62a_100000210614_100011218378 [1,1,0,0,0,0|1,0,0]=3 15636 B12R0.248 CCCCCCCSCC(O)CC 62a_100011218378_100000210316 [1,1,0,0,0,0|1,0,0]=3 15637 B12R0.248 CCCCCCCSCC(O)CO 62a_100000210614_100011219619 [1,1,0,0,0,0|1,0,0]=3 15638 B12R0.248 CCCCCCCSCC(O)CO 62a_100011219619_100000210316 [1,1,0,0,0,0|1,0,0]=3 15639 B12R0.248 CCCCCCCSC[C@@H](C)CC 62a_100000210614_100009816398 [1,1,0,0,0,0|1,0,0]=3 15640 B12R0.248 CCCCCCCSC[C@@H](C)CC 62a_100009816398_100000210316 [1,1,0,0,0,0|1,0,0]=3 15641 B12R0.248 CCCCCCCSC[C@@H](C)CO 62a_100000059175_100000210316 [1,1,0,0,0,0|1,0,0]=3 15642 B12R0.248 CCCCCCCSC[C@@H](C)CO 62a_100000210614_100000059175 [1,1,0,0,0,0|1,0,0]=3 15643 B12R0.248 CCCCCCCSC[C@@H](O)CF 62a_100000210614_100015614560 [1,1,0,0,0,0|2,0,0]=4 15644 B12R0.248 CCCCCCCSC[C@@H](O)CF 62a_100015614560_100000210316 [1,1,0,0,0,0|2,0,0]=4 15645 B12R0.248 CCCCCCCSC[C@@H](O)CO 62a_100000210614_100009815848 [1,1,0,0,0,0|1,0,0]=3 15646 B12R0.248 CCCCCCCSC[C@@H](O)CO 62a_100009815848_100000210316 [1,1,0,0,0,0|1,0,0]=3 15647 B12R0.248 CCCCCCNCCC(C)CC 2230a_100020591266_100000210314 [1,1,0,0,0,0|1,0,0]=3 15648 B12R0.248 CCCCCCNCCC(C)CO 2230a_106354213184_100000210314 [1,1,0,0,0,0|1,0,0]=3 15649 B12R0.248 CCCCCCNCCC(C)CO 34a_106354213184_100000210314 [1,1,0,0,0,0|1,0,0]=3 15650 B12R0.248 CCCCCCOCCC(C)CC 7a_100011215188_100000210314 [1,1,0,0,0,0|1,0,0]=3 15651 B12R0.248 CCCCCCOCCC(C)OC 7a_100000764861_100000210314 [1,1,0,0,0,0|2,0,0]=4 15652 B12R0.248 CCCCCNCCCN(C)CC 2230a_100000209983_100015186262 [1,1,0,0,0,0|2,0,0]=4 15653 B12R0.248 CCCCCNCCOC(C)CC 34a_100000224656_100011215416 [1,1,0,0,0,0|2,0,0]=4 15654 B12R0.248 CCCCCNCCOC(C)CO 34a_100000224656_100012180447 [1,1,0,0,0,0|2,0,0]=4 15655 B12R0.248 CCCCCOCCCC(C)CC 7a_100011216074_100000210326 [1,1,0,0,0,0|1,0,0]=3 15656 B12R0.248 CCCCCOCCCN(C)CC 7a_100000210253_100015186262 [1,1,0,0,0,0|2,0,0]=4 15657 B12R0.248 CCCCCOCCC[C@@H](C)CN 34a_100160569302_100000718602 [1,1,0,0,0,0|2,0,0]=4 15658 B12R0.248 CCCCCOCCOC(C)CC 34a_100011215259_100011215416 [1,1,0,0,0,0|2,0,0]=4 15659 B12R0.248 CCCCCOCCOC(C)CC 7a_100011215259_100000758301 [1,1,0,0,0,0|2,0,0]=4 15660 B12R0.248 CCCCCOCCOC(C)CO 34a_100011215259_100012180447 [1,1,0,0,0,0|2,0,0]=4 15661 B12R0.248 CCCCCOCCOC(C)CO 7a_100011215259_100012180447 [1,1,0,0,0,0|2,0,0]=4 15662 B12R0.248 CCCCCSCCCN(C)CC 62a_100000210326_100015186262 [1,1,0,0,0,0|2,0,0]=4 15663 B12R0.248 CCCCOCCCNC(C)CC 2230a_200000211371_100000758301 [1,1,0,0,0,0|2,0,0]=4 15664 B12R0.248 CCCCOCCCNC(C)CC 34a_200000211371_100011215416 [1,1,0,0,0,0|2,0,0]=4 15665 B12R0.248 CCCCOCCCNC(C)CO 2230a_200000211371_100012180447 [1,1,0,0,0,0|2,0,0]=4 15666 B12R0.248 CCCCOCCCNC(C)CO 34a_200000211371_100012180447 [1,1,0,0,0,0|2,0,0]=4 15667 B12R0.248 CCCCOCCCOC(C)CC 34a_200011215613_100011215416 [1,1,0,0,0,0|2,0,0]=4 15668 B12R0.248 CCCCOCCCOC(C)CC 7a_200011215613_100000758301 [1,1,0,0,0,0|2,0,0]=4 15669 B12R0.248 CCCCOCCCOC(C)CO 34a_200011215613_100012180447 [1,1,0,0,0,0|2,0,0]=4 15670 B12R0.248 CCCCOCCCOC(C)CO 7a_200011215613_100012180447 [1,1,0,0,0,0|2,0,0]=4 15671 B12R0.248 CCCCOCCNCC(C)CC 2230a_100020588543_100000743108 [1,1,0,0,0,0|2,0,0]=4 15672 B12R0.248 CCCCOCCNCC(C)CO 34a_100000744482_100000743108 [1,1,0,0,0,0|2,0,0]=4 15673 B12R0.248 CCCCOCCNCC(O)CC 2230a_100011218483_100000743108 [1,1,0,0,0,0|2,0,0]=4 15674 B12R0.248 CCCCOCCNC[C@@H](F)CO 34a_100015665980_100000743108 [1,1,0,0,0,0|2,0,0]=4 15675 B12R0.248 CCCCOCCNC[C@H](O)CO 2230a_100020644852_100000743108 [1,1,0,0,0,0|2,0,0]=4 15676 B12R0.248 CCCCOCCOCC(C)CC 34a_100000210238_100000748023 [1,1,0,0,0,0|2,0,0]=4 15677 B12R0.248 CCCCOCCOCC(C)CC 7a_100000210238_100000748023 [1,1,0,0,0,0|2,0,0]=4 15678 B12R0.248 CCCCOCCOCC(O)CC 34a_100000210238_100011218378 [1,1,0,0,0,0|2,0,0]=4 15679 B12R0.248 CCCCOCCOCC(O)CC 7a_100000210238_100011218378 [1,1,0,0,0,0|2,0,0]=4 15680 B12R0.248 CCCCOCCOCC(O)CO 34a_100000210238_100011219619 [1,1,0,0,0,0|2,0,0]=4 15681 B12R0.248 CCCCOCCOCC(O)CO 7a_100000210238_100011219619 [1,1,0,0,0,0|2,0,0]=4 15682 B12R0.248 CCCCOCCOC[C@@H](C)CC 34a_100000210238_100009816398 [1,1,0,0,0,0|2,0,0]=4 15683 B12R0.248 CCCCOCCOC[C@@H](C)CC 7a_100000210238_100009816398 [1,1,0,0,0,0|2,0,0]=4 15684 B12R0.248 CCCCOCCOC[C@@H](C)CC 7a_100009816381_100000743108 [1,1,0,0,0,0|2,0,0]=4 15685 B12R0.248 CCCCOCCOC[C@@H](C)CO 34a_100000210238_100000059175 [1,1,0,0,0,0|2,0,0]=4 15686 B12R0.248 CCCCOCCOC[C@@H](C)CO 7a_100000210238_100000059175 [1,1,0,0,0,0|2,0,0]=4 15687 B12R0.248 CCCCOCCOC[C@@H](O)CO 34a_100000210238_100009815848 [1,1,0,0,0,0|2,0,0]=4 15688 B12R0.248 CCCCOCCOC[C@@H](O)CO 7a_100000210238_100009815848 [1,1,0,0,0,0|2,0,0]=4 15689 B12R0.248 CCCCOCCSCC(C)CC 62a_100000743108_100000748023 [1,1,0,0,0,0|2,0,0]=4 15690 B12R0.248 CCCCOCCSCC(C)CC 62a_100000748023_100000743108 [1,1,0,0,0,0|2,0,0]=4 15691 B12R0.248 CCCCOCCSCC(O)CC 62a_100000743108_100011218378 [1,1,0,0,0,0|2,0,0]=4 15692 B12R0.248 CCCCOCCSCC(O)CC 62a_100011218378_100000743108 [1,1,0,0,0,0|2,0,0]=4 15693 B12R0.248 CCCCOCCSCC(O)CO 62a_100000743108_100011219619 [1,1,0,0,0,0|2,0,0]=4 15694 B12R0.248 CCCCOCCSCC(O)CO 62a_100011219619_100000743108 [1,1,0,0,0,0|2,0,0]=4 15695 B12R0.248 CCCCOCCSC[C@@H](C)CC 62a_100000743108_100009816398 [1,1,0,0,0,0|2,0,0]=4 15696 B12R0.248 CCCCOCCSC[C@@H](C)CC 62a_100009816398_100000743108 [1,1,0,0,0,0|2,0,0]=4 15697 B12R0.248 CCCCOCCSC[C@@H](C)CO 62a_100000059175_100000743108 [1,1,0,0,0,0|2,0,0]=4 15698 B12R0.248 CCCCOCCSC[C@@H](C)CO 62a_100000743108_100000059175 [1,1,0,0,0,0|2,0,0]=4 15699 B12R0.248 CCCCOCCSC[C@@H](O)CO 62a_100000743108_100009815848 [1,1,0,0,0,0|2,0,0]=4 15700 B12R0.248 CCCCOCCSC[C@@H](O)CO 62a_100009815848_100000743108 [1,1,0,0,0,0|2,0,0]=4 15701 B12R0.248 CCCCOCNCCC(C)CC 2230a_100020591266_100011995733 [1,1,0,0,0,0|2,0,0]=4 15702 B12R0.248 CCCCOCNCCC(C)CO 2230a_106354213184_100011995733 [1,1,0,0,0,0|2,0,0]=4 15703 B12R0.248 CCCCOCNCCC(C)CO 34a_106354213184_100011995733 [1,1,0,0,0,0|2,0,0]=4 15704 B12R0.248 CCCCSCCNCC(C)CC 2230a_100025743550_100000748023 [1,1,0,0,0,0|2,0,0]=4 15705 B12R0.248 CCCCSCCNCC(C)CC 270004a_100025743550_100000243153 [1,1,0,0,0,0|2,0,0]=4 15706 B12R0.248 CCCCSCCNCC(O)CC 2230a_100025743550_100011218378 [1,1,0,0,0,0|2,0,0]=4 15707 B12R0.248 CCCCSCCNCC(O)CO 2230a_100025743550_100011219619 [1,1,0,0,0,0|2,0,0]=4 15708 B12R0.248 CCCCSCCNC[C@@H](C)CC 2230a_100025743550_100009816398 [1,1,0,0,0,0|2,0,0]=4 15709 B12R0.248 CCCCSCCNC[C@@H](C)CO 2230a_100025743550_100000059175 [1,1,0,0,0,0|2,0,0]=4 15710 B12R0.248 CCCCSCCNC[C@@H](O)CO 2230a_100025743550_100009815848 [1,1,0,0,0,0|2,0,0]=4 15711 B12R0.248 CCCCSCCOCC(C)CC 34a_200000230436_100000748023 [1,1,0,0,0,0|2,0,0]=4 15712 B12R0.248 CCCCSCCOCC(C)CC 7a_200000230436_100000748023 [1,1,0,0,0,0|2,0,0]=4 15713 B12R0.248 CCCCSCCOCC(O)CC 34a_200000230436_100011218378 [1,1,0,0,0,0|2,0,0]=4 15714 B12R0.248 CCCCSCCOCC(O)CC 7a_200000230436_100011218378 [1,1,0,0,0,0|2,0,0]=4 15715 B12R0.248 CCCCSCCOCC(O)CO 34a_200000230436_100011219619 [1,1,0,0,0,0|2,0,0]=4 15716 B12R0.248 CCCCSCCOCC(O)CO 7a_200000230436_100011219619 [1,1,0,0,0,0|2,0,0]=4 15717 B12R0.248 CCCCSCCOC[C@@H](C)CC 34a_200000230436_100009816398 [1,1,0,0,0,0|2,0,0]=4 15718 B12R0.248 CCCCSCCOC[C@@H](C)CC 7a_200000230436_100009816398 [1,1,0,0,0,0|2,0,0]=4 15719 B12R0.248 CCCCSCCOC[C@@H](C)CO 34a_200000230436_100000059175 [1,1,0,0,0,0|2,0,0]=4 15720 B12R0.248 CCCCSCCOC[C@@H](C)CO 7a_200000230436_100000059175 [1,1,0,0,0,0|2,0,0]=4 15721 B12R0.248 CCCCSCCOC[C@@H](O)CO 34a_200000230436_100009815848 [1,1,0,0,0,0|2,0,0]=4 15722 B12R0.248 CCCCSCCOC[C@@H](O)CO 7a_200000230436_100009815848 [1,1,0,0,0,0|2,0,0]=4 15723 B12R0.248 CCCOCCCCCC(C)CC 7a_200000035636_100000210303 [1,1,0,0,0,0|1,0,0]=3 15724 B12R0.248 CCCOCCCNCC(C)CC 2230a_100011217757_100000748023 [1,1,0,0,0,0|2,0,0]=4 15725 B12R0.248 CCCOCCCNCC(C)CC 270004a_100011217757_100000243153 [1,1,0,0,0,0|2,0,0]=4 15726 B12R0.248 CCCOCCCNCC(C)CC 34a_100011217757_100000748023 [1,1,0,0,0,0|2,0,0]=4 15727 B12R0.248 CCCOCCCNCC(O)CC 2230a_100011217757_100011218378 [1,1,0,0,0,0|2,0,0]=4 15728 B12R0.248 CCCOCCCNCC(O)CC 34a_100011217757_100011218378 [1,1,0,0,0,0|2,0,0]=4 15729 B12R0.248 CCCOCCCNCC(O)CO 2230a_100011217757_100011219619 [1,1,0,0,0,0|2,0,0]=4 15730 B12R0.248 CCCOCCCNCC(O)CO 34a_100011217757_100011219619 [1,1,0,0,0,0|2,0,0]=4 15731 B12R0.248 CCCOCCCNC[C@@H](C)CC 2230a_100011217757_100009816398 [1,1,0,0,0,0|2,0,0]=4 15732 B12R0.248 CCCOCCCNC[C@@H](C)CC 34a_100011217757_100009816398 [1,1,0,0,0,0|2,0,0]=4 15733 B12R0.248 CCCOCCCNC[C@@H](C)CO 2230a_100011217757_100000059175 [1,1,0,0,0,0|2,0,0]=4 15734 B12R0.248 CCCOCCCNC[C@@H](C)CO 34a_100011217757_100000059175 [1,1,0,0,0,0|2,0,0]=4 15735 B12R0.248 CCCOCCCNC[C@@H](O)CO 2230a_100011217757_100009815848 [1,1,0,0,0,0|2,0,0]=4 15736 B12R0.248 CCCOCCCNC[C@@H](O)CO 34a_100011217757_100009815848 [1,1,0,0,0,0|2,0,0]=4 15737 B12R0.248 CCCOCCNCCC(C)CC 2230a_100020591266_100011215938 [1,1,0,0,0,0|2,0,0]=4 15738 B12R0.248 CCCOCCNCCC(C)CO 2230a_106354213184_100011215938 [1,1,0,0,0,0|2,0,0]=4 15739 B12R0.248 CCCOCCNCCC(C)CO 34a_106354213184_100011215938 [1,1,0,0,0,0|2,0,0]=4 15740 B12R0.248 CCCOCCOCCC(C)CC 7a_100011215188_100011215938 [1,1,0,0,0,0|2,0,0]=4 15741 B12R0.248 CCN(C)CCCCCCCCO 2230a_100000225621_100000033203 [1,1,0,0,0,0|1,0,0]=3 15742 B12R0.248 CCN(C)CCCCCCCCO 269982a_100000225621_100000033203 [1,1,0,0,0,0|1,0,0]=3 15743 B12R0.248 CCN(C)CCCNCCCCO 2230a_100000750430_100015186262 [1,1,0,0,0,0|2,0,0]=4 15744 B12R0.248 CCN(C)CCCSCCCCO 62a_100000210776_100015186262 [1,1,0,0,0,0|2,0,0]=4 15745 B12R0.248 CCOCCCNCCC(C)CC 2230a_100020591266_100012232248 [1,1,0,0,0,0|2,0,0]=4 15746 B12R0.248 CCOCCCNCCC(C)CO 2230a_106354213184_100012232248 [1,1,0,0,0,0|2,0,0]=4 15747 B12R0.248 CCOCCCNCCC(C)CO 34a_106354213184_100012232248 [1,1,0,0,0,0|2,0,0]=4 15748 B12R0.248 CCOCCCOCCC(C)CC 7a_100011215188_100012232248 [1,1,0,0,0,0|2,0,0]=4 15749 B12R0.248 CCOCCOCCCC(C)CC 7a_100011216074_100011215890 [1,1,0,0,0,0|2,0,0]=4 15750 B12R0.248 CCSCCOCCCC(C)CC 7a_100011216074_100000757381 [1,1,0,0,0,0|2,0,0]=4 15751 B12R0.248 CC[C@H](C)CNCCCCCCO 2230a_100000686447_100009816398 [1,1,0,0,0,0|1,0,0]=3 15752 B12R0.248 CC[C@H](C)CNCCCCCCO 34a_100000686447_100009816398 [1,1,0,0,0,0|1,0,0]=3 15753 B12R0.248 CC[C@H](C)CNCCCCCOC 2230a_100000747528_100009816398 [1,1,0,0,0,0|2,0,0]=4 15754 B12R0.248 CC[C@H](C)CNCCCCCOC 34a_100000747528_100009816398 [1,1,0,0,0,0|2,0,0]=4 15755 B12R0.248 CC[C@H](C)COCCCCCCBr 34a_100011215345_100009816398 [1,1,0,0,0,0|2,0,0]=4 15756 B12R0.248 CC[C@H](C)COCCCCCCBr 7a_100011215345_100009816398 [1,1,0,0,0,0|2,0,0]=4 15757 B12R0.248 CC[C@H](C)COCCCCCCCl 34a_100000766143_100009816398 [1,1,0,0,0,0|2,0,0]=4 15758 B12R0.248 CC[C@H](C)COCCCCCCCl 7a_100000766143_100009816398 [1,1,0,0,0,0|2,0,0]=4 15759 B12R0.248 CC[C@H](C)COCCCCCCF 34a_100000732779_100009816398 [1,1,0,0,0,0|2,0,0]=4 15760 B12R0.248 CC[C@H](C)COCCCCCCF 7a_100000732779_100009816398 [1,1,0,0,0,0|2,0,0]=4 15761 B12R0.248 CC[C@H](C)COCCCCCCF 7a_100009816381_100015922095 [1,1,0,0,0,0|2,0,0]=4 15762 B12R0.248 CC[C@H](C)COCCCCCCN 34a_100000686447_100009816398 [1,1,0,0,0,0|2,0,0]=4 15763 B12R0.248 CC[C@H](C)COCCCCCCO 7a_100009816381_100000766143 [1,1,0,0,0,0|1,0,0]=3 15764 B12R0.248 CC[C@H](C)COCCCCCNC 34a_100000722520_100009816398 [1,1,0,0,0,0|2,0,0]=4 15765 B12R0.248 CC[C@H](C)CSCCCCCCF 62a_100009816398_100015922095 [1,1,0,0,0,0|2,0,0]=4 15766 B12R0.248 CC[C@H](C)CSCCCCCCF 62a_100015922095_100009816398 [1,1,0,0,0,0|2,0,0]=4 15767 B12R0.248 CC[C@H](C)CSCCCCCCO 62a_100000766143_100009816398 [1,1,0,0,0,0|1,0,0]=3 15768 B12R0.248 CC[C@H](C)CSCCCCCCO 62a_100009816398_100000766143 [1,1,0,0,0,0|1,0,0]=3 15769 B12R0.248 CNC(=O)CCCCCCCCO 240690a_100102657272_100000015970 [1,1,0,0,0,0|1,0,1]=4 15770 B12R0.248 CNCCCCCOCC(O)CO 34a_100000722520_100011219619 [1,1,0,0,0,0|2,0,0]=4 15771 B12R0.248 CNCCCCCOC[C@@H](C)CO 34a_100000722520_100000059175 [1,1,0,0,0,0|2,0,0]=4 15772 B12R0.248 CNCCCCCOC[C@@H](O)CO 34a_100000722520_100009815848 [1,1,0,0,0,0|2,0,0]=4 15773 B12R0.248 COC(C)CCOCCCCCO 7a_100000764861_100000746330 [1,1,0,0,0,0|2,0,0]=4 15774 B12R0.248 COC(C)COCCCCCCO 34a_100000690652_100000766143 [1,1,0,0,0,0|2,0,0]=4 15775 B12R0.248 COC(C)SCCCCCCCO 62a_100000760002_100009879195 [1,1,0,0,0,0|2,0,0]=4 15776 B12R0.248 COC(C)SCCCCCCCO 62a_100009879195_100000760002 [1,1,0,0,0,0|2,0,0]=4 15777 B12R0.248 COCCCCCCN[C@H](C)CO 2230a_100000737577_100011998445 [1,1,0,0,0,0|2,0,0]=4 15778 B12R0.248 COCCCCCCOC(C)CO 34a_200012092642_100012180447 [1,1,0,0,0,0|2,0,0]=4 15779 B12R0.248 COCCCCCCOC(C)CO 7a_200012092642_100012180447 [1,1,0,0,0,0|2,0,0]=4 15780 B12R0.248 COCCCCCCSC(C)CO 62a_100012180447_100011998445 [1,1,0,0,0,0|2,0,0]=4 15781 B12R0.248 COCCCCCCS[C@H](C)CO 62a_100011998445_100016084084 [1,1,0,0,0,0|2,0,0]=4 15782 B12R0.248 COCCCCCCS[C@H](C)CO 62a_100016084084_100011998445 [1,1,0,0,0,0|2,0,0]=4 15783 B12R0.248 COCCCCCNCC(O)CO 2230a_100000747528_100011219619 [1,1,0,0,0,0|2,0,0]=4 15784 B12R0.248 COCCCCCNCC(O)CO 34a_100000747528_100011219619 [1,1,0,0,0,0|2,0,0]=4 15785 B12R0.248 COCCCCCNC[C@@H](C)CO 2230a_100000747528_100000059175 [1,1,0,0,0,0|2,0,0]=4 15786 B12R0.248 COCCCCCNC[C@@H](C)CO 34a_100000747528_100000059175 [1,1,0,0,0,0|2,0,0]=4 15787 B12R0.248 COCCCCCNC[C@@H](O)CO 2230a_100000747528_100009815848 [1,1,0,0,0,0|2,0,0]=4 15788 B12R0.248 COCCCCCNC[C@@H](O)CO 34a_100000747528_100009815848 [1,1,0,0,0,0|2,0,0]=4 15789 B12R0.248 COCCCCNCCC(C)CO 2230a_106354213184_100000730899 [1,1,0,0,0,0|2,0,0]=4 15790 B12R0.248 COCCCCNCCC(C)CO 34a_106354213184_100000755781 [1,1,0,0,0,0|2,0,0]=4 15791 B12R0.248 CO[C@H](C)CNCCCCCCO 2230a_100020591295_100000766143 [1,1,0,0,0,0|2,0,0]=4 15792 B12R0.248 C[C@@H](CN)CCCOCCCCO 34a_100160569302_100011216708 [1,1,0,0,0,0|2,0,0]=4 15793 B12R0.248 C[C@@H](CO)CNCCCCCCO 2230a_100000686447_100000059175 [1,1,0,0,0,0|2,0,0]=4 15794 B12R0.248 C[C@@H](CO)CNCCCCCCO 34a_100000686447_100000059175 [1,1,0,0,0,0|2,0,0]=4 15795 B12R0.248 C[C@@H](CO)COCCCCCCBr 34a_100011215345_100000059175 [1,1,0,0,0,0|2,0,0]=4 15796 B12R0.248 C[C@@H](CO)COCCCCCCBr 7a_100011215345_100000059175 [1,1,0,0,0,0|2,0,0]=4 15797 B12R0.248 C[C@@H](CO)COCCCCCCCl 34a_100000766143_100000059175 [1,1,0,0,0,0|2,0,0]=4 15798 B12R0.248 C[C@@H](CO)COCCCCCCCl 7a_100000766143_100000059175 [1,1,0,0,0,0|2,0,0]=4 15799 B12R0.248 C[C@@H](CO)COCCCCCCF 34a_100000732779_100000059175 [1,1,0,0,0,0|2,0,0]=4 15800 B12R0.248 C[C@@H](CO)COCCCCCCF 7a_100000732779_100000059175 [1,1,0,0,0,0|2,0,0]=4 15801 B12R0.248 C[C@@H](CO)COCCCCCCN 34a_100000686447_100000059175 [1,1,0,0,0,0|2,0,0]=4 15802 B12R0.248 C[C@@H](CO)CSCCCCCCF 62a_100000059175_100015922095 [1,1,0,0,0,0|2,0,0]=4 15803 B12R0.248 C[C@@H](CO)CSCCCCCCF 62a_100015922095_100000059175 [1,1,0,0,0,0|2,0,0]=4 15804 B12R0.248 C[C@@H](CO)CSCCCCCCO 62a_100000059175_100000766143 [1,1,0,0,0,0|2,0,0]=4 15805 B12R0.248 C[C@@H](CO)CSCCCCCCO 62a_100000766143_100000059175 [1,1,0,0,0,0|2,0,0]=4 15806 B12R0.248 C[C@H](CO)NCCCCCCCO 2230a_100000737577_100000760002 [1,1,0,0,0,0|2,0,0]=4 15807 B12R0.248 C[C@H](CO)SCCCCCCCO 62a_100000760002_100016084084 [1,1,0,0,0,0|2,0,0]=4 15808 B12R0.248 C[C@H](CO)SCCCCCCCO 62a_100016084084_100000760002 [1,1,0,0,0,0|2,0,0]=4 15809 B12R0.248 NCCCCCCOCC(O)CO 34a_100000686447_100011219619 [1,1,0,0,0,0|2,0,0]=4 15810 B12R0.248 NCCCCCCOC[C@@H](O)CO 34a_100000686447_100009815848 [1,1,0,0,0,0|2,0,0]=4 15811 B12R0.248 NC[C@@H](F)COCCCCCCO 34a_100015665980_100000766143 [1,1,0,0,0,0|2,0,0]=4 15812 B12R0.248 O=C(CO)CCCCCCCCO 1458a_100000210174_100000033203 [1,1,0,0,0,0|1,0,1]=4 15813 B12R0.248 OCC(O)COCCCCCCBr 34a_100011215345_100011219619 [1,1,0,0,0,0|2,0,0]=4 15814 B12R0.248 OCC(O)COCCCCCCBr 7a_100011215345_100011219619 [1,1,0,0,0,0|2,0,0]=4 15815 B12R0.248 OCC(O)COCCCCCCCl 34a_100000766143_100011219619 [1,1,0,0,0,0|2,0,0]=4 15816 B12R0.248 OCC(O)COCCCCCCCl 7a_100000766143_100011219619 [1,1,0,0,0,0|2,0,0]=4 15817 B12R0.248 OCC(O)COCCCCCCF 34a_100000732779_100011219619 [1,1,0,0,0,0|2,0,0]=4 15818 B12R0.248 OCC(O)COCCCCCCF 7a_100000732779_100011219619 [1,1,0,0,0,0|2,0,0]=4 15819 B12R0.248 OCC(O)CSCCCCCCF 62a_100011219619_100015922095 [1,1,0,0,0,0|2,0,0]=4 15820 B12R0.248 OCC(O)CSCCCCCCF 62a_100015922095_100011219619 [1,1,0,0,0,0|2,0,0]=4 15821 B12R0.248 OCCCCCCNCC(O)CO 2230a_100000686447_100011219619 [1,1,0,0,0,0|2,0,0]=4 15822 B12R0.248 OCCCCCCNCC(O)CO 34a_100000686447_100011219619 [1,1,0,0,0,0|2,0,0]=4 15823 B12R0.248 OCCCCCCNC[C@@H](F)CO 34a_100015665980_100000766143 [1,1,0,0,0,0|2,0,0]=4 15824 B12R0.248 OCCCCCCNC[C@@H](O)CF 2230a_100000686447_100015614560 [1,1,0,0,0,0|2,0,0]=4 15825 B12R0.248 OCCCCCCNC[C@@H](O)CF 34a_100000686447_100015614560 [1,1,0,0,0,0|2,0,0]=4 15826 B12R0.248 OCCCCCCNC[C@@H](O)CO 2230a_100000686447_100009815848 [1,1,0,0,0,0|2,0,0]=4 15827 B12R0.248 OCCCCCCNC[C@@H](O)CO 34a_100000686447_100009815848 [1,1,0,0,0,0|2,0,0]=4 15828 B12R0.248 OCCCCCCNC[C@H](O)CO 2230a_100020644852_100000766143 [1,1,0,0,0,0|2,0,0]=4 15829 B12R0.248 OCCCCCCOCC(Cl)CCl 34a_100000033668_100000766143 [1,1,0,0,0,0|2,0,0]=4 15830 B12R0.248 OCCCCCCSCC(O)CO 62a_100000766143_100011219619 [1,1,0,0,0,0|2,0,0]=4 15831 B12R0.248 OCCCCCCSCC(O)CO 62a_100011219619_100000766143 [1,1,0,0,0,0|2,0,0]=4 15832 B12R0.248 OCCCCCCSC[C@@H](O)CF 62a_100000766143_100015614560 [1,1,0,0,0,0|2,0,0]=4 15833 B12R0.248 OCCCCCCSC[C@@H](O)CF 62a_100015614560_100000766143 [1,1,0,0,0,0|2,0,0]=4 15834 B12R0.248 OCCCCCCSC[C@@H](O)CO 62a_100000766143_100009815848 [1,1,0,0,0,0|2,0,0]=4 15835 B12R0.248 OCCCCCCSC[C@@H](O)CO 62a_100009815848_100000766143 [1,1,0,0,0,0|2,0,0]=4 15836 B12R0.248 OC[C@@H](O)CNCCCCCCF 2230a_100020644852_100015922095 [1,1,0,0,0,0|2,0,0]=4 15837 B12R0.248 OC[C@H](F)CNCCCCCCF 34a_100015665980_100015922095 [1,1,0,0,0,0|2,0,0]=4 15838 B12R0.248 OC[C@H](O)COCCCCCCBr 34a_100011215345_100009815848 [1,1,0,0,0,0|2,0,0]=4 15839 B12R0.248 OC[C@H](O)COCCCCCCBr 7a_100011215345_100009815848 [1,1,0,0,0,0|2,0,0]=4 15840 B12R0.248 OC[C@H](O)COCCCCCCCl 34a_100000766143_100009815848 [1,1,0,0,0,0|2,0,0]=4 15841 B12R0.248 OC[C@H](O)COCCCCCCCl 7a_100000766143_100009815848 [1,1,0,0,0,0|2,0,0]=4 15842 B12R0.248 OC[C@H](O)COCCCCCCF 34a_100000732779_100009815848 [1,1,0,0,0,0|2,0,0]=4 15843 B12R0.248 OC[C@H](O)COCCCCCCF 7a_100000732779_100009815848 [1,1,0,0,0,0|2,0,0]=4 15844 B12R0.248 OC[C@H](O)CSCCCCCCF 62a_100009815848_100015922095 [1,1,0,0,0,0|2,0,0]=4 15845 B12R0.248 OC[C@H](O)CSCCCCCCF 62a_100015922095_100009815848 [1,1,0,0,0,0|2,0,0]=4 15846 B14R0.1 CCCC(C)CCCOCC(C)CCC 34a_100011713154_100011216630 [0,2,0,0,0,0|2,0,0]=4 15847 B14R0.1 CCCC(C)CCCOCC(C)CCC 7a_100011713154_100011216630 [0,2,0,0,0,0|2,0,0]=4 15848 B14R0.32 CCC(C)CCCCCOC(C)CCO 7a_200000035636_100009893172 [0,2,0,0,0,0|1,0,0]=3 15849 B14R0.32 CCCC(C)OCCCCCC(C)CC 7a_200000035636_100000766640 [0,2,0,0,0,0|2,0,0]=4 15850 B14R0.73 C=C(CCC)CC(=O)CCCCCCO 1458a_100000138376_100000766143 [0,2,0,0,0,0|0,0,2]=4 15851 B14R0.73 CCCC(=O)CC(=O)CCCCCCO 1458a_100011996774_100000747444 [0,2,0,0,0,0|0,0,2]=4 15852 B14R0.73 CCCC(C)CC(=O)CCCCCCF 1458a_100000748435_100015922095 [0,2,0,0,0,0|1,0,1]=4 15853 B14R0.73 CCCC(C)CC(=O)CCCCCCO 1458a_100000748435_100000766143 [0,2,0,0,0,0|0,0,1]=3 15854 B14R0.73 CCCC(C)CC(=O)CCCCCCO 1458a_100011996774_100011216630 [0,2,0,0,0,0|0,0,1]=3 15855 B14R0.73 CCCC(C)CC(=O)NCCCCCO 240690a_100000762737_100000748435 [0,2,0,0,0,0|1,0,1]=4 15856 B14R0.73 CCCC(C)NC(=O)CCCCCCO 240690a_100000741246_100011996774 [0,2,0,0,0,0|1,0,1]=4 15857 B14R0.73 CCCCCCCC(=O)CC(C)CCC 1458a_100000211969_100011216630 [0,2,0,0,0,0|1,0,1]=4 15858 B14R0.73 CCCCCCCC(=O)CC(C)CCC 1458a_100000748435_100000210614 [0,2,0,0,0,0|1,0,1]=4 15859 B14R0.73 CCCCCCCC(=O)N[C@H](C)CCO 240690a_100000706166_100000211969 [0,2,0,0,0,0|1,0,1]=4 15860 B14R0.73 CCCCCCCC(=O)N[C@H](C)CCO 527a_100000706166_100000211969 [0,2,0,0,0,0|1,0,1]=4 15861 B14R0.73 CCCCCCCC(C)NC(C)CCC 2230a_100000741246_200011218727 [0,2,0,0,0,0|2,0,0]=4 15862 B14R0.73 CCCCCCCC(C)NC(C)CCC 270004a_100000741246_100000210596 [0,2,0,0,0,0|2,0,0]=4 15863 B14R0.73 CCCCCCCC(C)N[C@H](C)CCO 2230a_100000706166_200011218727 [0,2,0,0,0,0|1,0,0]=3 15864 B14R0.73 CCCCCCCC(C)N[C@H](C)CCO 270004a_100000706166_100000210596 [0,2,0,0,0,0|1,0,0]=3 15865 B14R0.73 CCCCCCCC(C)N[C@H](C)CCO 34a_100000706166_200011218727 [0,2,0,0,0,0|1,0,0]=3 15866 B14R0.73 CCCCCCCC(C)OC(C)CCBr 34a_100012276601_200011218727 [0,2,0,0,0,0|2,0,0]=4 15867 B14R0.73 CCCCCCCC(C)OC(C)CCC 34a_100000764384_200011218727 [0,2,0,0,0,0|2,0,0]=4 15868 B14R0.73 CCCCCCCC(C)OC(C)CCC 34a_200011215852_100000766640 [0,2,0,0,0,0|2,0,0]=4 15869 B14R0.73 CCCCCCCC(C)OC(C)CCC 7a_100000764384_200011218727 [0,2,0,0,0,0|2,0,0]=4 15870 B14R0.73 CCCCCCCC(C)OC(C)CCC 7a_200011215852_100000766640 [0,2,0,0,0,0|2,0,0]=4 15871 B14R0.73 CCCCCCCC(C)OC(C)CCO 34a_200011215852_100009893172 [0,2,0,0,0,0|1,0,0]=3 15872 B14R0.73 CCCCCCCC(C)OC(C)CCO 7a_200011215852_100009893172 [0,2,0,0,0,0|1,0,0]=3 15873 B14R0.73 CCCCCCCC(C)SC(C)CCC 62a_100000766640_200011218727 [0,2,0,0,0,0|2,0,0]=4 15874 B14R0.73 CCCCCCCC(C)SC(C)CCC 62a_200011218727_100000766640 [0,2,0,0,0,0|2,0,0]=4 15875 B14R0.73 CCCCCCCC(C)SC(C)CCO 62a_100009893172_200011218727 [0,2,0,0,0,0|1,0,0]=3 15876 B14R0.73 CCCCCCCC(C)SC(C)CCO 62a_200011218727_100009893172 [0,2,0,0,0,0|1,0,0]=3 15877 B14R0.73 CCCCCCCC(O)CC(=O)CCC 1458a_200011667753_100000210303 [0,2,0,0,0,0|1,0,1]=4 15878 B14R0.73 CCCCCCCC(O)CC(=O)CCF 1458a_200011667753_100011217306 [0,2,0,0,0,0|1,0,1]=4 15879 B14R0.73 CCCCCCCC(O)CC(=O)CCO 1458a_200011667753_100000211926 [0,2,0,0,0,0|0,0,1]=3 15880 B14R0.73 CCCCCCCN(C)CC(C)CCC 2230a_100000228206_100011216630 [0,2,0,0,0,0|2,0,0]=4 15881 B14R0.73 CCCCCCCN(C)CC(C)CCC 269982a_100000228206_100011216630 [0,2,0,0,0,0|2,0,0]=4 15882 B14R0.73 CCCCCCCN(C)CC(C)CCC 270004a_100000228206_100000243154 [0,2,0,0,0,0|2,0,0]=4 15883 B14R0.73 CCCS(=O)CC(=O)CCCCCCO 1458a_100011387404_100000766143 [0,2,0,0,0,0|1,0,1]=4 15884 B14R0.73 CCSC(C)CC(=O)CCCCCCO 1458a_200011311441_100000766143 [0,2,0,0,0,0|1,0,1]=4 15885 B14R0.73 COCC(O)CN(C)CCCCCCO 2230a_100000739405_100000766143 [0,2,0,0,0,0|2,0,0]=4 15886 B14R0.73 COCC(O)CN(C)CCCCCCO 269982a_100000739405_100000766143 [0,2,0,0,0,0|2,0,0]=4 15887 B14R0.83 CC(CCO)C(=O)CCCCCCCO 1458a_100011219782_100009893172 [0,2,0,0,0,0|1,0,1]=4 15888 B14R0.83 CC(CCO)N(C)CCCCCCCO 2230a_100000731037_100000760002 [0,2,0,0,0,0|2,0,0]=4 15889 B14R0.83 CC(CCO)N(C)CCCCCCCO 269982a_100000731037_100000760002 [0,2,0,0,0,0|2,0,0]=4 15890 B14R0.83 CCCC(C)C(=O)CCCCCCCO 1458a_100000210906_100000760002 [0,2,0,0,0,0|0,0,1]=3 15891 B14R0.83 CCCC(C)C(=O)CCCCCCCO 1458a_100011219782_100000766640 [0,2,0,0,0,0|0,0,1]=3 15892 B14R0.83 CCCC(C)C(=O)NCCCCCCO 240690a_100000686447_100000210906 [0,2,0,0,0,0|1,0,1]=4 15893 B14R0.83 CCCC(C)C(=O)NCCCCCCO 527a_100000686447_100000210906 [0,2,0,0,0,0|1,0,1]=4 15894 B14R0.83 CCCC(C)C(C)NCCCCCCO 270004a_100000686447_100011216282 [0,2,0,0,0,0|1,0,0]=3 15895 B14R0.83 CCCC(C)C(C)OCCCCCCF 34a_100000708338_100015922095 [0,2,0,0,0,0|2,0,0]=4 15896 B14R0.83 CCCC(C)C(C)OCCCCCCF 7a_100000708338_100015922095 [0,2,0,0,0,0|2,0,0]=4 15897 B14R0.83 CCCC(C)C(C)OCCCCCCO 34a_100000708338_100000766143 [0,2,0,0,0,0|1,0,0]=3 15898 B14R0.83 CCCC(C)C(C)OCCCCCCO 7a_100000708338_100000766143 [0,2,0,0,0,0|1,0,0]=3 15899 B14R0.83 CCCCCCCCC(=O)C(C)CCC 1458a_100000210188_100000766640 [0,2,0,0,0,0|1,0,1]=4 15900 B14R0.83 CCCCCCCCC(=O)C(C)CCC 1458a_100000210906_100000210759 [0,2,0,0,0,0|1,0,1]=4 15901 B14R0.83 CCCCCCCCC(=O)C(C)CCO 1458a_100000210188_100009893172 [0,2,0,0,0,0|0,0,1]=3 15902 B14R0.83 CCCCCCCCC(=O)N(C)CCO 240690a_100000210263_100000210188 [0,2,0,0,0,0|1,0,1]=4 15903 B14R0.83 CCCCCCCCC(=O)N(C)CCO 527a_100000210263_100000210188 [0,2,0,0,0,0|1,0,1]=4 15904 B14R0.83 CCCCCCCCC(=O)[C@@H](O)CCC 1458a_100009822183_100000210759 [0,2,0,0,0,0|1,0,1]=4 15905 B14R0.83 CCCCCCCCC(C)N(C)CCC 270004a_100000747261_100011216694 [0,2,0,0,0,0|2,0,0]=4 15906 B14R0.83 CCCCCCCCC(C)N(C)CCO 270004a_100000210263_100011216694 [0,2,0,0,0,0|1,0,0]=3 15907 B14R0.83 CCCCCCCCC(O)C(=O)CCC 1458a_200011995895_100000210303 [0,2,0,0,0,0|1,0,1]=4 15908 B14R0.83 CCCCCCCCC(O)C(=O)CCF 1458a_200011995895_100011217306 [0,2,0,0,0,0|1,0,1]=4 15909 B14R0.83 CCCCCCCCC(O)C(=O)CCO 1458a_200011995895_100000211926 [0,2,0,0,0,0|0,0,1]=3 15910 B14R0.83 CCCCCCCCN(C)C(=O)CCO 240690a_100000207567_100011216618 [0,2,0,0,0,0|1,0,1]=4 15911 B14R0.83 CCCCCCCCN(C)C(C)CCC 2230a_100000207567_100000766640 [0,2,0,0,0,0|2,0,0]=4 15912 B14R0.83 CCCCCCCCN(C)C(C)CCC 269982a_100000207567_100000766640 [0,2,0,0,0,0|2,0,0]=4 15913 B14R0.83 CCCCCCCCN(C)C(C)CCC 270004a_100000207567_100000211909 [0,2,0,0,0,0|2,0,0]=4 15914 B14R0.83 CCCCCCCCN(C)C(C)CCO 2230a_100000207567_100009893172 [0,2,0,0,0,0|1,0,0]=3 15915 B14R0.83 CCCCCCCCN(C)C(C)CCO 2230a_100000731037_100000210759 [0,2,0,0,0,0|1,0,0]=3 15916 B14R0.83 CCCCCCCCN(C)C(C)CCO 269982a_100000207567_100009893172 [0,2,0,0,0,0|1,0,0]=3 15917 B14R0.83 CCCCCCCCN(C)C(C)CCO 269982a_100000731037_100000210759 [0,2,0,0,0,0|1,0,0]=3 15918 B14R0.83 CCCCCCCNC(C)C(C)CCC 270004a_100000229938_100011216282 [0,2,0,0,0,0|2,0,0]=4 15919 B14R0.83 CCCCCCCOC(C)C(C)CCC 34a_100000708338_100000210614 [0,2,0,0,0,0|2,0,0]=4 15920 B14R0.83 CCCCCCCOC(C)C(C)CCC 7a_100000708338_100000210614 [0,2,0,0,0,0|2,0,0]=4 15921 B14R0.83 CCCN(C)C(=O)CCCCCCCO 240690a_100000747261_100011219782 [0,2,0,0,0,0|1,0,1]=4 15922 B14R0.83 CCC[C@H](O)C(=O)CCCCCCCO 1458a_100009822183_100000760002 [0,2,0,0,0,0|0,0,1]=3 15923 B14R0.83 CCC[C@H](O)C(=O)NCCCCCCO 240690a_100000686447_100009822183 [0,2,0,0,0,0|1,0,1]=4 15924 B14R0.83 CCOC(C)C(=O)CCCCCCCO 1458a_100000739345_100000760002 [0,2,0,0,0,0|1,0,1]=4 15925 B14R0.83 CCSC(C)C(=O)CCCCCCCO 1458a_100000230601_100000760002 [0,2,0,0,0,0|1,0,1]=4 15926 B14R0.83 COCC(C)C(=O)CCCCCCCO 1458a_100000751857_100000760002 [0,2,0,0,0,0|1,0,1]=4 15927 B14R0.83 COCC(C)C(=O)CCCCCCCO 1458a_100011219782_100000765312 [0,2,0,0,0,0|1,0,1]=4 15928 B14R0.83 COCCCCCCN(C)C(C)CCO 2230a_100000731037_100011998445 [0,2,0,0,0,0|2,0,0]=4 15929 B14R0.83 COCCCCCCN(C)C(C)CCO 269982a_100000731037_100011998445 [0,2,0,0,0,0|2,0,0]=4 15930 B14R0.83 CSCC(C)C(=O)CCCCCCCO 1458a_100000753918_100000760002 [0,2,0,0,0,0|1,0,1]=4 15931 B14R0.90 C#CC(CCC)OCCCCCCCC 34a_200011217317_100000210759 [0,2,0,0,0,0|2,0,0]=4 15932 B14R0.90 C#CC(CCC)OCCCCCCCC 7a_200011217317_100000210759 [0,2,0,0,0,0|2,0,0]=4 15933 B14R0.90 C#CC(CCC)OCCCCCCCO 34a_200011217317_100000760002 [0,2,0,0,0,0|1,0,0]=3 15934 B14R0.90 C#CC(CCC)OCCCCCCCO 7a_200011217317_100000760002 [0,2,0,0,0,0|1,0,0]=3 15935 B14R0.90 C=CC(CCC)OCCCCCCCC 34a_100011216692_100000210759 [0,2,0,0,0,0|2,0,0]=4 15936 B14R0.90 C=CC(CCC)OCCCCCCCC 7a_100011216692_100000210759 [0,2,0,0,0,0|2,0,0]=4 15937 B14R0.90 C=CC(CCC)OCCCCCCCO 34a_100011216692_100000760002 [0,2,0,0,0,0|1,0,0]=3 15938 B14R0.90 C=CC(CCC)OCCCCCCCO 7a_100011216692_100000760002 [0,2,0,0,0,0|1,0,0]=3 15939 B14R0.90 CCC(COC)NCCCCCCCO 2230a_100000757820_100000760002 [0,2,0,0,0,0|2,0,0]=4 15940 B14R0.90 CCC(COC)NCCCCCCCO 270004a_100011996573_100000757811 [0,2,0,0,0,0|2,0,0]=4 15941 B14R0.90 CCC(COC)OCCCCCCCO 7a_200011214946_100000760002 [0,2,0,0,0,0|2,0,0]=4 15942 B14R0.90 CCCC(C#N)OCCCCCCCO 34a_100000686963_100000760002 [0,2,0,0,0,0|1,0,0]=3 15943 B14R0.90 CCCC(C#N)OCCCCCCCO 7a_100000686963_100000760002 [0,2,0,0,0,0|1,0,0]=3 15944 B14R0.90 CCCC(CC)NCCCCCCCO 2230a_100000747048_100000760002 [0,2,0,0,0,0|1,0,0]=3 15945 B14R0.90 CCCC(CC)NCCCCCCCO 270004a_100011996573_100000687865 [0,2,0,0,0,0|1,0,0]=3 15946 B14R0.90 CCCC(CC)NCCCOCCCO 270004a_100011310245_100000687865 [0,2,0,0,0,0|2,0,0]=4 15947 B14R0.90 CCCC(CC)OCCCCCCCBr 7a_100000760002_100011219200 [0,2,0,0,0,0|2,0,0]=4 15948 B14R0.90 CCCC(CC)OCCCCCCCO 34a_100000687864_100000760002 [0,2,0,0,0,0|1,0,0]=3 15949 B14R0.90 CCCC(CC)OCCCCCCCO 7a_100000687864_100000760002 [0,2,0,0,0,0|1,0,0]=3 15950 B14R0.90 CCCC(CC)SCCCCCCCO 62a_100000760002_100011219200 [0,2,0,0,0,0|1,0,0]=3 15951 B14R0.90 CCCC(CC)SCCCCCCCO 62a_100011219200_100000760002 [0,2,0,0,0,0|1,0,0]=3 15952 B14R0.90 CCCC(CCOCCCCCF)SC 34a_100000032865_100000729378 [0,2,0,0,0,0|2,0,0]=4 15953 B14R0.90 CCCC(CCOCCCCCF)SC 7a_100000032865_100000729378 [0,2,0,0,0,0|2,0,0]=4 15954 B14R0.90 CCCC(CCOCCCCCO)SC 34a_100000032865_100000746330 [0,2,0,0,0,0|1,0,0]=3 15955 B14R0.90 CCCC(CCOCCCCCO)SC 7a_100000032865_100000746330 [0,2,0,0,0,0|1,0,0]=3 15956 B14R0.90 CCCC(CCOCCOCCO)SC 34a_100000032865_100000692535 [0,2,0,0,0,0|2,0,0]=4 15957 B14R0.90 CCCC(CCOCCOCCO)SC 7a_100000032865_100011215305 [0,2,0,0,0,0|2,0,0]=4 15958 B14R0.90 CCCCCCCCCN(CC)CCC 2230a_100000226822_100011214924 [0,2,0,0,0,0|2,0,0]=4 15959 B14R0.90 CCCCCCCCCN(CC)CCC 269982a_100000226822_100000210670 [0,2,0,0,0,0|2,0,0]=4 15960 B14R0.90 CCCCCCCCCN(CC)CCO 2230a_100000210973_100011214924 [0,2,0,0,0,0|1,0,0]=3 15961 B14R0.90 CCCCCCCCCN(CC)CCO 269982a_100000210973_100000210670 [0,2,0,0,0,0|1,0,0]=3 15962 B14R0.90 CCCCCCCCNC(CC)CCC 2230a_100000747048_100000210759 [0,2,0,0,0,0|2,0,0]=4 15963 B14R0.90 CCCCCCCCNC(CC)CCC 270004a_100000229939_100000687865 [0,2,0,0,0,0|2,0,0]=4 15964 B14R0.90 CCCCCCCCN[C@H](CO)CCC 2230a_100000732646_100000210759 [0,2,0,0,0,0|2,0,0]=4 15965 B14R0.90 CCCCCCCCN[C@H](CO)CCC 34a_100000732646_100000210759 [0,2,0,0,0,0|2,0,0]=4 15966 B14R0.90 CCCCCCCCOC(C#N)CCC 34a_100000686963_100000210759 [0,2,0,0,0,0|2,0,0]=4 15967 B14R0.90 CCCCCCCCOC(C#N)CCC 7a_100000686963_100000210759 [0,2,0,0,0,0|2,0,0]=4 15968 B14R0.90 CCCCCCCCOC(CC)CCC 34a_100000687864_100000210759 [0,2,0,0,0,0|2,0,0]=4 15969 B14R0.90 CCCCCCCCOC(CC)CCC 7a_100000210232_100011219200 [0,2,0,0,0,0|2,0,0]=4 15970 B14R0.90 CCCCCCCCOC(CC)CCC 7a_100000687864_100000210759 [0,2,0,0,0,0|2,0,0]=4 15971 B14R0.90 CCCCCCCCSC(CC)CCC 62a_100000210759_100011219200 [0,2,0,0,0,0|2,0,0]=4 15972 B14R0.90 CCCCCCCCSC(CC)CCC 62a_100011219200_100000210317 [0,2,0,0,0,0|2,0,0]=4 15973 B14R0.90 CCCCCCOCCC(CCC)SC 34a_100000032865_100000210314 [0,2,0,0,0,0|2,0,0]=4 15974 B14R0.90 CCCCCCOCCC(CCC)SC 7a_100000032865_100000210314 [0,2,0,0,0,0|2,0,0]=4 15975 B14R0.90 CCCN(CC)CCCCCCCCO 2230a_100000226822_100000033203 [0,2,0,0,0,0|1,0,0]=3 15976 B14R0.90 CCCN(CC)CCCCCCCCO 269982a_100000226822_100000033203 [0,2,0,0,0,0|1,0,0]=3 15977 B14R0.90 CCC[C@@H](CO)NCCCCCCCO 2230a_100000732646_100000760002 [0,2,0,0,0,0|1,0,0]=3 15978 B14R0.90 CCC[C@@H](CO)NCCCCCCCO 34a_100000732646_100000760002 [0,2,0,0,0,0|1,0,0]=3 15979 B14R0.90 CCN(CCO)CCCCCCCCO 2230a_100000210973_100000033203 [0,2,0,0,0,0|2,0,0]=4 15980 B14R0.90 CCN(CCO)CCCCCCCCO 269982a_100000210973_100000033203 [0,2,0,0,0,0|2,0,0]=4 15981 B14R0.90 CCOC(CC)CNCCCCCCO 2230a_100015183923_100000766143 [0,2,0,0,0,0|2,0,0]=4 15982 B14R0.90 CCOC(CC)CNCCCCCCO 34a_100015183923_100000766143 [0,2,0,0,0,0|2,0,0]=4 15983 B14R0.90 COCC(CCl)OCCCCCCCO 34a_100011215053_100000760002 [0,2,0,0,0,0|2,0,0]=4 15984 B14R0.90 COCC(CN)OCCCCCCCO 34a_100000756049_100000760002 [0,2,0,0,0,0|2,0,0]=4 15985 B14R0.90 COCC(CO)NCCCCCCCO 2230a_100000724102_100000760002 [0,2,0,0,0,0|2,0,0]=4 15986 B14R0.90 COCC(CO)NCCCCCCCO 34a_100000724102_100000760002 [0,2,0,0,0,0|2,0,0]=4 15987 B14R0.163 CCCCC(C)OCCCC(C)CCC 34a_100011713154_200011215066 [0,2,0,0,0,0|2,0,0]=4 15988 B14R0.163 CCCCC(C)OCCCC(C)CCC 7a_100011713154_200011215066 [0,2,0,0,0,0|2,0,0]=4 15989 B14R0.181 CC(CO)N(C)CCCCCCCCO 2230a_100000693034_100000033203 [0,2,0,0,0,0|2,0,0]=4 15990 B14R0.181 CC(CO)N(C)CCCCCCCCO 269982a_100000693034_100000033203 [0,2,0,0,0,0|2,0,0]=4 15991 B14R0.181 CCC(=O)C(C)NCCCCCCCO 2230a_100011996573_100000742827 [0,2,0,0,0,0|1,0,1]=4 15992 B14R0.181 CCC(=O)C(C)SCCCCCCCO 62a_100000742827_100000760002 [0,2,0,0,0,0|1,0,1]=4 15993 B14R0.181 CCC(=O)C(C)SCCCCCCCO 62a_100000760002_100000742827 [0,2,0,0,0,0|1,0,1]=4 15994 B14R0.181 CCC(C)C(=O)CCCCCCCCO 1458a_100011192722_100000033203 [0,2,0,0,0,0|0,0,1]=3 15995 B14R0.181 CCC(C)C(=O)NCCCCCCCO 240690a_100011996573_100011192722 [0,2,0,0,0,0|1,0,1]=4 15996 B14R0.181 CCC(C)C(C)NCCCCCCCO 269862a_100011996573_100000210599 [0,2,0,0,0,0|1,0,0]=3 15997 B14R0.181 CCC(C)C(C)NCCCCCCCO 270004a_100011996573_100000210599 [0,2,0,0,0,0|1,0,0]=3 15998 B14R0.181 CCC(C)C(C)NCCCOCCCO 269862a_100011310245_100000210599 [0,2,0,0,0,0|2,0,0]=4 15999 B14R0.181 CCC(C)C(C)NCCCOCCCO 270004a_100011310245_100000210599 [0,2,0,0,0,0|2,0,0]=4 16000 B14R0.181 CCC(C)C(C)OCCCCCCCO 7a_100011215189_100000760002 [0,2,0,0,0,0|1,0,0]=3 16001 B14R0.181 CCC(C)N(C)CCCCCCCCO 2230a_100000741768_100000033203 [0,2,0,0,0,0|1,0,0]=3 16002 B14R0.181 CCC(C)N(C)CCCCCCCCO 269982a_100000741768_100000033203 [0,2,0,0,0,0|1,0,0]=3 16003 B14R0.181 CCC(O)C(=O)CCCCCCCCO 1458a_100011196387_100000033203 [0,2,0,0,0,0|0,0,1]=3 16004 B14R0.181 CCC(O)C(=O)NCCCCCCCO 240690a_100011996573_100011196387 [0,2,0,0,0,0|1,0,1]=4 16005 B14R0.181 CCCCCCCCCC(=O)C(C)CC 1458a_100000210558_100000758301 [0,2,0,0,0,0|1,0,1]=4 16006 B14R0.181 CCCCCCCCCC(=O)C(C)CC 1458a_100011192722_100000210670 [0,2,0,0,0,0|1,0,1]=4 16007 B14R0.181 CCCCCCCCCC(=O)C(O)CC 1458a_100011196387_100000210670 [0,2,0,0,0,0|1,0,1]=4 16008 B14R0.181 CCCCCCCCCC(=O)C(O)CO 1458a_100011215603_100000210670 [0,2,0,0,0,0|0,0,1]=3 16009 B14R0.181 CCCCCCCCCN(C)C(=O)CO 240690a_100000232482_100000210174 [0,2,0,0,0,0|1,0,1]=4 16010 B14R0.181 CCCCCCCCCN(C)C(=O)CO 527a_100000232482_100000210174 [0,2,0,0,0,0|1,0,1]=4 16011 B14R0.181 CCCCCCCCCN(C)C(C)CC 2230a_100000232482_100000758301 [0,2,0,0,0,0|2,0,0]=4 16012 B14R0.181 CCCCCCCCCN(C)C(C)CC 2230a_100000741768_100011214924 [0,2,0,0,0,0|2,0,0]=4 16013 B14R0.181 CCCCCCCCCN(C)C(C)CC 269982a_100000232482_100000758301 [0,2,0,0,0,0|2,0,0]=4 16014 B14R0.181 CCCCCCCCCN(C)C(C)CC 269982a_100000741768_100000210670 [0,2,0,0,0,0|2,0,0]=4 16015 B14R0.181 CCCCCCCCCN(C)C(C)CO 2230a_100000232482_100012180447 [0,2,0,0,0,0|1,0,0]=3 16016 B14R0.181 CCCCCCCCCN(C)C(C)CO 2230a_100000693034_100011214924 [0,2,0,0,0,0|1,0,0]=3 16017 B14R0.181 CCCCCCCCCN(C)C(C)CO 269982a_100000693034_100000210670 [0,2,0,0,0,0|1,0,0]=3 16018 B14R0.181 CCCCCCCCCN(C)[C@H](C)CO 269982a_100000232482_100016084084 [0,2,0,0,0,0|1,0,0]=3 16019 B14R0.181 CCCCCCCCNC(=O)C(O)CO 240690a_100000229939_100011215603 [0,2,0,0,0,0|1,0,1]=4 16020 B14R0.181 CCCCCCCCNC(C)C(C)CC 269862a_100000229939_100000210599 [0,2,0,0,0,0|2,0,0]=4 16021 B14R0.181 CCCCCCCCNC(C)C(C)CC 270004a_100000229939_100000210599 [0,2,0,0,0,0|2,0,0]=4 16022 B14R0.181 CCCCCCCCOC(C)C(C)CC 7a_100011215189_100000210759 [0,2,0,0,0,0|2,0,0]=4 16023 B14R0.181 CCN(C)C(=O)CCCCCCCCO 240690a_100000225621_100000015970 [0,2,0,0,0,0|1,0,1]=4 16024 B14R0.181 CCN(C)C(C)COCCCCCCO 7a_100000732741_100000766143 [0,2,0,0,0,0|2,0,0]=4 16025 B14R0.181 COC(C)C(=O)CCCCCCCCO 1458a_100000743197_100000033203 [0,2,0,0,0,0|1,0,1]=4 16026 B14R0.181 CSC(C)C(=O)CCCCCCCCO 1458a_100000149566_100000033203 [0,2,0,0,0,0|1,0,1]=4 16027 B14R0.181 O=C(CCCCCCCCO)C(O)CO 1458a_100011215603_100000033203 [0,2,0,0,0,0|1,0,1]=4 16028 B14R0.199 CCCC(C)CCC(C)NCCCCO 270004a_100000750430_200011216527 [0,2,0,0,0,0|1,0,0]=3 16029 B14R0.199 CCCCCCC(C)NCC(C)CCC 2230a_100000210919_100011216630 [0,2,0,0,0,0|2,0,0]=4 16030 B14R0.199 CCCCCCC(C)NCC(C)CCC 270004a_100000210919_100000243154 [0,2,0,0,0,0|2,0,0]=4 16031 B14R0.199 CCCCCCC(C)NCC(C)CCC 34a_100000210919_100011216630 [0,2,0,0,0,0|2,0,0]=4 16032 B14R0.199 CCCCCCC(C)OCC(C)CCC 34a_100000210265_100011216630 [0,2,0,0,0,0|2,0,0]=4 16033 B14R0.199 CCCCCCC(C)OCC(C)CCC 34a_100000688023_100011215978 [0,2,0,0,0,0|2,0,0]=4 16034 B14R0.199 CCCCCCC(C)OCC(C)CCC 7a_100000210265_100011216630 [0,2,0,0,0,0|2,0,0]=4 16035 B14R0.199 CCCCCCC(C)OCC(C)CCC 7a_100000688023_100011215978 [0,2,0,0,0,0|2,0,0]=4 16036 B14R0.199 CCCCCCC(C)OCC(C)CCN 34a_106354213184_100011215978 [0,2,0,0,0,0|2,0,0]=4 16037 B14R0.199 CCCCCCC(C)OC[C@@H](N)CCC 34a_100000732646_100011215978 [0,2,0,0,0,0|2,0,0]=4 16038 B14R0.199 CCCCCCC(C)SCC(C)CCC 62a_100011215978_100011216630 [0,2,0,0,0,0|2,0,0]=4 16039 B14R0.199 CCCCCCC(C)SCC(C)CCC 62a_100011216630_100011215978 [0,2,0,0,0,0|2,0,0]=4 16040 B14R0.199 CCCCCNC(C)CCC(C)CCC 270004a_100000209983_200011216527 [0,2,0,0,0,0|2,0,0]=4 16041 B14R0.391 C=C(C)CN(C)CCCCCCCCO 2230a_100000225649_100000033203 [0,2,0,0,0,0|1,0,1]=4 16042 B14R0.391 C=C(C)CN(C)CCCCCCCCO 269982a_100000225649_100000033203 [0,2,0,0,0,0|1,0,1]=4 16043 B14R0.391 CC(C)CC(=O)CCCCCCCCO 1458a_100000210554_100000033203 [0,2,0,0,0,0|0,0,1]=3 16044 B14R0.391 CC(C)CC(=O)NCCCCCCCO 240690a_100011996573_100000210554 [0,2,0,0,0,0|1,0,1]=4 16045 B14R0.391 CC(C)CC(C)NCCCCCCCO 2230a_100000692259_100000760002 [0,2,0,0,0,0|1,0,0]=3 16046 B14R0.391 CC(C)CC(C)NCCCCCCCO 2230a_100011996573_100000731052 [0,2,0,0,0,0|1,0,0]=3 16047 B14R0.391 CC(C)CC(C)NCCCCCCCO 34a_100011996573_100000731052 [0,2,0,0,0,0|1,0,0]=3 16048 B14R0.391 CC(C)CC(C)NCCCOCCCO 2230a_100011310245_100000731052 [0,2,0,0,0,0|2,0,0]=4 16049 B14R0.391 CC(C)CC(C)NCCCOCCCO 34a_100011310245_100000731052 [0,2,0,0,0,0|2,0,0]=4 16050 B14R0.391 CC(C)CC(C)OCCCCCCCBr 34a_100000760002_100000731052 [0,2,0,0,0,0|2,0,0]=4 16051 B14R0.391 CC(C)CC(C)OCCCCCCCBr 7a_100000760002_100000731052 [0,2,0,0,0,0|2,0,0]=4 16052 B14R0.391 CC(C)CC(C)OCCCCCCCN 34a_100011996573_100000731052 [0,2,0,0,0,0|2,0,0]=4 16053 B14R0.391 CC(C)CC(C)OCCCCCCCO 34a_100000211805_100000760002 [0,2,0,0,0,0|1,0,0]=3 16054 B14R0.391 CC(C)CC(C)OCCCCCCCO 7a_100000211805_100000760002 [0,2,0,0,0,0|1,0,0]=3 16055 B14R0.391 CC(C)CC(C)SCCCCCCCO 62a_100000731052_100000760002 [0,2,0,0,0,0|1,0,0]=3 16056 B14R0.391 CC(C)CC(C)SCCCCCCCO 62a_100000760002_100000731052 [0,2,0,0,0,0|1,0,0]=3 16057 B14R0.391 CC(C)CN(C)CCCCCCCCO 2230a_100000747067_100000033203 [0,2,0,0,0,0|1,0,0]=3 16058 B14R0.391 CC(C)CN(C)CCCCCCCCO 269982a_100000747067_100000033203 [0,2,0,0,0,0|1,0,0]=3 16059 B14R0.391 CC(C)C[C@H](N)CCOCCCCCF 34a_100161151251_100000729378 [0,2,0,0,0,0|2,0,0]=4 16060 B14R0.391 CC(C)C[C@H](N)CCOCCCCCO 34a_100161151251_100000746330 [0,2,0,0,0,0|1,0,0]=3 16061 B14R0.391 CC(C)C[C@H](N)CCOCCOCCO 34a_100161151251_100000692535 [0,2,0,0,0,0|2,0,0]=4 16062 B14R0.391 CC(C)C[C@H](N)COCCCCCCF 34a_100011830311_100015922095 [0,2,0,0,0,0|2,0,0]=4 16063 B14R0.391 CC(C)C[C@H](N)COCCCCCCO 34a_100011830311_100000766143 [0,2,0,0,0,0|1,0,0]=3 16064 B14R0.391 CC(C)NC(=O)CCCCCCCCO 240690a_100138425928_100000015970 [0,2,0,0,0,0|1,0,1]=4 16065 B14R0.391 CC(CN(C)C)SCCCCCCCO 62a_100000760002_100020606517 [0,2,0,0,0,0|2,0,0]=4 16066 B14R0.391 CC(CN(C)C)SCCCCCCCO 62a_100020606517_100000760002 [0,2,0,0,0,0|2,0,0]=4 16067 B14R0.391 CC(CNCCCCCCO)CN(C)C 2230a_100000686447_100015348159 [0,2,0,0,0,0|2,0,0]=4 16068 B14R0.391 CC(CSCCCCCCO)CN(C)C 62a_100000766143_100015348159 [0,2,0,0,0,0|2,0,0]=4 16069 B14R0.391 CC(CSCCCCCCO)CN(C)C 62a_100015348159_100000766143 [0,2,0,0,0,0|2,0,0]=4 16070 B14R0.391 CC(O)CN(C)CCCCCCCCO 2230a_100000227577_100000033203 [0,2,0,0,0,0|1,0,0]=3 16071 B14R0.391 CC(O)CN(C)CCCCCCCCO 269982a_100000227577_100000033203 [0,2,0,0,0,0|1,0,0]=3 16072 B14R0.391 CCCCCCCCCC(=O)CC(C)C 1458a_100000210554_100000210670 [0,2,0,0,0,0|1,0,1]=4 16073 B14R0.391 CCCCCCCCCC(=O)CC(C)C 1458a_100000210558_100000210624 [0,2,0,0,0,0|1,0,1]=4 16074 B14R0.391 CCCCCCCCCC(=O)CC(C)O 1458a_100000210558_100011218427 [0,2,0,0,0,0|0,0,1]=3 16075 B14R0.391 CCCCCCCCCC(=O)CC(F)F 1458a_100000210558_100011934356 [0,2,0,0,0,0|1,0,1]=4 16076 B14R0.391 CCCCCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100000210670 [0,2,0,0,0,0|0,0,1]=3 16077 B14R0.391 CCCCCCCCCC(C)CN(C)C 270004a_100102631434_200011218516 [0,2,0,0,0,0|2,0,0]=4 16078 B14R0.391 CCCCCCCCCC(C)OC(C)C 34a_100011218016_100000210206 [0,2,0,0,0,0|2,0,0]=4 16079 B14R0.391 CCCCCCCCCC(C)OC(C)C 7a_100011218016_100000210206 [0,2,0,0,0,0|2,0,0]=4 16080 B14R0.391 CCCCCCCCCN(C)CC(=O)O 269956a_100000746989_100000210670 [0,2,0,0,0,0|1,0,1]=4 16081 B14R0.391 CCCCCCCCCN(C)CC(C)C 2230a_100000232482_100000210760 [0,2,0,0,0,0|2,0,0]=4 16082 B14R0.391 CCCCCCCCCN(C)CC(C)C 2230a_100000747067_100011214924 [0,2,0,0,0,0|2,0,0]=4 16083 B14R0.391 CCCCCCCCCN(C)CC(C)C 269982a_100000232482_100000210624 [0,2,0,0,0,0|2,0,0]=4 16084 B14R0.391 CCCCCCCCCN(C)CC(C)C 269982a_100000747067_100000210670 [0,2,0,0,0,0|2,0,0]=4 16085 B14R0.391 CCCCCCCCCN(C)CC(C)C 270004a_100000232482_100000210432 [0,2,0,0,0,0|2,0,0]=4 16086 B14R0.391 CCCCCCCCCN(C)CC(C)O 2230a_100000227577_100011214924 [0,2,0,0,0,0|1,0,0]=3 16087 B14R0.391 CCCCCCCCCN(C)CC(C)O 2230a_100000232482_100011218427 [0,2,0,0,0,0|1,0,0]=3 16088 B14R0.391 CCCCCCCCCN(C)CC(C)O 269982a_100000227577_100000210670 [0,2,0,0,0,0|1,0,0]=3 16089 B14R0.391 CCCCCCCCCN(C)CC(C)O 269982a_100000232482_100011218427 [0,2,0,0,0,0|1,0,0]=3 16090 B14R0.391 CCCCCCCCCN(C)CC(F)F 2230a_100000232482_100011934356 [0,2,0,0,0,0|2,0,0]=4 16091 B14R0.391 CCCCCCCCCN(C)CC(F)F 269982a_100000232482_100011934356 [0,2,0,0,0,0|2,0,0]=4 16092 B14R0.391 CCCCCCCCCN(C)C[C@@H](C)O 2230a_100000232482_100009817552 [0,2,0,0,0,0|1,0,0]=3 16093 B14R0.391 CCCCCCCCCN(C)C[C@@H](C)O 269982a_100000232482_100009817552 [0,2,0,0,0,0|1,0,0]=3 16094 B14R0.391 CCCCCCCCNC(=O)C[C@@H](C)O 240690a_100000229939_100011933948 [0,2,0,0,0,0|1,0,1]=4 16095 B14R0.391 CCCCCCCCNC(C)CC(C)C 2230a_100000229939_100000731052 [0,2,0,0,0,0|2,0,0]=4 16096 B14R0.391 CCCCCCCCNC(C)CC(C)C 2230a_100000692259_100000210759 [0,2,0,0,0,0|2,0,0]=4 16097 B14R0.391 CCCCCCCCNC(C)CC(C)C 34a_100000229939_100000731052 [0,2,0,0,0,0|2,0,0]=4 16098 B14R0.391 CCCCCCCCOC(C)CC(C)C 34a_100000210232_100000731052 [0,2,0,0,0,0|2,0,0]=4 16099 B14R0.391 CCCCCCCCOC(C)CC(C)C 34a_100000211805_100000210759 [0,2,0,0,0,0|2,0,0]=4 16100 B14R0.391 CCCCCCCCOC(C)CC(C)C 7a_100000210232_100000731052 [0,2,0,0,0,0|2,0,0]=4 16101 B14R0.391 CCCCCCCCOC(C)CC(C)C 7a_100000211805_100000210759 [0,2,0,0,0,0|2,0,0]=4 16102 B14R0.391 CCCCCCCCSC(C)CC(C)C 62a_100000210759_100000731052 [0,2,0,0,0,0|2,0,0]=4 16103 B14R0.391 CCCCCCCCSC(C)CC(C)C 62a_100000731052_100000210317 [0,2,0,0,0,0|2,0,0]=4 16104 B14R0.391 CCCCCCCNCC(O)CC(=O)O 269956a_100011218706_100000210614 [0,2,0,0,0,0|1,0,1]=4 16105 B14R0.391 CCCCCCCOC[C@@H](N)CC(C)C 34a_100011830311_100000210614 [0,2,0,0,0,0|2,0,0]=4 16106 B14R0.391 CCCCCCOCC[C@@H](N)CC(C)C 34a_100161151251_100000210314 [0,2,0,0,0,0|2,0,0]=4 16107 B14R0.391 CN(C)CC(=O)CCCCCCCCO 1458a_100000750896_100000033203 [0,2,0,0,0,0|1,0,1]=4 16108 B14R0.391 C[C@@H](O)CC(=O)CCCCCCCCO 1458a_100011933948_100000033203 [0,2,0,0,0,0|0,0,1]=3 16109 B14R0.391 C[C@@H](O)CC(=O)NCCCCCCCO 240690a_100011996573_100011933948 [0,2,0,0,0,0|1,0,1]=4 16110 B14R0.391 C[S+](C)CC(=O)CCCCCCCCO 1458a_200159257847_100000033203 [0,2,0,0,0,0|1,0,1]=4 16111 B14R0.393 C#CCC(=O)CCCCCCCCCC 1458a_100000210375_100000184674 [0,2,0,0,0,0|1,0,1]=4 16112 B14R0.393 C#CCC(=O)CCCCCCCCCC 1458a_100011220946_100000210319 [0,2,0,0,0,0|1,0,1]=4 16113 B14R0.393 C#CCC(=O)CCCCCCCCCO 1458a_100011220946_100009813782 [0,2,0,0,0,0|0,0,2]=4 16114 B14R0.393 C#CCC(C)OCCCCCCCCC 34a_100000685586_100011214924 [0,2,0,0,0,0|1,0,1]=4 16115 B14R0.393 C#CCC(C)OCCCCCCCCC 7a_100000685586_100000210328 [0,2,0,0,0,0|1,0,1]=4 16116 B14R0.393 C#CCC(C)OCCCCCCCCO 34a_100000685586_100000033203 [0,2,0,0,0,0|0,0,2]=4 16117 B14R0.393 C#CCC(C)OCCCCCCCCO 7a_100000685586_100000033203 [0,2,0,0,0,0|0,0,2]=4 16118 B14R0.393 C#CCCCCCCCCC(=O)CCC 1458a_100000029693_100000210303 [0,2,0,0,0,0|1,0,1]=4 16119 B14R0.393 C#CCCCCCCCCC(=O)CCO 1458a_100000029693_100000211926 [0,2,0,0,0,0|0,0,2]=4 16120 B14R0.393 C#CCCCCCCCNC(C)CCC 2230a_100000741246_100153394163 [0,2,0,0,0,0|1,0,1]=4 16121 B14R0.393 C#CCCCCCCCN[C@H](C)CCO 2230a_100000706166_100153394163 [0,2,0,0,0,0|0,0,2]=4 16122 B14R0.393 C#CCCCCCCCN[C@H](C)CCO 34a_100000706166_100153394163 [0,2,0,0,0,0|0,0,2]=4 16123 B14R0.393 C#CCCCCCCCOC(C)CCC 34a_100000054614_100000766640 [0,2,0,0,0,0|1,0,1]=4 16124 B14R0.393 C#CCCCCCCCOC(C)CCC 34a_100000764384_100153394163 [0,2,0,0,0,0|1,0,1]=4 16125 B14R0.393 C#CCCCCCCCOC(C)CCC 7a_100000054614_100000766640 [0,2,0,0,0,0|1,0,1]=4 16126 B14R0.393 C#CCCCCCCCOC(C)CCC 7a_100000764384_100153394163 [0,2,0,0,0,0|1,0,1]=4 16127 B14R0.393 C#CCCCCCCCOC(C)CCO 34a_100000054614_100009893172 [0,2,0,0,0,0|0,0,2]=4 16128 B14R0.393 C#CCCCCCCCOC(C)CCO 7a_100000054614_100009893172 [0,2,0,0,0,0|0,0,2]=4 16129 B14R0.393 C#CCCCCCCCSC(C)CCC 62a_100000766640_100153394163 [0,2,0,0,0,0|1,0,1]=4 16130 B14R0.393 C#CCCCCCCCSC(C)CCC 62a_100153394163_100000766640 [0,2,0,0,0,0|1,0,1]=4 16131 B14R0.393 C#CCCCCCCCSC(C)CCO 62a_100009893172_100153394163 [0,2,0,0,0,0|0,0,2]=4 16132 B14R0.393 C#CCCCCCCCSC(C)CCO 62a_100153394163_100009893172 [0,2,0,0,0,0|0,0,2]=4 16133 B14R0.393 C#CCCCCCCOCC(C)CCC 34a_100000688023_100012276617 [0,2,0,0,0,0|1,0,1]=4 16134 B14R0.393 C#CCCCCCCOCC(C)CCC 34a_100011217361_100011216630 [0,2,0,0,0,0|1,0,1]=4 16135 B14R0.393 C#CCCCCCCOCC(C)CCC 7a_100000688023_100012276617 [0,2,0,0,0,0|1,0,1]=4 16136 B14R0.393 C#CCCCCCCOCC(C)CCC 7a_100011217361_100011216630 [0,2,0,0,0,0|1,0,1]=4 16137 B14R0.393 C#CCCCCCCOC[C@@H](N)CCC 34a_100000732646_100012276617 [0,2,0,0,0,0|1,0,1]=4 16138 B14R0.393 C#CCCCCCCSCC(C)CCC 62a_100011216630_100012276617 [0,2,0,0,0,0|1,0,1]=4 16139 B14R0.393 C#CCCCCCCSCC(C)CCC 62a_100012276617_100011216630 [0,2,0,0,0,0|1,0,1]=4 16140 B14R0.393 C#CCCCCCOCCC(C)CCC 34a_100011217855_100012094781 [0,2,0,0,0,0|1,0,1]=4 16141 B14R0.393 C#CCCCCCOCCC(C)CCC 7a_100011217855_100012094781 [0,2,0,0,0,0|1,0,1]=4 16142 B14R0.393 C#CCCCCCOCC[C@@H](N)CCC 34a_100015193777_100012094781 [0,2,0,0,0,0|1,0,1]=4 16143 B14R0.393 C#CCCCCOCCCC(C)CCC 34a_100011713154_100010269958 [0,2,0,0,0,0|1,0,1]=4 16144 B14R0.393 C#CCCCCOCCCC(C)CCC 7a_100011713154_100010269958 [0,2,0,0,0,0|1,0,1]=4 16145 B14R0.393 C#CCN(C)CCCCCCCCCC 2230a_100000207566_100000038162 [0,2,0,0,0,0|1,0,1]=4 16146 B14R0.393 C#CCN(C)CCCCCCCCCC 2230a_100000225692_100000210320 [0,2,0,0,0,0|1,0,1]=4 16147 B14R0.393 C#CCN(C)CCCCCCCCCC 34a_100000225692_100000210320 [0,2,0,0,0,0|1,0,1]=4 16148 B14R0.393 C#CCN(C)CCCCCCCCCO 2230a_100000225692_100009813782 [0,2,0,0,0,0|0,0,2]=4 16149 B14R0.393 C#CCN(C)CCCCCCCCCO 34a_100000225692_100009813782 [0,2,0,0,0,0|0,0,2]=4 16150 B14R0.393 C/C=C/C(C)OCCCCCCCCO 34a_200102604097_100000033203 [0,2,0,0,0,0|0,0,2]=4 16151 B14R0.393 C=CCC(=O)CCCCCCCCCC 1458a_100000210193_100000210319 [0,2,0,0,0,0|1,0,1]=4 16152 B14R0.393 C=CCC(=O)CCCCCCCCCC 1458a_100000210375_100000210623 [0,2,0,0,0,0|1,0,1]=4 16153 B14R0.393 C=CCC(=O)CCCCCCCCCO 1458a_100000210193_100009813782 [0,2,0,0,0,0|0,0,2]=4 16154 B14R0.393 C=CCC(C)COCCCCCCCC 34a_100009832082_100000210759 [0,2,0,0,0,0|1,0,1]=4 16155 B14R0.393 C=CCC(C)COCCCCCCCC 7a_100009832082_100000210759 [0,2,0,0,0,0|1,0,1]=4 16156 B14R0.393 C=CCC(C)COCCCCCCCO 34a_100009832082_100000760002 [0,2,0,0,0,0|0,0,2]=4 16157 B14R0.393 C=CCC(C)COCCCCCCCO 7a_100009832082_100000760002 [0,2,0,0,0,0|0,0,2]=4 16158 B14R0.393 C=CCCCCCCCCC(=O)CCC 1458a_100000211349_100000210303 [0,2,0,0,0,0|1,0,1]=4 16159 B14R0.393 C=CCCCCCCCCC(=O)CCC 1458a_100000211992_100011933949 [0,2,0,0,0,0|1,0,1]=4 16160 B14R0.393 C=CCCCCCCCCC(=O)CCO 1458a_100000211349_100000211926 [0,2,0,0,0,0|0,0,2]=4 16161 B14R0.393 C=CCCCCCCCCC(=O)CCO 1458a_100011216618_100011933949 [0,2,0,0,0,0|0,0,2]=4 16162 B14R0.393 C=CCCCCCCCCN(C)CCC 2230a_100000747261_100011933949 [0,2,0,0,0,0|1,0,1]=4 16163 B14R0.393 C=CCCCCCCCCN(C)CCC 269982a_100000747261_100011933949 [0,2,0,0,0,0|1,0,1]=4 16164 B14R0.393 C=CCCCCCCCCN(C)CCO 2230a_100000210263_100011933949 [0,2,0,0,0,0|0,0,2]=4 16165 B14R0.393 C=CCCCCCCCCN(C)CCO 269982a_100000210263_100011933949 [0,2,0,0,0,0|0,0,2]=4 16166 B14R0.393 C=CCCCCCCCNC(C)CCC 2230a_100000741246_100012355270 [0,2,0,0,0,0|1,0,1]=4 16167 B14R0.393 C=CCCCCCCCN[C@H](C)CCO 2230a_100000706166_100012355270 [0,2,0,0,0,0|0,0,2]=4 16168 B14R0.393 C=CCCCCCCCN[C@H](C)CCO 34a_100000706166_100012355270 [0,2,0,0,0,0|0,0,2]=4 16169 B14R0.393 C=CCCCCCCCOC(C)CCC 34a_100000730831_100000766640 [0,2,0,0,0,0|1,0,1]=4 16170 B14R0.393 C=CCCCCCCCOC(C)CCC 34a_100000764384_100012355270 [0,2,0,0,0,0|1,0,1]=4 16171 B14R0.393 C=CCCCCCCCOC(C)CCC 7a_100000730831_100000766640 [0,2,0,0,0,0|1,0,1]=4 16172 B14R0.393 C=CCCCCCCCOC(C)CCC 7a_100000764384_100012355270 [0,2,0,0,0,0|1,0,1]=4 16173 B14R0.393 C=CCCCCCCCOC(C)CCO 34a_100000730831_100009893172 [0,2,0,0,0,0|0,0,2]=4 16174 B14R0.393 C=CCCCCCCCOC(C)CCO 7a_100000730831_100009893172 [0,2,0,0,0,0|0,0,2]=4 16175 B14R0.393 C=CCCCCCCCSC(C)CCC 62a_100000766640_100012355270 [0,2,0,0,0,0|1,0,1]=4 16176 B14R0.393 C=CCCCCCCCSC(C)CCC 62a_100012355270_100000766640 [0,2,0,0,0,0|1,0,1]=4 16177 B14R0.393 C=CCCCCCCCSC(C)CCO 62a_100009893172_100012355270 [0,2,0,0,0,0|0,0,2]=4 16178 B14R0.393 C=CCCCCCCCSC(C)CCO 62a_100012355270_100009893172 [0,2,0,0,0,0|0,0,2]=4 16179 B14R0.393 C=CCCCCCCOCC(C)CCC 34a_100000688023_100011215473 [0,2,0,0,0,0|1,0,1]=4 16180 B14R0.393 C=CCCCCCCOCC(C)CCC 34a_200011216477_100011216630 [0,2,0,0,0,0|1,0,1]=4 16181 B14R0.393 C=CCCCCCCOCC(C)CCC 7a_100000688023_100011215473 [0,2,0,0,0,0|1,0,1]=4 16182 B14R0.393 C=CCCCCCCOCC(C)CCC 7a_200011216477_100011216630 [0,2,0,0,0,0|1,0,1]=4 16183 B14R0.393 C=CCCCCCCOC[C@@H](N)CCC 34a_100000732646_100011215473 [0,2,0,0,0,0|1,0,1]=4 16184 B14R0.393 C=CCCCCCCSCC(C)CCC 62a_100011215473_100011216630 [0,2,0,0,0,0|1,0,1]=4 16185 B14R0.393 C=CCCCCCCSCC(C)CCC 62a_100011216630_100011215473 [0,2,0,0,0,0|1,0,1]=4 16186 B14R0.393 C=CCCCCCOCCC(C)CCC 34a_100011217855_100000700193 [0,2,0,0,0,0|1,0,1]=4 16187 B14R0.393 C=CCCCCCOCCC(C)CCC 7a_100011217855_100000700193 [0,2,0,0,0,0|1,0,1]=4 16188 B14R0.393 C=CCCCCCOCC[C@@H](N)CCC 34a_100015193777_100000700193 [0,2,0,0,0,0|1,0,1]=4 16189 B14R0.393 C=CCCCCOCCCC(C)CCC 34a_100011713154_100011215482 [0,2,0,0,0,0|1,0,1]=4 16190 B14R0.393 C=CCCCCOCCCC(C)CCC 7a_100011713154_100011215482 [0,2,0,0,0,0|1,0,1]=4 16191 B14R0.393 C=CCN(C)CCCCCCCCCC 2230a_100000207566_100000210623 [0,2,0,0,0,0|1,0,1]=4 16192 B14R0.393 C=CCN(C)CCCCCCCCCC 2230a_100000225617_100000210320 [0,2,0,0,0,0|1,0,1]=4 16193 B14R0.393 C=CCN(C)CCCCCCCCCC 269982a_100000207566_100000210623 [0,2,0,0,0,0|1,0,1]=4 16194 B14R0.393 C=CCN(C)CCCCCCCCCC 269982a_100000225617_100000210320 [0,2,0,0,0,0|1,0,1]=4 16195 B14R0.393 C=CCN(C)CCCCCCCCCO 2230a_100000225617_100009813782 [0,2,0,0,0,0|0,0,2]=4 16196 B14R0.393 C=CCN(C)CCCCCCCCCO 269982a_100000225617_100009813782 [0,2,0,0,0,0|0,0,2]=4 16197 B14R0.393 C=CC[C@@H](C)OCCCCCCCCC 34a_100000731007_100011214924 [0,2,0,0,0,0|1,0,1]=4 16198 B14R0.393 C=CC[C@@H](C)OCCCCCCCCC 7a_100000731007_100000210328 [0,2,0,0,0,0|1,0,1]=4 16199 B14R0.393 C=CC[C@@H](C)OCCCCCCCCO 34a_100000731007_100000033203 [0,2,0,0,0,0|0,0,2]=4 16200 B14R0.393 C=CC[C@@H](C)OCCCCCCCCO 7a_100000731007_100000033203 [0,2,0,0,0,0|0,0,2]=4 16201 B14R0.393 C=CC[C@@H](N)COCCCCCCCC 34a_100020615467_100000210759 [0,2,0,0,0,0|1,0,1]=4 16202 B14R0.393 C=CC[C@@H](N)COCCCCCCCO 34a_100020615467_100000760002 [0,2,0,0,0,0|0,0,2]=4 16203 B14R0.393 CC#CC(=O)CCCCCCCCCO 1458a_100000763181_100009813782 [0,2,0,0,0,0|0,0,2]=4 16204 B14R0.393 CC#CC(C)OCCCCCCCCO 34a_100011216543_100000033203 [0,2,0,0,0,0|0,0,2]=4 16205 B14R0.393 CC#CCCCCCCCC(=O)CCO 1458a_100000066323_100000211926 [0,2,0,0,0,0|0,0,2]=4 16206 B14R0.393 CC(CC#N)NCCCCCCCCO 2230a_102515433106_100009813641 [0,2,0,0,0,0|1,0,1]=4 16207 B14R0.393 CC(CC#N)SCCCCCCCCO 62a_100000033203_100009813641 [0,2,0,0,0,0|1,0,1]=4 16208 B14R0.393 CC(CC#N)SCCCCCCCCO 62a_100009813641_100000033203 [0,2,0,0,0,0|1,0,1]=4 16209 B14R0.393 CC(CCBr)OCCCCCCCCO 34a_100012276601_100000033203 [0,2,0,0,0,0|1,0,0]=3 16210 B14R0.393 CC(CCN)COCCCCCCCO 34a_106354213184_100000760002 [0,2,0,0,0,0|1,0,0]=3 16211 B14R0.393 CC(CCO)NCCCCCCCCO 2230a_102515433106_100009893172 [0,2,0,0,0,0|1,0,0]=3 16212 B14R0.393 CC(CCO)NCCCCCCCCO 34a_102515433106_100009893172 [0,2,0,0,0,0|1,0,0]=3 16213 B14R0.393 CC(CCO)OCCCCCCCCBr 34a_100009813846_100009893172 [0,2,0,0,0,0|1,0,0]=3 16214 B14R0.393 CC(CCO)OCCCCCCCCBr 7a_100009813846_100009893172 [0,2,0,0,0,0|1,0,0]=3 16215 B14R0.393 CC(CCO)OCCCCCCCCCl 34a_100000033203_100009893172 [0,2,0,0,0,0|1,0,0]=3 16216 B14R0.393 CC(CCO)OCCCCCCCCCl 7a_100000033203_100009893172 [0,2,0,0,0,0|1,0,0]=3 16217 B14R0.393 CC(CCO)OCCCCCCCCN 34a_102515433106_100009893172 [0,2,0,0,0,0|1,0,0]=3 16218 B14R0.393 CC(CCO)OCCCCCNCCN 34a_103619048469_100009893172 [0,2,0,0,0,0|2,0,0]=4 16219 B14R0.393 CC(CCO)SCCCCCCCCO 62a_100000033203_100009893172 [0,2,0,0,0,0|1,0,0]=3 16220 B14R0.393 CC(CCO)SCCCCCCCCO 62a_100009893172_100000033203 [0,2,0,0,0,0|1,0,0]=3 16221 B14R0.393 CC/C=C\CCCCCN[C@H](C)CCO 269862a_100000706166_100016288537 [0,2,0,0,0,0|0,0,2]=4 16222 B14R0.393 CC/C=C\CCCCCOC(C)CCO 34a_100016268722_100009893172 [0,2,0,0,0,0|0,0,2]=4 16223 B14R0.393 CC/C=C\CCCCCOC(C)CCO 7a_100016268722_100009893172 [0,2,0,0,0,0|0,0,2]=4 16224 B14R0.393 CC=CC(=O)CCCCCCCCCO 1458a_100000210699_100009813782 [0,2,0,0,0,0|0,0,2]=4 16225 B14R0.393 CCC#CCCCCCCC(=O)CCO 1458a_100011216618_200000036426 [0,2,0,0,0,0|0,0,2]=4 16226 B14R0.393 CCC#CCCCCCCN(C)CCO 2230a_100000210263_200000036426 [0,2,0,0,0,0|0,0,2]=4 16227 B14R0.393 CCC#CCCCCCCN(C)CCO 269982a_100000210263_200000036426 [0,2,0,0,0,0|0,0,2]=4 16228 B14R0.393 CCCC(=O)CCCCCCCCCF 1458a_200009909015_100000210303 [0,2,0,0,0,0|1,0,0]=3 16229 B14R0.393 CCCC(=O)CCCCCCCCCO 1458a_100000211992_100009813782 [0,2,0,0,0,0|0,0,0]=2 16230 B14R0.393 CCCC(=O)CNCCCCCCCO 2230a_100011996573_100000747444 [0,2,0,0,0,0|0,0,1]=3 16231 B14R0.393 CCCC(=O)CNCCCOCCCO 2230a_100011310245_100000747444 [0,2,0,0,0,0|1,0,1]=4 16232 B14R0.393 CCCC(=O)COCCCCCCCBr 7a_100000760002_100000747444 [0,2,0,0,0,0|1,0,1]=4 16233 B14R0.393 CCCC(=O)COCCCCCCOC 7a_200012092642_100000747444 [0,2,0,0,0,0|1,0,1]=4 16234 B14R0.393 CCCC(=O)CSCCCCCCCO 62a_100000747444_100000760002 [0,2,0,0,0,0|0,0,1]=3 16235 B14R0.393 CCCC(=O)CSCCCCCCCO 62a_100000760002_100000747444 [0,2,0,0,0,0|0,0,1]=3 16236 B14R0.393 CCCC(=O)CSCCCCCCOC 62a_100000747444_100011998445 [0,2,0,0,0,0|1,0,1]=4 16237 B14R0.393 CCCC(=O)CSCCCCCCOC 62a_100011998445_100000747444 [0,2,0,0,0,0|1,0,1]=4 16238 B14R0.393 CCCC(=O)NCCCCCCCCO 240690a_102515433106_100000211992 [0,2,0,0,0,0|0,0,1]=3 16239 B14R0.393 CCCC(=O)OCNCCCCCCO 2230a_100000686447_100000034017 [0,2,0,0,0,0|1,0,1]=4 16240 B14R0.393 CCCC(=O)OCNCCCCCCO 34a_100000686447_100000034017 [0,2,0,0,0,0|1,0,1]=4 16241 B14R0.393 CCCC(=O)OCSCCCCCCO 62a_100000766143_100000034017 [0,2,0,0,0,0|1,0,1]=4 16242 B14R0.393 CCCC(C)CCCOCCCCC#N 7a_100011713154_100000211819 [0,2,0,0,0,0|1,0,1]=4 16243 B14R0.393 CCCC(C)CCCOCCCCC=O 7a_100011713154_100000139335 [0,2,0,0,0,0|0,0,2]=4 16244 B14R0.393 CCCC(C)CCCOCCCCCF 34a_100011713154_100000729378 [0,2,0,0,0,0|1,0,0]=3 16245 B14R0.393 CCCC(C)CCCOCCCCCF 7a_100011713154_100000729378 [0,2,0,0,0,0|1,0,0]=3 16246 B14R0.393 CCCC(C)CCCOCCCCCO 34a_100011713154_100000746330 [0,2,0,0,0,0|0,0,0]=2 16247 B14R0.393 CCCC(C)CCCOCCCCCO 7a_100011713154_100000746330 [0,2,0,0,0,0|0,0,0]=2 16248 B14R0.393 CCCC(C)CCCOCCCCOC 34a_100011713154_100000755781 [0,2,0,0,0,0|1,0,0]=3 16249 B14R0.393 CCCC(C)CCCOCCCCOC 7a_100011713154_100000730899 [0,2,0,0,0,0|1,0,0]=3 16250 B14R0.393 CCCC(C)CCCOCCCOCC 34a_100011713154_100012232248 [0,2,0,0,0,0|2,0,0]=4 16251 B14R0.393 CCCC(C)CCCOCCCOCC 7a_100011713154_100012232248 [0,2,0,0,0,0|2,0,0]=4 16252 B14R0.393 CCCC(C)CCCOCCOCCO 34a_100011713154_100000692535 [0,2,0,0,0,0|1,0,0]=3 16253 B14R0.393 CCCC(C)CCCOCCOCCO 7a_100011713154_100011215305 [0,2,0,0,0,0|1,0,0]=3 16254 B14R0.393 CCCC(C)CCOCCCCCC#N 7a_100011217855_100009813376 [0,2,0,0,0,0|1,0,1]=4 16255 B14R0.393 CCCC(C)CCOCCCCCC=O 7a_100011217855_100000139337 [0,2,0,0,0,0|0,0,2]=4 16256 B14R0.393 CCCC(C)CCOCCCCCCF 34a_100011217855_100015922095 [0,2,0,0,0,0|1,0,0]=3 16257 B14R0.393 CCCC(C)CCOCCCCCCF 7a_100011217855_100015922095 [0,2,0,0,0,0|1,0,0]=3 16258 B14R0.393 CCCC(C)CCOCCCCCCO 34a_100011217855_100000766143 [0,2,0,0,0,0|0,0,0]=2 16259 B14R0.393 CCCC(C)CCOCCCCCCO 7a_100011217855_100000766143 [0,2,0,0,0,0|0,0,0]=2 16260 B14R0.393 CCCC(C)CCOCCOCCOC 34a_100011217855_100000695917 [0,2,0,0,0,0|2,0,0]=4 16261 B14R0.393 CCCC(C)CCOCCOCCOC 7a_100011217855_100000695917 [0,2,0,0,0,0|2,0,0]=4 16262 B14R0.393 CCCC(C)CNCCCCCCCO 2230a_100011996573_100011216630 [0,2,0,0,0,0|0,0,0]=2 16263 B14R0.393 CCCC(C)CNCCCCCCCO 270004a_100011996573_100000243154 [0,2,0,0,0,0|0,0,0]=2 16264 B14R0.393 CCCC(C)CNCCCCCCCO 34a_100011996573_100011216630 [0,2,0,0,0,0|0,0,0]=2 16265 B14R0.393 CCCC(C)CNCCCOCCCO 2230a_100011310245_100011216630 [0,2,0,0,0,0|1,0,0]=3 16266 B14R0.393 CCCC(C)CNCCCOCCCO 270004a_100011310245_100000243154 [0,2,0,0,0,0|1,0,0]=3 16267 B14R0.393 CCCC(C)CNCCCOCCCO 34a_100011310245_100011216630 [0,2,0,0,0,0|1,0,0]=3 16268 B14R0.393 CCCC(C)CNCCCOCCOC 2230a_100000206027_100011216630 [0,2,0,0,0,0|2,0,0]=4 16269 B14R0.393 CCCC(C)CNCCCOCCOC 270004a_100000206027_100000243154 [0,2,0,0,0,0|2,0,0]=4 16270 B14R0.393 CCCC(C)CNCCCOCCOC 34a_100000206027_100011216630 [0,2,0,0,0,0|2,0,0]=4 16271 B14R0.393 CCCC(C)COCCCCCCC#N 7a_100000688023_100009813337 [0,2,0,0,0,0|1,0,1]=4 16272 B14R0.393 CCCC(C)COCCCCCCCBr 34a_100000760002_100011216630 [0,2,0,0,0,0|1,0,0]=3 16273 B14R0.393 CCCC(C)COCCCCCCCBr 7a_100000760002_100011216630 [0,2,0,0,0,0|1,0,0]=3 16274 B14R0.393 CCCC(C)COCCCCCCCN 34a_100011996573_100011216630 [0,2,0,0,0,0|1,0,0]=3 16275 B14R0.393 CCCC(C)COCCCCCCCO 34a_100000688023_100000760002 [0,2,0,0,0,0|0,0,0]=2 16276 B14R0.393 CCCC(C)COCCCCCCCO 7a_100000688023_100000760002 [0,2,0,0,0,0|0,0,0]=2 16277 B14R0.393 CCCC(C)COCCCCCCOC 34a_100000688023_100011998445 [0,2,0,0,0,0|1,0,0]=3 16278 B14R0.393 CCCC(C)COCCCCCCOC 34a_200012092642_100011216630 [0,2,0,0,0,0|1,0,0]=3 16279 B14R0.393 CCCC(C)COCCCCCCOC 7a_100000688023_100011998445 [0,2,0,0,0,0|1,0,0]=3 16280 B14R0.393 CCCC(C)COCCCCCCOC 7a_200012092642_100011216630 [0,2,0,0,0,0|1,0,0]=3 16281 B14R0.393 CCCC(C)COCCCOCCCN 34a_100011310245_100011216630 [0,2,0,0,0,0|2,0,0]=4 16282 B14R0.393 CCCC(C)COCCCOCCOC 34a_100000688023_100011216529 [0,2,0,0,0,0|2,0,0]=4 16283 B14R0.393 CCCC(C)COCCCOCCOC 7a_100000688023_100011216529 [0,2,0,0,0,0|2,0,0]=4 16284 B14R0.393 CCCC(C)CSCCCCCCC#N 62a_100009813337_100011216630 [0,2,0,0,0,0|1,0,1]=4 16285 B14R0.393 CCCC(C)CSCCCCCCC#N 62a_100011216630_100009813337 [0,2,0,0,0,0|1,0,1]=4 16286 B14R0.393 CCCC(C)CSCCCCCCCO 62a_100000760002_100011216630 [0,2,0,0,0,0|0,0,0]=2 16287 B14R0.393 CCCC(C)CSCCCCCCCO 62a_100011216630_100000760002 [0,2,0,0,0,0|0,0,0]=2 16288 B14R0.393 CCCC(C)CSCCCCCCOC 62a_100011216630_100011998445 [0,2,0,0,0,0|1,0,0]=3 16289 B14R0.393 CCCC(C)CSCCCCCCOC 62a_100011998445_100011216630 [0,2,0,0,0,0|1,0,0]=3 16290 B14R0.393 CCCC(C)CSCCCOCCOC 62a_100011216529_100011216630 [0,2,0,0,0,0|2,0,0]=4 16291 B14R0.393 CCCC(C)CSCCCOCCOC 62a_100011216630_100011216529 [0,2,0,0,0,0|2,0,0]=4 16292 B14R0.393 CCCC(C)NCCCCCCCCO 2230a_100000741246_100000033203 [0,2,0,0,0,0|0,0,0]=2 16293 B14R0.393 CCCC(C)NCCCCCCCCO 2230a_102515433106_100000766640 [0,2,0,0,0,0|0,0,0]=2 16294 B14R0.393 CCCC(C)NCCCCCCCCO 270004a_102515433106_100000211909 [0,2,0,0,0,0|0,0,0]=2 16295 B14R0.393 CCCC(C)NCCCCCCCCO 34a_102515433106_100000766640 [0,2,0,0,0,0|0,0,0]=2 16296 B14R0.393 CCCC(C)NCCOCCOCCO 2230a_100000741246_100000032323 [0,2,0,0,0,0|2,0,0]=4 16297 B14R0.393 CCCC(C)NCCOCCOCCO 2230a_100011998139_100000766640 [0,2,0,0,0,0|2,0,0]=4 16298 B14R0.393 CCCC(C)NCCOCCOCCO 270004a_100011998139_100000211909 [0,2,0,0,0,0|2,0,0]=4 16299 B14R0.393 CCCC(C)NCCOCCOCCO 34a_100011998139_100000766640 [0,2,0,0,0,0|2,0,0]=4 16300 B14R0.393 CCCC(C)OCCCCCCCCBr 34a_100009813846_100000766640 [0,2,0,0,0,0|1,0,0]=3 16301 B14R0.393 CCCC(C)OCCCCCCCCBr 7a_100009813846_100000766640 [0,2,0,0,0,0|1,0,0]=3 16302 B14R0.393 CCCC(C)OCCCCCCCCCl 34a_100000033203_100000766640 [0,2,0,0,0,0|1,0,0]=3 16303 B14R0.393 CCCC(C)OCCCCCCCCCl 7a_100000033203_100000766640 [0,2,0,0,0,0|1,0,0]=3 16304 B14R0.393 CCCC(C)OCCCCCCCCN 34a_102515433106_100000766640 [0,2,0,0,0,0|1,0,0]=3 16305 B14R0.393 CCCC(C)OCCCCCCCCO 34a_100000764384_100000033203 [0,2,0,0,0,0|0,0,0]=2 16306 B14R0.393 CCCC(C)OCCCCCCCCO 7a_100000764384_100000033203 [0,2,0,0,0,0|0,0,0]=2 16307 B14R0.393 CCCC(C)OCCCCCNCCN 34a_103619048469_100000766640 [0,2,0,0,0,0|2,0,0]=4 16308 B14R0.393 CCCC(C)OCCCOCCCOC 34a_200011215475_100000766640 [0,2,0,0,0,0|2,0,0]=4 16309 B14R0.393 CCCC(C)OCCCOCCCOC 7a_200011215475_100000766640 [0,2,0,0,0,0|2,0,0]=4 16310 B14R0.393 CCCC(C)OCCOCCOCCO 34a_100000764384_100000032323 [0,2,0,0,0,0|2,0,0]=4 16311 B14R0.393 CCCC(C)OCCOCCOCCO 7a_100000764384_100000032323 [0,2,0,0,0,0|2,0,0]=4 16312 B14R0.393 CCCC(C)SCCCCCCCCO 62a_100000033203_100000766640 [0,2,0,0,0,0|0,0,0]=2 16313 B14R0.393 CCCC(C)SCCCCCCCCO 62a_100000766640_100000033203 [0,2,0,0,0,0|0,0,0]=2 16314 B14R0.393 CCCC(C)SCCOCCOCCO 62a_100000032323_100000766640 [0,2,0,0,0,0|2,0,0]=4 16315 B14R0.393 CCCC(C)SCCOCCOCCO 62a_100000766640_100000032323 [0,2,0,0,0,0|2,0,0]=4 16316 B14R0.393 CCCCC#CCCCN[C@H](C)CCO 2230a_100000706166_200000047210 [0,2,0,0,0,0|0,0,2]=4 16317 B14R0.393 CCCCC#CCCCN[C@H](C)CCO 34a_100000706166_200000047210 [0,2,0,0,0,0|0,0,2]=4 16318 B14R0.393 CCCCC#CCCCSC(C)CCO 62a_100009893172_200000047210 [0,2,0,0,0,0|0,0,2]=4 16319 B14R0.393 CCCCC#CCCCSC(C)CCO 62a_200000047210_100009893172 [0,2,0,0,0,0|0,0,2]=4 16320 B14R0.393 CCCCC/C=C\CCOC(C)CCO 34a_100016277358_100009893172 [0,2,0,0,0,0|0,0,2]=4 16321 B14R0.393 CCCCC/C=C\CCOC(C)CCO 7a_100016277358_100009893172 [0,2,0,0,0,0|0,0,2]=4 16322 B14R0.393 CCCCCC#CCCOC(C)CCO 34a_200000042877_100009893172 [0,2,0,0,0,0|0,0,2]=4 16323 B14R0.393 CCCCCC#CCCOC(C)CCO 7a_200000042877_100009893172 [0,2,0,0,0,0|0,0,2]=4 16324 B14R0.393 CCCCCC/C=C/COC(C)CCO 34a_200016276170_100009893172 [0,2,0,0,0,0|0,0,2]=4 16325 B14R0.393 CCCCCC/C=C/COC(C)CCO 7a_200016276170_100009893172 [0,2,0,0,0,0|0,0,2]=4 16326 B14R0.393 CCCCCCC#CCOC(C)CCO 34a_200000037284_100009893172 [0,2,0,0,0,0|0,0,2]=4 16327 B14R0.393 CCCCCCC#CCOC(C)CCO 7a_200000037284_100009893172 [0,2,0,0,0,0|0,0,2]=4 16328 B14R0.393 CCCCCCCCC=CC(=O)CCO 1458a_100015345288_100000211926 [0,2,0,0,0,0|0,0,2]=4 16329 B14R0.393 CCCCCCCCCCC(=O)CC#N 1458a_100000210375_100011214920 [0,2,0,0,0,0|1,0,1]=4 16330 B14R0.393 CCCCCCCCCCC(=O)CC#N 1458a_100051588842_100000210319 [0,2,0,0,0,0|1,0,1]=4 16331 B14R0.393 CCCCCCCCCCC(=O)CCC 1458a_100000210375_100000210303 [0,2,0,0,0,0|1,0,0]=3 16332 B14R0.393 CCCCCCCCCCC(=O)CCC 1458a_100000211992_100000210319 [0,2,0,0,0,0|1,0,0]=3 16333 B14R0.393 CCCCCCCCCCC(=O)CCF 1458a_100000210375_100011217306 [0,2,0,0,0,0|1,0,0]=3 16334 B14R0.393 CCCCCCCCCCC(=O)CCO 1458a_100000210375_100000211926 [0,2,0,0,0,0|0,0,0]=2 16335 B14R0.393 CCCCCCCCCCC(=O)CCO 1458a_100011216618_100000210319 [0,2,0,0,0,0|0,0,0]=2 16336 B14R0.393 CCCCCCCCCCC(=O)COC 1458a_100000210968_100000210319 [0,2,0,0,0,0|0,0,1]=3 16337 B14R0.393 CCCCCCCCCCC(=O)CSC 1458a_100000184570_100000210319 [0,2,0,0,0,0|0,1,1]=4 16338 B14R0.393 CCCCCCCCCCC(=O)NCC 11a_100015525214_100000210375 [0,2,0,0,0,0|1,0,1]=4 16339 B14R0.393 CCCCCCCCCCC(=O)NCC 240690a_100015525214_100000210375 [0,2,0,0,0,0|1,0,1]=4 16340 B14R0.393 CCCCCCCCCCC(C)NCC 270004a_100015525214_200011219864 [0,2,0,0,0,0|1,0,0]=3 16341 B14R0.393 CCCCCCCCCCC(C)OCC 34a_100011215000_100000210202 [0,2,0,0,0,0|1,0,0]=3 16342 B14R0.393 CCCCCCCCCCC(C)OCC 7a_100011215000_100000210202 [0,2,0,0,0,0|1,0,0]=3 16343 B14R0.393 CCCCCCCCCCC(C)OCF 34a_100011215000_100015361967 [0,2,0,0,0,0|1,0,0]=3 16344 B14R0.393 CCCCCCCCCCC(C)OCF 7a_100011215000_100015361967 [0,2,0,0,0,0|1,0,0]=3 16345 B14R0.393 CCCCCCCCCCN(C)CC#N 2230a_100000207566_100011215382 [0,2,0,0,0,0|1,0,1]=4 16346 B14R0.393 CCCCCCCCCCN(C)CC#N 2230a_100000748184_100000210320 [0,2,0,0,0,0|1,0,1]=4 16347 B14R0.393 CCCCCCCCCCN(C)CC#N 269982a_100000207566_100011214920 [0,2,0,0,0,0|1,0,1]=4 16348 B14R0.393 CCCCCCCCCCN(C)CC=O 2230a_100000207566_200015260668 [0,2,0,0,0,0|0,0,2]=4 16349 B14R0.393 CCCCCCCCCCN(C)CC=O 269982a_100000207566_200015260668 [0,2,0,0,0,0|0,0,2]=4 16350 B14R0.393 CCCCCCCCCCN(C)CCC 2230a_100000207566_100000210303 [0,2,0,0,0,0|1,0,0]=3 16351 B14R0.393 CCCCCCCCCCN(C)CCC 2230a_100000747261_100000210320 [0,2,0,0,0,0|1,0,0]=3 16352 B14R0.393 CCCCCCCCCCN(C)CCC 269982a_100000207566_100000210303 [0,2,0,0,0,0|1,0,0]=3 16353 B14R0.393 CCCCCCCCCCN(C)CCC 269982a_100000747261_100000210320 [0,2,0,0,0,0|1,0,0]=3 16354 B14R0.393 CCCCCCCCCCN(C)CCF 2230a_100000207566_100011217306 [0,2,0,0,0,0|1,0,0]=3 16355 B14R0.393 CCCCCCCCCCN(C)CCF 269982a_100000207566_100011217306 [0,2,0,0,0,0|1,0,0]=3 16356 B14R0.393 CCCCCCCCCCN(C)CCO 2230a_100000207566_100000211926 [0,2,0,0,0,0|0,0,0]=2 16357 B14R0.393 CCCCCCCCCCN(C)CCO 2230a_100000210263_100000210320 [0,2,0,0,0,0|0,0,0]=2 16358 B14R0.393 CCCCCCCCCCN(C)CCO 269982a_100000207566_100000211926 [0,2,0,0,0,0|0,0,0]=2 16359 B14R0.393 CCCCCCCCCCN(C)CCO 269982a_100000210263_100000210320 [0,2,0,0,0,0|0,0,0]=2 16360 B14R0.393 CCCCCCCCCCN(C)COC 2230a_100000207566_100000766300 [0,2,0,0,0,0|1,0,0]=3 16361 B14R0.393 CCCCCCCCCCN(C)COC 269982a_100000207566_100000766300 [0,2,0,0,0,0|1,0,0]=3 16362 B14R0.393 CCCCCCCCCCN(C)CSC 2230a_100000207566_100011218213 [0,2,0,0,0,0|1,1,0]=4 16363 B14R0.393 CCCCCCCCCCN(C)CSC 269982a_100000207566_100011218213 [0,2,0,0,0,0|1,1,0]=4 16364 B14R0.393 CCCCCCCCCNC(=O)CCC 11a_100000212291_100000211992 [0,2,0,0,0,0|1,0,1]=4 16365 B14R0.393 CCCCCCCCCNC(=O)CCC 1626a_100000212291_100000211992 [0,2,0,0,0,0|1,0,1]=4 16366 B14R0.393 CCCCCCCCCNC(=O)CCC 240690a_100000212291_100000211992 [0,2,0,0,0,0|1,0,1]=4 16367 B14R0.393 CCCCCCCCCNC(=O)CCC 527a_100000212291_100000211992 [0,2,0,0,0,0|1,0,1]=4 16368 B14R0.393 CCCCCCCCCNC(=O)CCO 240690a_100000212291_100011216618 [0,2,0,0,0,0|0,0,1]=3 16369 B14R0.393 CCCCCCCCCNC(=O)COC 11a_100000212291_100000210968 [0,2,0,0,0,0|1,0,1]=4 16370 B14R0.393 CCCCCCCCCNC(=O)COC 1626a_100000212291_100000210968 [0,2,0,0,0,0|1,0,1]=4 16371 B14R0.393 CCCCCCCCCNC(=O)COC 240690a_100000212291_100000210968 [0,2,0,0,0,0|1,0,1]=4 16372 B14R0.393 CCCCCCCCCNC(=O)COC 527a_100000212291_100000210968 [0,2,0,0,0,0|1,0,1]=4 16373 B14R0.393 CCCCCCCCCNC(C)CC#N 2230a_100000212291_100009813641 [0,2,0,0,0,0|1,0,1]=4 16374 B14R0.393 CCCCCCCCCNC(C)CCC 2230a_100000212291_100000766640 [0,2,0,0,0,0|1,0,0]=3 16375 B14R0.393 CCCCCCCCCNC(C)CCC 2230a_100000741246_100011214924 [0,2,0,0,0,0|1,0,0]=3 16376 B14R0.393 CCCCCCCCCNC(C)CCC 270004a_100000212291_100000211909 [0,2,0,0,0,0|1,0,0]=3 16377 B14R0.393 CCCCCCCCCNC(C)CCC 34a_100000212291_100000766640 [0,2,0,0,0,0|1,0,0]=3 16378 B14R0.393 CCCCCCCCCNC(C)CCO 2230a_100000212291_100009893172 [0,2,0,0,0,0|0,0,0]=2 16379 B14R0.393 CCCCCCCCCNC(C)CCO 34a_100000212291_100009893172 [0,2,0,0,0,0|0,0,0]=2 16380 B14R0.393 CCCCCCCCCNC(C)COC 2230a_100000212291_100000765312 [0,2,0,0,0,0|1,0,0]=3 16381 B14R0.393 CCCCCCCCCNC(C)COC 270004a_100000212291_100000749346 [0,2,0,0,0,0|1,0,0]=3 16382 B14R0.393 CCCCCCCCCNC(C)COC 34a_100000212291_100000765312 [0,2,0,0,0,0|1,0,0]=3 16383 B14R0.393 CCCCCCCCCNC(C)CSC 270004a_100000212291_100011216314 [0,2,0,0,0,0|1,1,0]=4 16384 B14R0.393 CCCCCCCCCN[C@@H](C)CC#N 2230a_100016994482_100011214924 [0,2,0,0,0,0|1,0,1]=4 16385 B14R0.393 CCCCCCCCCN[C@H](C)CCO 2230a_100000706166_100011214924 [0,2,0,0,0,0|0,0,0]=2 16386 B14R0.393 CCCCCCCCCN[C@H](C)CCO 34a_100000706166_100011214924 [0,2,0,0,0,0|0,0,0]=2 16387 B14R0.393 CCCCCCCCCN[C@H](C)COC 2230a_100000764878_100011214924 [0,2,0,0,0,0|1,0,0]=3 16388 B14R0.393 CCCCCCCCCOC(C)CC#N 7a_100000210712_100009813641 [0,2,0,0,0,0|1,0,1]=4 16389 B14R0.393 CCCCCCCCCOC(C)CCBr 34a_100012276601_100011214924 [0,2,0,0,0,0|1,0,0]=3 16390 B14R0.393 CCCCCCCCCOC(C)CCC 34a_100000210712_100000766640 [0,2,0,0,0,0|1,0,0]=3 16391 B14R0.393 CCCCCCCCCOC(C)CCC 34a_100000764384_100011214924 [0,2,0,0,0,0|1,0,0]=3 16392 B14R0.393 CCCCCCCCCOC(C)CCC 7a_100000210712_100000766640 [0,2,0,0,0,0|1,0,0]=3 16393 B14R0.393 CCCCCCCCCOC(C)CCC 7a_100000764384_100000210328 [0,2,0,0,0,0|1,0,0]=3 16394 B14R0.393 CCCCCCCCCOC(C)CCO 34a_100000210712_100009893172 [0,2,0,0,0,0|0,0,0]=2 16395 B14R0.393 CCCCCCCCCOC(C)CCO 7a_100000210712_100009893172 [0,2,0,0,0,0|0,0,0]=2 16396 B14R0.393 CCCCCCCCCOC(C)COC 34a_100000210712_100000765312 [0,2,0,0,0,0|1,0,0]=3 16397 B14R0.393 CCCCCCCCCOC(C)COC 7a_100000210712_100000765312 [0,2,0,0,0,0|1,0,0]=3 16398 B14R0.393 CCCCCCCCCO[C@H](C)COC 34a_100011934205_100011214924 [0,2,0,0,0,0|1,0,0]=3 16399 B14R0.393 CCCCCCCCCSC(C)CC#N 62a_100009813641_100000210670 [0,2,0,0,0,0|1,0,1]=4 16400 B14R0.393 CCCCCCCCCSC(C)CCC 62a_100000766640_100000210670 [0,2,0,0,0,0|1,0,0]=3 16401 B14R0.393 CCCCCCCCCSC(C)CCO 62a_100009893172_100000210670 [0,2,0,0,0,0|0,0,0]=2 16402 B14R0.393 CCCCCCCCCSC(C)COC 62a_100000765312_100000210670 [0,2,0,0,0,0|1,0,0]=3 16403 B14R0.393 CCCCCCCCNCC(=O)CCC 2230a_100000229939_100000747444 [0,2,0,0,0,0|1,0,1]=4 16404 B14R0.393 CCCCCCCCNCC(=O)NCO 2230a_100000229939_100000185155 [0,2,0,0,0,0|1,0,1]=4 16405 B14R0.393 CCCCCCCCNCC(=O)NCO 34a_100000229939_100000185155 [0,2,0,0,0,0|1,0,1]=4 16406 B14R0.393 CCCCCCCCNCC(C)CCC 2230a_100000229939_100011216630 [0,2,0,0,0,0|1,0,0]=3 16407 B14R0.393 CCCCCCCCNCC(C)CCC 270004a_100000229939_100000243154 [0,2,0,0,0,0|1,0,0]=3 16408 B14R0.393 CCCCCCCCNCC(C)CCC 34a_100000229939_100011216630 [0,2,0,0,0,0|1,0,0]=3 16409 B14R0.393 CCCCCCCCNCC(O)COC 2230a_100000756049_100000210759 [0,2,0,0,0,0|1,0,0]=3 16410 B14R0.393 CCCCCCCCNCC(O)COC 34a_100000229939_100011215053 [0,2,0,0,0,0|1,0,0]=3 16411 B14R0.393 CCCCCCCCNCC(O)COC 34a_100000756049_100000210759 [0,2,0,0,0,0|1,0,0]=3 16412 B14R0.393 CCCCCCCCNC[C@@H](O)CC#N 2230a_100000229939_100000001066 [0,2,0,0,0,0|1,0,1]=4 16413 B14R0.393 CCCCCCCCOCC(=O)CCC 1458a_100000759886_100000210303 [0,2,0,0,0,0|1,0,1]=4 16414 B14R0.393 CCCCCCCCOCC(=O)CCC 7a_100000210232_100000747444 [0,2,0,0,0,0|1,0,1]=4 16415 B14R0.393 CCCCCCCCOCC(=O)CCF 1458a_100000759886_100011217306 [0,2,0,0,0,0|1,0,1]=4 16416 B14R0.393 CCCCCCCCOCC(=O)CCO 1458a_100000759886_100000211926 [0,2,0,0,0,0|0,0,1]=3 16417 B14R0.393 CCCCCCCCOCC(=O)NCO 34a_100000210232_100000185155 [0,2,0,0,0,0|1,0,1]=4 16418 B14R0.393 CCCCCCCCOCC(=O)NCO 7a_100000210232_100000185155 [0,2,0,0,0,0|1,0,1]=4 16419 B14R0.393 CCCCCCCCOCC(C)CCC 34a_100000210232_100011216630 [0,2,0,0,0,0|1,0,0]=3 16420 B14R0.393 CCCCCCCCOCC(C)CCC 34a_100000688023_100000210759 [0,2,0,0,0,0|1,0,0]=3 16421 B14R0.393 CCCCCCCCOCC(C)CCC 7a_100000210232_100011216630 [0,2,0,0,0,0|1,0,0]=3 16422 B14R0.393 CCCCCCCCOCC(C)CCC 7a_100000688023_100000210759 [0,2,0,0,0,0|1,0,0]=3 16423 B14R0.393 CCCCCCCCOCC(C)CCN 34a_106354213184_100000210759 [0,2,0,0,0,0|1,0,0]=3 16424 B14R0.393 CCCCCCCCOCC(N)COC 34a_100000724102_100000210759 [0,2,0,0,0,0|1,0,0]=3 16425 B14R0.393 CCCCCCCCOCC(O)COC 34a_100000210232_100011215053 [0,2,0,0,0,0|1,0,0]=3 16426 B14R0.393 CCCCCCCCOCC(O)COC 7a_100000210232_100011215053 [0,2,0,0,0,0|1,0,0]=3 16427 B14R0.393 CCCCCCCCOC[C@@H](N)CCC 34a_100000732646_100000210759 [0,2,0,0,0,0|1,0,0]=3 16428 B14R0.393 CCCCCCCCOC[C@@H](O)CC#N 7a_100000210232_100000001066 [0,2,0,0,0,0|1,0,1]=4 16429 B14R0.393 CCCCCCCCSCC(=O)CCC 62a_100000210759_100000747444 [0,2,0,0,0,0|1,0,1]=4 16430 B14R0.393 CCCCCCCCSCC(=O)CCC 62a_100000747444_100000210317 [0,2,0,0,0,0|1,0,1]=4 16431 B14R0.393 CCCCCCCCSCC(=O)NCO 62a_100000185155_100000210317 [0,2,0,0,0,0|1,0,1]=4 16432 B14R0.393 CCCCCCCCSCC(=O)NCO 62a_100000210759_100000185155 [0,2,0,0,0,0|1,0,1]=4 16433 B14R0.393 CCCCCCCCSCC(C)CCC 62a_100000210759_100011216630 [0,2,0,0,0,0|1,0,0]=3 16434 B14R0.393 CCCCCCCCSCC(C)CCC 62a_100011216630_100000210317 [0,2,0,0,0,0|1,0,0]=3 16435 B14R0.393 CCCCCCCCSCC(O)COC 62a_100000210759_100011215053 [0,2,0,0,0,0|1,0,0]=3 16436 B14R0.393 CCCCCCCCSCC(O)COC 62a_100011215053_100000210317 [0,2,0,0,0,0|1,0,0]=3 16437 B14R0.393 CCCCCCCCSC[C@@H](O)CC#N 62a_100000001066_100000210317 [0,2,0,0,0,0|1,0,1]=4 16438 B14R0.393 CCCCCCCCSC[C@@H](O)CC#N 62a_100000210759_100000001066 [0,2,0,0,0,0|1,0,1]=4 16439 B14R0.393 CCCCCCCOCCC(C)CCC 34a_100011217855_100000210614 [0,2,0,0,0,0|1,0,0]=3 16440 B14R0.393 CCCCCCCOCCC(C)CCC 7a_100011217855_100000210614 [0,2,0,0,0,0|1,0,0]=3 16441 B14R0.393 CCCCCCCOCC[C@@H](N)CCC 34a_100015193777_100000210614 [0,2,0,0,0,0|1,0,0]=3 16442 B14R0.393 CCCCCCOCCCC(C)CCC 34a_100011713154_100000210314 [0,2,0,0,0,0|1,0,0]=3 16443 B14R0.393 CCCCCCOCCCC(C)CCC 7a_100011713154_100000210314 [0,2,0,0,0,0|1,0,0]=3 16444 B14R0.393 CCCCCCOCCOC(C)CCC 34a_100000691444_100000766640 [0,2,0,0,0,0|2,0,0]=4 16445 B14R0.393 CCCCCCOCCOC(C)CCC 7a_100000691444_100000766640 [0,2,0,0,0,0|2,0,0]=4 16446 B14R0.393 CCCCCCOCCOC(C)CCO 34a_100000691444_100009893172 [0,2,0,0,0,0|1,0,0]=3 16447 B14R0.393 CCCCCCOCCOC(C)CCO 7a_100000691444_100009893172 [0,2,0,0,0,0|1,0,0]=3 16448 B14R0.393 CCCCCCOCCOC(C)COC 34a_100000691444_100000765312 [0,2,0,0,0,0|2,0,0]=4 16449 B14R0.393 CCCCCCOCCOC(C)COC 7a_100000691444_100000765312 [0,2,0,0,0,0|2,0,0]=4 16450 B14R0.393 CCCCCNCCOCC(C)CCC 34a_100000224656_100011216630 [0,2,0,0,0,0|2,0,0]=4 16451 B14R0.393 CCCCCNCCOCC(O)COC 34a_100000224656_100011215053 [0,2,0,0,0,0|2,0,0]=4 16452 B14R0.393 CCCCCOCCOCC(C)CCC 34a_100011215259_100011216630 [0,2,0,0,0,0|2,0,0]=4 16453 B14R0.393 CCCCCOCCOCC(C)CCC 7a_100011215259_100011216630 [0,2,0,0,0,0|2,0,0]=4 16454 B14R0.393 CCCCCOCCOCC(O)COC 34a_100011215259_100011215053 [0,2,0,0,0,0|2,0,0]=4 16455 B14R0.393 CCCCCOCCOCC(O)COC 7a_100011215259_100011215053 [0,2,0,0,0,0|2,0,0]=4 16456 B14R0.393 CCCCNCCCCOC(C)CCC 34a_200011216965_100000766640 [0,2,0,0,0,0|2,0,0]=4 16457 B14R0.393 CCCCNCCCCOC(C)CCO 34a_200011216965_100009893172 [0,2,0,0,0,0|1,0,0]=3 16458 B14R0.393 CCCCNCCCCOC(C)COC 34a_200011216965_100000765312 [0,2,0,0,0,0|2,0,0]=4 16459 B14R0.393 CCCCOCCCCOC(C)CCC 34a_200000760531_100000766640 [0,2,0,0,0,0|2,0,0]=4 16460 B14R0.393 CCCCOCCCCOC(C)CCC 7a_200000760531_100000766640 [0,2,0,0,0,0|2,0,0]=4 16461 B14R0.393 CCCCOCCCCOC(C)CCO 34a_200000760531_100009893172 [0,2,0,0,0,0|1,0,0]=3 16462 B14R0.393 CCCCOCCCCOC(C)CCO 7a_200000760531_100009893172 [0,2,0,0,0,0|1,0,0]=3 16463 B14R0.393 CCCCOCCCCOC(C)COC 34a_200000760531_100000765312 [0,2,0,0,0,0|2,0,0]=4 16464 B14R0.393 CCCCOCCCCOC(C)COC 7a_200000760531_100000765312 [0,2,0,0,0,0|2,0,0]=4 16465 B14R0.393 CCCCOCCCNCC(C)CCC 2230a_200000211371_100011216630 [0,2,0,0,0,0|2,0,0]=4 16466 B14R0.393 CCCCOCCCNCC(C)CCC 270004a_200000211371_100000243154 [0,2,0,0,0,0|2,0,0]=4 16467 B14R0.393 CCCCOCCCNCC(C)CCC 34a_200000211371_100011216630 [0,2,0,0,0,0|2,0,0]=4 16468 B14R0.393 CCCCOCCCNCC(O)COC 34a_200000211371_100011215053 [0,2,0,0,0,0|2,0,0]=4 16469 B14R0.393 CCCCOCCCOCC(C)CCC 34a_200011215613_100011216630 [0,2,0,0,0,0|2,0,0]=4 16470 B14R0.393 CCCCOCCCOCC(C)CCC 7a_200011215613_100011216630 [0,2,0,0,0,0|2,0,0]=4 16471 B14R0.393 CCCCOCCCOCC(O)COC 34a_200011215613_100011215053 [0,2,0,0,0,0|2,0,0]=4 16472 B14R0.393 CCCCOCCCOCC(O)COC 7a_200011215613_100011215053 [0,2,0,0,0,0|2,0,0]=4 16473 B14R0.393 CCCCOCCOCCC(C)CCC 34a_100011217855_100000743108 [0,2,0,0,0,0|2,0,0]=4 16474 B14R0.393 CCCCOCCOCCC(C)CCC 7a_100011217855_100000743108 [0,2,0,0,0,0|2,0,0]=4 16475 B14R0.393 CCCCOCCOCC[C@@H](N)CCC 34a_100015193777_100000743108 [0,2,0,0,0,0|2,0,0]=4 16476 B14R0.393 CCCCOCOCCCC(C)CCC 34a_100011713154_100011995733 [0,2,0,0,0,0|2,0,0]=4 16477 B14R0.393 CCCN(C)CCCCCCCCCO 2230a_100000747261_100009813782 [0,2,0,0,0,0|0,0,0]=2 16478 B14R0.393 CCCN(C)CCCCCCCCCO 269982a_100000747261_100009813782 [0,2,0,0,0,0|0,0,0]=2 16479 B14R0.393 CCCOCCOCCCC(C)CCC 34a_100011713154_100011215938 [0,2,0,0,0,0|2,0,0]=4 16480 B14R0.393 CCCOCCOCCCC(C)CCC 7a_100011713154_100011215938 [0,2,0,0,0,0|2,0,0]=4 16481 B14R0.393 CCCOCCOCCNC(C)CCO 2230a_200011904461_100009893172 [0,2,0,0,0,0|2,0,0]=4 16482 B14R0.393 CCCOCCOCCNC(C)CCO 34a_200011904461_100009893172 [0,2,0,0,0,0|2,0,0]=4 16483 B14R0.393 CCC[C@H](N)CCOCCCCCCF 34a_100015193777_100015922095 [0,2,0,0,0,0|1,0,0]=3 16484 B14R0.393 CCC[C@H](N)CCOCCCCCCO 34a_100015193777_100000766143 [0,2,0,0,0,0|0,0,0]=2 16485 B14R0.393 CCC[C@H](N)CCOCCOCCOC 34a_100015193777_100000695917 [0,2,0,0,0,0|2,0,0]=4 16486 B14R0.393 CCC[C@H](N)COCCCCCCCO 34a_100000732646_100000760002 [0,2,0,0,0,0|0,0,0]=2 16487 B14R0.393 CCC[C@H](N)COCCCCCCOC 34a_100000732646_100011998445 [0,2,0,0,0,0|1,0,0]=3 16488 B14R0.393 CCC[C@H](N)COCCCOCCOC 34a_100000732646_100011216529 [0,2,0,0,0,0|2,0,0]=4 16489 B14R0.393 CCNC(=O)CCCCCCCCCF 11a_100015525214_200009909015 [0,2,0,0,0,0|1,0,1]=4 16490 B14R0.393 CCNC(=O)CCCCCCCCCF 240690a_100015525214_200009909015 [0,2,0,0,0,0|1,0,1]=4 16491 B14R0.393 CCNC(=O)CCCCCCCCCF 527a_100015525214_200009909015 [0,2,0,0,0,0|1,0,1]=4 16492 B14R0.393 CCNC(=O)CCCCCCCCCO 240690a_100015525214_100000032657 [0,2,0,0,0,0|0,0,1]=3 16493 B14R0.393 CCNC(=O)CCNCCCCCCO 2230a_100000686447_100000737597 [0,2,0,0,0,0|1,0,1]=4 16494 B14R0.393 CCNC(=O)CCNCCCCCCO 34a_100025743525_100000766143 [0,2,0,0,0,0|1,0,1]=4 16495 B14R0.393 CCNC(=O)CCSCCCCCCO 62a_100000737597_100000766143 [0,2,0,0,0,0|1,0,1]=4 16496 B14R0.393 CCNC(=O)CCSCCCCCCO 62a_100000766143_100000737597 [0,2,0,0,0,0|1,0,1]=4 16497 B14R0.393 CCNC(=O)CNCCCCCCCO 2230a_100011996573_100000183381 [0,2,0,0,0,0|1,0,1]=4 16498 B14R0.393 CCNC(=O)CNCCCCCCCO 2230a_100016988866_100000760002 [0,2,0,0,0,0|1,0,1]=4 16499 B14R0.393 CCNC(=O)CNCCCCCCCO 34a_100011996573_100000183381 [0,2,0,0,0,0|1,0,1]=4 16500 B14R0.393 CCNC(=O)CSCCCCCCCO 62a_100000183381_100000760002 [0,2,0,0,0,0|1,0,1]=4 16501 B14R0.393 CCNC(=O)CSCCCCCCCO 62a_100000760002_100000183381 [0,2,0,0,0,0|1,0,1]=4 16502 B14R0.393 CCNC(=O)NCCCCCCCCO 2708a_100015525214_102515433106 [0,2,0,0,0,0|1,0,1]=4 16503 B14R0.393 CCNC(=O)NCCCCCCCCO 2708a_102515433106_100015525214 [0,2,0,0,0,0|1,0,1]=4 16504 B14R0.393 CCNC(=O)NCCCCCCCCO 273464a_100015525214_102515433106 [0,2,0,0,0,0|1,0,1]=4 16505 B14R0.393 CCNC(=O)NCCCCCCCCO 273464a_102515433106_100015525214 [0,2,0,0,0,0|1,0,1]=4 16506 B14R0.393 CCNC(=O)NCCCCCCCCO 512a_100015525214_102515433106 [0,2,0,0,0,0|1,0,1]=4 16507 B14R0.393 CCNC(=O)NCCCCCCCCO 512a_102515433106_100015525214 [0,2,0,0,0,0|1,0,1]=4 16508 B14R0.393 CCOC(=O)CCCCCCCCOC 34a_100138415774_100010175975 [0,2,0,0,0,0|1,0,1]=4 16509 B14R0.393 CCOC(=O)CCCCCCNCCO 2230a_100016997473_100009814379 [0,2,0,0,0,0|1,0,1]=4 16510 B14R0.393 CCOC(=O)CCCCCCNCCO 34a_100016990907_100009814379 [0,2,0,0,0,0|1,0,1]=4 16511 B14R0.393 CCOC(=O)CCCCCCSCCO 62a_100000211926_100009814379 [0,2,0,0,0,0|1,0,1]=4 16512 B14R0.393 CCOC(=O)CCCCCOCCCO 7a_100011214988_100011215043 [0,2,0,0,0,0|1,0,1]=4 16513 B14R0.393 CCOC(=O)CCCCCSCCCO 62a_100000755133_100011215043 [0,2,0,0,0,0|1,0,1]=4 16514 B14R0.393 CCOC(=O)CCCCCSCCCO 62a_100011215043_100000755133 [0,2,0,0,0,0|1,0,1]=4 16515 B14R0.393 CCOC(=O)CCCCNCCCCO 2230a_100000750430_100000750268 [0,2,0,0,0,0|1,0,1]=4 16516 B14R0.393 CCOC(=O)CCCCNCCCCO 34a_100000750430_100000750268 [0,2,0,0,0,0|1,0,1]=4 16517 B14R0.393 CCOC(=O)CCCCSCCCCO 62a_100000210776_100000750268 [0,2,0,0,0,0|1,0,1]=4 16518 B14R0.393 CCOC(=O)CCCCSCCCCO 62a_100000750268_100000210776 [0,2,0,0,0,0|1,0,1]=4 16519 B14R0.393 CCOC(=O)CCCNCCCCCO 2230a_100000762737_100009991533 [0,2,0,0,0,0|1,0,1]=4 16520 B14R0.393 CCOC(=O)CCCNCCCCCO 34a_100000762737_100009991533 [0,2,0,0,0,0|1,0,1]=4 16521 B14R0.393 CCOC(=O)CCCOCCCCCO 7a_100012001163_100000746330 [0,2,0,0,0,0|1,0,1]=4 16522 B14R0.393 CCOC(=O)CCCSCCCCCO 62a_100000746330_100009991533 [0,2,0,0,0,0|1,0,1]=4 16523 B14R0.393 CCOC(=O)CCCSCCCCCO 62a_100009991533_100000746330 [0,2,0,0,0,0|1,0,1]=4 16524 B14R0.393 CCOC(=O)CCNCCCCCCO 2230a_100000686447_100011206558 [0,2,0,0,0,0|1,0,1]=4 16525 B14R0.393 CCOC(=O)CCNCCCCCCO 34a_100000686447_100000765890 [0,2,0,0,0,0|1,0,1]=4 16526 B14R0.393 CCOC(=O)CCSCCCCCCO 62a_100000765890_100000766143 [0,2,0,0,0,0|1,0,1]=4 16527 B14R0.393 CCOC(=O)CCSCCCCCCO 62a_100000766143_100000765890 [0,2,0,0,0,0|1,0,1]=4 16528 B14R0.393 CCOC(=O)CNCCCCCCCO 2230a_100011996573_100000188475 [0,2,0,0,0,0|1,0,1]=4 16529 B14R0.393 CCOC(=O)CNCCCCCCCO 34a_100011996573_100000188475 [0,2,0,0,0,0|1,0,1]=4 16530 B14R0.393 CCOC(=O)CSCCCCCCCO 62a_100000188475_100000760002 [0,2,0,0,0,0|1,0,1]=4 16531 B14R0.393 CCOC(=O)CSCCCCCCCO 62a_100000760002_100000188475 [0,2,0,0,0,0|1,0,1]=4 16532 B14R0.393 CN(CC#N)CCCCCCCCCO 2230a_100000748184_100009813782 [0,2,0,0,0,0|1,0,1]=4 16533 B14R0.393 CN(CCO)CCCCCCCCCO 2230a_100000210263_100009813782 [0,2,0,0,0,0|1,0,0]=3 16534 B14R0.393 CN(CCO)CCCCCCCCCO 269982a_100000210263_100009813782 [0,2,0,0,0,0|1,0,0]=3 16535 B14R0.393 CNNC(=O)CCCCCCCCCO 22a_100016993582_100000032657 [0,2,0,0,0,0|1,0,1]=4 16536 B14R0.393 COCC(=O)CCCCCCCCCO 1458a_100000210968_100009813782 [0,2,0,0,0,0|0,0,1]=3 16537 B14R0.393 COCC(=O)NCCCCCCCCO 240690a_102515433106_100000210968 [0,2,0,0,0,0|1,0,1]=4 16538 B14R0.393 COCC(C)NCCCCCCCCO 2230a_102515433106_100000765312 [0,2,0,0,0,0|1,0,0]=3 16539 B14R0.393 COCC(C)NCCCCCCCCO 270004a_102515433106_100000749346 [0,2,0,0,0,0|1,0,0]=3 16540 B14R0.393 COCC(C)NCCCCCCCCO 34a_102515433106_100000765312 [0,2,0,0,0,0|1,0,0]=3 16541 B14R0.393 COCC(C)OCCCCCCCCBr 34a_100009813846_100000765312 [0,2,0,0,0,0|2,0,0]=4 16542 B14R0.393 COCC(C)OCCCCCCCCBr 7a_100009813846_100000765312 [0,2,0,0,0,0|2,0,0]=4 16543 B14R0.393 COCC(C)OCCCCCCCCCl 34a_100000033203_100000765312 [0,2,0,0,0,0|2,0,0]=4 16544 B14R0.393 COCC(C)OCCCCCCCCCl 7a_100000033203_100000765312 [0,2,0,0,0,0|2,0,0]=4 16545 B14R0.393 COCC(C)OCCCCCCCCN 34a_102515433106_100000765312 [0,2,0,0,0,0|2,0,0]=4 16546 B14R0.393 COCC(C)SCCCCCCCCO 62a_100000033203_100000765312 [0,2,0,0,0,0|1,0,0]=3 16547 B14R0.393 COCC(C)SCCCCCCCCO 62a_100000765312_100000033203 [0,2,0,0,0,0|1,0,0]=3 16548 B14R0.393 COCC(N)COCCCCCCCO 34a_100000724102_100000760002 [0,2,0,0,0,0|1,0,0]=3 16549 B14R0.393 COCC(O)CNCCCCCCCO 2230a_100000756049_100000760002 [0,2,0,0,0,0|1,0,0]=3 16550 B14R0.393 COCC(O)CNCCCCCCCO 34a_100000756049_100000760002 [0,2,0,0,0,0|1,0,0]=3 16551 B14R0.393 COCC(O)CNCCCCCCCO 34a_100011996573_100011215053 [0,2,0,0,0,0|1,0,0]=3 16552 B14R0.393 COCC(O)CNCCCOCCCO 34a_100011310245_100011215053 [0,2,0,0,0,0|2,0,0]=4 16553 B14R0.393 COCC(O)COCCCCCCCBr 34a_100000760002_100011215053 [0,2,0,0,0,0|2,0,0]=4 16554 B14R0.393 COCC(O)COCCCCCCCBr 7a_100000760002_100011215053 [0,2,0,0,0,0|2,0,0]=4 16555 B14R0.393 COCC(O)COCCCCCCCN 34a_100011996573_100011215053 [0,2,0,0,0,0|2,0,0]=4 16556 B14R0.393 COCC(O)CSCCCCCCCO 62a_100000760002_100011215053 [0,2,0,0,0,0|1,0,0]=3 16557 B14R0.393 COCC(O)CSCCCCCCCO 62a_100011215053_100000760002 [0,2,0,0,0,0|1,0,0]=3 16558 B14R0.393 COCCCCCCNCC(O)COC 2230a_100000756049_100011998445 [0,2,0,0,0,0|2,0,0]=4 16559 B14R0.393 COCCCCCCNCC(O)COC 34a_100000756049_100011998445 [0,2,0,0,0,0|2,0,0]=4 16560 B14R0.393 COCCCCCCOCC(C)CCN 34a_106354213184_100011998445 [0,2,0,0,0,0|2,0,0]=4 16561 B14R0.393 COCCCCCCOCC(N)COC 34a_100000724102_100011998445 [0,2,0,0,0,0|2,0,0]=4 16562 B14R0.393 COCCCCCCOCC(O)COC 34a_200012092642_100011215053 [0,2,0,0,0,0|2,0,0]=4 16563 B14R0.393 COCCCCCCOCC(O)COC 7a_200012092642_100011215053 [0,2,0,0,0,0|2,0,0]=4 16564 B14R0.393 COCCCCCCSCC(O)COC 62a_100011215053_100011998445 [0,2,0,0,0,0|2,0,0]=4 16565 B14R0.393 COCCCCCCSCC(O)COC 62a_100011998445_100011215053 [0,2,0,0,0,0|2,0,0]=4 16566 B14R0.393 COCCCOCCCOC(C)CCO 34a_200011215475_100009893172 [0,2,0,0,0,0|2,0,0]=4 16567 B14R0.393 COCCCOCCCOC(C)CCO 7a_200011215475_100009893172 [0,2,0,0,0,0|2,0,0]=4 16568 B14R0.393 COC[C@@H](C)NCCCCCCCCO 2230a_100000764878_100000033203 [0,2,0,0,0,0|1,0,0]=3 16569 B14R0.393 COC[C@@H](C)OCCCCCCCCO 34a_100011934205_100000033203 [0,2,0,0,0,0|1,0,0]=3 16570 B14R0.393 CSCC(=O)CCCCCCCCCO 1458a_100000184570_100009813782 [0,2,0,0,0,0|0,0,1]=3 16571 B14R0.393 CSCC(=O)NCCCCCCCCO 240690a_102515433106_100000184570 [0,2,0,0,0,0|1,0,1]=4 16572 B14R0.393 CSCC(C)NCCCCCCCCO 270004a_102515433106_100011216314 [0,2,0,0,0,0|1,0,0]=3 16573 B14R0.393 C[C@@H](CC#N)NCCCCCCCCO 2230a_100016994482_100000033203 [0,2,0,0,0,0|1,0,1]=4 16574 B14R0.393 C[C@H](CCO)NCCCCCCCCO 2230a_100000706166_100000033203 [0,2,0,0,0,0|1,0,0]=3 16575 B14R0.393 C[C@H](CCO)NCCCCCCCCO 34a_100000706166_100000033203 [0,2,0,0,0,0|1,0,0]=3 16576 B14R0.393 N#CCC(=O)CCCCCCCCCO 1458a_100051588842_100009813782 [0,2,0,0,0,0|0,0,2]=4 16577 B14R0.393 N#CC[C@H](O)CNCCCCCCCO 2230a_100011996573_100000001066 [0,2,0,0,0,0|1,0,1]=4 16578 B14R0.393 N#CC[C@H](O)CSCCCCCCCO 62a_100000001066_100000760002 [0,2,0,0,0,0|1,0,1]=4 16579 B14R0.393 N#CC[C@H](O)CSCCCCCCCO 62a_100000760002_100000001066 [0,2,0,0,0,0|1,0,1]=4 16580 B14R0.393 O=C(CCF)CCCCCCCCCF 1458a_200009909015_100011217306 [0,2,0,0,0,0|1,0,1]=4 16581 B14R0.393 O=C(CCO)CCCCCCCCCF 1458a_200009909015_100000211926 [0,2,0,0,0,0|0,0,1]=3 16582 B14R0.393 O=C(CCO)CCCCCCCCCO 1458a_100011216618_100009813782 [0,2,0,0,0,0|0,0,1]=3 16583 B14R0.393 O=C(CCO)NCCCCCCCCO 240690a_102515433106_100011216618 [0,2,0,0,0,0|1,0,1]=4 16584 B14R0.432 CC(C)CCCCCCNC(=O)CCO 240690a_100000211014_100011216618 [0,2,0,0,0,0|1,0,1]=4 16585 B14R0.432 CC(C)CCCCCCNC(C)CCO 2230a_100000211014_100009893172 [0,2,0,0,0,0|1,0,0]=3 16586 B14R0.432 CC(C)CCCCCCNC(C)CCO 34a_100000211014_100009893172 [0,2,0,0,0,0|1,0,0]=3 16587 B14R0.432 CC(C)CCCCCOCC(C)CCN 34a_106354213184_100000210682 [0,2,0,0,0,0|2,0,0]=4 16588 B14R0.432 CC(C)NCCCCCOC(C)CCO 34a_100011629493_100009893172 [0,2,0,0,0,0|2,0,0]=4 16589 B14R0.432 CCCC(C)CCCOCCCC(C)C 34a_100011713154_100011214892 [0,2,0,0,0,0|2,0,0]=4 16590 B14R0.432 CCCC(C)CCCOCCCC(C)C 7a_100011713154_100011214892 [0,2,0,0,0,0|2,0,0]=4 16591 B14R0.432 CCCC(C)CCCOCCCC(C)O 34a_100011713154_200000718107 [0,2,0,0,0,0|1,0,0]=3 16592 B14R0.432 CCCC(C)CCCOCCCC(C)O 7a_100011713154_200000718107 [0,2,0,0,0,0|1,0,0]=3 16593 B14R0.432 CCCC(C)CCOCCCCB(O)O 34a_100011217855_200009817182 [0,2,0,0,0,0|2,0,0]=4 16594 B14R0.432 CCCC(C)CCOCCCCB(O)O 7a_100011217855_200009817182 [0,2,0,0,0,0|2,0,0]=4 16595 B14R0.432 CCCC(C)CCOCCCCC(C)C 34a_100011217855_100011216152 [0,2,0,0,0,0|2,0,0]=4 16596 B14R0.432 CCCC(C)CCOCCCCC(C)C 7a_100011217855_100011216152 [0,2,0,0,0,0|2,0,0]=4 16597 B14R0.432 CCCC(C)CNCCCCCC(C)C 2230a_100011290863_100011216630 [0,2,0,0,0,0|2,0,0]=4 16598 B14R0.432 CCCC(C)CNCCCCCC(C)C 270004a_100011290863_100000243154 [0,2,0,0,0,0|2,0,0]=4 16599 B14R0.432 CCCC(C)CNCCCCCC(C)C 34a_100011290863_100011216630 [0,2,0,0,0,0|2,0,0]=4 16600 B14R0.432 CCCC(C)COCCCCCB(O)O 34a_100000688023_200009817188 [0,2,0,0,0,0|2,0,0]=4 16601 B14R0.432 CCCC(C)COCCCCCB(O)O 7a_100000688023_200009817188 [0,2,0,0,0,0|2,0,0]=4 16602 B14R0.432 CCCC(C)COCCCCCC(C)C 34a_100000688023_100000210682 [0,2,0,0,0,0|2,0,0]=4 16603 B14R0.432 CCCC(C)COCCCCCC(C)C 34a_100011995859_100011216630 [0,2,0,0,0,0|2,0,0]=4 16604 B14R0.432 CCCC(C)COCCCCCC(C)C 7a_100000688023_100000210682 [0,2,0,0,0,0|2,0,0]=4 16605 B14R0.432 CCCC(C)COCCCCCC(C)C 7a_100011995859_100011216630 [0,2,0,0,0,0|2,0,0]=4 16606 B14R0.432 CCCC(C)CSCCCCCB(O)O 62a_100011216630_200009817188 [0,2,0,0,0,0|2,0,0]=4 16607 B14R0.432 CCCC(C)CSCCCCCB(O)O 62a_200009817188_100011216630 [0,2,0,0,0,0|2,0,0]=4 16608 B14R0.432 CCCC(C)CSCCCCCC(C)C 62a_100000210682_100011216630 [0,2,0,0,0,0|2,0,0]=4 16609 B14R0.432 CCCC(C)CSCCCCCC(C)C 62a_100011216630_100000210682 [0,2,0,0,0,0|2,0,0]=4 16610 B14R0.432 CCCC(C)NCCCCCCB(O)O 2230a_100000741246_100009817187 [0,2,0,0,0,0|2,0,0]=4 16611 B14R0.432 CCCC(C)NCCCCCCC(C)C 2230a_100000211014_100000766640 [0,2,0,0,0,0|2,0,0]=4 16612 B14R0.432 CCCC(C)NCCCCCCC(C)C 270004a_100000211014_100000211909 [0,2,0,0,0,0|2,0,0]=4 16613 B14R0.432 CCCC(C)NCCCCCCC(C)C 34a_100000211014_100000766640 [0,2,0,0,0,0|2,0,0]=4 16614 B14R0.432 CCCC(C)OCCCCCCB(O)O 34a_100000764384_100009817187 [0,2,0,0,0,0|2,0,0]=4 16615 B14R0.432 CCCC(C)OCCCCCCB(O)O 7a_100000764384_100009817187 [0,2,0,0,0,0|2,0,0]=4 16616 B14R0.432 CCCC(C)SCCCCCCB(O)O 62a_100000766640_100009817187 [0,2,0,0,0,0|2,0,0]=4 16617 B14R0.432 CCCC(C)SCCCCCCB(O)O 62a_100009817187_100000766640 [0,2,0,0,0,0|2,0,0]=4 16618 B14R0.432 CCC[C@H](N)CCOCCCCB(O)O 34a_100015193777_200009817182 [0,2,0,0,0,0|2,0,0]=4 16619 B14R0.432 CCC[C@H](N)CCOCCCCC(C)C 34a_100015193777_100011216152 [0,2,0,0,0,0|2,0,0]=4 16620 B14R0.432 CCC[C@H](N)COCCCCCB(O)O 34a_100000732646_200009817188 [0,2,0,0,0,0|2,0,0]=4 16621 B14R0.432 CCC[C@H](N)COCCCCCC(C)C 34a_100000732646_100000210682 [0,2,0,0,0,0|2,0,0]=4 16622 B14R0.493 C#CCCC(=O)CCCCCCCCC 1458a_100000210558_100000753159 [0,2,0,0,0,0|1,0,1]=4 16623 B14R0.493 C#CCCC(=O)CCCCCCCCC 1458a_100000692101_100000210670 [0,2,0,0,0,0|1,0,1]=4 16624 B14R0.493 C#CCCC(=O)CCCCCCCCO 1458a_100000692101_100000033203 [0,2,0,0,0,0|0,0,2]=4 16625 B14R0.493 C#CCCCCCCCC(=O)CCCC 1458a_100000087357_100000210211 [0,2,0,0,0,0|1,0,1]=4 16626 B14R0.493 C#CCCCCCCCC(=O)CCCC 1458a_100000210183_100153394163 [0,2,0,0,0,0|1,0,1]=4 16627 B14R0.493 C#CCCCCCCCC(=O)CCCO 1458a_100000087357_100011215043 [0,2,0,0,0,0|0,0,2]=4 16628 B14R0.493 C#CCCCCCCCN(C)CCCC 2230a_100000207549_100153394163 [0,2,0,0,0,0|1,0,1]=4 16629 B14R0.493 C#CCCCCCCCN(C)CCCC 269982a_100000207549_100153394163 [0,2,0,0,0,0|1,0,1]=4 16630 B14R0.493 C#CCCCCCCCN(C)CCCO 2230a_100000213112_100153394163 [0,2,0,0,0,0|0,0,2]=4 16631 B14R0.493 C#CCCCCCCCN(C)CCCO 269982a_100000213112_100153394163 [0,2,0,0,0,0|0,0,2]=4 16632 B14R0.493 C#CCCCCCCNC(C)CCCC 2230a_100000126638_100012276617 [0,2,0,0,0,0|1,0,1]=4 16633 B14R0.493 C#CCCCCCCOC(C)CCCC 34a_100000687866_100012276617 [0,2,0,0,0,0|1,0,1]=4 16634 B14R0.493 C#CCCCCCCOC(C)CCCC 34a_100011217361_200011215066 [0,2,0,0,0,0|1,0,1]=4 16635 B14R0.493 C#CCCCCCCOC(C)CCCC 7a_100000687866_100012276617 [0,2,0,0,0,0|1,0,1]=4 16636 B14R0.493 C#CCCCCCCOC(C)CCCC 7a_100011217361_200011215066 [0,2,0,0,0,0|1,0,1]=4 16637 B14R0.493 C#CCCCCCCSC(C)CCCC 62a_100012276617_200011215066 [0,2,0,0,0,0|1,0,1]=4 16638 B14R0.493 C#CCCCCCCSC(C)CCCC 62a_200011215066_100012276617 [0,2,0,0,0,0|1,0,1]=4 16639 B14R0.493 C#CCCCCCNC[C@H](C)CCCO 2230a_100160569302_100012094781 [0,2,0,0,0,0|0,0,2]=4 16640 B14R0.493 C#CCCCCCNC[C@H](C)CCCO 34a_100160569302_100012094781 [0,2,0,0,0,0|0,0,2]=4 16641 B14R0.493 C#CCCCCCOCC(C)CCCC 34a_100011995851_100012094781 [0,2,0,0,0,0|1,0,1]=4 16642 B14R0.493 C#CCCCCCOCC(C)CCCC 7a_100011995851_100012094781 [0,2,0,0,0,0|1,0,1]=4 16643 B14R0.493 C#CCCCCCOC[C@@H](N)CCCC 34a_100011934283_100012094781 [0,2,0,0,0,0|1,0,1]=4 16644 B14R0.493 C#CCCN(C)CCCCCCCCC 2230a_100000232482_100000688953 [0,2,0,0,0,0|1,0,1]=4 16645 B14R0.493 C#CCCN(C)CCCCCCCCC 269982a_100000232482_100000730999 [0,2,0,0,0,0|1,0,1]=4 16646 B14R0.493 C#CCCOCCCCC(C)CCCC 34a_200011021034_100000688953 [0,2,0,0,0,0|1,0,1]=4 16647 B14R0.493 C#CCCOCCCCC(C)CCCC 7a_200011021034_100000688953 [0,2,0,0,0,0|1,0,1]=4 16648 B14R0.493 C#CCOC(C)CCCCCCCCC 34a_100011218016_100000184674 [0,2,0,0,0,0|1,0,1]=4 16649 B14R0.493 C#CCOC(C)CCCCCCCCC 7a_100011218016_100000038162 [0,2,0,0,0,0|1,0,1]=4 16650 B14R0.493 C=CCCC(=O)CCCCCCCCC 1458a_100000210558_100000754431 [0,2,0,0,0,0|1,0,1]=4 16651 B14R0.493 C=CCCC(=O)CCCCCCCCC 1458a_100000749702_100000210670 [0,2,0,0,0,0|1,0,1]=4 16652 B14R0.493 C=CCCC(=O)CCCCCCCCO 1458a_100000749702_100000033203 [0,2,0,0,0,0|0,0,2]=4 16653 B14R0.493 C=CCCC(C)NCCCCCCCC 270004a_100000229939_100000762624 [0,2,0,0,0,0|1,0,1]=4 16654 B14R0.493 C=CCCC(C)NCCCCCCCO 270004a_100011996573_100000762624 [0,2,0,0,0,0|0,0,2]=4 16655 B14R0.493 C=CCCC(C)OCCCCCCCC 34a_100000765329_100000210759 [0,2,0,0,0,0|1,0,1]=4 16656 B14R0.493 C=CCCC(C)OCCCCCCCC 7a_100000765329_100000210759 [0,2,0,0,0,0|1,0,1]=4 16657 B14R0.493 C=CCCC(C)OCCCCCCCO 34a_100000765329_100000760002 [0,2,0,0,0,0|0,0,2]=4 16658 B14R0.493 C=CCCC(C)OCCCCCCCO 7a_100000765329_100000760002 [0,2,0,0,0,0|0,0,2]=4 16659 B14R0.493 C=CCCCCCCCC(=O)CCCC 1458a_100000210183_100012355270 [0,2,0,0,0,0|1,0,1]=4 16660 B14R0.493 C=CCCCCCCCC(=O)CCCC 1458a_100011216160_100000210211 [0,2,0,0,0,0|1,0,1]=4 16661 B14R0.493 C=CCCCCCCCC(=O)CCCO 1458a_100011216160_100011215043 [0,2,0,0,0,0|0,0,2]=4 16662 B14R0.493 C=CCCCCCCCN(C)CCCC 2230a_100000207549_100012355270 [0,2,0,0,0,0|1,0,1]=4 16663 B14R0.493 C=CCCCCCCCN(C)CCCC 269982a_100000207549_100012355270 [0,2,0,0,0,0|1,0,1]=4 16664 B14R0.493 C=CCCCCCCCN(C)CCCO 2230a_100000213112_100012355270 [0,2,0,0,0,0|0,0,2]=4 16665 B14R0.493 C=CCCCCCCCN(C)CCCO 269982a_100000213112_100012355270 [0,2,0,0,0,0|0,0,2]=4 16666 B14R0.493 C=CCCCCCCNC(C)CCCC 2230a_100000126638_100011215473 [0,2,0,0,0,0|1,0,1]=4 16667 B14R0.493 C=CCCCCCCOC(C)CCCC 34a_100000687866_100011215473 [0,2,0,0,0,0|1,0,1]=4 16668 B14R0.493 C=CCCCCCCOC(C)CCCC 34a_200011216477_200011215066 [0,2,0,0,0,0|1,0,1]=4 16669 B14R0.493 C=CCCCCCCOC(C)CCCC 7a_100000687866_100011215473 [0,2,0,0,0,0|1,0,1]=4 16670 B14R0.493 C=CCCCCCCOC(C)CCCC 7a_200011216477_200011215066 [0,2,0,0,0,0|1,0,1]=4 16671 B14R0.493 C=CCCCCCCSC(C)CCCC 62a_100011215473_200011215066 [0,2,0,0,0,0|1,0,1]=4 16672 B14R0.493 C=CCCCCCCSC(C)CCCC 62a_200011215066_100011215473 [0,2,0,0,0,0|1,0,1]=4 16673 B14R0.493 C=CCCCCCNC[C@H](C)CCCO 2230a_100160569302_100000700193 [0,2,0,0,0,0|0,0,2]=4 16674 B14R0.493 C=CCCCCCNC[C@H](C)CCCO 34a_100160569302_100000700193 [0,2,0,0,0,0|0,0,2]=4 16675 B14R0.493 C=CCCCCCOCC(C)CCCC 34a_100011995851_100000700193 [0,2,0,0,0,0|1,0,1]=4 16676 B14R0.493 C=CCCCCCOCC(C)CCCC 7a_100011995851_100000700193 [0,2,0,0,0,0|1,0,1]=4 16677 B14R0.493 C=CCCCCCOC[C@@H](N)CCCC 34a_100011934283_100000700193 [0,2,0,0,0,0|1,0,1]=4 16678 B14R0.493 C=CCCN(C)CCCCCCCCC 2230a_100000232482_100000754431 [0,2,0,0,0,0|1,0,1]=4 16679 B14R0.493 C=CCCN(C)CCCCCCCCC 2230a_100020639649_100011214924 [0,2,0,0,0,0|1,0,1]=4 16680 B14R0.493 C=CCCN(C)CCCCCCCCC 269982a_100000232482_100000754431 [0,2,0,0,0,0|1,0,1]=4 16681 B14R0.493 C=CCCN(C)CCCCCCCCC 269982a_100020639649_100000210670 [0,2,0,0,0,0|1,0,1]=4 16682 B14R0.493 C=CCCN(C)CCCCCCCCO 2230a_100020639649_100000033203 [0,2,0,0,0,0|0,0,2]=4 16683 B14R0.493 C=CCCN(C)CCCCCCCCO 269982a_100020639649_100000033203 [0,2,0,0,0,0|0,0,2]=4 16684 B14R0.493 C=CCCOCCCCC(C)CCCC 34a_200011021034_100000754431 [0,2,0,0,0,0|1,0,1]=4 16685 B14R0.493 C=CCCOCCCCC(C)CCCC 7a_200011021034_100000754431 [0,2,0,0,0,0|1,0,1]=4 16686 B14R0.493 C=CCNC(C)CCCCCCCCC 270004a_100020586998_100011215753 [0,2,0,0,0,0|1,0,1]=4 16687 B14R0.493 C=CCOC(C)CCCCCCCCC 34a_100011218016_100015514636 [0,2,0,0,0,0|1,0,1]=4 16688 B14R0.493 C=CCOC(C)CCCCCCCCC 7a_100011218016_100015514636 [0,2,0,0,0,0|1,0,1]=4 16689 B14R0.493 CC(CCCCl)OCCCCCCCO 34a_200000718107_100000760002 [0,2,0,0,0,0|1,0,0]=3 16690 B14R0.493 CC(CCCCl)OCCCCCCCO 7a_200000718107_100000760002 [0,2,0,0,0,0|1,0,0]=3 16691 B14R0.493 CC=CCC(=O)CCCCCCCCO 1458a_100121576822_100000033203 [0,2,0,0,0,0|0,0,2]=4 16692 B14R0.493 CCC#CC(=O)CCCCCCCCO 1458a_100011827653_100000033203 [0,2,0,0,0,0|0,0,2]=4 16693 B14R0.493 CCC#CC(C)OCCCCCCCO 34a_100000033903_100000760002 [0,2,0,0,0,0|0,0,2]=4 16694 B14R0.493 CCC#CC(C)OCCCCCCCO 7a_100000033903_100000760002 [0,2,0,0,0,0|0,0,2]=4 16695 B14R0.493 CCC=CC(=O)CCCCCCCCO 1458a_100000212282_100000033203 [0,2,0,0,0,0|0,0,2]=4 16696 B14R0.493 CCCCC#CCCCN(C)CCCO 2230a_100000213112_200000047210 [0,2,0,0,0,0|0,0,2]=4 16697 B14R0.493 CCCCC#CCCCN(C)CCCO 269982a_100000213112_200000047210 [0,2,0,0,0,0|0,0,2]=4 16698 B14R0.493 CCCCC(=O)CCCCCCCCO 1458a_100000210183_100000033203 [0,2,0,0,0,0|0,0,0]=2 16699 B14R0.493 CCCCC(=O)CCOCCOCCO 1458a_100000210183_100000032323 [0,2,0,0,0,0|1,0,1]=4 16700 B14R0.493 CCCCC(=O)CCOCCOCCO 1458a_100009915118_100000210211 [0,2,0,0,0,0|1,0,1]=4 16701 B14R0.493 CCCCC(=O)NCCCCCCCO 240690a_100011996573_100000210183 [0,2,0,0,0,0|0,0,1]=3 16702 B14R0.493 CCCCC(=O)NCCCOCCCO 240690a_100011310245_100000210183 [0,2,0,0,0,0|1,0,1]=4 16703 B14R0.493 CCCCC(C)CCCCOCCC#N 7a_200011021034_100000184422 [0,2,0,0,0,0|1,0,1]=4 16704 B14R0.493 CCCCC(C)CCCCOCCCF 34a_200011021034_100011934791 [0,2,0,0,0,0|1,0,0]=3 16705 B14R0.493 CCCCC(C)CCCCOCCCF 7a_200011021034_100011934791 [0,2,0,0,0,0|1,0,0]=3 16706 B14R0.493 CCCCC(C)CCCCOCCCO 34a_200011021034_100000230001 [0,2,0,0,0,0|0,0,0]=2 16707 B14R0.493 CCCCC(C)CCCCOCCCO 7a_200011021034_100011215043 [0,2,0,0,0,0|0,0,0]=2 16708 B14R0.493 CCCCC(C)CCCCOCCOC 34a_200011021034_100011201679 [0,2,0,0,0,0|1,0,0]=3 16709 B14R0.493 CCCCC(C)CCCCOCCOC 7a_200011021034_100000233755 [0,2,0,0,0,0|1,0,0]=3 16710 B14R0.493 CCCCC(C)CCCCOCCSC 34a_200011021034_100000212216 [0,2,0,0,0,0|1,1,0]=4 16711 B14R0.493 CCCCC(C)CCCCOCCSC 7a_200011021034_100000212216 [0,2,0,0,0,0|1,1,0]=4 16712 B14R0.493 CCCCC(C)COCCCCCC#N 7a_100011995851_100009813376 [0,2,0,0,0,0|1,0,1]=4 16713 B14R0.493 CCCCC(C)COCCCCCC=O 7a_100011995851_100000139337 [0,2,0,0,0,0|0,0,2]=4 16714 B14R0.493 CCCCC(C)COCCCCCCF 34a_100011995851_100015922095 [0,2,0,0,0,0|1,0,0]=3 16715 B14R0.493 CCCCC(C)COCCCCCCF 7a_100011995851_100015922095 [0,2,0,0,0,0|1,0,0]=3 16716 B14R0.493 CCCCC(C)COCCCCCCO 34a_100011995851_100000766143 [0,2,0,0,0,0|0,0,0]=2 16717 B14R0.493 CCCCC(C)COCCCCCCO 7a_100011995851_100000766143 [0,2,0,0,0,0|0,0,0]=2 16718 B14R0.493 CCCCC(C)COCCOCCOC 34a_100011995851_100000695917 [0,2,0,0,0,0|2,0,0]=4 16719 B14R0.493 CCCCC(C)COCCOCCOC 7a_100011995851_100000695917 [0,2,0,0,0,0|2,0,0]=4 16720 B14R0.493 CCCCC(C)NCCCCCCC#N 2230a_100000126638_100009813337 [0,2,0,0,0,0|1,0,1]=4 16721 B14R0.493 CCCCC(C)NCCCCCCCO 2230a_100000126638_100000760002 [0,2,0,0,0,0|0,0,0]=2 16722 B14R0.493 CCCCC(C)NCCCCCCCO 2230a_100011996573_200011215066 [0,2,0,0,0,0|0,0,0]=2 16723 B14R0.493 CCCCC(C)NCCCCCCCO 270004a_100011996573_100000210087 [0,2,0,0,0,0|0,0,0]=2 16724 B14R0.493 CCCCC(C)NCCCCCCCO 34a_100011996573_200011215066 [0,2,0,0,0,0|0,0,0]=2 16725 B14R0.493 CCCCC(C)NCCCCCCOC 2230a_100000126638_100011998445 [0,2,0,0,0,0|1,0,0]=3 16726 B14R0.493 CCCCC(C)NCCCOCCCO 2230a_100011310245_200011215066 [0,2,0,0,0,0|1,0,0]=3 16727 B14R0.493 CCCCC(C)NCCCOCCCO 270004a_100011310245_100000210087 [0,2,0,0,0,0|1,0,0]=3 16728 B14R0.493 CCCCC(C)NCCCOCCCO 34a_100011310245_200011215066 [0,2,0,0,0,0|1,0,0]=3 16729 B14R0.493 CCCCC(C)NCCCOCCOC 2230a_100000126638_100011216529 [0,2,0,0,0,0|2,0,0]=4 16730 B14R0.493 CCCCC(C)NCCCOCCOC 2230a_100000206027_200011215066 [0,2,0,0,0,0|2,0,0]=4 16731 B14R0.493 CCCCC(C)NCCCOCCOC 270004a_100000206027_100000210087 [0,2,0,0,0,0|2,0,0]=4 16732 B14R0.493 CCCCC(C)NCCCOCCOC 34a_100000206027_200011215066 [0,2,0,0,0,0|2,0,0]=4 16733 B14R0.493 CCCCC(C)OCCCCCCC#N 7a_100000687866_100009813337 [0,2,0,0,0,0|1,0,1]=4 16734 B14R0.493 CCCCC(C)OCCCCCCCBr 34a_100000760002_200011215066 [0,2,0,0,0,0|1,0,0]=3 16735 B14R0.493 CCCCC(C)OCCCCCCCBr 7a_100000760002_200011215066 [0,2,0,0,0,0|1,0,0]=3 16736 B14R0.493 CCCCC(C)OCCCCCCCN 34a_100011996573_200011215066 [0,2,0,0,0,0|1,0,0]=3 16737 B14R0.493 CCCCC(C)OCCCCCCCO 34a_100000687866_100000760002 [0,2,0,0,0,0|0,0,0]=2 16738 B14R0.493 CCCCC(C)OCCCCCCCO 7a_100000687866_100000760002 [0,2,0,0,0,0|0,0,0]=2 16739 B14R0.493 CCCCC(C)OCCCCCCOC 34a_100000687866_100011998445 [0,2,0,0,0,0|1,0,0]=3 16740 B14R0.493 CCCCC(C)OCCCCCCOC 34a_200012092642_200011215066 [0,2,0,0,0,0|1,0,0]=3 16741 B14R0.493 CCCCC(C)OCCCCCCOC 7a_100000687866_100011998445 [0,2,0,0,0,0|1,0,0]=3 16742 B14R0.493 CCCCC(C)OCCCCCCOC 7a_200012092642_200011215066 [0,2,0,0,0,0|1,0,0]=3 16743 B14R0.493 CCCCC(C)OCCCOCCCN 34a_100011310245_200011215066 [0,2,0,0,0,0|2,0,0]=4 16744 B14R0.493 CCCCC(C)OCCCOCCOC 34a_100000687866_100011216529 [0,2,0,0,0,0|2,0,0]=4 16745 B14R0.493 CCCCC(C)OCCCOCCOC 7a_100000687866_100011216529 [0,2,0,0,0,0|2,0,0]=4 16746 B14R0.493 CCCCC(C)SCCCCCCC#N 62a_100009813337_200011215066 [0,2,0,0,0,0|1,0,1]=4 16747 B14R0.493 CCCCC(C)SCCCCCCC#N 62a_200011215066_100009813337 [0,2,0,0,0,0|1,0,1]=4 16748 B14R0.493 CCCCC(C)SCCCCCCCO 62a_100000760002_200011215066 [0,2,0,0,0,0|0,0,0]=2 16749 B14R0.493 CCCCC(C)SCCCCCCCO 62a_200011215066_100000760002 [0,2,0,0,0,0|0,0,0]=2 16750 B14R0.493 CCCCC(C)SCCCCCCOC 62a_100011998445_200011215066 [0,2,0,0,0,0|1,0,0]=3 16751 B14R0.493 CCCCC(C)SCCCCCCOC 62a_200011215066_100011998445 [0,2,0,0,0,0|1,0,0]=3 16752 B14R0.493 CCCCC(C)SCCCOCCOC 62a_100011216529_200011215066 [0,2,0,0,0,0|2,0,0]=4 16753 B14R0.493 CCCCC(C)SCCCOCCOC 62a_200011215066_100011216529 [0,2,0,0,0,0|2,0,0]=4 16754 B14R0.493 CCCCC/C=C/CCC(=O)CCCO 1458a_200015255902_100011215043 [0,2,0,0,0,0|0,0,2]=4 16755 B14R0.493 CCCCCC/C=C/CC(=O)CCCO 1458a_100020681715_100011215043 [0,2,0,0,0,0|0,0,2]=4 16756 B14R0.493 CCCCCCCC=CC(=O)CCCO 1458a_200015332781_100011215043 [0,2,0,0,0,0|0,0,2]=4 16757 B14R0.493 CCCCCCCCCC(=O)C#CCO 1458a_100000049017_100000210670 [0,2,0,0,0,0|0,0,2]=4 16758 B14R0.493 CCCCCCCCCC(=O)CCC#N 1458a_100000210558_100011215226 [0,2,0,0,0,0|1,0,1]=4 16759 B14R0.493 CCCCCCCCCC(=O)CCC#N 1458a_100011934036_100000210670 [0,2,0,0,0,0|1,0,1]=4 16760 B14R0.493 CCCCCCCCCC(=O)CCCC 1458a_100000210183_100000210670 [0,2,0,0,0,0|1,0,0]=3 16761 B14R0.493 CCCCCCCCCC(=O)CCCC 1458a_100000210558_100000210211 [0,2,0,0,0,0|1,0,0]=3 16762 B14R0.493 CCCCCCCCCC(=O)CCCF 1458a_100000210558_100011934791 [0,2,0,0,0,0|1,0,0]=3 16763 B14R0.493 CCCCCCCCCC(=O)CCCO 1458a_100000210558_100011215043 [0,2,0,0,0,0|0,0,0]=2 16764 B14R0.493 CCCCCCCCCC(=O)CCOC 1458a_100000210558_100000233755 [0,2,0,0,0,0|0,0,1]=3 16765 B14R0.493 CCCCCCCCCC(=O)CCOC 1458a_100000749529_100000210670 [0,2,0,0,0,0|0,0,1]=3 16766 B14R0.493 CCCCCCCCCC(=O)CCSC 1458a_100000174002_100000210670 [0,2,0,0,0,0|0,1,1]=4 16767 B14R0.493 CCCCCCCCCC(=O)CCSC 1458a_100000210558_100000751147 [0,2,0,0,0,0|0,1,1]=4 16768 B14R0.493 CCCCCCCCCC(=O)COCC 1458a_100000211967_100000210670 [0,2,0,0,0,0|1,0,1]=4 16769 B14R0.493 CCCCCCCCCC(=O)CSCC 1458a_100000230394_100000210670 [0,2,0,0,0,0|1,0,1]=4 16770 B14R0.493 CCCCCCCCCC(=O)NCCC 11a_100020643023_100000210558 [0,2,0,0,0,0|1,0,1]=4 16771 B14R0.493 CCCCCCCCCC(=O)NCCC 1626a_100020643023_100000210558 [0,2,0,0,0,0|1,0,1]=4 16772 B14R0.493 CCCCCCCCCC(=O)NCCC 240690a_100020643023_100000210558 [0,2,0,0,0,0|1,0,1]=4 16773 B14R0.493 CCCCCCCCCC(=O)NCCC 527a_100020643023_100000210558 [0,2,0,0,0,0|1,0,1]=4 16774 B14R0.493 CCCCCCCCCC(=O)NCCF 11a_100000724931_100000210558 [0,2,0,0,0,0|1,0,1]=4 16775 B14R0.493 CCCCCCCCCC(=O)NCCF 1626a_100000724931_100000210558 [0,2,0,0,0,0|1,0,1]=4 16776 B14R0.493 CCCCCCCCCC(=O)NCCF 240690a_100000724931_100000210558 [0,2,0,0,0,0|1,0,1]=4 16777 B14R0.493 CCCCCCCCCC(=O)NCCF 527a_100000724931_100000210558 [0,2,0,0,0,0|1,0,1]=4 16778 B14R0.493 CCCCCCCCCC(=O)NCCO 240690a_100000210304_100000210558 [0,2,0,0,0,0|0,0,1]=3 16779 B14R0.493 CCCCCCCCCC(=O)NCCO 527a_100000210304_100000210558 [0,2,0,0,0,0|0,0,1]=3 16780 B14R0.493 CCCCCCCCCC(=O)OCOC 34a_100138415774_200010990708 [0,2,0,0,0,0|1,0,1]=4 16781 B14R0.493 CCCCCCCCCC(C)CNCC 270004a_100015525214_200011218516 [0,2,0,0,0,0|1,0,0]=3 16782 B14R0.493 CCCCCCCCCC(C)NCCC 270004a_100020643023_100011215753 [0,2,0,0,0,0|1,0,0]=3 16783 B14R0.493 CCCCCCCCCC(C)NCCO 270004a_100000210304_100011215753 [0,2,0,0,0,0|0,0,0]=2 16784 B14R0.493 CCCCCCCCCC(C)OCC#N 7a_100011218016_100011215382 [0,2,0,0,0,0|1,0,1]=4 16785 B14R0.493 CCCCCCCCCC(C)OCC=O 34a_100011218016_200009817547 [0,2,0,0,0,0|0,0,2]=4 16786 B14R0.493 CCCCCCCCCC(C)OCC=O 7a_100011218016_200015260668 [0,2,0,0,0,0|0,0,2]=4 16787 B14R0.493 CCCCCCCCCC(C)OCCC 34a_100011218016_100000210303 [0,2,0,0,0,0|1,0,0]=3 16788 B14R0.493 CCCCCCCCCC(C)OCCC 7a_100011218016_100000210303 [0,2,0,0,0,0|1,0,0]=3 16789 B14R0.493 CCCCCCCCCC(C)OCCF 34a_100011218016_100011217306 [0,2,0,0,0,0|1,0,0]=3 16790 B14R0.493 CCCCCCCCCC(C)OCCF 7a_100011218016_100011217306 [0,2,0,0,0,0|1,0,0]=3 16791 B14R0.493 CCCCCCCCCC(C)OCCO 34a_100011218016_100000211926 [0,2,0,0,0,0|0,0,0]=2 16792 B14R0.493 CCCCCCCCCC(C)OCCO 7a_100011218016_100000211926 [0,2,0,0,0,0|0,0,0]=2 16793 B14R0.493 CCCCCCCCCC(C)OCSC 34a_100011218016_100011218213 [0,2,0,0,0,0|1,1,0]=4 16794 B14R0.493 CCCCCCCCCN(C)CCC#N 2230a_100000184479_100011214924 [0,2,0,0,0,0|1,0,1]=4 16795 B14R0.493 CCCCCCCCCN(C)CCC#N 2230a_100000232482_100011215226 [0,2,0,0,0,0|1,0,1]=4 16796 B14R0.493 CCCCCCCCCN(C)CCC#N 2230a_200000021605_200000210301 [0,2,0,0,0,0|1,0,1]=4 16797 B14R0.493 CCCCCCCCCN(C)CCC#N 269982a_100000232482_100011215226 [0,2,0,0,0,0|1,0,1]=4 16798 B14R0.493 CCCCCCCCCN(C)CCCC 2230a_100000207549_100011214924 [0,2,0,0,0,0|1,0,0]=3 16799 B14R0.493 CCCCCCCCCN(C)CCCC 2230a_100000232482_100000210211 [0,2,0,0,0,0|1,0,0]=3 16800 B14R0.493 CCCCCCCCCN(C)CCCC 269982a_100000207549_100000210670 [0,2,0,0,0,0|1,0,0]=3 16801 B14R0.493 CCCCCCCCCN(C)CCCC 269982a_100000232482_100000210211 [0,2,0,0,0,0|1,0,0]=3 16802 B14R0.493 CCCCCCCCCN(C)CCCF 2230a_100000232482_100011934791 [0,2,0,0,0,0|1,0,0]=3 16803 B14R0.493 CCCCCCCCCN(C)CCCF 269982a_100000232482_100011934791 [0,2,0,0,0,0|1,0,0]=3 16804 B14R0.493 CCCCCCCCCN(C)CCCO 2230a_100000213112_100011214924 [0,2,0,0,0,0|0,0,0]=2 16805 B14R0.493 CCCCCCCCCN(C)CCCO 2230a_100000232482_100000230001 [0,2,0,0,0,0|0,0,0]=2 16806 B14R0.493 CCCCCCCCCN(C)CCCO 269982a_100000213112_100000210670 [0,2,0,0,0,0|0,0,0]=2 16807 B14R0.493 CCCCCCCCCN(C)CCCO 269982a_100000232482_100011215043 [0,2,0,0,0,0|0,0,0]=2 16808 B14R0.493 CCCCCCCCCN(C)CCOC 2230a_100000232482_100011201679 [0,2,0,0,0,0|1,0,0]=3 16809 B14R0.493 CCCCCCCCCN(C)CCOC 2230a_100000743101_100011214924 [0,2,0,0,0,0|1,0,0]=3 16810 B14R0.493 CCCCCCCCCN(C)CCOC 269982a_100000232482_100000233755 [0,2,0,0,0,0|1,0,0]=3 16811 B14R0.493 CCCCCCCCCN(C)CCOC 269982a_100000743101_100000210670 [0,2,0,0,0,0|1,0,0]=3 16812 B14R0.493 CCCCCCCCCN(C)CCSC 2230a_100000232482_100000751147 [0,2,0,0,0,0|1,1,0]=4 16813 B14R0.493 CCCCCCCCCN(C)CCSC 2230a_100000686725_100011214924 [0,2,0,0,0,0|1,1,0]=4 16814 B14R0.493 CCCCCCCCCN(C)CCSC 269982a_100000232482_100000212216 [0,2,0,0,0,0|1,1,0]=4 16815 B14R0.493 CCCCCCCCCN(C)CCSC 269982a_100000686725_100000210670 [0,2,0,0,0,0|1,1,0]=4 16816 B14R0.493 CCCCCCCCCN(C)COCC 269982a_100000232482_100000739092 [0,2,0,0,0,0|2,0,0]=4 16817 B14R0.493 CCCCCCCCCN([13CH3])CCC#N 2230a_200000021605_200025704644 [0,2,0,0,0,0|1,0,1]=4 16818 B14R0.493 CCCCCCCCNC(=O)CCCC 11a_100000229939_100000210183 [0,2,0,0,0,0|1,0,1]=4 16819 B14R0.493 CCCCCCCCNC(=O)CCCC 1626a_100000229939_100000210183 [0,2,0,0,0,0|1,0,1]=4 16820 B14R0.493 CCCCCCCCNC(=O)CCCC 240690a_100000229939_100000210183 [0,2,0,0,0,0|1,0,1]=4 16821 B14R0.493 CCCCCCCCNC(=O)CCCC 527a_100000229939_100000210183 [0,2,0,0,0,0|1,0,1]=4 16822 B14R0.493 CCCCCCCCNC(=O)CCOC 11a_100000229939_100000749529 [0,2,0,0,0,0|1,0,1]=4 16823 B14R0.493 CCCCCCCCNC(=O)CCOC 1626a_100000229939_100000749529 [0,2,0,0,0,0|1,0,1]=4 16824 B14R0.493 CCCCCCCCNC(=O)CCOC 240690a_100000229939_100000749529 [0,2,0,0,0,0|1,0,1]=4 16825 B14R0.493 CCCCCCCCNC(=O)CCOC 527a_100000229939_100000749529 [0,2,0,0,0,0|1,0,1]=4 16826 B14R0.493 CCCCCCCCNC(=O)NCCO 2708a_100000229939_100000210304 [0,2,0,0,0,0|1,0,1]=4 16827 B14R0.493 CCCCCCCCNC(=O)NCCO 273464a_100000210304_100000229939 [0,2,0,0,0,0|1,0,1]=4 16828 B14R0.493 CCCCCCCCNC(=O)NCCO 273464a_100000229939_100000210304 [0,2,0,0,0,0|1,0,1]=4 16829 B14R0.493 CCCCCCCCNC(=O)NCCO 512a_100000229939_100000210304 [0,2,0,0,0,0|1,0,1]=4 16830 B14R0.493 CCCCCCCCNC(C)CCCC 2230a_100000126638_100000210759 [0,2,0,0,0,0|1,0,0]=3 16831 B14R0.493 CCCCCCCCNC(C)CCCC 2230a_100000229939_200011215066 [0,2,0,0,0,0|1,0,0]=3 16832 B14R0.493 CCCCCCCCNC(C)CCCC 270004a_100000229939_100000210087 [0,2,0,0,0,0|1,0,0]=3 16833 B14R0.493 CCCCCCCCNC(C)CCCC 34a_100000229939_200011215066 [0,2,0,0,0,0|1,0,0]=3 16834 B14R0.493 CCCCCCCCNC(C)CCOC 270004a_100000229939_100000742357 [0,2,0,0,0,0|1,0,0]=3 16835 B14R0.493 CCCCCCCCNC(C)CCSC 270004a_100000229939_100011217047 [0,2,0,0,0,0|1,1,0]=4 16836 B14R0.493 CCCCCCCCNC(C)CSCC 270004a_100000229939_200011216171 [0,2,0,0,0,0|2,0,0]=4 16837 B14R0.493 CCCCCCCCOC(C)CCCC 34a_100000210232_200011215066 [0,2,0,0,0,0|1,0,0]=3 16838 B14R0.493 CCCCCCCCOC(C)CCCC 34a_100000687866_100000210759 [0,2,0,0,0,0|1,0,0]=3 16839 B14R0.493 CCCCCCCCOC(C)CCCC 7a_100000210232_200011215066 [0,2,0,0,0,0|1,0,0]=3 16840 B14R0.493 CCCCCCCCOC(C)CCCC 7a_100000687866_100000210759 [0,2,0,0,0,0|1,0,0]=3 16841 B14R0.493 CCCCCCCCOC(C)CCCCl 34a_200000718107_100000210759 [0,2,0,0,0,0|1,0,0]=3 16842 B14R0.493 CCCCCCCCOC(C)CCCCl 7a_200000718107_100000210759 [0,2,0,0,0,0|1,0,0]=3 16843 B14R0.493 CCCCCCCCOC(C)COCC 34a_100000718985_100000210759 [0,2,0,0,0,0|2,0,0]=4 16844 B14R0.493 CCCCCCCCOC(C)COCC 7a_100000718985_100000210759 [0,2,0,0,0,0|2,0,0]=4 16845 B14R0.493 CCCCCCCCSC(C)CCCC 62a_100000210759_200011215066 [0,2,0,0,0,0|1,0,0]=3 16846 B14R0.493 CCCCCCCCSC(C)CCCC 62a_200011215066_100000210317 [0,2,0,0,0,0|1,0,0]=3 16847 B14R0.493 CCCCCCCNCC(C)OCCC 2230a_100015185124_100000210681 [0,2,0,0,0,0|2,0,0]=4 16848 B14R0.493 CCCCCCCNCC(C)OCCC 34a_100015185124_100000210614 [0,2,0,0,0,0|2,0,0]=4 16849 B14R0.493 CCCCCCCNCC(O)COCC 2230a_102515437182_100000210681 [0,2,0,0,0,0|2,0,0]=4 16850 B14R0.493 CCCCCCCNCC(O)COCC 34a_102515437182_100000210614 [0,2,0,0,0,0|2,0,0]=4 16851 B14R0.493 CCCCCCCNC[C@H](C)CCCO 2230a_100160569302_100000210681 [0,2,0,0,0,0|0,0,0]=2 16852 B14R0.493 CCCCCCCNC[C@H](C)CCCO 34a_100160569302_100000210614 [0,2,0,0,0,0|0,0,0]=2 16853 B14R0.493 CCCCCCCOCC(C)CCCC 34a_100011995851_100000210614 [0,2,0,0,0,0|1,0,0]=3 16854 B14R0.493 CCCCCCCOCC(C)CCCC 7a_100011995851_100000210614 [0,2,0,0,0,0|1,0,0]=3 16855 B14R0.493 CCCCCCCOC[C@@H](C)OCOC 34a_100016172286_100000210614 [0,2,0,0,0,0|2,0,0]=4 16856 B14R0.493 CCCCCCCOC[C@@H](C)OCOC 7a_100016172286_100000210614 [0,2,0,0,0,0|2,0,0]=4 16857 B14R0.493 CCCCCCCOC[C@@H](N)CCCC 34a_100011934283_100000210614 [0,2,0,0,0,0|1,0,0]=3 16858 B14R0.493 CCCCCCCOC[C@@H](N)CCSC 34a_100011827619_100000210614 [0,2,0,0,0,0|1,1,0]=4 16859 B14R0.493 CCCCCNCCOC(C)CCCC 34a_100000224656_200011215066 [0,2,0,0,0,0|2,0,0]=4 16860 B14R0.493 CCCCCOCCOC(C)CCCC 34a_100011215259_200011215066 [0,2,0,0,0,0|2,0,0]=4 16861 B14R0.493 CCCCCOCCOC(C)CCCC 7a_100011215259_200011215066 [0,2,0,0,0,0|2,0,0]=4 16862 B14R0.493 CCCCN(C)CCCCCCCCO 2230a_100000207549_100000033203 [0,2,0,0,0,0|0,0,0]=2 16863 B14R0.493 CCCCN(C)CCCCCCCCO 269982a_100000207549_100000033203 [0,2,0,0,0,0|0,0,0]=2 16864 B14R0.493 CCCCN(C)CCOCCOCCO 2230a_100000207549_100000032323 [0,2,0,0,0,0|2,0,0]=4 16865 B14R0.493 CCCCN(C)CCOCCOCCO 2230a_200014138305_100000210211 [0,2,0,0,0,0|2,0,0]=4 16866 B14R0.493 CCCCN(C)CCOCCOCCO 269982a_100000207549_100000032323 [0,2,0,0,0,0|2,0,0]=4 16867 B14R0.493 CCCCN(C)CCOCCOCCO 269982a_200014138305_100000210211 [0,2,0,0,0,0|2,0,0]=4 16868 B14R0.493 CCCCN(C)CCOCCOCCO 34a_200014138305_100000210210 [0,2,0,0,0,0|2,0,0]=4 16869 B14R0.493 CCCCOCCCCC(C)CCCC 34a_200011021034_100000210210 [0,2,0,0,0,0|1,0,0]=3 16870 B14R0.493 CCCCOCCCCC(C)CCCC 7a_200011021034_100000210211 [0,2,0,0,0,0|1,0,0]=3 16871 B14R0.493 CCCCOCCCNC(C)CCCC 2230a_200000211371_200011215066 [0,2,0,0,0,0|2,0,0]=4 16872 B14R0.493 CCCCOCCCNC(C)CCCC 270004a_200000211371_100000210087 [0,2,0,0,0,0|2,0,0]=4 16873 B14R0.493 CCCCOCCCNC(C)CCCC 34a_200000211371_200011215066 [0,2,0,0,0,0|2,0,0]=4 16874 B14R0.493 CCCCOCCCNC(C)CCOC 270004a_200000211371_100000742357 [0,2,0,0,0,0|2,0,0]=4 16875 B14R0.493 CCCCOCCCOC(C)CCCC 34a_200011215613_200011215066 [0,2,0,0,0,0|2,0,0]=4 16876 B14R0.493 CCCCOCCCOC(C)CCCC 7a_200011215613_200011215066 [0,2,0,0,0,0|2,0,0]=4 16877 B14R0.493 CCCCOCCNC[C@H](C)CCCO 2230a_100160569302_100000743108 [0,2,0,0,0,0|1,0,0]=3 16878 B14R0.493 CCCCOCCNC[C@H](C)CCCO 34a_100160569302_100000743108 [0,2,0,0,0,0|1,0,0]=3 16879 B14R0.493 CCCCOCCOCC(=O)CCCO 1458a_100011216887_100011215043 [0,2,0,0,0,0|1,0,1]=4 16880 B14R0.493 CCCCOCCOCC(C)CCCC 34a_100011995851_100000743108 [0,2,0,0,0,0|2,0,0]=4 16881 B14R0.493 CCCCOCCOCC(C)CCCC 7a_100011995851_100000743108 [0,2,0,0,0,0|2,0,0]=4 16882 B14R0.493 CCCCOCCOC[C@@H](N)CCCC 34a_100011934283_100000743108 [0,2,0,0,0,0|2,0,0]=4 16883 B14R0.493 CCCC[C@H](N)COCCCCCCF 34a_100011934283_100015922095 [0,2,0,0,0,0|1,0,0]=3 16884 B14R0.493 CCCC[C@H](N)COCCCCCCO 34a_100011934283_100000766143 [0,2,0,0,0,0|0,0,0]=2 16885 B14R0.493 CCCC[C@H](N)COCCOCCOC 34a_100011934283_100000695917 [0,2,0,0,0,0|2,0,0]=4 16886 B14R0.493 CCCNC(=O)CCCCCCCCO 240690a_100020643023_100000015970 [0,2,0,0,0,0|0,0,1]=3 16887 B14R0.493 CCCNC(=O)CCCNCCCCO 2230a_100000750430_100011194427 [0,2,0,0,0,0|1,0,1]=4 16888 B14R0.493 CCCNC(=O)CCCSCCCCO 62a_100000210776_100011194427 [0,2,0,0,0,0|1,0,1]=4 16889 B14R0.493 CCCNC(=O)CCCSCCCCO 62a_100011194427_100000210776 [0,2,0,0,0,0|1,0,1]=4 16890 B14R0.493 CCCNC(=O)CNCCCCCCO 2230a_100000174927_100000766143 [0,2,0,0,0,0|1,0,1]=4 16891 B14R0.493 CCCNC(=O)CNCCCCCCO 2230a_100000686447_100000183358 [0,2,0,0,0,0|1,0,1]=4 16892 B14R0.493 CCCNC(=O)CNCCCCCCO 34a_100000686447_100000183358 [0,2,0,0,0,0|1,0,1]=4 16893 B14R0.493 CCCNC(=O)CSCCCCCCO 62a_100000183358_100000766143 [0,2,0,0,0,0|1,0,1]=4 16894 B14R0.493 CCCNC(=O)CSCCCCCCO 62a_100000766143_100000183358 [0,2,0,0,0,0|1,0,1]=4 16895 B14R0.493 CCCNC(=O)NCCCCCCCO 2708a_100011996573_100020643023 [0,2,0,0,0,0|1,0,1]=4 16896 B14R0.493 CCCNC(=O)NCCCCCCCO 2708a_100020643023_100011996573 [0,2,0,0,0,0|1,0,1]=4 16897 B14R0.493 CCCNC(=O)NCCCCCCCO 273464a_100011996573_100020643023 [0,2,0,0,0,0|1,0,1]=4 16898 B14R0.493 CCCNC(=O)NCCCCCCCO 273464a_100020643023_100011996573 [0,2,0,0,0,0|1,0,1]=4 16899 B14R0.493 CCCNC(=O)NCCCCCCCO 512a_100011996573_100020643023 [0,2,0,0,0,0|1,0,1]=4 16900 B14R0.493 CCCNC(=O)NCCCCCCCO 512a_100020643023_100011996573 [0,2,0,0,0,0|1,0,1]=4 16901 B14R0.493 CCCOC(=O)CNCCCCCCO 2230a_100000686447_200011215008 [0,2,0,0,0,0|1,0,1]=4 16902 B14R0.493 CCCOC(=O)CNCCCCCCO 34a_100000686447_200011215008 [0,2,0,0,0,0|1,0,1]=4 16903 B14R0.493 CCCOC(=O)CSCCCCCCO 62a_100000766143_200011215008 [0,2,0,0,0,0|1,0,1]=4 16904 B14R0.493 CCCOC(=O)CSCCCCCCO 62a_200011215008_100000766143 [0,2,0,0,0,0|1,0,1]=4 16905 B14R0.493 CCCOC(C)CNCCCCCCF 2230a_100015185124_100015922095 [0,2,0,0,0,0|2,0,0]=4 16906 B14R0.493 CCCOC(C)CNCCCCCCF 34a_100015185124_100015922095 [0,2,0,0,0,0|2,0,0]=4 16907 B14R0.493 CCCOC(C)CNCCCCCCO 2230a_100015185124_100000766143 [0,2,0,0,0,0|1,0,0]=3 16908 B14R0.493 CCCOC(C)CNCCCCCCO 34a_100015185124_100000766143 [0,2,0,0,0,0|1,0,0]=3 16909 B14R0.493 CCNNC(=O)CCCCCCCCO 22a_100000756455_100000015970 [0,2,0,0,0,0|1,0,1]=4 16910 B14R0.493 CCOCC(=O)CCCCCCCCO 1458a_100000211967_100000033203 [0,2,0,0,0,0|0,0,1]=3 16911 B14R0.493 CCOCC(=O)NCCCCCCCO 240690a_100011996573_100000211967 [0,2,0,0,0,0|1,0,1]=4 16912 B14R0.493 CCOCC(C)OCCCCCCCO 34a_100000718985_100000760002 [0,2,0,0,0,0|1,0,0]=3 16913 B14R0.493 CCOCC(C)OCCCCCCCO 7a_100000718985_100000760002 [0,2,0,0,0,0|1,0,0]=3 16914 B14R0.493 CCOCC(C)OCCCCCCOC 34a_100000718985_100011998445 [0,2,0,0,0,0|2,0,0]=4 16915 B14R0.493 CCOCC(C)OCCCCCCOC 7a_100000718985_100011998445 [0,2,0,0,0,0|2,0,0]=4 16916 B14R0.493 CCOCC(O)CNCCCCCCF 2230a_102515437182_100015922095 [0,2,0,0,0,0|2,0,0]=4 16917 B14R0.493 CCOCC(O)CNCCCCCCF 34a_102515437182_100015922095 [0,2,0,0,0,0|2,0,0]=4 16918 B14R0.493 CCOCC(O)CNCCCCCCO 2230a_102515437182_100000766143 [0,2,0,0,0,0|1,0,0]=3 16919 B14R0.493 CCOCC(O)CNCCCCCCO 34a_102515437182_100000766143 [0,2,0,0,0,0|1,0,0]=3 16920 B14R0.493 CCSCC(=O)CCCCCCCCO 1458a_100000230394_100000033203 [0,2,0,0,0,0|0,0,1]=3 16921 B14R0.493 CCSCC(=O)NCCCCCCCO 240690a_100011996573_100000230394 [0,2,0,0,0,0|1,0,1]=4 16922 B14R0.493 CCSCC(C)NCCCCCCCO 270004a_100011996573_200011216171 [0,2,0,0,0,0|1,0,0]=3 16923 B14R0.493 CCSCC(C)NCCCOCCCO 270004a_100011310245_200011216171 [0,2,0,0,0,0|2,0,0]=4 16924 B14R0.493 CN(CCC#N)CCCCCCCCO 2230a_100000184479_100000033203 [0,2,0,0,0,0|1,0,1]=4 16925 B14R0.493 CN(CCCO)CCCCCCCCO 2230a_100000213112_100000033203 [0,2,0,0,0,0|1,0,0]=3 16926 B14R0.493 CN(CCCO)CCCCCCCCO 269982a_100000213112_100000033203 [0,2,0,0,0,0|1,0,0]=3 16927 B14R0.493 COCCC(=O)CCCCCCCCO 1458a_100000749529_100000033203 [0,2,0,0,0,0|0,0,1]=3 16928 B14R0.493 COCCC(=O)NCCCCCCCO 240690a_100011996573_100000749529 [0,2,0,0,0,0|1,0,1]=4 16929 B14R0.493 COCCC(C)NCCCCCCCO 270004a_100011996573_100000742357 [0,2,0,0,0,0|1,0,0]=3 16930 B14R0.493 COCCC(C)NCCCOCCCO 270004a_100011310245_100000742357 [0,2,0,0,0,0|2,0,0]=4 16931 B14R0.493 COCCCCCCOC(C)CCCCl 34a_200000718107_100011998445 [0,2,0,0,0,0|2,0,0]=4 16932 B14R0.493 COCCCCCCOC(C)CCCCl 7a_200000718107_100011998445 [0,2,0,0,0,0|2,0,0]=4 16933 B14R0.493 COCCN(C)CCCCCCCCO 2230a_100000743101_100000033203 [0,2,0,0,0,0|1,0,0]=3 16934 B14R0.493 COCCN(C)CCCCCCCCO 269982a_100000743101_100000033203 [0,2,0,0,0,0|1,0,0]=3 16935 B14R0.493 COCCOCCNC[C@H](C)CCCO 2230a_100160569302_100000695917 [0,2,0,0,0,0|2,0,0]=4 16936 B14R0.493 COCCOCCNC[C@H](C)CCCO 34a_100160569302_100000695917 [0,2,0,0,0,0|2,0,0]=4 16937 B14R0.493 COCO[C@H](C)COCCCCCCO 34a_100016172286_100000766143 [0,2,0,0,0,0|2,0,0]=4 16938 B14R0.493 COCO[C@H](C)COCCCCCCO 7a_100016172286_100000766143 [0,2,0,0,0,0|2,0,0]=4 16939 B14R0.493 CSCCC(=O)CCCCCCCCO 1458a_100000174002_100000033203 [0,2,0,0,0,0|0,0,1]=3 16940 B14R0.493 CSCCC(=O)NCCCCCCCO 240690a_100011996573_100000174002 [0,2,0,0,0,0|1,0,1]=4 16941 B14R0.493 CSCCC(C)NCCCCCCCO 270004a_100011996573_100011217047 [0,2,0,0,0,0|1,0,0]=3 16942 B14R0.493 CSCCC(C)NCCCOCCCO 270004a_100011310245_100011217047 [0,2,0,0,0,0|2,0,0]=4 16943 B14R0.493 CSCCN(C)CCCCCCCCO 2230a_100000686725_100000033203 [0,2,0,0,0,0|1,0,0]=3 16944 B14R0.493 CSCCN(C)CCCCCCCCO 269982a_100000686725_100000033203 [0,2,0,0,0,0|1,0,0]=3 16945 B14R0.493 CSCC[C@H](N)COCCCCCCF 34a_100011827619_100015922095 [0,2,0,0,0,0|2,0,0]=4 16946 B14R0.493 CSCC[C@H](N)COCCCCCCO 34a_100011827619_100000766143 [0,2,0,0,0,0|1,0,0]=3 16947 B14R0.493 C[C@H](CCCO)CNCCCCCC#N 2230a_100160569302_100009813376 [0,2,0,0,0,0|1,0,1]=4 16948 B14R0.493 C[C@H](CCCO)CNCCCCCC=O 2230a_100160569302_100000139337 [0,2,0,0,0,0|1,0,1]=4 16949 B14R0.493 C[C@H](CCCO)CNCCCCCCF 2230a_100160569302_100015922095 [0,2,0,0,0,0|1,0,0]=3 16950 B14R0.493 C[C@H](CCCO)CNCCCCCCF 34a_100160569302_100015922095 [0,2,0,0,0,0|1,0,0]=3 16951 B14R0.493 C[C@H](CCCO)CNCCCCCCO 2230a_100160569302_100000766143 [0,2,0,0,0,0|1,0,0]=3 16952 B14R0.493 C[C@H](CCCO)CNCCCCCCO 34a_100160569302_100000766143 [0,2,0,0,0,0|1,0,0]=3 16953 B14R0.493 N#CCCC(=O)CCCCCCCCO 1458a_100011934036_100000033203 [0,2,0,0,0,0|0,0,2]=4 16954 B14R0.493 O=C(CCCCCCCCO)NCCF 240690a_100000724931_100000015970 [0,2,0,0,0,0|1,0,1]=4 16955 B14R0.493 O=C(CCCCCCCCO)NCCO 240690a_100000210304_100000015970 [0,2,0,0,0,0|1,0,1]=4 16956 B14R0.1390 CC(C)(CCBr)OCCCCCCCO 7a_100000702414_100000760002 [0,2,0,0,0,0|2,0,0]=4 16957 B14R0.1390 CCCC(C)(C)COCCCCCCF 7a_100011995695_100015922095 [0,2,0,0,0,0|2,0,0]=4 16958 B14R0.1390 CCCC(C)(C)COCCCCCCO 7a_100011995695_100000766143 [0,2,0,0,0,0|1,0,0]=3 16959 B14R0.1390 CCCC(C)(C)OCCCCCCCO 7a_100000748436_100000760002 [0,2,0,0,0,0|1,0,0]=3 16960 B14R0.1390 CCCCCCCCOC(C)(C)CCBr 7a_100000702414_100000210759 [0,2,0,0,0,0|2,0,0]=4 16961 B14R0.1390 CCCCCCCCOC(C)(C)CCC 7a_100000748436_100000210759 [0,2,0,0,0,0|2,0,0]=4 16962 B14R0.1390 CCCCCCCOCC(C)(C)CCC 7a_100011995695_100000210614 [0,2,0,0,0,0|2,0,0]=4 16963 B14R0.1390 CCCCCCCOC[N+](C)(C)CCO 7a_100000210272_200010270792 [0,2,0,0,0,0|2,0,0]=4 16964 B14R0.1390 CCCCCCCSC[N+](C)(C)CCO 62a_100000210614_200010270792 [0,2,0,0,0,0|2,0,0]=4 16965 B14R0.1390 CCCCCCCSC[N+](C)(C)CCO 62a_200010270792_100000210316 [0,2,0,0,0,0|2,0,0]=4 16966 B14R0.1390 CCCS(=O)(=O)NCCCCCCCO 270084a_100011996573_100000211391 [0,2,0,0,0,0|2,0,0]=4 16967 B14R0.1390 CCCS(=O)(=O)NCCCCCCCO 274078a_100011996573_100000211391 [0,2,0,0,0,0|2,0,0]=4 16968 B14R0.1390 CCCS(=O)(=O)NCCCCCCCO 40a_100011996573_100000054278 [0,2,0,0,0,0|2,0,0]=4 16969 B14R0.1390 CCNC(C)(C)COCCCCCCO 7a_100000747347_100000766143 [0,2,0,0,0,0|2,0,0]=4 16970 B14R0.1390 COCC(C)(C)CNCCCCCCO 2230a_100000734190_100000766143 [0,2,0,0,0,0|2,0,0]=4 16971 B14R0.1390 COCC(C)(C)NCCCCCCCO 2230a_100000752728_100000760002 [0,2,0,0,0,0|2,0,0]=4 16972 B14R0.1390 CSCC(C)(C)NCCCCCCCO 2230a_100000759623_100000760002 [0,2,0,0,0,0|2,0,0]=4 16973 B14R0.1390 CSCC(C)(C)NCCCCCCCO 7a_100000759623_100000760002 [0,2,0,0,0,0|2,0,0]=4 16974 B14R0.2432 CCCC(C)COC[C@@H](N)CCCCN 34a_100016993712_100011216630 [0,2,0,0,0,0|2,0,0]=4 16975 B14R0.2432 CCCCCC(C)OCCC(C)CCC 34a_100011217855_200011218191 [0,2,0,0,0,0|2,0,0]=4 16976 B14R0.2432 CCCCCC(C)OCCC(C)CCC 7a_100011217855_200011218191 [0,2,0,0,0,0|2,0,0]=4 16977 B14R0.2432 CCCCCC(C)OCC[C@@H](N)CCC 34a_100015193777_200011218191 [0,2,0,0,0,0|2,0,0]=4 16978 B14R0.2 CC(=O)CCCC(=O)CCCCCCO 1458a_100011996774_100011215641 [0,2,0,0,0,0|0,0,2]=4 16979 B14R0.2 CC(C)CCCC(=O)CCCCCCF 1458a_100011216857_100015922095 [0,2,0,0,0,0|1,0,1]=4 16980 B14R0.2 CC(C)CCCC(=O)CCCCCCO 1458a_100011216857_100000766143 [0,2,0,0,0,0|0,0,1]=3 16981 B14R0.2 CC(C)CCCC(=O)CCCCCCO 1458a_100011996774_100011214892 [0,2,0,0,0,0|0,0,1]=3 16982 B14R0.2 CC(C)CCCC(=O)NCCCCCO 240690a_100000762737_100011216857 [0,2,0,0,0,0|1,0,1]=4 16983 B14R0.2 CC(C)CCCC(C)CCNCCCF 2230a_100015189416_100009816328 [0,2,0,0,0,0|2,0,0]=4 16984 B14R0.2 CC(C)CCCC(C)CCNCCCF 2230a_102516457229_100011934791 [0,2,0,0,0,0|2,0,0]=4 16985 B14R0.2 CC(C)CCCC(C)CCNCCCF 34a_100015189416_100009816328 [0,2,0,0,0,0|2,0,0]=4 16986 B14R0.2 CC(C)CCCC(C)CCNCCCO 2230a_102516457229_100000230001 [0,2,0,0,0,0|1,0,0]=3 16987 B14R0.2 CC(C)CCCC(C)CCOCCCBr 34a_100011217188_100009816328 [0,2,0,0,0,0|2,0,0]=4 16988 B14R0.2 CC(C)CCCC(C)CCOCCCCl 34a_100000230001_100009816328 [0,2,0,0,0,0|2,0,0]=4 16989 B14R0.2 CC(C)CCCC(C)CCOCCCF 34a_100000015991_100011934791 [0,2,0,0,0,0|2,0,0]=4 16990 B14R0.2 CC(C)CCCC(C)CCOCCCF 34a_100000759539_100009816328 [0,2,0,0,0,0|2,0,0]=4 16991 B14R0.2 CC(C)CCCC(C)CCOCCCF 7a_100000015991_100011934791 [0,2,0,0,0,0|2,0,0]=4 16992 B14R0.2 CC(C)CCCC(C)CCOCCCN 34a_100000182051_100009816328 [0,2,0,0,0,0|2,0,0]=4 16993 B14R0.2 CC(C)CCCC(C)CCOCCCO 34a_100000015991_100000230001 [0,2,0,0,0,0|1,0,0]=3 16994 B14R0.2 CC(C)CCCC(C)CCOCCCO 7a_100000015991_100011215043 [0,2,0,0,0,0|1,0,0]=3 16995 B14R0.2 CC(C)CCCC(C)CCSCCCF 62a_100009816328_100011934791 [0,2,0,0,0,0|2,0,0]=4 16996 B14R0.2 CC(C)CCCC(C)CCSCCCF 62a_100011934791_100009816328 [0,2,0,0,0,0|2,0,0]=4 16997 B14R0.2 CC(C)CCCC(C)CCSCCCO 62a_100009816328_100011215043 [0,2,0,0,0,0|1,0,0]=3 16998 B14R0.2 CC(C)CCCC(C)CCSCCCO 62a_100011215043_100009816328 [0,2,0,0,0,0|1,0,0]=3 16999 B14R0.2 CC(C)CCCC(C)NCCCCCF 2230a_100000210607_100000729378 [0,2,0,0,0,0|2,0,0]=4 17000 B14R0.2 CC(C)CCCC(C)NCCCCCO 2230a_100000210607_100000746330 [0,2,0,0,0,0|1,0,0]=3 17001 B14R0.2 CC(C)CCCC(C)NCCCCCO 270004a_100000762737_100000753411 [0,2,0,0,0,0|1,0,0]=3 17002 B14R0.2 CC(C)CCCC(C)NCCOCCO 2230a_100000210607_100011215305 [0,2,0,0,0,0|2,0,0]=4 17003 B14R0.2 CC(C)CCCC(C)NCCOCCO 270004a_100000211614_100000753411 [0,2,0,0,0,0|2,0,0]=4 17004 B14R0.2 CC(C)CCCC(C)NCCSCCO 270004a_100011219999_100000753411 [0,2,0,0,0,0|2,0,0]=4 17005 B14R0.2 CC(C)CCCC(C)OCCCCCF 34a_200011218570_100000729378 [0,2,0,0,0,0|2,0,0]=4 17006 B14R0.2 CC(C)CCCC(C)OCCCCCF 7a_200011218570_100000729378 [0,2,0,0,0,0|2,0,0]=4 17007 B14R0.2 CC(C)CCCC(C)OCCCCCO 34a_200011218570_100000746330 [0,2,0,0,0,0|1,0,0]=3 17008 B14R0.2 CC(C)CCCC(C)OCCCCCO 7a_200011218570_100000746330 [0,2,0,0,0,0|1,0,0]=3 17009 B14R0.2 CC(C)CCCC(C)OCCOCCO 34a_200011218570_100000692535 [0,2,0,0,0,0|2,0,0]=4 17010 B14R0.2 CC(C)CCCC(C)OCCOCCO 7a_200011218570_100011215305 [0,2,0,0,0,0|2,0,0]=4 17011 B14R0.2 CC(C)CCNC(=O)CCCCCCO 240690a_100000210545_100011996774 [0,2,0,0,0,0|1,0,1]=4 17012 B14R0.2 CC(C)COCC(=O)CCCCCCO 1458a_100011223364_100000766143 [0,2,0,0,0,0|1,0,1]=4 17013 B14R0.2 CC(C)OCCC(=O)CCCCCCO 1458a_100011996774_100000211751 [0,2,0,0,0,0|1,0,1]=4 17014 B14R0.2 CC(C)SCCC(=O)CCCCCCO 1458a_100011996774_100000730970 [0,2,0,0,0,0|1,0,1]=4 17015 B14R0.2 CC(CCOC(C)C)NCCCCCO 270004a_100000762737_200011219172 [0,2,0,0,0,0|2,0,0]=4 17016 B14R0.2 CC(O)CCCC(=O)CCCCCCO 1458a_100011996774_200000718107 [0,2,0,0,0,0|0,0,1]=3 17017 B14R0.2 CC(O)CCNC(=O)CCCCCCO 240690a_200000755665_100011996774 [0,2,0,0,0,0|1,0,1]=4 17018 B14R0.2 CCCCCCCC(=O)CCCC(C)C 1458a_100000211969_100011214892 [0,2,0,0,0,0|1,0,1]=4 17019 B14R0.2 CCCCCCCC(=O)CCCC(C)C 1458a_100011216857_100000210614 [0,2,0,0,0,0|1,0,1]=4 17020 B14R0.2 CCCCCCCC(=O)CCCC(C)O 1458a_100000211969_200000718107 [0,2,0,0,0,0|0,0,1]=3 17021 B14R0.2 CCCCCCCC(=O)NCCC(C)O 240690a_200000755665_100000211969 [0,2,0,0,0,0|1,0,1]=4 17022 B14R0.2 CCCCCCCC(=O)NCCC(C)O 527a_200000755665_100000211969 [0,2,0,0,0,0|1,0,1]=4 17023 B14R0.2 CCCCCCCC(C)NCCC(C)C 270004a_100000210545_100000210596 [0,2,0,0,0,0|2,0,0]=4 17024 B14R0.2 CCCCCCCC(C)NCCC(C)O 2230a_200000755665_200011218727 [0,2,0,0,0,0|1,0,0]=3 17025 B14R0.2 CCCCCCCC(C)NCCC(C)O 270004a_200000755665_100000210596 [0,2,0,0,0,0|1,0,0]=3 17026 B14R0.2 CCCCCCCC(C)OCCC(C)Br 34a_100009893172_200011218727 [0,2,0,0,0,0|2,0,0]=4 17027 B14R0.2 CCCCCCCC(C)OCCC(C)C 34a_100000210254_200011218727 [0,2,0,0,0,0|2,0,0]=4 17028 B14R0.2 CCCCCCCC(C)OCCC(C)C 34a_200011215852_100000210312 [0,2,0,0,0,0|2,0,0]=4 17029 B14R0.2 CCCCCCCC(C)OCCC(C)C 7a_100000210254_200011218727 [0,2,0,0,0,0|2,0,0]=4 17030 B14R0.2 CCCCCCCC(C)OCCC(C)C 7a_200011215852_100000210626 [0,2,0,0,0,0|2,0,0]=4 17031 B14R0.2 CCCCCCCC(C)OCCC(C)O 34a_200011215852_100012276601 [0,2,0,0,0,0|1,0,0]=3 17032 B14R0.2 CCCCCCCC(C)OCCC(C)O 7a_200011215852_100012276601 [0,2,0,0,0,0|1,0,0]=3 17033 B14R0.2 CCCCCCCC(C)OCCC(F)F 34a_100103093639_200011218727 [0,2,0,0,0,0|2,0,0]=4 17034 B14R0.2 CCCCCCCC(C)OCC[C@@H](C)N 34a_100000706166_200011218727 [0,2,0,0,0,0|2,0,0]=4 17035 B14R0.2 CCCCCCCC(C)SCCC(C)C 62a_100000210312_200011218727 [0,2,0,0,0,0|2,0,0]=4 17036 B14R0.2 CCCCCCCC(C)SCCC(C)C 62a_200011218727_100000210312 [0,2,0,0,0,0|2,0,0]=4 17037 B14R0.2 CCCCCCCC(C)SCCC(C)O 62a_100012276601_200011218727 [0,2,0,0,0,0|1,0,0]=3 17038 B14R0.2 CCCCCCCC(C)SCCC(C)O 62a_200011218727_100012276601 [0,2,0,0,0,0|1,0,0]=3 17039 B14R0.2 CCCCCCCN(C)CCCC(=O)O 269956a_100000719178_100000210614 [0,2,0,0,0,0|1,0,1]=4 17040 B14R0.2 CCCCCCCN(C)CCCC(C)C 2230a_100000228206_100011214892 [0,2,0,0,0,0|2,0,0]=4 17041 B14R0.2 CCCCCCCN(C)CCCC(C)C 269982a_100000228206_100011214892 [0,2,0,0,0,0|2,0,0]=4 17042 B14R0.2 CCCCCCCN(C)CCCC(C)O 2230a_100000228206_200000718107 [0,2,0,0,0,0|1,0,0]=3 17043 B14R0.2 CCCCCCCN(C)CCCC(C)O 269982a_100000228206_200000718107 [0,2,0,0,0,0|1,0,0]=3 17044 B14R0.2 CCCCCCNC(=O)CCCC(C)O 1626a_100000210581_100000761597 [0,2,0,0,0,0|1,0,1]=4 17045 B14R0.2 CCCCCCNC(=O)CCCC(C)O 527a_100000210581_100000761597 [0,2,0,0,0,0|1,0,1]=4 17046 B14R0.2 CCCCCCNC(C)CCCC(C)C 2230a_100000210607_100000210314 [0,2,0,0,0,0|2,0,0]=4 17047 B14R0.2 CCCCCCNC(C)CCCC(C)C 270004a_100000210581_100000753411 [0,2,0,0,0,0|2,0,0]=4 17048 B14R0.2 CCCCCCOC(C)CCCC(C)C 34a_200011218570_100000210314 [0,2,0,0,0,0|2,0,0]=4 17049 B14R0.2 CCCCCCOC(C)CCCC(C)C 7a_200011218570_100000210314 [0,2,0,0,0,0|2,0,0]=4 17050 B14R0.2 CCCCNCCC(C)CCCC(C)C 2230a_100000102301_100009816328 [0,2,0,0,0,0|2,0,0]=4 17051 B14R0.2 CCCCNCCC(C)CCCC(C)C 2230a_102516457229_100000210211 [0,2,0,0,0,0|2,0,0]=4 17052 B14R0.2 CCCCNCCC(C)CCCC(C)C 7a_106832991798_100009816328 [0,2,0,0,0,0|2,0,0]=4 17053 B14R0.2 CCCCOCCC(C)CCCC(C)C 34a_100000015991_100000210210 [0,2,0,0,0,0|2,0,0]=4 17054 B14R0.2 CCCCOCCC(C)CCCC(C)C 34a_100000210227_100009816328 [0,2,0,0,0,0|2,0,0]=4 17055 B14R0.2 CCCCOCCC(C)CCCC(C)C 7a_100000015991_100000210211 [0,2,0,0,0,0|2,0,0]=4 17056 B14R0.2 CCCCOCCC(C)CCCC(C)C 7a_100000210227_100009816328 [0,2,0,0,0,0|2,0,0]=4 17057 B14R0.2 CCCCSCCC(C)CCCC(C)C 62a_100000210211_100009816328 [0,2,0,0,0,0|2,0,0]=4 17058 B14R0.2 CCCCSCCC(C)CCCC(C)C 62a_100009816328_100000210210 [0,2,0,0,0,0|2,0,0]=4 17059 B14R0.2 CN(C)CCCC(=O)CCCCCCO 1458a_100011996774_100000695564 [0,2,0,0,0,0|1,0,1]=4 17060 B14R0.2 CN(C)CCCN(C)CCCCCCO 269982a_100000225831_100000766143 [0,2,0,0,0,0|2,0,0]=4 17061 B14R0.2 COCCCCCC(=O)CCCC(C)O 1458a_100011935119_200000718107 [0,2,0,0,0,0|1,0,1]=4 17062 B14R0.68 CC(Br)CCOCCCCCCB(O)O 34a_100009893172_100009817187 [0,2,0,0,0,0|2,0,0]=4 17063 B14R0.68 CC(C)CCCCCCCOCC(C)C 34a_200000210741_100000210624 [0,2,0,0,0,0|2,0,0]=4 17064 B14R0.68 CC(C)CCCCCCCOCC(C)C 7a_200000210741_100000210760 [0,2,0,0,0,0|2,0,0]=4 17065 B14R0.68 CC(C)CCCCCCCOCC(C)O 34a_200000210741_100011218427 [0,2,0,0,0,0|1,0,0]=3 17066 B14R0.68 CC(C)CCCCCCCOCC(C)O 7a_200000210741_100011218427 [0,2,0,0,0,0|1,0,0]=3 17067 B14R0.68 CC(C)CCCCCCCOCC(F)F 34a_200000210741_100011934356 [0,2,0,0,0,0|2,0,0]=4 17068 B14R0.68 CC(C)CCCCCCCOCC(F)F 7a_200000210741_100011934356 [0,2,0,0,0,0|2,0,0]=4 17069 B14R0.68 CC(C)CCCCCCCOC[C@@H](C)O 34a_200000210741_100009817552 [0,2,0,0,0,0|1,0,0]=3 17070 B14R0.68 CC(C)CCCCCCCOC[C@@H](C)O 7a_200000210741_100009817552 [0,2,0,0,0,0|1,0,0]=3 17071 B14R0.68 CC(C)CCCCCCNCCC(C)C 2230a_100000211014_100000210312 [0,2,0,0,0,0|2,0,0]=4 17072 B14R0.68 CC(C)CCCCCCNCCC(C)C 269862a_100000211014_100000185833 [0,2,0,0,0,0|2,0,0]=4 17073 B14R0.68 CC(C)CCCCCCNCCC(C)C 34a_100000211014_100000210312 [0,2,0,0,0,0|2,0,0]=4 17074 B14R0.68 CC(C)CCCCCCNCCC(C)O 2230a_100000211014_100012276601 [0,2,0,0,0,0|1,0,0]=3 17075 B14R0.68 CC(C)CCCCCCNCCC(C)O 34a_100000211014_100012276601 [0,2,0,0,0,0|1,0,0]=3 17076 B14R0.68 CC(C)CCCCCNCCCC(C)C 2230a_100011290863_100011214892 [0,2,0,0,0,0|2,0,0]=4 17077 B14R0.68 CC(C)CCCCCNCCCC(C)C 2230a_200000737386_100000210682 [0,2,0,0,0,0|2,0,0]=4 17078 B14R0.68 CC(C)CCCCCNCCCC(C)C 34a_100011290863_100011214892 [0,2,0,0,0,0|2,0,0]=4 17079 B14R0.68 CC(C)CCCCCNCCCC(C)C 34a_200000737386_100000210682 [0,2,0,0,0,0|2,0,0]=4 17080 B14R0.68 CC(C)CCCCCNCCCC(C)O 2230a_100011290863_200000718107 [0,2,0,0,0,0|1,0,0]=3 17081 B14R0.68 CC(C)CCCCCNCCCC(C)O 34a_100011290863_200000718107 [0,2,0,0,0,0|1,0,0]=3 17082 B14R0.68 CC(C)CCCCCOCCCC(C)C 34a_100000210774_100000210682 [0,2,0,0,0,0|2,0,0]=4 17083 B14R0.68 CC(C)CCCCCOCCCC(C)C 34a_100011995859_100011214892 [0,2,0,0,0,0|2,0,0]=4 17084 B14R0.68 CC(C)CCCCCOCCCC(C)C 7a_100000210774_100000210682 [0,2,0,0,0,0|2,0,0]=4 17085 B14R0.68 CC(C)CCCCCOCCCC(C)C 7a_100011995859_100011214892 [0,2,0,0,0,0|2,0,0]=4 17086 B14R0.68 CC(C)CCCCCOCCCC(C)O 34a_100011995859_200000718107 [0,2,0,0,0,0|1,0,0]=3 17087 B14R0.68 CC(C)CCCCCOCCCC(C)O 7a_100011995859_200000718107 [0,2,0,0,0,0|1,0,0]=3 17088 B14R0.68 CC(C)CCCCCSCCCC(C)C 62a_100000210682_100011214892 [0,2,0,0,0,0|2,0,0]=4 17089 B14R0.68 CC(C)CCCCCSCCCC(C)C 62a_100011214892_100000210682 [0,2,0,0,0,0|2,0,0]=4 17090 B14R0.68 CC(C)CCCCCSCCCC(C)O 62a_100000210682_200000718107 [0,2,0,0,0,0|1,0,0]=3 17091 B14R0.68 CC(C)CCCCCSCCCC(C)O 62a_200000718107_100000210682 [0,2,0,0,0,0|1,0,0]=3 17092 B14R0.68 CC(C)CCCCOCCCCB(O)O 34a_100011214890_200009817182 [0,2,0,0,0,0|2,0,0]=4 17093 B14R0.68 CC(C)CCCCOCCCCB(O)O 7a_100011214890_200009817182 [0,2,0,0,0,0|2,0,0]=4 17094 B14R0.68 CC(C)CCCCOCCCCC(C)C 34a_100011214890_100011216152 [0,2,0,0,0,0|2,0,0]=4 17095 B14R0.68 CC(C)CCCCOCCCCC(C)C 7a_100011214890_100011216152 [0,2,0,0,0,0|2,0,0]=4 17096 B14R0.68 CC(C)CCCCSCCCCB(O)O 62a_100011216152_200009817182 [0,2,0,0,0,0|2,0,0]=4 17097 B14R0.68 CC(C)CCCCSCCCCB(O)O 62a_200009817182_100011216152 [0,2,0,0,0,0|2,0,0]=4 17098 B14R0.68 CC(C)CCCCSCCCCC(C)C 62a_100011216152_100011216152 [0,2,0,0,0,0|2,0,0]=4 17099 B14R0.68 CC(C)CCCNCCCCCB(O)O 2230a_200000737386_200009817188 [0,2,0,0,0,0|2,0,0]=4 17100 B14R0.68 CC(C)CCCNCCCCCB(O)O 34a_200000737386_200009817188 [0,2,0,0,0,0|2,0,0]=4 17101 B14R0.68 CC(C)CCCOCCCCCB(O)O 34a_100000210774_200009817188 [0,2,0,0,0,0|2,0,0]=4 17102 B14R0.68 CC(C)CCCOCCCCCB(O)O 7a_100000210774_200009817188 [0,2,0,0,0,0|2,0,0]=4 17103 B14R0.68 CC(C)CCCSCCCCCB(O)O 62a_100011214892_200009817188 [0,2,0,0,0,0|2,0,0]=4 17104 B14R0.68 CC(C)CCCSCCCCCB(O)O 62a_200009817188_100011214892 [0,2,0,0,0,0|2,0,0]=4 17105 B14R0.68 CC(C)CCOCCCCCCB(O)O 34a_100000210254_100009817187 [0,2,0,0,0,0|2,0,0]=4 17106 B14R0.68 CC(C)CCOCCCCCCB(O)O 7a_100000210254_100009817187 [0,2,0,0,0,0|2,0,0]=4 17107 B14R0.68 CC(C)CCSCCCCCCB(O)O 62a_100000210312_100009817187 [0,2,0,0,0,0|2,0,0]=4 17108 B14R0.68 CC(C)CCSCCCCCCB(O)O 62a_100009817187_100000210312 [0,2,0,0,0,0|2,0,0]=4 17109 B14R0.68 CC(C)COCCCNCCCC(C)O 2230a_100000205972_200000718107 [0,2,0,0,0,0|2,0,0]=4 17110 B14R0.68 CC(C)COCCCNCCCC(C)O 34a_100000205972_200000718107 [0,2,0,0,0,0|2,0,0]=4 17111 B14R0.68 CC(O)CCCOCCCCNC(C)C 34a_100011521146_200000718107 [0,2,0,0,0,0|2,0,0]=4 17112 B14R0.68 CC(O)CCCSCCCCCB(O)O 62a_200000718107_200009817188 [0,2,0,0,0,0|2,0,0]=4 17113 B14R0.68 CC(O)CCCSCCCCCB(O)O 62a_200009817188_200000718107 [0,2,0,0,0,0|2,0,0]=4 17114 B14R0.68 CC(O)CCNCCCCCCB(O)O 2230a_200000755665_100009817187 [0,2,0,0,0,0|2,0,0]=4 17115 B14R0.68 CC(O)CCOCCCCCNC(C)C 34a_100011629493_100012276601 [0,2,0,0,0,0|2,0,0]=4 17116 B14R0.68 CC(O)CCSCCCCCCB(O)O 62a_100009817187_100012276601 [0,2,0,0,0,0|2,0,0]=4 17117 B14R0.68 CC(O)CCSCCCCCCB(O)O 62a_100012276601_100009817187 [0,2,0,0,0,0|2,0,0]=4 17118 B14R0.68 C[C@@H](N)CCOCCCCCCB(O)O 34a_100000706166_100009817187 [0,2,0,0,0,0|2,0,0]=4 17119 B14R0.88 CC(C)(C)CCNCCCCCCCO 2230a_100000738805_100000760002 [0,2,0,0,0,0|1,0,0]=3 17120 B14R0.88 CC(C)(C)CCNCCCCCCCO 2230a_100011996573_100000755188 [0,2,0,0,0,0|1,0,0]=3 17121 B14R0.88 CC(C)(C)CCNCCCCCCCO 34a_100011996573_100000755188 [0,2,0,0,0,0|1,0,0]=3 17122 B14R0.88 CC(C)(C)CCNCCCOCCCO 2230a_100011310245_100000755188 [0,2,0,0,0,0|2,0,0]=4 17123 B14R0.88 CC(C)(C)CCNCCCOCCCO 34a_100011310245_100000755188 [0,2,0,0,0,0|2,0,0]=4 17124 B14R0.88 CC(C)(C)CCOCCCCCCCBr 34a_100000760002_100000755188 [0,2,0,0,0,0|2,0,0]=4 17125 B14R0.88 CC(C)(C)CCOCCCCCCCBr 7a_100000760002_100000755188 [0,2,0,0,0,0|2,0,0]=4 17126 B14R0.88 CC(C)(C)CCOCCCCCCCN 34a_100011996573_100000755188 [0,2,0,0,0,0|2,0,0]=4 17127 B14R0.88 CC(C)(C)CCOCCCCCCCO 7a_100000765024_100000760002 [0,2,0,0,0,0|1,0,0]=3 17128 B14R0.88 CC(C)(C)CCSCCCCCCCO 62a_100000755188_100000760002 [0,2,0,0,0,0|1,0,0]=3 17129 B14R0.88 CC(C)(C)CCSCCCCCCCO 62a_100000760002_100000755188 [0,2,0,0,0,0|1,0,0]=3 17130 B14R0.88 CC(C)(C)CNCCCCCCCCO 2230a_100000743828_100000033203 [0,2,0,0,0,0|1,0,0]=3 17131 B14R0.88 CC(C)(C)CNCCCCCCCCO 270004a_102515433106_100011204126 [0,2,0,0,0,0|1,0,0]=3 17132 B14R0.88 CC(C)(C)CNCCCCCCCCO 34a_102515433106_100011219605 [0,2,0,0,0,0|1,0,0]=3 17133 B14R0.88 CC(C)(C)COCCCCCCCCBr 34a_100009813846_100011219605 [0,2,0,0,0,0|2,0,0]=4 17134 B14R0.88 CC(C)(C)COCCCCCCCCCl 34a_100000033203_100011219605 [0,2,0,0,0,0|2,0,0]=4 17135 B14R0.88 CC(C)(C)COCCCCCCCCN 34a_102515433106_100011219605 [0,2,0,0,0,0|2,0,0]=4 17136 B14R0.88 CC(C)(C)CSCCCCCCCCO 62a_100000033203_100011219605 [0,2,0,0,0,0|1,0,0]=3 17137 B14R0.88 CC(C)(C)CSCCCCCCCCO 62a_100011219605_100000033203 [0,2,0,0,0,0|1,0,0]=3 17138 B14R0.88 CC(C)(C)NCCCCCCCCCO 2230a_100000715429_100009813782 [0,2,0,0,0,0|1,0,0]=3 17139 B14R0.88 CC(C)(C)NCCCCCCCCCO 34a_100000078944_100000210625 [0,2,0,0,0,0|1,0,0]=3 17140 B14R0.88 CC(C)(C)OCCCCCCCCCBr 34a_100009813782_100000210625 [0,2,0,0,0,0|2,0,0]=4 17141 B14R0.88 CC(C)(C)OCCCCCCCCCCl 34a_100009868337_100000210625 [0,2,0,0,0,0|2,0,0]=4 17142 B14R0.88 CC(C)(C)OCCCCCCCCCN 34a_100000078944_100000210625 [0,2,0,0,0,0|2,0,0]=4 17143 B14R0.88 CC(C)(C)OCCCCCCCCCO 34a_100015890283_100009813782 [0,2,0,0,0,0|1,0,0]=3 17144 B14R0.88 CC(C)(C)OCCCCCCCCCO 7a_100015890283_100009813782 [0,2,0,0,0,0|1,0,0]=3 17145 B14R0.88 CC(C)(C)OCCCNCCCCCO 2230a_100011250582_100000746330 [0,2,0,0,0,0|2,0,0]=4 17146 B14R0.88 CC(C)(C)OCCNCCCCCCO 2230a_100000747557_100000766143 [0,2,0,0,0,0|2,0,0]=4 17147 B14R0.88 CC(C)(C)OCCOCCCCCCO 34a_100000693234_100000766143 [0,2,0,0,0,0|2,0,0]=4 17148 B14R0.88 CC(C)(C)OCCOCCCCCCO 7a_100000693234_100000766143 [0,2,0,0,0,0|2,0,0]=4 17149 B14R0.88 CC(C)(C)SCCCCCCCCCO 62a_100000211941_100009813782 [0,2,0,0,0,0|1,0,0]=3 17150 B14R0.88 CC(C)(C)SCCCCCCCCCO 62a_100009813782_100000211941 [0,2,0,0,0,0|1,0,0]=3 17151 B14R0.88 CC(C)(C)SCCNCCCCCCO 2230a_100000689375_100000766143 [0,2,0,0,0,0|2,0,0]=4 17152 B14R0.88 CC(C)(F)CCNCCCCCCCO 2230a_100016253952_100000760002 [0,2,0,0,0,0|1,0,0]=3 17153 B14R0.88 CC(C)(F)CNCCCCCCCCO 2230a_100020643315_100000033203 [0,2,0,0,0,0|1,0,0]=3 17154 B14R0.88 CC(C)(F)CNCCCCCCCCO 34a_102515433106_100011997219 [0,2,0,0,0,0|1,0,0]=3 17155 B14R0.88 CC(C)(F)COCCCCCCCCBr 34a_100009813846_100011997219 [0,2,0,0,0,0|2,0,0]=4 17156 B14R0.88 CC(C)(F)COCCCCCCCCCl 34a_100000033203_100011997219 [0,2,0,0,0,0|2,0,0]=4 17157 B14R0.88 CC(C)(F)COCCCCCCCCN 34a_102515433106_100011997219 [0,2,0,0,0,0|2,0,0]=4 17158 B14R0.88 CC(C)(F)COCCCCCCCCO 34a_100000716592_100000033203 [0,2,0,0,0,0|1,0,0]=3 17159 B14R0.88 CC(C)(F)CSCCCCCCCCO 62a_100000033203_100011997219 [0,2,0,0,0,0|1,0,0]=3 17160 B14R0.88 CC(C)(F)CSCCCCCCCCO 62a_100011997219_100000033203 [0,2,0,0,0,0|1,0,0]=3 17161 B14R0.88 CC(C)(O)CCCCCNCCCCO 2230a_100000750430_100010402123 [0,2,0,0,0,0|1,0,0]=3 17162 B14R0.88 CC(C)(O)CCCCCNCCCCO 34a_100000750430_100010402123 [0,2,0,0,0,0|1,0,0]=3 17163 B14R0.88 CC(C)(O)CCCCCOCCCCBr 34a_100011216708_100010402123 [0,2,0,0,0,0|2,0,0]=4 17164 B14R0.88 CC(C)(O)CCCCCOCCCCCl 34a_100000210776_100010402123 [0,2,0,0,0,0|2,0,0]=4 17165 B14R0.88 CC(C)(O)CCCCCOCCCCCl 7a_100000210776_100010402123 [0,2,0,0,0,0|2,0,0]=4 17166 B14R0.88 CC(C)(O)CCCCCOCCCCF 34a_100011995726_100010402123 [0,2,0,0,0,0|2,0,0]=4 17167 B14R0.88 CC(C)(O)CCCCCOCCCCF 7a_100011995726_100010402123 [0,2,0,0,0,0|2,0,0]=4 17168 B14R0.88 CC(C)(O)CCCCCOCCCCI 34a_200012148704_100010402123 [0,2,0,0,0,0|2,0,0]=4 17169 B14R0.88 CC(C)(O)CCCCCOCCCCN 34a_100000750430_100010402123 [0,2,0,0,0,0|2,0,0]=4 17170 B14R0.88 CC(C)(O)CCCCCSCCCCF 62a_100000729493_100010402123 [0,2,0,0,0,0|2,0,0]=4 17171 B14R0.88 CC(C)(O)CCCCCSCCCCF 62a_100010402123_100000729493 [0,2,0,0,0,0|2,0,0]=4 17172 B14R0.88 CC(C)(O)CCCCCSCCCCO 62a_100000210776_100010402123 [0,2,0,0,0,0|1,0,0]=3 17173 B14R0.88 CC(C)(O)CCCCCSCCCCO 62a_100010402123_100000210776 [0,2,0,0,0,0|1,0,0]=3 17174 B14R0.88 CC(C)(O)CCCNCCCCCCO 2230a_100000686447_100009888830 [0,2,0,0,0,0|1,0,0]=3 17175 B14R0.88 CC(C)(O)CCCNCCCCCCO 34a_100000686447_100009888830 [0,2,0,0,0,0|1,0,0]=3 17176 B14R0.88 CC(C)(O)CCCOCCCCCCBr 34a_100011215345_100009888830 [0,2,0,0,0,0|2,0,0]=4 17177 B14R0.88 CC(C)(O)CCCOCCCCCCBr 7a_100011215345_100009888830 [0,2,0,0,0,0|2,0,0]=4 17178 B14R0.88 CC(C)(O)CCCOCCCCCCCl 34a_100000766143_100009888830 [0,2,0,0,0,0|2,0,0]=4 17179 B14R0.88 CC(C)(O)CCCOCCCCCCCl 7a_100000766143_100009888830 [0,2,0,0,0,0|2,0,0]=4 17180 B14R0.88 CC(C)(O)CCCOCCCCCCF 34a_100000732779_100009888830 [0,2,0,0,0,0|2,0,0]=4 17181 B14R0.88 CC(C)(O)CCCOCCCCCCF 7a_100000732779_100009888830 [0,2,0,0,0,0|2,0,0]=4 17182 B14R0.88 CC(C)(O)CCCOCCCCCCN 34a_100000686447_100009888830 [0,2,0,0,0,0|2,0,0]=4 17183 B14R0.88 CC(C)(O)CCCSCCCCCCF 62a_100009888830_100015922095 [0,2,0,0,0,0|2,0,0]=4 17184 B14R0.88 CC(C)(O)CCCSCCCCCCF 62a_100015922095_100009888830 [0,2,0,0,0,0|2,0,0]=4 17185 B14R0.88 CC(C)(O)CCCSCCCCCCO 62a_100000766143_100009888830 [0,2,0,0,0,0|1,0,0]=3 17186 B14R0.88 CC(C)(O)CCCSCCCCCCO 62a_100009888830_100000766143 [0,2,0,0,0,0|1,0,0]=3 17187 B14R0.88 CC(C)(O)CCNCCCCCCCO 2230a_100011996573_100000702414 [0,2,0,0,0,0|1,0,0]=3 17188 B14R0.88 CC(C)(O)CCNCCCCCCCO 34a_100011996573_100000702414 [0,2,0,0,0,0|1,0,0]=3 17189 B14R0.88 CC(C)(O)CCNCCCOCCCO 2230a_100011310245_100000702414 [0,2,0,0,0,0|2,0,0]=4 17190 B14R0.88 CC(C)(O)CCNCCCOCCCO 34a_100011310245_100000702414 [0,2,0,0,0,0|2,0,0]=4 17191 B14R0.88 CC(C)(O)CCOCCCCCCCBr 34a_100000760002_100000702414 [0,2,0,0,0,0|2,0,0]=4 17192 B14R0.88 CC(C)(O)CCOCCCCCCCBr 7a_100000760002_100000702414 [0,2,0,0,0,0|2,0,0]=4 17193 B14R0.88 CC(C)(O)CCOCCCCCCCN 34a_100011996573_100000702414 [0,2,0,0,0,0|2,0,0]=4 17194 B14R0.88 CC(C)(O)CCSCCCCCCCO 62a_100000702414_100000760002 [0,2,0,0,0,0|1,0,0]=3 17195 B14R0.88 CC(C)(O)CCSCCCCCCCO 62a_100000760002_100000702414 [0,2,0,0,0,0|1,0,0]=3 17196 B14R0.88 CC(C)(O)CNCCCCCCCCO 2230a_100000751335_100000033203 [0,2,0,0,0,0|1,0,0]=3 17197 B14R0.88 CC(C)(O)CNCCCCCCCCO 34a_102515433106_100000764493 [0,2,0,0,0,0|1,0,0]=3 17198 B14R0.88 CC(C)(O)COCCCCCCCCBr 34a_100009813846_100000764493 [0,2,0,0,0,0|2,0,0]=4 17199 B14R0.88 CC(C)(O)COCCCCCCCCBr 7a_100009813846_100000764493 [0,2,0,0,0,0|2,0,0]=4 17200 B14R0.88 CC(C)(O)COCCCCCCCCCl 34a_100000033203_100000764493 [0,2,0,0,0,0|2,0,0]=4 17201 B14R0.88 CC(C)(O)COCCCCCCCCCl 7a_100000033203_100000764493 [0,2,0,0,0,0|2,0,0]=4 17202 B14R0.88 CC(C)(O)COCCCCCCCCN 34a_102515433106_100000764493 [0,2,0,0,0,0|2,0,0]=4 17203 B14R0.88 CC(C)(O)CSCCCCCCCCO 62a_100000033203_100000764493 [0,2,0,0,0,0|1,0,0]=3 17204 B14R0.88 CC(C)(O)CSCCCCCCCCO 62a_100000764493_100000033203 [0,2,0,0,0,0|1,0,0]=3 17205 B14R0.88 CC(F)(F)COCCCCCCCCO 34a_100000068830_100000033203 [0,2,0,0,0,0|1,0,0]=3 17206 B14R0.88 CCCCCCCCCCNC(C)(C)C 2230a_100000715429_100000210320 [0,2,0,0,0,0|2,0,0]=4 17207 B14R0.88 CCCCCCCCCCNC(C)(C)C 34a_100000684558_100000210625 [0,2,0,0,0,0|2,0,0]=4 17208 B14R0.88 CCCCCCCCCCNC(F)(F)F 34a_100000684558_200103152311 [0,2,0,0,0,0|2,0,0]=4 17209 B14R0.88 CCCCCCCCCCOC(C)(C)C 34a_100000210711_100000210625 [0,2,0,0,0,0|2,0,0]=4 17210 B14R0.88 CCCCCCCCCCOC(C)(C)C 34a_100015890283_100000210320 [0,2,0,0,0,0|2,0,0]=4 17211 B14R0.88 CCCCCCCCCCOC(C)(C)C 7a_100015890283_100000210320 [0,2,0,0,0,0|2,0,0]=4 17212 B14R0.88 CCCCCCCCCCOC(F)(F)F 34a_100000210711_200103152311 [0,2,0,0,0,0|2,0,0]=4 17213 B14R0.88 CCCCCCCCCCOC(F)(F)F 7a_100000210711_200000243211 [0,2,0,0,0,0|2,0,0]=4 17214 B14R0.88 CCCCCCCCCCSC(C)(C)C 62a_100000211941_100000210320 [0,2,0,0,0,0|2,0,0]=4 17215 B14R0.88 CCCCCCCCCCSC(F)(F)F 62a_200000243211_100000210320 [0,2,0,0,0,0|2,0,0]=4 17216 B14R0.88 CCCCCCCCCNCC(C)(C)C 2230a_100000743828_100011214924 [0,2,0,0,0,0|2,0,0]=4 17217 B14R0.88 CCCCCCCCCNCC(C)(C)C 270004a_100000212291_100011204126 [0,2,0,0,0,0|2,0,0]=4 17218 B14R0.88 CCCCCCCCCNCC(C)(C)C 34a_100000212291_100011219605 [0,2,0,0,0,0|2,0,0]=4 17219 B14R0.88 CCCCCCCCCNCC(C)(C)F 2230a_100020643315_100011214924 [0,2,0,0,0,0|2,0,0]=4 17220 B14R0.88 CCCCCCCCCNCC(C)(C)F 34a_100000212291_100011997219 [0,2,0,0,0,0|2,0,0]=4 17221 B14R0.88 CCCCCCCCCNCC(C)(C)O 2230a_100000751335_100011214924 [0,2,0,0,0,0|1,0,0]=3 17222 B14R0.88 CCCCCCCCCNCC(C)(C)O 34a_100000212291_100000764493 [0,2,0,0,0,0|1,0,0]=3 17223 B14R0.88 CCCCCCCCCNCC(F)(F)F 2230a_100000212291_100000763148 [0,2,0,0,0,0|2,0,0]=4 17224 B14R0.88 CCCCCCCCCNCC(F)(F)F 34a_100000717047_100011214924 [0,2,0,0,0,0|2,0,0]=4 17225 B14R0.88 CCCCCCCCCOCC(C)(C)C 34a_100000210712_100011219605 [0,2,0,0,0,0|2,0,0]=4 17226 B14R0.88 CCCCCCCCCOCC(C)(C)F 34a_100000210712_100011997219 [0,2,0,0,0,0|2,0,0]=4 17227 B14R0.88 CCCCCCCCCOCC(C)(C)F 34a_100000716592_100011214924 [0,2,0,0,0,0|2,0,0]=4 17228 B14R0.88 CCCCCCCCCOCC(C)(C)O 34a_100000210712_100000764493 [0,2,0,0,0,0|1,0,0]=3 17229 B14R0.88 CCCCCCCCCOCC(C)(C)O 7a_100000210712_100000764493 [0,2,0,0,0,0|1,0,0]=3 17230 B14R0.88 CCCCCCCCCOCC(C)(F)F 34a_100000068830_100011214924 [0,2,0,0,0,0|2,0,0]=4 17231 B14R0.88 CCCCCCCCCOCC(F)(F)Br 34a_100011217949_100011214924 [0,2,0,0,0,0|2,0,0]=4 17232 B14R0.88 CCCCCCCCCOCC(F)(F)Cl 34a_100000734434_100011214924 [0,2,0,0,0,0|2,0,0]=4 17233 B14R0.88 CCCCCCCCCOCC(F)(F)F 34a_100000210435_100011214924 [0,2,0,0,0,0|2,0,0]=4 17234 B14R0.88 CCCCCCCCCSCC(C)(C)C 62a_100011219605_100000210670 [0,2,0,0,0,0|2,0,0]=4 17235 B14R0.88 CCCCCCCCCSCC(C)(C)F 62a_100011997219_100000210670 [0,2,0,0,0,0|2,0,0]=4 17236 B14R0.88 CCCCCCCCCSCC(C)(C)O 62a_100000764493_100000210670 [0,2,0,0,0,0|1,0,0]=3 17237 B14R0.88 CCCCCCCCCSCC(F)(F)F 62a_100000763148_100000210670 [0,2,0,0,0,0|2,0,0]=4 17238 B14R0.88 CCCCCCCCNCCC(C)(C)C 2230a_100000229939_100000755188 [0,2,0,0,0,0|2,0,0]=4 17239 B14R0.88 CCCCCCCCNCCC(C)(C)C 2230a_100000738805_100000210759 [0,2,0,0,0,0|2,0,0]=4 17240 B14R0.88 CCCCCCCCNCCC(C)(C)C 34a_100000229939_100000755188 [0,2,0,0,0,0|2,0,0]=4 17241 B14R0.88 CCCCCCCCNCCC(C)(C)F 2230a_100016253952_100000210759 [0,2,0,0,0,0|2,0,0]=4 17242 B14R0.88 CCCCCCCCNCCC(C)(C)O 2230a_100000229939_100000702414 [0,2,0,0,0,0|1,0,0]=3 17243 B14R0.88 CCCCCCCCNCCC(C)(C)O 34a_100000229939_100000702414 [0,2,0,0,0,0|1,0,0]=3 17244 B14R0.88 CCCCCCCCNCCC(F)(F)F 2230a_100000740434_100000210759 [0,2,0,0,0,0|2,0,0]=4 17245 B14R0.88 CCCCCCCCNCCC(F)(F)F 34a_100000229939_100011219754 [0,2,0,0,0,0|2,0,0]=4 17246 B14R0.88 CCCCCCCCNCCC(F)(F)F 34a_100000740434_100000210759 [0,2,0,0,0,0|2,0,0]=4 17247 B14R0.88 CCCCCCCCOCCC(C)(C)C 34a_100000210232_100000755188 [0,2,0,0,0,0|2,0,0]=4 17248 B14R0.88 CCCCCCCCOCCC(C)(C)C 7a_100000210232_100000755188 [0,2,0,0,0,0|2,0,0]=4 17249 B14R0.88 CCCCCCCCOCCC(C)(C)C 7a_100000765024_100000210759 [0,2,0,0,0,0|2,0,0]=4 17250 B14R0.88 CCCCCCCCOCCC(C)(C)O 34a_100000210232_100000702414 [0,2,0,0,0,0|1,0,0]=3 17251 B14R0.88 CCCCCCCCOCCC(C)(C)O 7a_100000210232_100000702414 [0,2,0,0,0,0|1,0,0]=3 17252 B14R0.88 CCCCCCCCOCCC(F)(F)F 34a_100000210232_100011219754 [0,2,0,0,0,0|2,0,0]=4 17253 B14R0.88 CCCCCCCCOCCC(F)(F)F 34a_100000752437_100000210759 [0,2,0,0,0,0|2,0,0]=4 17254 B14R0.88 CCCCCCCCOCCC(F)(F)F 7a_100000210232_100011219754 [0,2,0,0,0,0|2,0,0]=4 17255 B14R0.88 CCCCCCCCSCCC(C)(C)C 62a_100000210759_100000755188 [0,2,0,0,0,0|2,0,0]=4 17256 B14R0.88 CCCCCCCCSCCC(C)(C)C 62a_100000755188_100000210317 [0,2,0,0,0,0|2,0,0]=4 17257 B14R0.88 CCCCCCCCSCCC(C)(C)O 62a_100000210759_100000702414 [0,2,0,0,0,0|1,0,0]=3 17258 B14R0.88 CCCCCCCCSCCC(C)(C)O 62a_100000702414_100000210317 [0,2,0,0,0,0|1,0,0]=3 17259 B14R0.88 CCCCCCCCSCCC(F)(F)F 62a_100000210759_100011219754 [0,2,0,0,0,0|2,0,0]=4 17260 B14R0.88 CCCCCCCCSCCC(F)(F)F 62a_100011219754_100000210317 [0,2,0,0,0,0|2,0,0]=4 17261 B14R0.88 CCCCCCCNCCCC(C)(C)O 2230a_100000229938_100009888830 [0,2,0,0,0,0|1,0,0]=3 17262 B14R0.88 CCCCCCCNCCCC(F)(F)F 2230a_100000229938_100011215983 [0,2,0,0,0,0|2,0,0]=4 17263 B14R0.88 CCCCCCCNCCCC(F)(F)F 2230a_100000727188_100000210681 [0,2,0,0,0,0|2,0,0]=4 17264 B14R0.88 CCCCCCCNCCCC(F)(F)F 34a_100000727188_100000210614 [0,2,0,0,0,0|2,0,0]=4 17265 B14R0.88 CCCCCCCOCCCC(C)(C)O 34a_100000210272_100009888830 [0,2,0,0,0,0|1,0,0]=3 17266 B14R0.88 CCCCCCCOCCCC(C)(C)O 7a_100000210272_100009888830 [0,2,0,0,0,0|1,0,0]=3 17267 B14R0.88 CCCCCCCOCCCC(F)(F)F 34a_100000210272_100011215983 [0,2,0,0,0,0|2,0,0]=4 17268 B14R0.88 CCCCCCCOCCCC(F)(F)F 34a_100000749235_100000210614 [0,2,0,0,0,0|2,0,0]=4 17269 B14R0.88 CCCCCCCOCCCC(F)(F)F 7a_100000210272_100011216173 [0,2,0,0,0,0|2,0,0]=4 17270 B14R0.88 CCCCCCCSCCCC(C)(C)O 62a_100000210614_100009888830 [0,2,0,0,0,0|1,0,0]=3 17271 B14R0.88 CCCCCCCSCCCC(C)(C)O 62a_100009888830_100000210316 [0,2,0,0,0,0|1,0,0]=3 17272 B14R0.88 CCCCCCCSCCCC(F)(F)F 62a_100000210614_100011216173 [0,2,0,0,0,0|2,0,0]=4 17273 B14R0.88 CCCCCCCSCCCC(F)(F)F 62a_100011216173_100000210316 [0,2,0,0,0,0|2,0,0]=4 17274 B14R0.88 CCCCCCNCCCCC(F)(F)F 2230a_100000210581_100000692467 [0,2,0,0,0,0|2,0,0]=4 17275 B14R0.88 CCCCCCOCCCCC(F)(F)F 34a_100000210259_100000692467 [0,2,0,0,0,0|2,0,0]=4 17276 B14R0.88 CCCCCCOCCCCC(F)(F)F 34a_100000749236_100000210314 [0,2,0,0,0,0|2,0,0]=4 17277 B14R0.88 CCCCCCOCCCCC(F)(F)F 7a_100000210259_100000692467 [0,2,0,0,0,0|2,0,0]=4 17278 B14R0.88 CCCCCCOCCCCC(F)(F)F 7a_100000749236_100000210314 [0,2,0,0,0,0|2,0,0]=4 17279 B14R0.88 CCCCCCOCCOCC(C)(C)O 34a_100000691444_100000764493 [0,2,0,0,0,0|2,0,0]=4 17280 B14R0.88 CCCCCCOCCOCC(C)(C)O 7a_100000691444_100000764493 [0,2,0,0,0,0|2,0,0]=4 17281 B14R0.88 CCCCCCSCCCCC(F)(F)F 62a_100000210314_100000692467 [0,2,0,0,0,0|2,0,0]=4 17282 B14R0.88 CCCCCCSCCCCC(F)(F)F 62a_100000692467_100000210757 [0,2,0,0,0,0|2,0,0]=4 17283 B14R0.88 CCCCCNCCCCCC(C)(C)O 2230a_100000209983_100010402123 [0,2,0,0,0,0|1,0,0]=3 17284 B14R0.88 CCCCCNCCCCCC(F)(F)F 2230a_100000209983_100010187589 [0,2,0,0,0,0|2,0,0]=4 17285 B14R0.88 CCCCCNCCOCCC(C)(C)O 34a_100000224656_100000702414 [0,2,0,0,0,0|2,0,0]=4 17286 B14R0.88 CCCCCOCCCCCC(C)(C)O 34a_100000210253_100010402123 [0,2,0,0,0,0|1,0,0]=3 17287 B14R0.88 CCCCCOCCCCCC(C)(C)O 7a_100000210253_100010402123 [0,2,0,0,0,0|1,0,0]=3 17288 B14R0.88 CCCCCOCCCCCC(F)(F)F 34a_100000210253_100010187589 [0,2,0,0,0,0|2,0,0]=4 17289 B14R0.88 CCCCCOCCCCCC(F)(F)F 7a_100000210253_100010187589 [0,2,0,0,0,0|2,0,0]=4 17290 B14R0.88 CCCCCOCCOCCC(C)(C)O 34a_100011215259_100000702414 [0,2,0,0,0,0|2,0,0]=4 17291 B14R0.88 CCCCCOCCOCCC(C)(C)O 7a_100011215259_100000702414 [0,2,0,0,0,0|2,0,0]=4 17292 B14R0.88 CCCCCSCCCCCC(C)(C)O 62a_100000210326_100010402123 [0,2,0,0,0,0|1,0,0]=3 17293 B14R0.88 CCCCCSCCCCCC(C)(C)O 62a_100010402123_100000210326 [0,2,0,0,0,0|1,0,0]=3 17294 B14R0.88 CCCCCSCCCCCC(F)(F)F 62a_100000210326_100010187589 [0,2,0,0,0,0|2,0,0]=4 17295 B14R0.88 CCCCCSCCCCCC(F)(F)F 62a_100010187589_100000210326 [0,2,0,0,0,0|2,0,0]=4 17296 B14R0.88 CCCCNCCCCOCC(C)(C)O 34a_200011216965_100000764493 [0,2,0,0,0,0|2,0,0]=4 17297 B14R0.88 CCCCOCCCCOCC(C)(C)O 34a_200000760531_100000764493 [0,2,0,0,0,0|2,0,0]=4 17298 B14R0.88 CCCCOCCCCOCC(C)(C)O 7a_200000760531_100000764493 [0,2,0,0,0,0|2,0,0]=4 17299 B14R0.88 CCCCOCCCNCCC(C)(C)O 2230a_200000211371_100000702414 [0,2,0,0,0,0|2,0,0]=4 17300 B14R0.88 CCCCOCCCNCCC(C)(C)O 34a_200000211371_100000702414 [0,2,0,0,0,0|2,0,0]=4 17301 B14R0.88 CCCCOCCCOCCC(C)(C)O 34a_200011215613_100000702414 [0,2,0,0,0,0|2,0,0]=4 17302 B14R0.88 CCCCOCCCOCCC(C)(C)O 7a_200011215613_100000702414 [0,2,0,0,0,0|2,0,0]=4 17303 B14R0.88 CCCCOCCOCCCC(C)(C)O 34a_100000210238_100009888830 [0,2,0,0,0,0|2,0,0]=4 17304 B14R0.88 CCCCOCCOCCCC(C)(C)O 7a_100000210238_100009888830 [0,2,0,0,0,0|2,0,0]=4 17305 B14R0.88 CCCCOCCSCCCC(C)(C)O 62a_100000743108_100009888830 [0,2,0,0,0,0|2,0,0]=4 17306 B14R0.88 CCCCOCCSCCCC(C)(C)O 62a_100009888830_100000743108 [0,2,0,0,0,0|2,0,0]=4 17307 B14R0.88 CCCCSCCNCCCC(C)(C)O 2230a_100025743550_100009888830 [0,2,0,0,0,0|2,0,0]=4 17308 B14R0.88 CCCCSCCOCCCC(C)(C)O 34a_200000230436_100009888830 [0,2,0,0,0,0|2,0,0]=4 17309 B14R0.88 CCCCSCCOCCCC(C)(C)O 7a_200000230436_100009888830 [0,2,0,0,0,0|2,0,0]=4 17310 B14R0.88 CCCOCCCNCCCC(C)(C)O 2230a_100011217757_100009888830 [0,2,0,0,0,0|2,0,0]=4 17311 B14R0.88 CCCOCCCNCCCC(C)(C)O 34a_100011217757_100009888830 [0,2,0,0,0,0|2,0,0]=4 17312 B14R0.88 CCOCCNCCCCCC(C)(C)O 2230a_102516460346_100010402123 [0,2,0,0,0,0|2,0,0]=4 17313 B14R0.88 CCOCCNCCCCCC(C)(C)O 34a_102516460346_100010402123 [0,2,0,0,0,0|2,0,0]=4 17314 B14R0.88 CCOCCOCCCCCC(C)(C)O 34a_100000210136_100010402123 [0,2,0,0,0,0|2,0,0]=4 17315 B14R0.88 CCOCCOCCCCCC(C)(C)O 7a_100000210136_100010402123 [0,2,0,0,0,0|2,0,0]=4 17316 B14R0.88 CCOCCSCCCCCC(C)(C)O 62a_100000210147_100010402123 [0,2,0,0,0,0|2,0,0]=4 17317 B14R0.88 CCOCCSCCCCCC(C)(C)O 62a_100010402123_100011215890 [0,2,0,0,0,0|2,0,0]=4 17318 B14R0.88 CCSCCNCCCCCC(C)(C)O 2230a_100000106463_100010402123 [0,2,0,0,0,0|2,0,0]=4 17319 B14R0.88 CCSCCOCCCCCC(C)(C)O 34a_100000212035_100010402123 [0,2,0,0,0,0|2,0,0]=4 17320 B14R0.88 CCSCCOCCCCCC(C)(C)O 7a_100000212035_100010402123 [0,2,0,0,0,0|2,0,0]=4 17321 B14R0.88 CCSCCSCCCCCC(C)(C)O 62a_100000757381_100010402123 [0,2,0,0,0,0|2,0,0]=4 17322 B14R0.88 CCSCCSCCCCCC(C)(C)O 62a_100010402123_100000757381 [0,2,0,0,0,0|2,0,0]=4 17323 B14R0.88 CNCCCCCCCCCC(F)(F)F 2230a_106832991635_200041927475 [0,2,0,0,0,0|2,0,0]=4 17324 B14R0.88 CNCCCCCCCCCC(F)(F)F 34a_100102657272_200041927475 [0,2,0,0,0,0|2,0,0]=4 17325 B14R0.88 CNCCCCCCCCCC(F)(F)F 7a_106832991635_200041927475 [0,2,0,0,0,0|2,0,0]=4 17326 B14R0.88 CNCCCCCOCCCC(C)(C)O 34a_100000722520_100009888830 [0,2,0,0,0,0|2,0,0]=4 17327 B14R0.88 CNCCCOCCCCCC(C)(C)O 34a_100000213112_100010402123 [0,2,0,0,0,0|2,0,0]=4 17328 B14R0.88 COCCCCCCCCCC(F)(F)F 34a_100138415774_200041927475 [0,2,0,0,0,0|2,0,0]=4 17329 B14R0.88 COCCCCCCOCCC(C)(C)O 34a_200012092642_100000702414 [0,2,0,0,0,0|2,0,0]=4 17330 B14R0.88 COCCCCCCOCCC(C)(C)O 7a_200012092642_100000702414 [0,2,0,0,0,0|2,0,0]=4 17331 B14R0.88 COCCCCCCSCCC(C)(C)O 62a_100000702414_100011998445 [0,2,0,0,0,0|2,0,0]=4 17332 B14R0.88 COCCCCCCSCCC(C)(C)O 62a_100011998445_100000702414 [0,2,0,0,0,0|2,0,0]=4 17333 B14R0.88 COCCCCCNCCCC(C)(C)O 2230a_100000747528_100009888830 [0,2,0,0,0,0|2,0,0]=4 17334 B14R0.88 COCCCCCNCCCC(C)(C)O 34a_100000747528_100009888830 [0,2,0,0,0,0|2,0,0]=4 17335 B14R0.88 COCCCNCCCCCC(C)(C)O 34a_100150723488_100010402123 [0,2,0,0,0,0|2,0,0]=4 17336 B14R0.88 COCCCOCCCCCC(C)(C)O 34a_100000740835_100010402123 [0,2,0,0,0,0|2,0,0]=4 17337 B14R0.88 COCCCSCCCCCC(C)(C)O 62a_100000709357_100010402123 [0,2,0,0,0,0|2,0,0]=4 17338 B14R0.88 COCCCSCCCCCC(C)(C)O 62a_100010402123_100000709357 [0,2,0,0,0,0|2,0,0]=4 17339 B14R0.88 CS(=O)(=O)CCCNCCCCCCO 2230a_100000686447_100000754308 [0,2,0,0,0,0|2,0,0]=4 17340 B14R0.88 CS(=O)(=O)CCCNCCCCCCO 2230a_100000742409_100000766143 [0,2,0,0,0,0|2,0,0]=4 17341 B14R0.88 CS(=O)(=O)CCCNCCCCCCO 34a_100000686447_100000754308 [0,2,0,0,0,0|2,0,0]=4 17342 B14R0.88 CS(=O)(=O)CCCNCCCCCCO 34a_100000742409_100000766143 [0,2,0,0,0,0|2,0,0]=4 17343 B14R0.88 CS(=O)(=O)CCCOCCCCCCO 34a_100000689940_100000766143 [0,2,0,0,0,0|2,0,0]=4 17344 B14R0.88 CS(=O)(=O)CCCOCCCCCCO 7a_100000689940_100000766143 [0,2,0,0,0,0|2,0,0]=4 17345 B14R0.88 CS(=O)(=O)CCCSCCCCCCO 62a_100000754308_100000766143 [0,2,0,0,0,0|2,0,0]=4 17346 B14R0.88 CS(=O)(=O)CCCSCCCCCCO 62a_100000766143_100000754308 [0,2,0,0,0,0|2,0,0]=4 17347 B14R0.88 CS(=O)(=O)CCNCCCCCCCO 2230a_100000740961_100000760002 [0,2,0,0,0,0|2,0,0]=4 17348 B14R0.88 CS(=O)(=O)CCNCCCCCCCO 2230a_100011996573_100000731031 [0,2,0,0,0,0|2,0,0]=4 17349 B14R0.88 CS(=O)(=O)CCNCCCCCCCO 34a_100000740961_100000760002 [0,2,0,0,0,0|2,0,0]=4 17350 B14R0.88 CS(=O)(=O)CCNCCCCCCCO 34a_100011996573_100000731031 [0,2,0,0,0,0|2,0,0]=4 17351 B14R0.88 CS(=O)(=O)CCOCCCCCCCO 34a_100000211924_100000760002 [0,2,0,0,0,0|2,0,0]=4 17352 B14R0.88 CS(=O)(=O)CCOCCCCCCCO 7a_100000211924_100000760002 [0,2,0,0,0,0|2,0,0]=4 17353 B14R0.88 CS(=O)(=O)CCSCCCCCCCO 62a_100000731031_100000760002 [0,2,0,0,0,0|2,0,0]=4 17354 B14R0.88 CS(=O)(=O)CCSCCCCCCCO 62a_100000760002_100000230027 [0,2,0,0,0,0|2,0,0]=4 17355 B14R0.88 CS(=O)(=O)NCCCCCCCCCO 40a_100000078944_100000738038 [0,2,0,0,0,0|2,0,0]=4 17356 B14R0.88 CSCCCCCCCCCC(F)(F)F 62a_200000210301_200041927475 [0,2,0,0,0,0|2,0,0]=4 17357 B14R0.88 CSCCCCCCCCCC(F)(F)F 62a_200041927475_200000210301 [0,2,0,0,0,0|2,0,0]=4 17358 B14R0.88 CSCCCNCCCCCC(C)(C)O 2230a_100000749238_100010402123 [0,2,0,0,0,0|2,0,0]=4 17359 B14R0.88 CSCCCOCCCCCC(C)(C)O 34a_100000690336_100010402123 [0,2,0,0,0,0|2,0,0]=4 17360 B14R0.88 CSCCCOCCCCCC(C)(C)O 7a_100000690336_100010402123 [0,2,0,0,0,0|2,0,0]=4 17361 B14R0.88 C[N+](C)(C)CCCCCCSCCCO 62a_100009996864_100011215043 [0,2,0,0,0,0|2,0,0]=4 17362 B14R0.88 C[N+](C)(C)CCCCCCSCCCO 62a_100011215043_100009996864 [0,2,0,0,0,0|2,0,0]=4 17363 B14R0.88 C[N+](C)(C)CCCCCNCCCCO 2230a_100000750430_100009813293 [0,2,0,0,0,0|2,0,0]=4 17364 B14R0.88 C[N+](C)(C)CCCCCNCCCCO 34a_100000750430_100009813293 [0,2,0,0,0,0|2,0,0]=4 17365 B14R0.88 C[N+](C)(C)CCCCCSCCCCO 62a_100000210776_100009813293 [0,2,0,0,0,0|2,0,0]=4 17366 B14R0.88 C[N+](C)(C)CCCCCSCCCCO 62a_100009813293_100000210776 [0,2,0,0,0,0|2,0,0]=4 17367 B14R0.88 C[N+](C)(C)CCCNCCCCCCO 2230a_100000686447_100016990835 [0,2,0,0,0,0|2,0,0]=4 17368 B14R0.88 C[N+](C)(C)CCCNCCCCCCO 34a_100000686447_100016990835 [0,2,0,0,0,0|2,0,0]=4 17369 B14R0.88 C[N+](C)(C)CCCSCCCCCCO 62a_100000766143_100016990835 [0,2,0,0,0,0|2,0,0]=4 17370 B14R0.88 C[N+](C)(C)CCCSCCCCCCO 62a_100016990835_100000766143 [0,2,0,0,0,0|2,0,0]=4 17371 B14R0.88 C[N+](C)(C)CCNCCCCCCCO 34a_100011996573_100000085578 [0,2,0,0,0,0|2,0,0]=4 17372 B14R0.88 C[N+](C)(C)CCOCCCCCCCO 7a_200020618287_100000760002 [0,2,0,0,0,0|2,0,0]=4 17373 B14R0.88 C[N+](C)(C)CCSCCCCCCCO 62a_100000085578_100000760002 [0,2,0,0,0,0|2,0,0]=4 17374 B14R0.88 C[N+](C)(C)CCSCCCCCCCO 62a_100000760002_100000085578 [0,2,0,0,0,0|2,0,0]=4 17375 B14R0.88 C[N+](C)(C)CSCCCCCCCCO 62a_100000033203_200000036245 [0,2,0,0,0,0|2,0,0]=4 17376 B14R0.88 C[N+](C)(C)CSCCCCCCCCO 62a_200000036245_100000033203 [0,2,0,0,0,0|2,0,0]=4 17377 B14R0.88 C[Si](C)(C)CCCCOCCCCCO 7a_200009881916_100000746330 [0,2,0,0,0,0|1,1,0]=4 17378 B14R0.88 C[Si](C)(C)CCCNCCCCCCO 2230a_100000686447_100011219597 [0,2,0,0,0,0|1,1,0]=4 17379 B14R0.88 C[Si](C)(C)CCCNCCCCCCO 34a_100000686447_100011219597 [0,2,0,0,0,0|1,1,0]=4 17380 B14R0.88 C[Si](C)(C)CCCOCCCCCCO 7a_200011215415_100000766143 [0,2,0,0,0,0|1,1,0]=4 17381 B14R0.88 C[Si](C)(C)CCCSCCCCCCO 62a_100000766143_100011219597 [0,2,0,0,0,0|1,1,0]=4 17382 B14R0.88 C[Si](C)(C)CCCSCCCCCCO 62a_100011219597_100000766143 [0,2,0,0,0,0|1,1,0]=4 17383 B14R0.88 C[Si](C)(C)CCNCCCCCCCO 2230a_100011996573_200000733723 [0,2,0,0,0,0|1,1,0]=4 17384 B14R0.88 C[Si](C)(C)CCNCCCCCCCO 34a_100011996573_200000733723 [0,2,0,0,0,0|1,1,0]=4 17385 B14R0.88 C[Si](C)(C)CCOCCCCCCCO 7a_100000039746_100000760002 [0,2,0,0,0,0|1,1,0]=4 17386 B14R0.88 C[Si](C)(C)CCSCCCCCCCO 62a_100000760002_200000733723 [0,2,0,0,0,0|1,1,0]=4 17387 B14R0.88 C[Si](C)(C)CCSCCCCCCCO 62a_200000733723_100000760002 [0,2,0,0,0,0|1,1,0]=4 17388 B14R0.88 C[Si](C)(C)CNCCCCCCCCO 2230a_102515433106_100000037933 [0,2,0,0,0,0|1,1,0]=4 17389 B14R0.88 C[Si](C)(C)CSCCCCCCCCO 62a_100000033203_100000037933 [0,2,0,0,0,0|1,1,0]=4 17390 B14R0.88 C[Si](C)(C)CSCCCCCCCCO 62a_100000037933_100000033203 [0,2,0,0,0,0|1,1,0]=4 17391 B14R0.88 OCCCCCCCCCNC(F)(F)F 34a_100000078944_200103152311 [0,2,0,0,0,0|2,0,0]=4 17392 B14R0.88 OCCCCCCCCCSC(F)(F)F 62a_100009813782_200103152311 [0,2,0,0,0,0|2,0,0]=4 17393 B14R0.88 OCCCCCCCCCSC(F)(F)F 62a_200000243211_100009813782 [0,2,0,0,0,0|2,0,0]=4 17394 B14R0.88 OCCCCCCCCNCC(F)(F)F 2230a_102515433106_100000763148 [0,2,0,0,0,0|2,0,0]=4 17395 B14R0.88 OCCCCCCCCNCC(F)(F)F 34a_100000717047_100000033203 [0,2,0,0,0,0|2,0,0]=4 17396 B14R0.88 OCCCCCCCCOCC(F)(F)Br 34a_100011217949_100000033203 [0,2,0,0,0,0|2,0,0]=4 17397 B14R0.88 OCCCCCCCCOCC(F)(F)Cl 34a_100000734434_100000033203 [0,2,0,0,0,0|2,0,0]=4 17398 B14R0.88 OCCCCCCCCOCC(F)(F)F 34a_100000210435_100000033203 [0,2,0,0,0,0|2,0,0]=4 17399 B14R0.88 OCCCCCCCCSCC(F)(F)F 62a_100000033203_100000763148 [0,2,0,0,0,0|2,0,0]=4 17400 B14R0.88 OCCCCCCCCSCC(F)(F)F 62a_100000763148_100000033203 [0,2,0,0,0,0|2,0,0]=4 17401 B14R0.88 OCCCCCCCNCCC(F)(F)F 2230a_100000740434_100000760002 [0,2,0,0,0,0|2,0,0]=4 17402 B14R0.88 OCCCCCCCNCCC(F)(F)F 34a_100000740434_100000760002 [0,2,0,0,0,0|2,0,0]=4 17403 B14R0.88 OCCCCCCCNCCC(F)(F)F 34a_100011996573_100011219754 [0,2,0,0,0,0|2,0,0]=4 17404 B14R0.88 OCCCCCCCOCCC(F)(F)F 34a_100000752437_100000760002 [0,2,0,0,0,0|2,0,0]=4 17405 B14R0.88 OCCCCCCCSCCC(F)(F)F 62a_100000760002_100011219754 [0,2,0,0,0,0|2,0,0]=4 17406 B14R0.88 OCCCCCCCSCCC(F)(F)F 62a_100011219754_100000760002 [0,2,0,0,0,0|2,0,0]=4 17407 B14R0.88 OCCCCCCNCCCC(F)(F)F 2230a_100000686447_100011215983 [0,2,0,0,0,0|2,0,0]=4 17408 B14R0.88 OCCCCCCNCCCC(F)(F)F 2230a_100000727188_100000766143 [0,2,0,0,0,0|2,0,0]=4 17409 B14R0.88 OCCCCCCNCCCC(F)(F)F 34a_100000686447_100011215983 [0,2,0,0,0,0|2,0,0]=4 17410 B14R0.88 OCCCCCCNCCCC(F)(F)F 34a_100000727188_100000766143 [0,2,0,0,0,0|2,0,0]=4 17411 B14R0.88 OCCCCCCOCCCC(F)(F)F 34a_100000749235_100000766143 [0,2,0,0,0,0|2,0,0]=4 17412 B14R0.88 OCCCCCCSCCCC(F)(F)F 62a_100000766143_100011216173 [0,2,0,0,0,0|2,0,0]=4 17413 B14R0.88 OCCCCCCSCCCC(F)(F)F 62a_100011216173_100000766143 [0,2,0,0,0,0|2,0,0]=4 17414 B14R0.88 OCCCCCNCCCCC(F)(F)F 2230a_100000762737_100000692467 [0,2,0,0,0,0|2,0,0]=4 17415 B14R0.88 OCCCCCNCCCCC(F)(F)F 34a_100000762737_100000692467 [0,2,0,0,0,0|2,0,0]=4 17416 B14R0.88 OCCCCCOCCCCC(F)(F)F 34a_100000749236_100000746330 [0,2,0,0,0,0|2,0,0]=4 17417 B14R0.88 OCCCCCOCCCCC(F)(F)F 7a_100000749236_100000746330 [0,2,0,0,0,0|2,0,0]=4 17418 B14R0.88 OCCCCCSCCCCC(F)(F)F 62a_100000692467_100000746330 [0,2,0,0,0,0|2,0,0]=4 17419 B14R0.88 OCCCCCSCCCCC(F)(F)F 62a_100000746330_100000692467 [0,2,0,0,0,0|2,0,0]=4 17420 B14R0.88 OCCCCNCCCCCC(F)(F)F 2230a_100000750430_100010187589 [0,2,0,0,0,0|2,0,0]=4 17421 B14R0.88 OCCCCNCCCCCC(F)(F)F 34a_100000750430_100010187589 [0,2,0,0,0,0|2,0,0]=4 17422 B14R0.88 OCCCCSCCCCCC(F)(F)F 62a_100000210776_100010187589 [0,2,0,0,0,0|2,0,0]=4 17423 B14R0.88 OCCCCSCCCCCC(F)(F)F 62a_100010187589_100000210776 [0,2,0,0,0,0|2,0,0]=4 17424 B14R0.88 [13CH3]SCCCCCCCCCC(F)(F)F 62a_200025704644_200041927475 [0,2,0,0,0,0|2,0,0]=4 17425 B14R0.88 [13CH3]SCCCCCCCCCC(F)(F)F 62a_200041927475_200025704644 [0,2,0,0,0,0|2,0,0]=4 17426 B14R0.153 CC(=O)CCCCNC[C@H](C)CCCO 34a_100160569302_100009817362 [0,2,0,0,0,0|1,0,1]=4 17427 B14R0.153 CC(C)CCCCCCC(=O)CCCF 1458a_100000040743_100011934791 [0,2,0,0,0,0|1,0,1]=4 17428 B14R0.153 CC(C)CCCCCCC(=O)CCCO 1458a_100000040743_100011215043 [0,2,0,0,0,0|0,0,1]=3 17429 B14R0.153 CC(C)CCCCCCC(=O)NCCO 240690a_100000210304_100000040743 [0,2,0,0,0,0|1,0,1]=4 17430 B14R0.153 CC(C)CCCCCCC(=O)NCCO 527a_100000210304_100000040743 [0,2,0,0,0,0|1,0,1]=4 17431 B14R0.153 CC(C)CCCCCOC(C)CCCCl 34a_200000718107_100000210682 [0,2,0,0,0,0|2,0,0]=4 17432 B14R0.153 CC(C)CCCCCOC(C)CCCCl 7a_200000718107_100000210682 [0,2,0,0,0,0|2,0,0]=4 17433 B14R0.153 CC(C)CCCCNC[C@H](C)CCCO 2230a_100160569302_100011216152 [0,2,0,0,0,0|1,0,0]=3 17434 B14R0.153 CC(C)CCCCNC[C@H](C)CCCO 34a_100160569302_100011216152 [0,2,0,0,0,0|1,0,0]=3 17435 B14R0.153 CCCCC(=O)CCCCCCB(O)O 1458a_100000210183_100009817187 [0,2,0,0,0,0|1,0,1]=4 17436 B14R0.153 CCCCC(=O)CCCCCCC(C)C 1458a_100000040743_100000210211 [0,2,0,0,0,0|1,0,1]=4 17437 B14R0.153 CCCCC(C)CCCCOCC(C)C 34a_200011021034_100000210624 [0,2,0,0,0,0|2,0,0]=4 17438 B14R0.153 CCCCC(C)CCCCOCC(C)C 7a_200011021034_100000210760 [0,2,0,0,0,0|2,0,0]=4 17439 B14R0.153 CCCCC(C)CCCCOCC(C)O 34a_200011021034_100011218427 [0,2,0,0,0,0|1,0,0]=3 17440 B14R0.153 CCCCC(C)CCCCOCC(C)O 7a_200011021034_100011218427 [0,2,0,0,0,0|1,0,0]=3 17441 B14R0.153 CCCCC(C)CCCCOCC(F)F 34a_200011021034_100011934356 [0,2,0,0,0,0|2,0,0]=4 17442 B14R0.153 CCCCC(C)CCCCOCC(F)F 7a_200011021034_100011934356 [0,2,0,0,0,0|2,0,0]=4 17443 B14R0.153 CCCCC(C)CCCCOC[C@@H](C)O 34a_200011021034_100009817552 [0,2,0,0,0,0|1,0,0]=3 17444 B14R0.153 CCCCC(C)CCCCOC[C@@H](C)O 7a_200011021034_100009817552 [0,2,0,0,0,0|1,0,0]=3 17445 B14R0.153 CCCCC(C)COCCCCB(O)O 34a_100011995851_200009817182 [0,2,0,0,0,0|2,0,0]=4 17446 B14R0.153 CCCCC(C)COCCCCB(O)O 7a_100011995851_200009817182 [0,2,0,0,0,0|2,0,0]=4 17447 B14R0.153 CCCCC(C)COCCCCC(C)C 34a_100011995851_100011216152 [0,2,0,0,0,0|2,0,0]=4 17448 B14R0.153 CCCCC(C)COCCCCC(C)C 7a_100011995851_100011216152 [0,2,0,0,0,0|2,0,0]=4 17449 B14R0.153 CCCCC(C)NCCCCCB(O)O 2230a_100000126638_200009817188 [0,2,0,0,0,0|2,0,0]=4 17450 B14R0.153 CCCCC(C)NCCCCCC(C)C 2230a_100000126638_100000210682 [0,2,0,0,0,0|2,0,0]=4 17451 B14R0.153 CCCCC(C)NCCCCCC(C)C 2230a_100011290863_200011215066 [0,2,0,0,0,0|2,0,0]=4 17452 B14R0.153 CCCCC(C)NCCCCCC(C)C 270004a_100011290863_100000210087 [0,2,0,0,0,0|2,0,0]=4 17453 B14R0.153 CCCCC(C)NCCCCCC(C)C 34a_100011290863_200011215066 [0,2,0,0,0,0|2,0,0]=4 17454 B14R0.153 CCCCC(C)OCCCCCB(O)O 34a_100000687866_200009817188 [0,2,0,0,0,0|2,0,0]=4 17455 B14R0.153 CCCCC(C)OCCCCCB(O)O 7a_100000687866_200009817188 [0,2,0,0,0,0|2,0,0]=4 17456 B14R0.153 CCCCC(C)OCCCCCC(C)C 34a_100000687866_100000210682 [0,2,0,0,0,0|2,0,0]=4 17457 B14R0.153 CCCCC(C)OCCCCCC(C)C 34a_100011995859_200011215066 [0,2,0,0,0,0|2,0,0]=4 17458 B14R0.153 CCCCC(C)OCCCCCC(C)C 7a_100000687866_100000210682 [0,2,0,0,0,0|2,0,0]=4 17459 B14R0.153 CCCCC(C)OCCCCCC(C)C 7a_100011995859_200011215066 [0,2,0,0,0,0|2,0,0]=4 17460 B14R0.153 CCCCC(C)SCCCCCB(O)O 62a_200009817188_200011215066 [0,2,0,0,0,0|2,0,0]=4 17461 B14R0.153 CCCCC(C)SCCCCCB(O)O 62a_200011215066_200009817188 [0,2,0,0,0,0|2,0,0]=4 17462 B14R0.153 CCCCC(C)SCCCCCC(C)C 62a_100000210682_200011215066 [0,2,0,0,0,0|2,0,0]=4 17463 B14R0.153 CCCCC(C)SCCCCCC(C)C 62a_200011215066_100000210682 [0,2,0,0,0,0|2,0,0]=4 17464 B14R0.153 CCCCN(C)CCCCCCB(O)O 2230a_100000207549_100009817187 [0,2,0,0,0,0|2,0,0]=4 17465 B14R0.153 CCCCN(C)CCCCCCB(O)O 269982a_100000207549_100009817187 [0,2,0,0,0,0|2,0,0]=4 17466 B14R0.153 CCCC[C@H](N)COCCCCB(O)O 34a_100011934283_200009817182 [0,2,0,0,0,0|2,0,0]=4 17467 B14R0.153 CCCC[C@H](N)COCCCCC(C)C 34a_100011934283_100011216152 [0,2,0,0,0,0|2,0,0]=4 17468 B14R0.231 CC(C)CCCCCC(=O)CCCCF 1458a_100000766313_100000729493 [0,2,0,0,0,0|1,0,1]=4 17469 B14R0.231 CC(C)CCCCCC(=O)CCCCO 1458a_100000695505_100000210682 [0,2,0,0,0,0|0,0,1]=3 17470 B14R0.231 CC(C)CCCCCC(=O)CCCCO 1458a_100000766313_100000210776 [0,2,0,0,0,0|0,0,1]=3 17471 B14R0.231 CC(C)CCCCCC(=O)COCCO 1458a_100000708028_100000210682 [0,2,0,0,0,0|1,0,1]=4 17472 B14R0.231 CC(C)CCCCCC(=O)NCCCO 240690a_100000182051_100000766313 [0,2,0,0,0,0|1,0,1]=4 17473 B14R0.231 CC(C)CCCCCC(=O)NCCCO 527a_100000182051_100000766313 [0,2,0,0,0,0|1,0,1]=4 17474 B14R0.231 CC(C)CCCCCN(C)CCCCO 2230a_100000717598_100000210682 [0,2,0,0,0,0|1,0,0]=3 17475 B14R0.231 CC(C)CCCCCN(C)CCCCO 269982a_100000717598_100000210682 [0,2,0,0,0,0|1,0,0]=3 17476 B14R0.231 CC(C)CCCOC[C@@H](N)CCCCN 34a_100016993712_100011214892 [0,2,0,0,0,0|2,0,0]=4 17477 B14R0.231 CC(O)CCCOC[C@@H](N)CCCCN 34a_100016993712_200000718107 [0,2,0,0,0,0|2,0,0]=4 17478 B14R0.231 CCCCCC(=O)CCCCCB(O)O 1458a_100000212188_200009817188 [0,2,0,0,0,0|1,0,1]=4 17479 B14R0.231 CCCCCC(=O)CCCCCC(C)C 1458a_100000212188_100000210682 [0,2,0,0,0,0|1,0,1]=4 17480 B14R0.231 CCCCCC(=O)CCCCCC(C)C 1458a_100000766313_100000210326 [0,2,0,0,0,0|1,0,1]=4 17481 B14R0.231 CCCCCC(=O)CSCCCC(C)O 62a_200000718107_200012276598 [0,2,0,0,0,0|1,0,1]=4 17482 B14R0.231 CCCCCC(=O)CSCCCC(C)O 62a_200012276598_200000718107 [0,2,0,0,0,0|1,0,1]=4 17483 B14R0.231 CCCCCC(C)NCCCCB(O)O 2230a_100000211957_200009817182 [0,2,0,0,0,0|2,0,0]=4 17484 B14R0.231 CCCCCC(C)NCCCCC(C)C 2230a_100000211957_100011216152 [0,2,0,0,0,0|2,0,0]=4 17485 B14R0.231 CCCCCC(C)OCCCCB(O)O 34a_100011215632_200009817182 [0,2,0,0,0,0|2,0,0]=4 17486 B14R0.231 CCCCCC(C)OCCCCB(O)O 7a_100011215632_200009817182 [0,2,0,0,0,0|2,0,0]=4 17487 B14R0.231 CCCCCC(C)OCCCCC(C)C 34a_100011214890_200011218191 [0,2,0,0,0,0|2,0,0]=4 17488 B14R0.231 CCCCCC(C)OCCCCC(C)C 34a_100011215632_100011216152 [0,2,0,0,0,0|2,0,0]=4 17489 B14R0.231 CCCCCC(C)OCCCCC(C)C 7a_100011214890_200011218191 [0,2,0,0,0,0|2,0,0]=4 17490 B14R0.231 CCCCCC(C)OCCCCC(C)C 7a_100011215632_100011216152 [0,2,0,0,0,0|2,0,0]=4 17491 B14R0.231 CCCCCC(C)SCCCCB(O)O 62a_200009817182_200011218191 [0,2,0,0,0,0|2,0,0]=4 17492 B14R0.231 CCCCCC(C)SCCCCB(O)O 62a_200011218191_200009817182 [0,2,0,0,0,0|2,0,0]=4 17493 B14R0.231 CCCCCC(C)SCCCCC(C)C 62a_100011216152_200011218191 [0,2,0,0,0,0|2,0,0]=4 17494 B14R0.231 CCCCCC(C)SCCCCC(C)C 62a_200011218191_100011216152 [0,2,0,0,0,0|2,0,0]=4 17495 B14R0.231 CCCCCN(C)CCCCCB(O)O 2230a_100000223495_200009817188 [0,2,0,0,0,0|2,0,0]=4 17496 B14R0.231 CCCCCN(C)CCCCCB(O)O 269982a_100000223495_200009817188 [0,2,0,0,0,0|2,0,0]=4 17497 B14R0.231 CCCCCN(C)CCCCCC(C)C 2230a_100000223495_100000210682 [0,2,0,0,0,0|2,0,0]=4 17498 B14R0.231 CCCCCN(C)CCCCCC(C)C 269982a_100000223495_100000210682 [0,2,0,0,0,0|2,0,0]=4 17499 B14R0.305 CC(C)CCCCCCCOC(C)CO 34a_200000210741_100012180447 [0,2,0,0,0,0|1,0,0]=3 17500 B14R0.305 CC(C)CCCCCCCOC(C)CO 7a_200000210741_100012180447 [0,2,0,0,0,0|1,0,0]=3 17501 B14R0.305 CC(C)CCCCCCNCC(O)CO 2230a_100000211014_100011219619 [0,2,0,0,0,0|1,0,0]=3 17502 B14R0.305 CC(C)CCCCCCNCC(O)CO 34a_100000211014_100011219619 [0,2,0,0,0,0|1,0,0]=3 17503 B14R0.305 CC(C)CCCCCCNC[C@@H](C)CO 2230a_100000211014_100000059175 [0,2,0,0,0,0|1,0,0]=3 17504 B14R0.305 CC(C)CCCCCCNC[C@@H](C)CO 34a_100000211014_100000059175 [0,2,0,0,0,0|1,0,0]=3 17505 B14R0.305 CC(C)CCCCCCNC[C@@H](O)CF 2230a_100000211014_100015614560 [0,2,0,0,0,0|2,0,0]=4 17506 B14R0.305 CC(C)CCCCCCNC[C@@H](O)CF 34a_100000211014_100015614560 [0,2,0,0,0,0|2,0,0]=4 17507 B14R0.305 CC(C)CCCCCCNC[C@@H](O)CO 2230a_100000211014_100009815848 [0,2,0,0,0,0|1,0,0]=3 17508 B14R0.305 CC(C)CCCCCCNC[C@@H](O)CO 34a_100000211014_100009815848 [0,2,0,0,0,0|1,0,0]=3 17509 B14R0.305 CC(C)CCCCCNCCC(C)CO 2230a_106354213184_100000210682 [0,2,0,0,0,0|1,0,0]=3 17510 B14R0.305 CC(C)CCCCCNCCC(C)CO 34a_106354213184_100000210682 [0,2,0,0,0,0|1,0,0]=3 17511 B14R0.305 CC(C)CCCCOCCC[C@@H](C)CN 34a_100160569302_100011216152 [0,2,0,0,0,0|2,0,0]=4 17512 B14R0.305 CC(C)NCCCCCOCC(O)CO 34a_100011629493_100011219619 [0,2,0,0,0,0|2,0,0]=4 17513 B14R0.305 CC(C)NCCCCCOC[C@@H](C)CO 34a_100011629493_100000059175 [0,2,0,0,0,0|2,0,0]=4 17514 B14R0.305 CC(C)NCCCCCOC[C@@H](O)CO 34a_100011629493_100009815848 [0,2,0,0,0,0|2,0,0]=4 17515 B14R0.305 CCC(C)CCCCCOCCC(C)C 7a_200000035636_100000210626 [0,2,0,0,0,0|2,0,0]=4 17516 B14R0.305 CCC(C)CCCCCOCCC(C)O 7a_200000035636_100012276601 [0,2,0,0,0,0|1,0,0]=3 17517 B14R0.305 CCC(C)CCCOCCCCB(O)O 7a_100011216074_200009817182 [0,2,0,0,0,0|2,0,0]=4 17518 B14R0.305 CCC(C)CCCOCCCCC(C)C 7a_100011216074_100011216152 [0,2,0,0,0,0|2,0,0]=4 17519 B14R0.305 CCC(C)CCNCCCCCB(O)O 2230a_100020591266_200009817188 [0,2,0,0,0,0|2,0,0]=4 17520 B14R0.305 CCC(C)CCNCCCCCC(C)C 2230a_100020591266_100000210682 [0,2,0,0,0,0|2,0,0]=4 17521 B14R0.305 CCC(C)CCOCCCCCB(O)O 7a_100011215188_200009817188 [0,2,0,0,0,0|2,0,0]=4 17522 B14R0.305 CCC(C)CCOCCCCCC(C)C 7a_100011215188_100000210682 [0,2,0,0,0,0|2,0,0]=4 17523 B14R0.305 CCC(C)CNCCCCCCB(O)O 2230a_100020588543_100009817187 [0,2,0,0,0,0|2,0,0]=4 17524 B14R0.305 CCC(C)CNCCCCCCC(C)C 2230a_100000211014_100000748023 [0,2,0,0,0,0|2,0,0]=4 17525 B14R0.305 CCC(C)CNCCCCCCC(C)C 270004a_100000211014_100000243153 [0,2,0,0,0,0|2,0,0]=4 17526 B14R0.305 CCC(C)CNCCCCCCC(C)C 34a_100000211014_100000748023 [0,2,0,0,0,0|2,0,0]=4 17527 B14R0.305 CCC(C)CSCCCCCCB(O)O 62a_100000748023_100009817187 [0,2,0,0,0,0|2,0,0]=4 17528 B14R0.305 CCC(C)CSCCCCCCB(O)O 62a_100009817187_100000748023 [0,2,0,0,0,0|2,0,0]=4 17529 B14R0.305 CCC(C)OCCCCCCCC(C)C 34a_200000210741_100011215416 [0,2,0,0,0,0|2,0,0]=4 17530 B14R0.305 CCC(C)OCCCCCCCC(C)C 7a_200000210741_100000758301 [0,2,0,0,0,0|2,0,0]=4 17531 B14R0.305 CCC(O)CNCCCCCCB(O)O 2230a_100011218483_100009817187 [0,2,0,0,0,0|2,0,0]=4 17532 B14R0.305 CCC(O)CNCCCCCCC(C)C 2230a_100000211014_100011218378 [0,2,0,0,0,0|2,0,0]=4 17533 B14R0.305 CCC(O)CNCCCCCCC(C)C 34a_100000211014_100011218378 [0,2,0,0,0,0|2,0,0]=4 17534 B14R0.305 CCC(O)CSCCCCCCB(O)O 62a_100009817187_100011218378 [0,2,0,0,0,0|2,0,0]=4 17535 B14R0.305 CCC(O)CSCCCCCCB(O)O 62a_100011218378_100009817187 [0,2,0,0,0,0|2,0,0]=4 17536 B14R0.305 CC[C@H](C)CNCCCCCCC(C)C 2230a_100000211014_100009816398 [0,2,0,0,0,0|2,0,0]=4 17537 B14R0.305 CC[C@H](C)CNCCCCCCC(C)C 34a_100000211014_100009816398 [0,2,0,0,0,0|2,0,0]=4 17538 B14R0.305 CC[C@H](C)COCCCCCCB(O)O 7a_100009816381_100009817187 [0,2,0,0,0,0|2,0,0]=4 17539 B14R0.305 CC[C@H](C)CSCCCCCCB(O)O 62a_100009816398_100009817187 [0,2,0,0,0,0|2,0,0]=4 17540 B14R0.305 CC[C@H](C)CSCCCCCCB(O)O 62a_100009817187_100009816398 [0,2,0,0,0,0|2,0,0]=4 17541 B14R0.337 C#CC(=O)CCCCCCCCCCC 1458a_100000211873_100011215454 [0,2,0,0,0,0|0,0,2]=4 17542 B14R0.337 C#CC(=O)CCCCCCCCCCO 1458a_100000211873_100009813290 [0,2,0,0,0,0|0,0,2]=4 17543 B14R0.337 C#CC(C)NCCCCCCCCCC 2230a_100000707721_100000210320 [0,2,0,0,0,0|1,0,1]=4 17544 B14R0.337 C#CC(C)NCCCCCCCCCC 34a_100000684558_200000035995 [0,2,0,0,0,0|1,0,1]=4 17545 B14R0.337 C#CC(C)NCCCCCCCCCC 34a_100000707721_100000210320 [0,2,0,0,0,0|1,0,1]=4 17546 B14R0.337 C#CC(C)NCCCCCCCCCO 2230a_100000707721_100009813782 [0,2,0,0,0,0|1,0,0]=3 17547 B14R0.337 C#CC(C)NCCCCCCCCCO 34a_100000078944_200000035995 [0,2,0,0,0,0|1,0,0]=3 17548 B14R0.337 C#CC(C)NCCCCCCCCCO 34a_100000707721_100009813782 [0,2,0,0,0,0|1,0,0]=3 17549 B14R0.337 C#CC(C)OCCCCCCCCCBr 34a_100009813782_200000035995 [0,2,0,0,0,0|2,0,0]=4 17550 B14R0.337 C#CC(C)OCCCCCCCCCC 34a_100000210711_200000035995 [0,2,0,0,0,0|1,0,1]=4 17551 B14R0.337 C#CC(C)OCCCCCCCCCCl 34a_100009868337_200000035995 [0,2,0,0,0,0|2,0,0]=4 17552 B14R0.337 C#CC(C)OCCCCCCCCCN 34a_100000078944_200000035995 [0,2,0,0,0,0|2,0,0]=4 17553 B14R0.337 C#CC(C)SCCCCCCCCCC 62a_200000035995_100000210320 [0,2,0,0,0,0|1,0,1]=4 17554 B14R0.337 C#CC(C)SCCCCCCCCCO 62a_200000035995_100009813782 [0,2,0,0,0,0|1,0,0]=3 17555 B14R0.337 C#CC(O)CCCCCNCCCCC 2230a_100000209983_200010408556 [0,2,0,0,0,0|1,0,0]=3 17556 B14R0.337 C#CC(O)CCCCCNCCCCO 2230a_100000750430_200010408556 [0,2,0,0,0,0|0,0,2]=4 17557 B14R0.337 C#CC(O)CCCCCNCCCCO 34a_100000750430_200010408556 [0,2,0,0,0,0|0,0,2]=4 17558 B14R0.337 C#CC(O)CCCCCNCCCOC 34a_100150723488_200010408556 [0,2,0,0,0,0|2,0,0]=4 17559 B14R0.337 C#CC(O)CCCCCNCCCSC 2230a_100000749238_200010408556 [0,2,0,0,0,0|2,0,0]=4 17560 B14R0.337 C#CC(O)CCCCCNCCOCC 2230a_102516460346_200010408556 [0,2,0,0,0,0|2,0,0]=4 17561 B14R0.337 C#CC(O)CCCCCNCCOCC 34a_102516460346_200010408556 [0,2,0,0,0,0|2,0,0]=4 17562 B14R0.337 C#CC(O)CCCCCNCCSCC 2230a_100000106463_200010408556 [0,2,0,0,0,0|2,0,0]=4 17563 B14R0.337 C#CC(O)CCCCCOCCCCBr 34a_100011216708_200010408556 [0,2,0,0,0,0|2,0,0]=4 17564 B14R0.337 C#CC(O)CCCCCOCCCCC 34a_100000210253_200010408556 [0,2,0,0,0,0|1,0,0]=3 17565 B14R0.337 C#CC(O)CCCCCOCCCCC 7a_100000210253_200010408556 [0,2,0,0,0,0|1,0,0]=3 17566 B14R0.337 C#CC(O)CCCCCOCCCCCl 34a_100000210776_200010408556 [0,2,0,0,0,0|2,0,0]=4 17567 B14R0.337 C#CC(O)CCCCCOCCCCCl 7a_100000210776_200010408556 [0,2,0,0,0,0|2,0,0]=4 17568 B14R0.337 C#CC(O)CCCCCOCCCCF 34a_100011995726_200010408556 [0,2,0,0,0,0|2,0,0]=4 17569 B14R0.337 C#CC(O)CCCCCOCCCCF 7a_100011995726_200010408556 [0,2,0,0,0,0|2,0,0]=4 17570 B14R0.337 C#CC(O)CCCCCOCCCCI 34a_200012148704_200010408556 [0,2,0,0,0,0|2,0,0]=4 17571 B14R0.337 C#CC(O)CCCCCOCCCCN 34a_100000750430_200010408556 [0,2,0,0,0,0|2,0,0]=4 17572 B14R0.337 C#CC(O)CCCCCOCCCNC 34a_100000213112_200010408556 [0,2,0,0,0,0|2,0,0]=4 17573 B14R0.337 C#CC(O)CCCCCOCCCOC 34a_100000740835_200010408556 [0,2,0,0,0,0|2,0,0]=4 17574 B14R0.337 C#CC(O)CCCCCOCCCSC 34a_100000690336_200010408556 [0,2,0,0,0,0|2,0,0]=4 17575 B14R0.337 C#CC(O)CCCCCOCCCSC 7a_100000690336_200010408556 [0,2,0,0,0,0|2,0,0]=4 17576 B14R0.337 C#CC(O)CCCCCOCCOCC 34a_100000210136_200010408556 [0,2,0,0,0,0|2,0,0]=4 17577 B14R0.337 C#CC(O)CCCCCOCCOCC 7a_100000210136_200010408556 [0,2,0,0,0,0|2,0,0]=4 17578 B14R0.337 C#CC(O)CCCCCOCCSCC 34a_100000212035_200010408556 [0,2,0,0,0,0|2,0,0]=4 17579 B14R0.337 C#CC(O)CCCCCOCCSCC 7a_100000212035_200010408556 [0,2,0,0,0,0|2,0,0]=4 17580 B14R0.337 C#CC(O)CCCCCSCCCCC 62a_100000210326_200010408556 [0,2,0,0,0,0|1,0,0]=3 17581 B14R0.337 C#CC(O)CCCCCSCCCCC 62a_200010408556_100000210326 [0,2,0,0,0,0|1,0,0]=3 17582 B14R0.337 C#CC(O)CCCCCSCCCCF 62a_100000729493_200010408556 [0,2,0,0,0,0|2,0,0]=4 17583 B14R0.337 C#CC(O)CCCCCSCCCCF 62a_200010408556_100000729493 [0,2,0,0,0,0|2,0,0]=4 17584 B14R0.337 C#CC(O)CCCCCSCCCCO 62a_100000210776_200010408556 [0,2,0,0,0,0|0,0,2]=4 17585 B14R0.337 C#CC(O)CCCCCSCCCCO 62a_200010408556_100000210776 [0,2,0,0,0,0|0,0,2]=4 17586 B14R0.337 C#CC(O)CCCCCSCCCOC 62a_100000709357_200010408556 [0,2,0,0,0,0|2,0,0]=4 17587 B14R0.337 C#CC(O)CCCCCSCCCOC 62a_200010408556_100000709357 [0,2,0,0,0,0|2,0,0]=4 17588 B14R0.337 C#CC(O)CCCCCSCCOCC 62a_100000210147_200010408556 [0,2,0,0,0,0|2,0,0]=4 17589 B14R0.337 C#CC(O)CCCCCSCCOCC 62a_200010408556_100011215890 [0,2,0,0,0,0|2,0,0]=4 17590 B14R0.337 C#CC(O)CCCCCSCCSCC 62a_100000757381_200010408556 [0,2,0,0,0,0|2,0,0]=4 17591 B14R0.337 C#CC(O)CCCCCSCCSCC 62a_200010408556_100000757381 [0,2,0,0,0,0|2,0,0]=4 17592 B14R0.337 C#CCCCCCCCCOC(C)CC 34a_100000065265_100011215416 [0,2,0,0,0,0|1,0,1]=4 17593 B14R0.337 C#CCCCCCCCCOC(C)CC 7a_100000065265_100000758301 [0,2,0,0,0,0|1,0,1]=4 17594 B14R0.337 C#CCCCCCCCCOC(C)CO 34a_100000065265_100012180447 [0,2,0,0,0,0|0,0,2]=4 17595 B14R0.337 C#CCCCCCCCCOC(C)CO 7a_100000065265_100012180447 [0,2,0,0,0,0|0,0,2]=4 17596 B14R0.337 C#CCCCCCCCNCC(C)CC 2230a_100020588543_100153394163 [0,2,0,0,0,0|1,0,1]=4 17597 B14R0.337 C#CCCCCCCCNCC(C)CO 34a_100000744482_100153394163 [0,2,0,0,0,0|0,0,2]=4 17598 B14R0.337 C#CCCCCCCCNCC(O)CC 2230a_100011218483_100153394163 [0,2,0,0,0,0|1,0,1]=4 17599 B14R0.337 C#CCCCCCCCNC[C@@H](F)CO 34a_100015665980_100153394163 [0,2,0,0,0,0|0,0,2]=4 17600 B14R0.337 C#CCCCCCCCNC[C@H](O)CO 2230a_100020644852_100153394163 [0,2,0,0,0,0|0,0,2]=4 17601 B14R0.337 C#CCCCCCCCOCC(C)CC 34a_100000054614_100000748023 [0,2,0,0,0,0|1,0,1]=4 17602 B14R0.337 C#CCCCCCCCOCC(C)CC 7a_100000054614_100000748023 [0,2,0,0,0,0|1,0,1]=4 17603 B14R0.337 C#CCCCCCCCOCC(O)CC 34a_100000054614_100011218378 [0,2,0,0,0,0|1,0,1]=4 17604 B14R0.337 C#CCCCCCCCOCC(O)CC 7a_100000054614_100011218378 [0,2,0,0,0,0|1,0,1]=4 17605 B14R0.337 C#CCCCCCCCOCC(O)CO 34a_100000054614_100011219619 [0,2,0,0,0,0|0,0,2]=4 17606 B14R0.337 C#CCCCCCCCOCC(O)CO 7a_100000054614_100011219619 [0,2,0,0,0,0|0,0,2]=4 17607 B14R0.337 C#CCCCCCCCOC[C@@H](C)CC 34a_100000054614_100009816398 [0,2,0,0,0,0|1,0,1]=4 17608 B14R0.337 C#CCCCCCCCOC[C@@H](C)CC 7a_100000054614_100009816398 [0,2,0,0,0,0|1,0,1]=4 17609 B14R0.337 C#CCCCCCCCOC[C@@H](C)CC 7a_100009816381_100153394163 [0,2,0,0,0,0|1,0,1]=4 17610 B14R0.337 C#CCCCCCCCOC[C@@H](C)CO 34a_100000054614_100000059175 [0,2,0,0,0,0|0,0,2]=4 17611 B14R0.337 C#CCCCCCCCOC[C@@H](C)CO 7a_100000054614_100000059175 [0,2,0,0,0,0|0,0,2]=4 17612 B14R0.337 C#CCCCCCCCOC[C@@H](O)CO 34a_100000054614_100009815848 [0,2,0,0,0,0|0,0,2]=4 17613 B14R0.337 C#CCCCCCCCOC[C@@H](O)CO 7a_100000054614_100009815848 [0,2,0,0,0,0|0,0,2]=4 17614 B14R0.337 C#CCCCCCCCSCC(C)CC 62a_100000748023_100153394163 [0,2,0,0,0,0|1,0,1]=4 17615 B14R0.337 C#CCCCCCCCSCC(C)CC 62a_100153394163_100000748023 [0,2,0,0,0,0|1,0,1]=4 17616 B14R0.337 C#CCCCCCCCSCC(O)CC 62a_100011218378_100153394163 [0,2,0,0,0,0|1,0,1]=4 17617 B14R0.337 C#CCCCCCCCSCC(O)CC 62a_100153394163_100011218378 [0,2,0,0,0,0|1,0,1]=4 17618 B14R0.337 C#CCCCCCCCSCC(O)CO 62a_100011219619_100153394163 [0,2,0,0,0,0|0,0,2]=4 17619 B14R0.337 C#CCCCCCCCSCC(O)CO 62a_100153394163_100011219619 [0,2,0,0,0,0|0,0,2]=4 17620 B14R0.337 C#CCCCCCCCSC[C@@H](C)CC 62a_100009816398_100153394163 [0,2,0,0,0,0|1,0,1]=4 17621 B14R0.337 C#CCCCCCCCSC[C@@H](C)CC 62a_100153394163_100009816398 [0,2,0,0,0,0|1,0,1]=4 17622 B14R0.337 C#CCCCCCCCSC[C@@H](C)CO 62a_100000059175_100153394163 [0,2,0,0,0,0|0,0,2]=4 17623 B14R0.337 C#CCCCCCCCSC[C@@H](C)CO 62a_100153394163_100000059175 [0,2,0,0,0,0|0,0,2]=4 17624 B14R0.337 C#CCCCCCCCSC[C@@H](O)CO 62a_100009815848_100153394163 [0,2,0,0,0,0|0,0,2]=4 17625 B14R0.337 C#CCCCCCCCSC[C@@H](O)CO 62a_100153394163_100009815848 [0,2,0,0,0,0|0,0,2]=4 17626 B14R0.337 C#CCCCCCCNCCC(C)CC 2230a_100020591266_100012276617 [0,2,0,0,0,0|1,0,1]=4 17627 B14R0.337 C#CCCCCCCNCCC(C)CO 2230a_106354213184_100012276617 [0,2,0,0,0,0|0,0,2]=4 17628 B14R0.337 C#CCCCCCCNCCC(C)CO 34a_106354213184_100012276617 [0,2,0,0,0,0|0,0,2]=4 17629 B14R0.337 C#CCCCCCCOCCC(C)CC 7a_100011215188_100012276617 [0,2,0,0,0,0|1,0,1]=4 17630 B14R0.337 C#CCCCCCOCCCC(C)CC 7a_100011216074_100012094781 [0,2,0,0,0,0|1,0,1]=4 17631 B14R0.337 C#CCCCOCCCCCC(C)CC 7a_200000035636_100011215417 [0,2,0,0,0,0|1,0,1]=4 17632 B14R0.337 C#C[C@@H](C)OCCCCCCCCCC 34a_100009815206_100000210320 [0,2,0,0,0,0|1,0,1]=4 17633 B14R0.337 C#C[C@@H](C)OCCCCCCCCCC 7a_100009815206_100000210320 [0,2,0,0,0,0|1,0,1]=4 17634 B14R0.337 C#C[C@@H](C)OCCCCCCCCCO 34a_100009815206_100009813782 [0,2,0,0,0,0|1,0,0]=3 17635 B14R0.337 C#C[C@@H](C)OCCCCCCCCCO 7a_100009815206_100009813782 [0,2,0,0,0,0|1,0,0]=3 17636 B14R0.337 C=CC(=O)CCCCCCCCCCC 1458a_100000185746_100011215454 [0,2,0,0,0,0|0,0,2]=4 17637 B14R0.337 C=CC(=O)CCCCCCCCCCO 1458a_100000185746_100009813290 [0,2,0,0,0,0|0,0,2]=4 17638 B14R0.337 C=CC(C)COCCCCCCCCC 34a_100011215527_100011214924 [0,2,0,0,0,0|1,0,1]=4 17639 B14R0.337 C=CC(C)COCCCCCCCCC 7a_100011215527_100000210328 [0,2,0,0,0,0|1,0,1]=4 17640 B14R0.337 C=CC(C)COCCCCCCCCO 34a_100011215527_100000033203 [0,2,0,0,0,0|1,0,0]=3 17641 B14R0.337 C=CC(C)COCCCCCCCCO 7a_100011215527_100000033203 [0,2,0,0,0,0|1,0,0]=3 17642 B14R0.337 C=CC(C)OCCCCCCCCCC 34a_100000695699_100000210320 [0,2,0,0,0,0|1,0,1]=4 17643 B14R0.337 C=CC(C)OCCCCCCCCCO 34a_100000695699_100009813782 [0,2,0,0,0,0|1,0,0]=3 17644 B14R0.337 C=CC(C)SCCCCCCCCCC 62a_100011215867_100000210320 [0,2,0,0,0,0|1,0,1]=4 17645 B14R0.337 C=CC(C)SCCCCCCCCCO 62a_100011215867_100009813782 [0,2,0,0,0,0|1,0,0]=3 17646 B14R0.337 C=CC(O)CNCCCCCCCCC 2230a_100000212291_100000730141 [0,2,0,0,0,0|1,0,0]=3 17647 B14R0.337 C=CC(O)CNCCCCCCCCC 34a_100000212291_100000730141 [0,2,0,0,0,0|1,0,0]=3 17648 B14R0.337 C=CC(O)CNCCCCCCCCO 2230a_102515433106_100000730141 [0,2,0,0,0,0|0,0,2]=4 17649 B14R0.337 C=CC(O)CNCCCCCCCCO 34a_102515433106_100000730141 [0,2,0,0,0,0|0,0,2]=4 17650 B14R0.337 C=CC(O)COCCCCCCCCBr 34a_100009813846_100000730141 [0,2,0,0,0,0|2,0,0]=4 17651 B14R0.337 C=CC(O)COCCCCCCCCBr 7a_100009813846_100000730141 [0,2,0,0,0,0|2,0,0]=4 17652 B14R0.337 C=CC(O)COCCCCCCCCC 34a_100000210712_100000730141 [0,2,0,0,0,0|1,0,0]=3 17653 B14R0.337 C=CC(O)COCCCCCCCCC 7a_100000210712_100000730141 [0,2,0,0,0,0|1,0,0]=3 17654 B14R0.337 C=CC(O)COCCCCCCCCCl 34a_100000033203_100000730141 [0,2,0,0,0,0|2,0,0]=4 17655 B14R0.337 C=CC(O)COCCCCCCCCCl 7a_100000033203_100000730141 [0,2,0,0,0,0|2,0,0]=4 17656 B14R0.337 C=CC(O)COCCCCCCCCN 34a_102515433106_100000730141 [0,2,0,0,0,0|2,0,0]=4 17657 B14R0.337 C=CC(O)COCCCCNCCCC 34a_200011216965_100000730141 [0,2,0,0,0,0|2,0,0]=4 17658 B14R0.337 C=CC(O)COCCCCOCCCC 34a_200000760531_100000730141 [0,2,0,0,0,0|2,0,0]=4 17659 B14R0.337 C=CC(O)COCCCCOCCCC 7a_200000760531_100000730141 [0,2,0,0,0,0|2,0,0]=4 17660 B14R0.337 C=CC(O)COCCOCCCCCC 34a_100000691444_100000730141 [0,2,0,0,0,0|2,0,0]=4 17661 B14R0.337 C=CC(O)COCCOCCCCCC 7a_100000691444_100000730141 [0,2,0,0,0,0|2,0,0]=4 17662 B14R0.337 C=CC(O)CSCCCCCCCCC 62a_100000730141_100000210670 [0,2,0,0,0,0|1,0,0]=3 17663 B14R0.337 C=CC(O)CSCCCCCCCCO 62a_100000033203_100000730141 [0,2,0,0,0,0|0,0,2]=4 17664 B14R0.337 C=CC(O)CSCCCCCCCCO 62a_100000730141_100000033203 [0,2,0,0,0,0|0,0,2]=4 17665 B14R0.337 C=CCCCCCCCCCC(=O)CC 1458a_100000210414_100009814027 [0,2,0,0,0,0|1,0,1]=4 17666 B14R0.337 C=CCCCCCCCCCC(=O)CO 1458a_100000210174_100009814027 [0,2,0,0,0,0|0,0,2]=4 17667 B14R0.337 C=CCCCCCCCCCN(C)CC 2230a_100000225621_100009814027 [0,2,0,0,0,0|1,0,1]=4 17668 B14R0.337 C=CCCCCCCCCCN(C)CC 269982a_100000225621_100009814027 [0,2,0,0,0,0|1,0,1]=4 17669 B14R0.337 C=CCCCCCCCCNC(C)CC 2230a_100000209981_100011933949 [0,2,0,0,0,0|1,0,1]=4 17670 B14R0.337 C=CCCCCCCCCN[C@H](C)CO 2230a_100000737577_100011933949 [0,2,0,0,0,0|0,0,2]=4 17671 B14R0.337 C=CCCCCCCCCOC(C)CC 34a_100011215194_100011215416 [0,2,0,0,0,0|1,0,1]=4 17672 B14R0.337 C=CCCCCCCCCOC(C)CC 7a_100000210228_100011933949 [0,2,0,0,0,0|1,0,1]=4 17673 B14R0.337 C=CCCCCCCCCOC(C)CC 7a_100011215194_100000758301 [0,2,0,0,0,0|1,0,1]=4 17674 B14R0.337 C=CCCCCCCCCOC(C)CO 34a_100011215194_100012180447 [0,2,0,0,0,0|0,0,2]=4 17675 B14R0.337 C=CCCCCCCCCOC(C)CO 7a_100011215194_100012180447 [0,2,0,0,0,0|0,0,2]=4 17676 B14R0.337 C=CCCCCCCCCSC(C)CC 62a_100000758301_100011933949 [0,2,0,0,0,0|1,0,1]=4 17677 B14R0.337 C=CCCCCCCCCSC(C)CC 62a_100011933949_100000758301 [0,2,0,0,0,0|1,0,1]=4 17678 B14R0.337 C=CCCCCCCCCSC(C)CO 62a_100012180447_100011933949 [0,2,0,0,0,0|0,0,2]=4 17679 B14R0.337 C=CCCCCCCCCS[C@H](C)CO 62a_100011933949_100016084084 [0,2,0,0,0,0|0,0,2]=4 17680 B14R0.337 C=CCCCCCCCCS[C@H](C)CO 62a_100016084084_100011933949 [0,2,0,0,0,0|0,0,2]=4 17681 B14R0.337 C=CCCCCCCCNCC(C)CC 2230a_100020588543_100012355270 [0,2,0,0,0,0|1,0,1]=4 17682 B14R0.337 C=CCCCCCCCNCC(C)CO 34a_100000744482_100012355270 [0,2,0,0,0,0|0,0,2]=4 17683 B14R0.337 C=CCCCCCCCNCC(O)CC 2230a_100011218483_100012355270 [0,2,0,0,0,0|1,0,1]=4 17684 B14R0.337 C=CCCCCCCCNC[C@@H](F)CO 34a_100015665980_100012355270 [0,2,0,0,0,0|0,0,2]=4 17685 B14R0.337 C=CCCCCCCCNC[C@H](O)CO 2230a_100020644852_100012355270 [0,2,0,0,0,0|0,0,2]=4 17686 B14R0.337 C=CCCCCCCCOCC(C)CC 34a_100000730831_100000748023 [0,2,0,0,0,0|1,0,1]=4 17687 B14R0.337 C=CCCCCCCCOCC(C)CC 7a_100000730831_100000748023 [0,2,0,0,0,0|1,0,1]=4 17688 B14R0.337 C=CCCCCCCCOCC(O)CC 34a_100000730831_100011218378 [0,2,0,0,0,0|1,0,1]=4 17689 B14R0.337 C=CCCCCCCCOCC(O)CC 7a_100000730831_100011218378 [0,2,0,0,0,0|1,0,1]=4 17690 B14R0.337 C=CCCCCCCCOCC(O)CO 34a_100000730831_100011219619 [0,2,0,0,0,0|0,0,2]=4 17691 B14R0.337 C=CCCCCCCCOCC(O)CO 7a_100000730831_100011219619 [0,2,0,0,0,0|0,0,2]=4 17692 B14R0.337 C=CCCCCCCCOC[C@@H](C)CC 34a_100000730831_100009816398 [0,2,0,0,0,0|1,0,1]=4 17693 B14R0.337 C=CCCCCCCCOC[C@@H](C)CC 7a_100000730831_100009816398 [0,2,0,0,0,0|1,0,1]=4 17694 B14R0.337 C=CCCCCCCCOC[C@@H](C)CC 7a_100009816381_100012355270 [0,2,0,0,0,0|1,0,1]=4 17695 B14R0.337 C=CCCCCCCCOC[C@@H](C)CO 34a_100000730831_100000059175 [0,2,0,0,0,0|0,0,2]=4 17696 B14R0.337 C=CCCCCCCCOC[C@@H](C)CO 7a_100000730831_100000059175 [0,2,0,0,0,0|0,0,2]=4 17697 B14R0.337 C=CCCCCCCCOC[C@@H](O)CO 34a_100000730831_100009815848 [0,2,0,0,0,0|0,0,2]=4 17698 B14R0.337 C=CCCCCCCCOC[C@@H](O)CO 7a_100000730831_100009815848 [0,2,0,0,0,0|0,0,2]=4 17699 B14R0.337 C=CCCCCCCCSCC(C)CC 62a_100000748023_100012355270 [0,2,0,0,0,0|1,0,1]=4 17700 B14R0.337 C=CCCCCCCCSCC(C)CC 62a_100012355270_100000748023 [0,2,0,0,0,0|1,0,1]=4 17701 B14R0.337 C=CCCCCCCCSCC(O)CC 62a_100011218378_100012355270 [0,2,0,0,0,0|1,0,1]=4 17702 B14R0.337 C=CCCCCCCCSCC(O)CC 62a_100012355270_100011218378 [0,2,0,0,0,0|1,0,1]=4 17703 B14R0.337 C=CCCCCCCCSCC(O)CO 62a_100011219619_100012355270 [0,2,0,0,0,0|0,0,2]=4 17704 B14R0.337 C=CCCCCCCCSCC(O)CO 62a_100012355270_100011219619 [0,2,0,0,0,0|0,0,2]=4 17705 B14R0.337 C=CCCCCCCCSC[C@@H](C)CC 62a_100009816398_100012355270 [0,2,0,0,0,0|1,0,1]=4 17706 B14R0.337 C=CCCCCCCCSC[C@@H](C)CC 62a_100012355270_100009816398 [0,2,0,0,0,0|1,0,1]=4 17707 B14R0.337 C=CCCCCCCCSC[C@@H](C)CO 62a_100000059175_100012355270 [0,2,0,0,0,0|0,0,2]=4 17708 B14R0.337 C=CCCCCCCCSC[C@@H](C)CO 62a_100012355270_100000059175 [0,2,0,0,0,0|0,0,2]=4 17709 B14R0.337 C=CCCCCCCCSC[C@@H](O)CO 62a_100009815848_100012355270 [0,2,0,0,0,0|0,0,2]=4 17710 B14R0.337 C=CCCCCCCCSC[C@@H](O)CO 62a_100012355270_100009815848 [0,2,0,0,0,0|0,0,2]=4 17711 B14R0.337 C=CCCCCCCNCCC(C)CC 2230a_100020591266_100011215473 [0,2,0,0,0,0|1,0,1]=4 17712 B14R0.337 C=CCCCCCCNCCC(C)CO 2230a_106354213184_100011215473 [0,2,0,0,0,0|0,0,2]=4 17713 B14R0.337 C=CCCCCCCNCCC(C)CO 34a_106354213184_100011215473 [0,2,0,0,0,0|0,0,2]=4 17714 B14R0.337 C=CCCCCCCOCCC(C)CC 7a_100011215188_100011215473 [0,2,0,0,0,0|1,0,1]=4 17715 B14R0.337 C=CCCCCCOCCCC(C)CC 7a_100011216074_100000700193 [0,2,0,0,0,0|1,0,1]=4 17716 B14R0.337 C=CCCCOCCCCCC(C)CC 7a_200000035636_100000757094 [0,2,0,0,0,0|1,0,1]=4 17717 B14R0.337 C=C[C@H](N)COCCCCCCCCC 34a_100016989147_100011214924 [0,2,0,0,0,0|1,0,1]=4 17718 B14R0.337 C=C[C@H](N)COCCCCCCCCO 34a_100016989147_100000033203 [0,2,0,0,0,0|0,0,2]=4 17719 B14R0.337 CC(C#N)NCCCCCCCCCO 2230a_100000078944_100000184139 [0,2,0,0,0,0|1,0,0]=3 17720 B14R0.337 CC(C#N)NCCCCCCCCCO 2230a_100000737613_100009813782 [0,2,0,0,0,0|1,0,0]=3 17721 B14R0.337 CC(C#N)OCCCCCCCCCBr 7a_100009813782_100000703298 [0,2,0,0,0,0|2,0,0]=4 17722 B14R0.337 CC(C#N)OCCCCCCCCCCl 7a_100009868337_100000703298 [0,2,0,0,0,0|2,0,0]=4 17723 B14R0.337 CC(C#N)OCCCCCCCCCO 34a_100011218135_100009813782 [0,2,0,0,0,0|1,0,0]=3 17724 B14R0.337 CC(C#N)SCCCCCCCCCO 62a_100000703298_100009813782 [0,2,0,0,0,0|1,0,0]=3 17725 B14R0.337 CC(C#N)SCCCCCCCCCO 62a_100009813782_100000703298 [0,2,0,0,0,0|1,0,0]=3 17726 B14R0.337 CC(CF)OCCCCCCCCCO 34a_100016041109_100009813782 [0,2,0,0,0,0|1,0,0]=3 17727 B14R0.337 CC(CF)OCCCCCCCCCO 7a_100016041109_100009813782 [0,2,0,0,0,0|1,0,0]=3 17728 B14R0.337 CC(CN)COCCCCCCCCO 34a_100000744482_100000033203 [0,2,0,0,0,0|1,0,0]=3 17729 B14R0.337 CC(CN)OCCCCCCCCCO 34a_100000210904_100009813782 [0,2,0,0,0,0|1,0,0]=3 17730 B14R0.337 CC(CO)CCNCCCCCCC#N 2230a_106354213184_100009813337 [0,2,0,0,0,0|1,0,1]=4 17731 B14R0.337 CC(CO)CCNCCCCCCCO 2230a_106354213184_100000760002 [0,2,0,0,0,0|1,0,0]=3 17732 B14R0.337 CC(CO)CCNCCCCCCCO 34a_106354213184_100000760002 [0,2,0,0,0,0|1,0,0]=3 17733 B14R0.337 CC(CO)CNCCCCCCCCO 34a_100000744482_100000033203 [0,2,0,0,0,0|1,0,0]=3 17734 B14R0.337 CC(CO)NCCCCCCCCCO 2230a_100000078944_100012180447 [0,2,0,0,0,0|1,0,0]=3 17735 B14R0.337 CC(CO)NCCCCCCCCCO 34a_100000078944_100012180447 [0,2,0,0,0,0|1,0,0]=3 17736 B14R0.337 CC(CO)OCCCCCCCCCBr 34a_100009813782_100012180447 [0,2,0,0,0,0|1,0,0]=3 17737 B14R0.337 CC(CO)OCCCCCCCCCBr 7a_100009813782_100012180447 [0,2,0,0,0,0|1,0,0]=3 17738 B14R0.337 CC(CO)OCCCCCCCCCCl 34a_100009868337_100012180447 [0,2,0,0,0,0|1,0,0]=3 17739 B14R0.337 CC(CO)OCCCCCCCCCCl 7a_100009868337_100012180447 [0,2,0,0,0,0|1,0,0]=3 17740 B14R0.337 CC(CO)OCCCCCCCCCN 34a_100000078944_100012180447 [0,2,0,0,0,0|1,0,0]=3 17741 B14R0.337 CC(CO)SCCCCCCCCCO 62a_100012180447_100009813782 [0,2,0,0,0,0|1,0,0]=3 17742 B14R0.337 CC/C=C\CCCCCNCC(C)CO 269862a_100000744482_100016288537 [0,2,0,0,0,0|0,0,2]=4 17743 B14R0.337 CC/C=C\CCCCCNC[C@@H](F)CO 269862a_100015665980_100016288537 [0,2,0,0,0,0|0,0,2]=4 17744 B14R0.337 CC/C=C\CCCCCNC[C@H](O)CO 269862a_100020644852_100016288537 [0,2,0,0,0,0|0,0,2]=4 17745 B14R0.337 CC/C=C\CCCCCOCC(O)CO 34a_100016268722_100011219619 [0,2,0,0,0,0|0,0,2]=4 17746 B14R0.337 CC/C=C\CCCCCOCC(O)CO 7a_100016268722_100011219619 [0,2,0,0,0,0|0,0,2]=4 17747 B14R0.337 CC/C=C\CCCCCOC[C@@H](C)CO 34a_100016268722_100000059175 [0,2,0,0,0,0|0,0,2]=4 17748 B14R0.337 CC/C=C\CCCCCOC[C@@H](C)CO 7a_100016268722_100000059175 [0,2,0,0,0,0|0,0,2]=4 17749 B14R0.337 CC/C=C\CCCCCOC[C@@H](O)CO 34a_100016268722_100009815848 [0,2,0,0,0,0|0,0,2]=4 17750 B14R0.337 CC/C=C\CCCCCOC[C@@H](O)CO 7a_100016268722_100009815848 [0,2,0,0,0,0|0,0,2]=4 17751 B14R0.337 CCC#CCCCCCCN[C@H](C)CO 2230a_100000737577_200000036426 [0,2,0,0,0,0|0,0,2]=4 17752 B14R0.337 CCC#CCCCCCCSC(C)CO 62a_100012180447_200000036426 [0,2,0,0,0,0|0,0,2]=4 17753 B14R0.337 CCC#CCCCCCCS[C@H](C)CO 62a_100016084084_200000036426 [0,2,0,0,0,0|0,0,2]=4 17754 B14R0.337 CCC#CCCCCCCS[C@H](C)CO 62a_200000036426_100016084084 [0,2,0,0,0,0|0,0,2]=4 17755 B14R0.337 CCC(=O)CCCCCCCCCCO 1458a_100000210414_100009813290 [0,2,0,0,0,0|0,0,0]=2 17756 B14R0.337 CCC(=O)COCCCCCCCCBr 7a_100009813846_100000747405 [0,2,0,0,0,0|1,0,1]=4 17757 B14R0.337 CCC(=O)COCCCCCCCCCl 7a_100000033203_100000747405 [0,2,0,0,0,0|1,0,1]=4 17758 B14R0.337 CCC(=O)COCCCCCCCCO 34a_100000725409_100000033203 [0,2,0,0,0,0|0,0,1]=3 17759 B14R0.337 CCC(=O)CSCCCCCCCCO 62a_100000033203_100000747405 [0,2,0,0,0,0|0,0,1]=3 17760 B14R0.337 CCC(=O)CSCCCCCCCCO 62a_100000747405_100000033203 [0,2,0,0,0,0|0,0,1]=3 17761 B14R0.337 CCC(=O)NCCCCCCCCCO 240690a_100000078944_100000210414 [0,2,0,0,0,0|0,0,1]=3 17762 B14R0.337 CCC(=O)NCCNCCCCCCO 34a_100132302217_100000766143 [0,2,0,0,0,0|1,0,1]=4 17763 B14R0.337 CCC(=O)NCCOCCCCCCO 34a_200000158885_100000766143 [0,2,0,0,0,0|1,0,1]=4 17764 B14R0.337 CCC(=O)NCCOCCCCCCO 7a_200000158885_100000766143 [0,2,0,0,0,0|1,0,1]=4 17765 B14R0.337 CCC(=O)OCCOCCCCCCO 7a_200000031056_100000766143 [0,2,0,0,0,0|1,0,1]=4 17766 B14R0.337 CCC(C)CCCCCOCC#CCO 7a_200000035636_200000047223 [0,2,0,0,0,0|0,0,2]=4 17767 B14R0.337 CCC(C)CCCCCOCCCC#N 7a_200000035636_100000687738 [0,2,0,0,0,0|1,0,1]=4 17768 B14R0.337 CCC(C)CCCCCOCCCC=O 7a_200000035636_200011292268 [0,2,0,0,0,0|0,0,2]=4 17769 B14R0.337 CCC(C)CCCCCOCCCCF 7a_200000035636_100000729493 [0,2,0,0,0,0|1,0,0]=3 17770 B14R0.337 CCC(C)CCCCCOCCCCO 7a_200000035636_100000210776 [0,2,0,0,0,0|0,0,0]=2 17771 B14R0.337 CCC(C)CCCCCOCCCOC 7a_200000035636_100000740836 [0,2,0,0,0,0|1,0,0]=3 17772 B14R0.337 CCC(C)CCCOCCCCCC#N 7a_100011216074_100009813376 [0,2,0,0,0,0|1,0,1]=4 17773 B14R0.337 CCC(C)CCCOCCCCCC=O 7a_100011216074_100000139337 [0,2,0,0,0,0|0,0,2]=4 17774 B14R0.337 CCC(C)CCCOCCCCCCF 7a_100011216074_100015922095 [0,2,0,0,0,0|1,0,0]=3 17775 B14R0.337 CCC(C)CCCOCCCCCCO 7a_100011216074_100000766143 [0,2,0,0,0,0|0,0,0]=2 17776 B14R0.337 CCC(C)CCCOCCOCCOC 7a_100011216074_100000695917 [0,2,0,0,0,0|2,0,0]=4 17777 B14R0.337 CCC(C)CCNCCCCCCC#N 2230a_100020591266_100009813337 [0,2,0,0,0,0|1,0,1]=4 17778 B14R0.337 CCC(C)CCNCCCCCCCO 2230a_100020591266_100000760002 [0,2,0,0,0,0|0,0,0]=2 17779 B14R0.337 CCC(C)CCNCCCCCCOC 2230a_100020591266_100011998445 [0,2,0,0,0,0|1,0,0]=3 17780 B14R0.337 CCC(C)CCNCCCOCCOC 2230a_100020591266_100011216529 [0,2,0,0,0,0|2,0,0]=4 17781 B14R0.337 CCC(C)CCOCCCCCCC#N 7a_100011215188_100009813337 [0,2,0,0,0,0|1,0,1]=4 17782 B14R0.337 CCC(C)CCOCCCCCCCO 7a_100011215188_100000760002 [0,2,0,0,0,0|0,0,0]=2 17783 B14R0.337 CCC(C)CCOCCCCCCOC 7a_100011215188_100011998445 [0,2,0,0,0,0|1,0,0]=3 17784 B14R0.337 CCC(C)CCOCCCOCCOC 7a_100011215188_100011216529 [0,2,0,0,0,0|2,0,0]=4 17785 B14R0.337 CCC(C)CNCCCCCCCCO 2230a_100020588543_100000033203 [0,2,0,0,0,0|0,0,0]=2 17786 B14R0.337 CCC(C)CNCCCCCCCCO 2230a_102515433106_100000748023 [0,2,0,0,0,0|0,0,0]=2 17787 B14R0.337 CCC(C)CNCCCCCCCCO 270004a_102515433106_100000243153 [0,2,0,0,0,0|0,0,0]=2 17788 B14R0.337 CCC(C)CNCCCCCCCCO 34a_102515433106_100000748023 [0,2,0,0,0,0|0,0,0]=2 17789 B14R0.337 CCC(C)CNCCOCCOCCO 2230a_100011998139_100000748023 [0,2,0,0,0,0|2,0,0]=4 17790 B14R0.337 CCC(C)CNCCOCCOCCO 2230a_100020588543_100000032323 [0,2,0,0,0,0|2,0,0]=4 17791 B14R0.337 CCC(C)CNCCOCCOCCO 270004a_100011998139_100000243153 [0,2,0,0,0,0|2,0,0]=4 17792 B14R0.337 CCC(C)CNCCOCCOCCO 34a_100011998139_100000748023 [0,2,0,0,0,0|2,0,0]=4 17793 B14R0.337 CCC(C)COCCCCCCCCBr 34a_100009813846_100000748023 [0,2,0,0,0,0|1,0,0]=3 17794 B14R0.337 CCC(C)COCCCCCCCCBr 7a_100009813846_100000748023 [0,2,0,0,0,0|1,0,0]=3 17795 B14R0.337 CCC(C)COCCCCCCCCCl 34a_100000033203_100000748023 [0,2,0,0,0,0|1,0,0]=3 17796 B14R0.337 CCC(C)COCCCCCCCCCl 7a_100000033203_100000748023 [0,2,0,0,0,0|1,0,0]=3 17797 B14R0.337 CCC(C)COCCCCCCCCN 34a_102515433106_100000748023 [0,2,0,0,0,0|1,0,0]=3 17798 B14R0.337 CCC(C)COCCCCCNCCN 34a_103619048469_100000748023 [0,2,0,0,0,0|2,0,0]=4 17799 B14R0.337 CCC(C)COCCCOCCCOC 34a_200011215475_100000748023 [0,2,0,0,0,0|2,0,0]=4 17800 B14R0.337 CCC(C)COCCCOCCCOC 7a_200011215475_100000748023 [0,2,0,0,0,0|2,0,0]=4 17801 B14R0.337 CCC(C)CSCCCCCCCCO 62a_100000033203_100000748023 [0,2,0,0,0,0|0,0,0]=2 17802 B14R0.337 CCC(C)CSCCCCCCCCO 62a_100000748023_100000033203 [0,2,0,0,0,0|0,0,0]=2 17803 B14R0.337 CCC(C)CSCCOCCOCCO 62a_100000032323_100000748023 [0,2,0,0,0,0|2,0,0]=4 17804 B14R0.337 CCC(C)CSCCOCCOCCO 62a_100000748023_100000032323 [0,2,0,0,0,0|2,0,0]=4 17805 B14R0.337 CCC(C)NCCCCCCCCCO 2230a_100000078944_100000758301 [0,2,0,0,0,0|0,0,0]=2 17806 B14R0.337 CCC(C)NCCCCCCCCCO 2230a_100000209981_100009813782 [0,2,0,0,0,0|0,0,0]=2 17807 B14R0.337 CCC(C)NCCCCCCCCCO 34a_100000078944_100011215416 [0,2,0,0,0,0|0,0,0]=2 17808 B14R0.337 CCC(C)NCCCOCCOCCO 2230a_100011996194_100000758301 [0,2,0,0,0,0|2,0,0]=4 17809 B14R0.337 CCC(C)NCCCOCCOCCO 34a_100011996194_100011215416 [0,2,0,0,0,0|2,0,0]=4 17810 B14R0.337 CCC(C)OCCCCCCCCCBr 34a_100009813782_100011215416 [0,2,0,0,0,0|1,0,0]=3 17811 B14R0.337 CCC(C)OCCCCCCCCCBr 7a_100009813782_100000758301 [0,2,0,0,0,0|1,0,0]=3 17812 B14R0.337 CCC(C)OCCCCCCCCCCl 34a_100009868337_100011215416 [0,2,0,0,0,0|1,0,0]=3 17813 B14R0.337 CCC(C)OCCCCCCCCCCl 7a_100009868337_100000758301 [0,2,0,0,0,0|1,0,0]=3 17814 B14R0.337 CCC(C)OCCCCCCCCCN 34a_100000078944_100011215416 [0,2,0,0,0,0|1,0,0]=3 17815 B14R0.337 CCC(C)OCCCCCCCCCO 7a_100000210228_100009813782 [0,2,0,0,0,0|0,0,0]=2 17816 B14R0.337 CCC(C)SCCCCCCCCCO 62a_100000758301_100009813782 [0,2,0,0,0,0|0,0,0]=2 17817 B14R0.337 CCC(C)SCCCCCCCCCO 62a_100009813782_100000758301 [0,2,0,0,0,0|0,0,0]=2 17818 B14R0.337 CCC(O)CNCCCCCCCCO 2230a_100011218483_100000033203 [0,2,0,0,0,0|0,0,0]=2 17819 B14R0.337 CCC(O)CNCCCCCCCCO 2230a_102515433106_100011218378 [0,2,0,0,0,0|0,0,0]=2 17820 B14R0.337 CCC(O)CNCCCCCCCCO 34a_102515433106_100011218378 [0,2,0,0,0,0|0,0,0]=2 17821 B14R0.337 CCC(O)CNCCOCCOCCO 2230a_100011218483_100000032323 [0,2,0,0,0,0|2,0,0]=4 17822 B14R0.337 CCC(O)CNCCOCCOCCO 2230a_100011998139_100011218378 [0,2,0,0,0,0|2,0,0]=4 17823 B14R0.337 CCC(O)CNCCOCCOCCO 34a_100011998139_100011218378 [0,2,0,0,0,0|2,0,0]=4 17824 B14R0.337 CCC(O)COCCCCCCCCBr 34a_100009813846_100011218378 [0,2,0,0,0,0|1,0,0]=3 17825 B14R0.337 CCC(O)COCCCCCCCCBr 7a_100009813846_100011218378 [0,2,0,0,0,0|1,0,0]=3 17826 B14R0.337 CCC(O)COCCCCCCCCCl 34a_100000033203_100011218378 [0,2,0,0,0,0|1,0,0]=3 17827 B14R0.337 CCC(O)COCCCCCCCCCl 7a_100000033203_100011218378 [0,2,0,0,0,0|1,0,0]=3 17828 B14R0.337 CCC(O)COCCCCCCCCN 34a_102515433106_100011218378 [0,2,0,0,0,0|1,0,0]=3 17829 B14R0.337 CCC(O)COCCCCCNCCN 34a_103619048469_100011218378 [0,2,0,0,0,0|2,0,0]=4 17830 B14R0.337 CCC(O)COCCCOCCCOC 34a_200011215475_100011218378 [0,2,0,0,0,0|2,0,0]=4 17831 B14R0.337 CCC(O)COCCCOCCCOC 7a_200011215475_100011218378 [0,2,0,0,0,0|2,0,0]=4 17832 B14R0.337 CCC(O)CSCCCCCCCCO 62a_100000033203_100011218378 [0,2,0,0,0,0|0,0,0]=2 17833 B14R0.337 CCC(O)CSCCCCCCCCO 62a_100011218378_100000033203 [0,2,0,0,0,0|0,0,0]=2 17834 B14R0.337 CCC(O)CSCCOCCOCCO 62a_100000032323_100011218378 [0,2,0,0,0,0|2,0,0]=4 17835 B14R0.337 CCC(O)CSCCOCCOCCO 62a_100011218378_100000032323 [0,2,0,0,0,0|2,0,0]=4 17836 B14R0.337 CCCC/C=C/CCCCOC(C)CO 34a_200020645093_100012180447 [0,2,0,0,0,0|0,0,2]=4 17837 B14R0.337 CCCC/C=C/CCCCOC(C)CO 7a_200020645093_100012180447 [0,2,0,0,0,0|0,0,2]=4 17838 B14R0.337 CCCCC#CCCCCOC(C)CO 34a_200000066234_100012180447 [0,2,0,0,0,0|0,0,2]=4 17839 B14R0.337 CCCCC#CCCCCOC(C)CO 7a_200000066234_100012180447 [0,2,0,0,0,0|0,0,2]=4 17840 B14R0.337 CCCCC#CCCCNCC(C)CO 34a_100000744482_200000047210 [0,2,0,0,0,0|0,0,2]=4 17841 B14R0.337 CCCCC#CCCCNC[C@@H](F)CO 34a_100015665980_200000047210 [0,2,0,0,0,0|0,0,2]=4 17842 B14R0.337 CCCCC#CCCCNC[C@H](O)CO 2230a_100020644852_200000047210 [0,2,0,0,0,0|0,0,2]=4 17843 B14R0.337 CCCCC#CCCCSCC(O)CO 62a_100011219619_200000047210 [0,2,0,0,0,0|0,0,2]=4 17844 B14R0.337 CCCCC#CCCCSCC(O)CO 62a_200000047210_100011219619 [0,2,0,0,0,0|0,0,2]=4 17845 B14R0.337 CCCCC#CCCCSC[C@@H](C)CO 62a_100000059175_200000047210 [0,2,0,0,0,0|0,0,2]=4 17846 B14R0.337 CCCCC#CCCCSC[C@@H](C)CO 62a_200000047210_100000059175 [0,2,0,0,0,0|0,0,2]=4 17847 B14R0.337 CCCCC#CCCCSC[C@@H](O)CO 62a_100009815848_200000047210 [0,2,0,0,0,0|0,0,2]=4 17848 B14R0.337 CCCCC#CCCCSC[C@@H](O)CO 62a_200000047210_100009815848 [0,2,0,0,0,0|0,0,2]=4 17849 B14R0.337 CCCCC/C=C\CCCOC(C)CO 34a_100020655193_100012180447 [0,2,0,0,0,0|0,0,2]=4 17850 B14R0.337 CCCCC/C=C\CCCOC(C)CO 7a_100020655193_100012180447 [0,2,0,0,0,0|0,0,2]=4 17851 B14R0.337 CCCCC/C=C\CCOCC(O)CO 34a_100016277358_100011219619 [0,2,0,0,0,0|0,0,2]=4 17852 B14R0.337 CCCCC/C=C\CCOCC(O)CO 7a_100016277358_100011219619 [0,2,0,0,0,0|0,0,2]=4 17853 B14R0.337 CCCCC/C=C\CCOC[C@@H](C)CO 34a_100016277358_100000059175 [0,2,0,0,0,0|0,0,2]=4 17854 B14R0.337 CCCCC/C=C\CCOC[C@@H](C)CO 7a_100016277358_100000059175 [0,2,0,0,0,0|0,0,2]=4 17855 B14R0.337 CCCCC/C=C\CCOC[C@@H](O)CO 34a_100016277358_100009815848 [0,2,0,0,0,0|0,0,2]=4 17856 B14R0.337 CCCCC/C=C\CCOC[C@@H](O)CO 7a_100016277358_100009815848 [0,2,0,0,0,0|0,0,2]=4 17857 B14R0.337 CCCCCC#CCCOCC(O)CO 34a_200000042877_100011219619 [0,2,0,0,0,0|0,0,2]=4 17858 B14R0.337 CCCCCC#CCCOCC(O)CO 7a_200000042877_100011219619 [0,2,0,0,0,0|0,0,2]=4 17859 B14R0.337 CCCCCC#CCCOC[C@@H](C)CO 34a_200000042877_100000059175 [0,2,0,0,0,0|0,0,2]=4 17860 B14R0.337 CCCCCC#CCCOC[C@@H](C)CO 7a_200000042877_100000059175 [0,2,0,0,0,0|0,0,2]=4 17861 B14R0.337 CCCCCC#CCCOC[C@@H](O)CO 34a_200000042877_100009815848 [0,2,0,0,0,0|0,0,2]=4 17862 B14R0.337 CCCCCC#CCCOC[C@@H](O)CO 7a_200000042877_100009815848 [0,2,0,0,0,0|0,0,2]=4 17863 B14R0.337 CCCCCC#CCNCCC(C)CO 2230a_106354213184_100009816472 [0,2,0,0,0,0|0,0,2]=4 17864 B14R0.337 CCCCCC#CCNCCC(C)CO 34a_106354213184_100009816472 [0,2,0,0,0,0|0,0,2]=4 17865 B14R0.337 CCCCCC/C=C/COCC(O)CO 34a_200016276170_100011219619 [0,2,0,0,0,0|0,0,2]=4 17866 B14R0.337 CCCCCC/C=C/COCC(O)CO 7a_200016276170_100011219619 [0,2,0,0,0,0|0,0,2]=4 17867 B14R0.337 CCCCCC/C=C/COC[C@@H](C)CO 34a_200016276170_100000059175 [0,2,0,0,0,0|0,0,2]=4 17868 B14R0.337 CCCCCC/C=C/COC[C@@H](C)CO 7a_200016276170_100000059175 [0,2,0,0,0,0|0,0,2]=4 17869 B14R0.337 CCCCCC/C=C/COC[C@@H](O)CO 34a_200016276170_100009815848 [0,2,0,0,0,0|0,0,2]=4 17870 B14R0.337 CCCCCC/C=C/COC[C@@H](O)CO 7a_200016276170_100009815848 [0,2,0,0,0,0|0,0,2]=4 17871 B14R0.337 CCCCCCC#CCCOC(C)CO 34a_200000033163_100012180447 [0,2,0,0,0,0|0,0,2]=4 17872 B14R0.337 CCCCCCC#CCCOC(C)CO 7a_200000033163_100012180447 [0,2,0,0,0,0|0,0,2]=4 17873 B14R0.337 CCCCCCC#CCOCC(O)CO 34a_200000037284_100011219619 [0,2,0,0,0,0|0,0,2]=4 17874 B14R0.337 CCCCCCC#CCOCC(O)CO 7a_200000037284_100011219619 [0,2,0,0,0,0|0,0,2]=4 17875 B14R0.337 CCCCCCC#CCOC[C@@H](C)CO 34a_200000037284_100000059175 [0,2,0,0,0,0|0,0,2]=4 17876 B14R0.337 CCCCCCC#CCOC[C@@H](C)CO 7a_200000037284_100000059175 [0,2,0,0,0,0|0,0,2]=4 17877 B14R0.337 CCCCCCC#CCOC[C@@H](O)CO 34a_200000037284_100009815848 [0,2,0,0,0,0|0,0,2]=4 17878 B14R0.337 CCCCCCC#CCOC[C@@H](O)CO 7a_200000037284_100009815848 [0,2,0,0,0,0|0,0,2]=4 17879 B14R0.337 CCCCCCCC#CCOC(C)CO 34a_200000061759_100012180447 [0,2,0,0,0,0|0,0,2]=4 17880 B14R0.337 CCCCCCCC#CCOC(C)CO 7a_200000061759_100012180447 [0,2,0,0,0,0|0,0,2]=4 17881 B14R0.337 CCCCCCCCCCCC(=O)CC 1458a_100000210414_100011215454 [0,2,0,0,0,0|1,0,0]=3 17882 B14R0.337 CCCCCCCCCCCC(=O)CC 1458a_100000210736_100000210202 [0,2,0,0,0,0|1,0,0]=3 17883 B14R0.337 CCCCCCCCCCCC(=O)CF 1458a_100000210736_100015361967 [0,2,0,0,0,0|1,0,0]=3 17884 B14R0.337 CCCCCCCCCCCC(=O)CO 1458a_100000210174_100011215454 [0,2,0,0,0,0|0,0,0]=2 17885 B14R0.337 CCCCCCCCCCCC(=O)NC 11a_106832991635_100000210736 [0,2,0,0,0,0|0,0,2]=4 17886 B14R0.337 CCCCCCCCCCCC(=O)NC 1626a_100102657272_100000210736 [0,2,0,0,0,0|0,0,2]=4 17887 B14R0.337 CCCCCCCCCCCC(=O)NC 240690a_100102657272_100000210736 [0,2,0,0,0,0|0,0,2]=4 17888 B14R0.337 CCCCCCCCCCCC(C)NC 270004a_106832991635_100011216755 [0,2,0,0,0,0|1,0,0]=3 17889 B14R0.337 CCCCCCCCCCCC(C)OC 34a_100011217895_200000210301 [0,2,0,0,0,0|0,0,0]=2 17890 B14R0.337 CCCCCCCCCCCC(C)OC 7a_100011217895_200000210301 [0,2,0,0,0,0|0,0,0]=2 17891 B14R0.337 CCCCCCCCCCCC(C)O[13CH3] 34a_100011217895_200025704644 [0,2,0,0,0,0|0,0,0]=2 17892 B14R0.337 CCCCCCCCCCCC(C)O[13CH3] 7a_100011217895_200025704644 [0,2,0,0,0,0|0,0,0]=2 17893 B14R0.337 CCCCCCCCCCCN(C)CC 2230a_100000225621_100011215454 [0,2,0,0,0,0|1,0,0]=3 17894 B14R0.337 CCCCCCCCCCCN(C)CC 269982a_100000225621_100011215454 [0,2,0,0,0,0|1,0,0]=3 17895 B14R0.337 CCCCCCCCCCNC(=O)CC 11a_100000684558_100000210414 [0,2,0,0,0,0|1,0,1]=4 17896 B14R0.337 CCCCCCCCCCNC(=O)CC 1626a_100000684558_100000210414 [0,2,0,0,0,0|1,0,1]=4 17897 B14R0.337 CCCCCCCCCCNC(=O)CC 240690a_100000684558_100000210414 [0,2,0,0,0,0|1,0,1]=4 17898 B14R0.337 CCCCCCCCCCNC(=O)CC 527a_100000684558_100000210414 [0,2,0,0,0,0|1,0,1]=4 17899 B14R0.337 CCCCCCCCCCNC(=O)CO 240690a_100000684558_100000210174 [0,2,0,0,0,0|0,0,1]=3 17900 B14R0.337 CCCCCCCCCCNC(=O)CO 527a_100000684558_100000210174 [0,2,0,0,0,0|0,0,1]=3 17901 B14R0.337 CCCCCCCCCCNC(C)C#N 2230a_100000684558_100000184139 [0,2,0,0,0,0|1,0,1]=4 17902 B14R0.337 CCCCCCCCCCNC(C)C#N 2230a_100000737613_100000210320 [0,2,0,0,0,0|1,0,1]=4 17903 B14R0.337 CCCCCCCCCCNC(C)CC 2230a_100000209981_100000210320 [0,2,0,0,0,0|1,0,0]=3 17904 B14R0.337 CCCCCCCCCCNC(C)CC 2230a_100000684558_100000758301 [0,2,0,0,0,0|1,0,0]=3 17905 B14R0.337 CCCCCCCCCCNC(C)CC 34a_100000684558_100011215416 [0,2,0,0,0,0|1,0,0]=3 17906 B14R0.337 CCCCCCCCCCNC(C)CO 2230a_100000684558_100012180447 [0,2,0,0,0,0|0,0,0]=2 17907 B14R0.337 CCCCCCCCCCNC(C)CO 34a_100000684558_100012180447 [0,2,0,0,0,0|0,0,0]=2 17908 B14R0.337 CCCCCCCCCCN[C@H](C)CO 2230a_100000737577_100000210320 [0,2,0,0,0,0|0,0,0]=2 17909 B14R0.337 CCCCCCCCCCOC(C)C#N 34a_100011218135_100000210320 [0,2,0,0,0,0|1,0,1]=4 17910 B14R0.337 CCCCCCCCCCOC(C)C#N 7a_100000210711_100000703298 [0,2,0,0,0,0|1,0,1]=4 17911 B14R0.337 CCCCCCCCCCOC(C)CC 34a_100000210711_100011215416 [0,2,0,0,0,0|1,0,0]=3 17912 B14R0.337 CCCCCCCCCCOC(C)CC 7a_100000210228_100000210320 [0,2,0,0,0,0|1,0,0]=3 17913 B14R0.337 CCCCCCCCCCOC(C)CC 7a_100000210711_100000758301 [0,2,0,0,0,0|1,0,0]=3 17914 B14R0.337 CCCCCCCCCCOC(C)CF 34a_100016041109_100000210320 [0,2,0,0,0,0|1,0,0]=3 17915 B14R0.337 CCCCCCCCCCOC(C)CF 7a_100016041109_100000210320 [0,2,0,0,0,0|1,0,0]=3 17916 B14R0.337 CCCCCCCCCCOC(C)CN 34a_100000210904_100000210320 [0,2,0,0,0,0|1,0,0]=3 17917 B14R0.337 CCCCCCCCCCOC(C)CO 34a_100000210711_100012180447 [0,2,0,0,0,0|0,0,0]=2 17918 B14R0.337 CCCCCCCCCCOC(C)CO 7a_100000210711_100012180447 [0,2,0,0,0,0|0,0,0]=2 17919 B14R0.337 CCCCCCCCCCSC(C)C#N 62a_100000703298_100000210320 [0,2,0,0,0,0|1,0,1]=4 17920 B14R0.337 CCCCCCCCCCSC(C)CC 62a_100000758301_100000210320 [0,2,0,0,0,0|1,0,0]=3 17921 B14R0.337 CCCCCCCCCCSC(C)CO 62a_100012180447_100000210320 [0,2,0,0,0,0|0,0,0]=2 17922 B14R0.337 CCCCCCCCCCSC(C)OC 62a_100009879195_100000210320 [0,2,0,0,0,0|1,0,0]=3 17923 B14R0.337 CCCCCCCCCCSC(F)C#N 62a_200000117898_100000210320 [0,2,0,0,0,0|1,0,1]=4 17924 B14R0.337 CCCCCCCCCCS[C@H](C)CO 62a_100016084084_100000210320 [0,2,0,0,0,0|0,0,0]=2 17925 B14R0.337 CCCCCCCCCNCC(=O)OC 2230a_100000212291_100000747449 [0,2,0,0,0,0|1,0,1]=4 17926 B14R0.337 CCCCCCCCCNCC(=O)OC 34a_100000212291_100000747449 [0,2,0,0,0,0|1,0,1]=4 17927 B14R0.337 CCCCCCCCCNCC(C)CC 2230a_100000212291_100000748023 [0,2,0,0,0,0|1,0,0]=3 17928 B14R0.337 CCCCCCCCCNCC(C)CC 2230a_100020588543_100011214924 [0,2,0,0,0,0|1,0,0]=3 17929 B14R0.337 CCCCCCCCCNCC(C)CC 270004a_100000212291_100000243153 [0,2,0,0,0,0|1,0,0]=3 17930 B14R0.337 CCCCCCCCCNCC(C)CC 34a_100000212291_100000748023 [0,2,0,0,0,0|1,0,0]=3 17931 B14R0.337 CCCCCCCCCNCC(C)CO 34a_100000744482_100011214924 [0,2,0,0,0,0|0,0,0]=2 17932 B14R0.337 CCCCCCCCCNCC(O)CC 2230a_100000212291_100011218378 [0,2,0,0,0,0|1,0,0]=3 17933 B14R0.337 CCCCCCCCCNCC(O)CC 2230a_100011218483_100011214924 [0,2,0,0,0,0|1,0,0]=3 17934 B14R0.337 CCCCCCCCCNCC(O)CC 34a_100000212291_100011218378 [0,2,0,0,0,0|1,0,0]=3 17935 B14R0.337 CCCCCCCCCNCC(O)CO 2230a_100000212291_100011219619 [0,2,0,0,0,0|0,0,0]=2 17936 B14R0.337 CCCCCCCCCNCC(O)CO 34a_100000212291_100011219619 [0,2,0,0,0,0|0,0,0]=2 17937 B14R0.337 CCCCCCCCCNC[C@@H](C)CC 2230a_100000212291_100009816398 [0,2,0,0,0,0|1,0,0]=3 17938 B14R0.337 CCCCCCCCCNC[C@@H](C)CC 34a_100000212291_100009816398 [0,2,0,0,0,0|1,0,0]=3 17939 B14R0.337 CCCCCCCCCNC[C@@H](C)CO 2230a_100000212291_100000059175 [0,2,0,0,0,0|0,0,0]=2 17940 B14R0.337 CCCCCCCCCNC[C@@H](C)CO 34a_100000212291_100000059175 [0,2,0,0,0,0|0,0,0]=2 17941 B14R0.337 CCCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100011214924 [0,2,0,0,0,0|1,0,0]=3 17942 B14R0.337 CCCCCCCCCNC[C@@H](F)CO 34a_100015665980_100011214924 [0,2,0,0,0,0|0,0,0]=2 17943 B14R0.337 CCCCCCCCCNC[C@@H](O)CF 2230a_100000212291_100015614560 [0,2,0,0,0,0|1,0,0]=3 17944 B14R0.337 CCCCCCCCCNC[C@@H](O)CF 34a_100000212291_100015614560 [0,2,0,0,0,0|1,0,0]=3 17945 B14R0.337 CCCCCCCCCNC[C@@H](O)CO 2230a_100000212291_100009815848 [0,2,0,0,0,0|0,0,0]=2 17946 B14R0.337 CCCCCCCCCNC[C@@H](O)CO 34a_100000212291_100009815848 [0,2,0,0,0,0|0,0,0]=2 17947 B14R0.337 CCCCCCCCCNC[C@H](O)CO 2230a_100020644852_100011214924 [0,2,0,0,0,0|0,0,0]=2 17948 B14R0.337 CCCCCCCCCOCC(=O)CC 34a_100000725409_100011214924 [0,2,0,0,0,0|1,0,1]=4 17949 B14R0.337 CCCCCCCCCOCC(=O)CC 7a_100000210712_100000747405 [0,2,0,0,0,0|1,0,1]=4 17950 B14R0.337 CCCCCCCCCOCC(=O)OC 34a_100000210712_100000747449 [0,2,0,0,0,0|1,0,1]=4 17951 B14R0.337 CCCCCCCCCOCC(=O)OC 7a_100000210712_100000747449 [0,2,0,0,0,0|1,0,1]=4 17952 B14R0.337 CCCCCCCCCOCC(C)CC 34a_100000210712_100000748023 [0,2,0,0,0,0|1,0,0]=3 17953 B14R0.337 CCCCCCCCCOCC(C)CC 7a_100000210712_100000748023 [0,2,0,0,0,0|1,0,0]=3 17954 B14R0.337 CCCCCCCCCOCC(C)CN 34a_100000744482_100011214924 [0,2,0,0,0,0|1,0,0]=3 17955 B14R0.337 CCCCCCCCCOCC(C)OC 34a_100000690652_100011214924 [0,2,0,0,0,0|1,0,0]=3 17956 B14R0.337 CCCCCCCCCOCC(Cl)CCl 34a_100000033668_100011214924 [0,2,0,0,0,0|1,0,0]=3 17957 B14R0.337 CCCCCCCCCOCC(O)CC 34a_100000210712_100011218378 [0,2,0,0,0,0|1,0,0]=3 17958 B14R0.337 CCCCCCCCCOCC(O)CC 7a_100000210712_100011218378 [0,2,0,0,0,0|1,0,0]=3 17959 B14R0.337 CCCCCCCCCOCC(O)CO 34a_100000210712_100011219619 [0,2,0,0,0,0|0,0,0]=2 17960 B14R0.337 CCCCCCCCCOCC(O)CO 7a_100000210712_100011219619 [0,2,0,0,0,0|0,0,0]=2 17961 B14R0.337 CCCCCCCCCOC[C@@H](C)CC 34a_100000210712_100009816398 [0,2,0,0,0,0|1,0,0]=3 17962 B14R0.337 CCCCCCCCCOC[C@@H](C)CC 7a_100000210712_100009816398 [0,2,0,0,0,0|1,0,0]=3 17963 B14R0.337 CCCCCCCCCOC[C@@H](C)CC 7a_100009816381_100000210328 [0,2,0,0,0,0|1,0,0]=3 17964 B14R0.337 CCCCCCCCCOC[C@@H](C)CO 34a_100000210712_100000059175 [0,2,0,0,0,0|0,0,0]=2 17965 B14R0.337 CCCCCCCCCOC[C@@H](C)CO 7a_100000210712_100000059175 [0,2,0,0,0,0|0,0,0]=2 17966 B14R0.337 CCCCCCCCCOC[C@@H](O)CF 34a_100000210712_100015614560 [0,2,0,0,0,0|1,0,0]=3 17967 B14R0.337 CCCCCCCCCOC[C@@H](O)CF 7a_100000210712_100015614560 [0,2,0,0,0,0|1,0,0]=3 17968 B14R0.337 CCCCCCCCCOC[C@@H](O)CO 34a_100000210712_100009815848 [0,2,0,0,0,0|0,0,0]=2 17969 B14R0.337 CCCCCCCCCOC[C@@H](O)CO 7a_100000210712_100009815848 [0,2,0,0,0,0|0,0,0]=2 17970 B14R0.337 CCCCCCCCCOC[C@H](F)CN 34a_100015665980_100011214924 [0,2,0,0,0,0|1,0,0]=3 17971 B14R0.337 CCCCCCCCCSCC(=O)CC 62a_100000747405_100000210670 [0,2,0,0,0,0|1,0,1]=4 17972 B14R0.337 CCCCCCCCCSCC(=O)OC 62a_100000747449_100000210670 [0,2,0,0,0,0|1,0,1]=4 17973 B14R0.337 CCCCCCCCCSCC(C)CC 62a_100000748023_100000210670 [0,2,0,0,0,0|1,0,0]=3 17974 B14R0.337 CCCCCCCCCSCC(O)CC 62a_100011218378_100000210670 [0,2,0,0,0,0|1,0,0]=3 17975 B14R0.337 CCCCCCCCCSCC(O)CO 62a_100011219619_100000210670 [0,2,0,0,0,0|0,0,0]=2 17976 B14R0.337 CCCCCCCCCSC[C@@H](C)CC 62a_100009816398_100000210670 [0,2,0,0,0,0|1,0,0]=3 17977 B14R0.337 CCCCCCCCCSC[C@@H](C)CO 62a_100000059175_100000210670 [0,2,0,0,0,0|0,0,0]=2 17978 B14R0.337 CCCCCCCCCSC[C@@H](O)CF 62a_100015614560_100000210670 [0,2,0,0,0,0|1,0,0]=3 17979 B14R0.337 CCCCCCCCCSC[C@@H](O)CO 62a_100009815848_100000210670 [0,2,0,0,0,0|0,0,0]=2 17980 B14R0.337 CCCCCCCCNCCC(=O)OC 2230a_100000229939_100000204255 [0,2,0,0,0,0|1,0,1]=4 17981 B14R0.337 CCCCCCCCNCCC(=O)OC 34a_100000229939_100000742370 [0,2,0,0,0,0|1,0,1]=4 17982 B14R0.337 CCCCCCCCNCCC(C)CC 2230a_100020591266_100000210759 [0,2,0,0,0,0|1,0,0]=3 17983 B14R0.337 CCCCCCCCNCCC(C)CO 2230a_106354213184_100000210759 [0,2,0,0,0,0|0,0,0]=2 17984 B14R0.337 CCCCCCCCNCCC(C)CO 34a_106354213184_100000210759 [0,2,0,0,0,0|0,0,0]=2 17985 B14R0.337 CCCCCCCCOCCC(=NO)N 34a_100000749954_100000210759 [0,2,0,0,0,0|1,0,1]=4 17986 B14R0.337 CCCCCCCCOCCC(=O)OC 34a_100000210232_100000742370 [0,2,0,0,0,0|1,0,1]=4 17987 B14R0.337 CCCCCCCCOCCC(=O)OC 7a_100000210232_100000204255 [0,2,0,0,0,0|1,0,1]=4 17988 B14R0.337 CCCCCCCCOCCC(C)CC 7a_100011215188_100000210759 [0,2,0,0,0,0|1,0,0]=3 17989 B14R0.337 CCCCCCCCOCCC(C)OC 7a_100000764861_100000210759 [0,2,0,0,0,0|1,0,0]=3 17990 B14R0.337 CCCCCCCCSCCC(=O)OC 62a_100000204255_100000210317 [0,2,0,0,0,0|1,0,1]=4 17991 B14R0.337 CCCCCCCCSCCC(=O)OC 62a_100000210759_100000204255 [0,2,0,0,0,0|1,0,1]=4 17992 B14R0.337 CCCCCCCNCCCC(=O)OC 2230a_100000229938_100011218270 [0,2,0,0,0,0|1,0,1]=4 17993 B14R0.337 CCCCCCCNCCCN(C)CC 2230a_100000229938_100015186262 [0,2,0,0,0,0|2,0,0]=4 17994 B14R0.337 CCCCCCCOCCCC(=O)OC 34a_100000210272_100000742333 [0,2,0,0,0,0|1,0,1]=4 17995 B14R0.337 CCCCCCCOCCCC(=O)OC 7a_100000210272_100011218270 [0,2,0,0,0,0|1,0,1]=4 17996 B14R0.337 CCCCCCCOCCCC(C)CC 7a_100011216074_100000210614 [0,2,0,0,0,0|1,0,0]=3 17997 B14R0.337 CCCCCCCOCCCN(C)CC 7a_100000210272_100015186262 [0,2,0,0,0,0|2,0,0]=4 17998 B14R0.337 CCCCCCCOCCC[C@@H](C)CN 34a_100160569302_100000210614 [0,2,0,0,0,0|1,0,0]=3 17999 B14R0.337 CCCCCCCSCCCC(=O)OC 62a_100000210614_100011218270 [0,2,0,0,0,0|1,0,1]=4 18000 B14R0.337 CCCCCCCSCCCC(=O)OC 62a_100011218270_100000210316 [0,2,0,0,0,0|1,0,1]=4 18001 B14R0.337 CCCCCCCSCCCN(C)CC 62a_100000210614_100015186262 [0,2,0,0,0,0|2,0,0]=4 18002 B14R0.337 CCCCCCNCCCCC(=O)OC 2230a_100000210581_100000204269 [0,2,0,0,0,0|1,0,1]=4 18003 B14R0.337 CCCCCCOCCCCC(=O)OC 34a_100000059025_100000210314 [0,2,0,0,0,0|1,0,1]=4 18004 B14R0.337 CCCCCCOCCCCC(=O)OC 34a_100000210259_100000204269 [0,2,0,0,0,0|1,0,1]=4 18005 B14R0.337 CCCCCCOCCCCC(=O)OC 7a_100000059025_100000210314 [0,2,0,0,0,0|1,0,1]=4 18006 B14R0.337 CCCCCCOCCCCC(=O)OC 7a_100000210259_100000204269 [0,2,0,0,0,0|1,0,1]=4 18007 B14R0.337 CCCCCCOCCOCC(C)CC 34a_100000691444_100000748023 [0,2,0,0,0,0|2,0,0]=4 18008 B14R0.337 CCCCCCOCCOCC(C)CC 7a_100000691444_100000748023 [0,2,0,0,0,0|2,0,0]=4 18009 B14R0.337 CCCCCCOCCOCC(O)CC 34a_100000691444_100011218378 [0,2,0,0,0,0|2,0,0]=4 18010 B14R0.337 CCCCCCOCCOCC(O)CC 7a_100000691444_100011218378 [0,2,0,0,0,0|2,0,0]=4 18011 B14R0.337 CCCCCCOCCOCC(O)CO 34a_100000691444_100011219619 [0,2,0,0,0,0|1,0,0]=3 18012 B14R0.337 CCCCCCOCCOCC(O)CO 7a_100000691444_100011219619 [0,2,0,0,0,0|1,0,0]=3 18013 B14R0.337 CCCCCCOCCOC[C@@H](C)CC 34a_100000691444_100009816398 [0,2,0,0,0,0|2,0,0]=4 18014 B14R0.337 CCCCCCOCCOC[C@@H](C)CC 7a_100000691444_100009816398 [0,2,0,0,0,0|2,0,0]=4 18015 B14R0.337 CCCCCCOCCOC[C@@H](C)CO 34a_100000691444_100000059175 [0,2,0,0,0,0|1,0,0]=3 18016 B14R0.337 CCCCCCOCCOC[C@@H](C)CO 7a_100000691444_100000059175 [0,2,0,0,0,0|1,0,0]=3 18017 B14R0.337 CCCCCCOCCOC[C@@H](O)CF 34a_100000691444_100015614560 [0,2,0,0,0,0|2,0,0]=4 18018 B14R0.337 CCCCCCOCCOC[C@@H](O)CF 7a_100000691444_100015614560 [0,2,0,0,0,0|2,0,0]=4 18019 B14R0.337 CCCCCCOCCOC[C@@H](O)CO 34a_100000691444_100009815848 [0,2,0,0,0,0|1,0,0]=3 18020 B14R0.337 CCCCCCOCCOC[C@@H](O)CO 7a_100000691444_100009815848 [0,2,0,0,0,0|1,0,0]=3 18021 B14R0.337 CCCCCCSCCCCC(=O)OC 62a_100000204269_100000210757 [0,2,0,0,0,0|1,0,1]=4 18022 B14R0.337 CCCCCCSCCCCC(=O)OC 62a_100000210314_100000204269 [0,2,0,0,0,0|1,0,1]=4 18023 B14R0.337 CCCCCNCCCCCC(=O)OC 2230a_100000209983_100009816466 [0,2,0,0,0,0|1,0,1]=4 18024 B14R0.337 CCCCCOCCCCCC(=O)OC 34a_100000074720_100000718602 [0,2,0,0,0,0|1,0,1]=4 18025 B14R0.337 CCCCCOCCCCCC(=O)OC 34a_100000210253_100009816466 [0,2,0,0,0,0|1,0,1]=4 18026 B14R0.337 CCCCCOCCCCCC(=O)OC 7a_100000074720_100000210326 [0,2,0,0,0,0|1,0,1]=4 18027 B14R0.337 CCCCCOCCCCCC(=O)OC 7a_100000210253_100009816466 [0,2,0,0,0,0|1,0,1]=4 18028 B14R0.337 CCCCCOCCCCCC(C)CC 7a_200000035636_100000210326 [0,2,0,0,0,0|1,0,0]=3 18029 B14R0.337 CCCCCSCCCCCC(=O)OC 62a_100000210326_100009816466 [0,2,0,0,0,0|1,0,1]=4 18030 B14R0.337 CCCCCSCCCCCC(=O)OC 62a_100009816466_100000210326 [0,2,0,0,0,0|1,0,1]=4 18031 B14R0.337 CCCCNCCCCCCC(=O)OC 2230a_100000102301_100009815986 [0,2,0,0,0,0|1,0,1]=4 18032 B14R0.337 CCCCNCCCCCCC(=O)OC 7a_106832991798_100009815986 [0,2,0,0,0,0|1,0,1]=4 18033 B14R0.337 CCCCNCCCCOCC(C)CC 34a_200011216965_100000748023 [0,2,0,0,0,0|2,0,0]=4 18034 B14R0.337 CCCCNCCCCOCC(O)CC 34a_200011216965_100011218378 [0,2,0,0,0,0|2,0,0]=4 18035 B14R0.337 CCCCNCCCCOCC(O)CO 34a_200011216965_100011219619 [0,2,0,0,0,0|1,0,0]=3 18036 B14R0.337 CCCCNCCCCOC[C@@H](C)CC 34a_200011216965_100009816398 [0,2,0,0,0,0|2,0,0]=4 18037 B14R0.337 CCCCNCCCCOC[C@@H](C)CO 34a_200011216965_100000059175 [0,2,0,0,0,0|1,0,0]=3 18038 B14R0.337 CCCCNCCCCOC[C@@H](O)CF 34a_200011216965_100015614560 [0,2,0,0,0,0|2,0,0]=4 18039 B14R0.337 CCCCNCCCCOC[C@@H](O)CO 34a_200011216965_100009815848 [0,2,0,0,0,0|1,0,0]=3 18040 B14R0.337 CCCCOCCCCCCC(=O)OC 34a_100000210227_100009815986 [0,2,0,0,0,0|1,0,1]=4 18041 B14R0.337 CCCCOCCCCCCC(=O)OC 34a_100009863599_100000210210 [0,2,0,0,0,0|1,0,1]=4 18042 B14R0.337 CCCCOCCCCCCC(=O)OC 7a_100000210227_100009815986 [0,2,0,0,0,0|1,0,1]=4 18043 B14R0.337 CCCCOCCCCCCC(=O)OC 7a_100009863599_100000210211 [0,2,0,0,0,0|1,0,1]=4 18044 B14R0.337 CCCCOCCCCOCC(C)CC 34a_200000760531_100000748023 [0,2,0,0,0,0|2,0,0]=4 18045 B14R0.337 CCCCOCCCCOCC(C)CC 7a_200000760531_100000748023 [0,2,0,0,0,0|2,0,0]=4 18046 B14R0.337 CCCCOCCCCOCC(O)CC 34a_200000760531_100011218378 [0,2,0,0,0,0|2,0,0]=4 18047 B14R0.337 CCCCOCCCCOCC(O)CC 7a_200000760531_100011218378 [0,2,0,0,0,0|2,0,0]=4 18048 B14R0.337 CCCCOCCCCOCC(O)CO 34a_200000760531_100011219619 [0,2,0,0,0,0|1,0,0]=3 18049 B14R0.337 CCCCOCCCCOCC(O)CO 7a_200000760531_100011219619 [0,2,0,0,0,0|1,0,0]=3 18050 B14R0.337 CCCCOCCCCOC[C@@H](C)CC 34a_200000760531_100009816398 [0,2,0,0,0,0|2,0,0]=4 18051 B14R0.337 CCCCOCCCCOC[C@@H](C)CC 7a_200000760531_100009816398 [0,2,0,0,0,0|2,0,0]=4 18052 B14R0.337 CCCCOCCCCOC[C@@H](C)CO 34a_200000760531_100000059175 [0,2,0,0,0,0|1,0,0]=3 18053 B14R0.337 CCCCOCCCCOC[C@@H](C)CO 7a_200000760531_100000059175 [0,2,0,0,0,0|1,0,0]=3 18054 B14R0.337 CCCCOCCCCOC[C@@H](O)CF 34a_200000760531_100015614560 [0,2,0,0,0,0|2,0,0]=4 18055 B14R0.337 CCCCOCCCCOC[C@@H](O)CF 7a_200000760531_100015614560 [0,2,0,0,0,0|2,0,0]=4 18056 B14R0.337 CCCCOCCCCOC[C@@H](O)CO 34a_200000760531_100009815848 [0,2,0,0,0,0|1,0,0]=3 18057 B14R0.337 CCCCOCCCCOC[C@@H](O)CO 7a_200000760531_100009815848 [0,2,0,0,0,0|1,0,0]=3 18058 B14R0.337 CCCCOCCOCCCC(C)CC 7a_100011216074_100000743108 [0,2,0,0,0,0|2,0,0]=4 18059 B14R0.337 CCCCOCCOCCC[C@@H](C)CN 34a_100160569302_100000743108 [0,2,0,0,0,0|2,0,0]=4 18060 B14R0.337 CCCCOCCOCCOC(C)CO 34a_100011215186_100012180447 [0,2,0,0,0,0|2,0,0]=4 18061 B14R0.337 CCCCOCCOCCOC(C)CO 7a_100011215186_100012180447 [0,2,0,0,0,0|2,0,0]=4 18062 B14R0.337 CCCCSCCCCCCC(=O)OC 62a_100000210211_100009815986 [0,2,0,0,0,0|1,0,1]=4 18063 B14R0.337 CCCCSCCCCCCC(=O)OC 62a_100009815986_100000210210 [0,2,0,0,0,0|1,0,1]=4 18064 B14R0.337 CCCOCCCCCCCC(=O)OC 34a_100000210258_100010004213 [0,2,0,0,0,0|1,0,1]=4 18065 B14R0.337 CCCOCCCCCCCC(=O)OC 34a_100011022521_100000210303 [0,2,0,0,0,0|1,0,1]=4 18066 B14R0.337 CCCOCCCCCCCC(=O)OC 7a_100011022521_100000210303 [0,2,0,0,0,0|1,0,1]=4 18067 B14R0.337 CCCOCCOCCNCC(O)CO 2230a_200011904461_100011219619 [0,2,0,0,0,0|2,0,0]=4 18068 B14R0.337 CCCOCCOCCNCC(O)CO 34a_200011904461_100011219619 [0,2,0,0,0,0|2,0,0]=4 18069 B14R0.337 CCCOCCOCCNC[C@@H](C)CO 2230a_200011904461_100000059175 [0,2,0,0,0,0|2,0,0]=4 18070 B14R0.337 CCCOCCOCCNC[C@@H](C)CO 34a_200011904461_100000059175 [0,2,0,0,0,0|2,0,0]=4 18071 B14R0.337 CCCOCCOCCNC[C@@H](O)CO 2230a_200011904461_100009815848 [0,2,0,0,0,0|2,0,0]=4 18072 B14R0.337 CCCOCCOCCNC[C@@H](O)CO 34a_200011904461_100009815848 [0,2,0,0,0,0|2,0,0]=4 18073 B14R0.337 CCCSCCCCCCCC(=O)OC 62a_100000210303_100010004213 [0,2,0,0,0,0|1,0,1]=4 18074 B14R0.337 CCCSCCCCCCCC(=O)OC 62a_100010004213_100000210303 [0,2,0,0,0,0|1,0,1]=4 18075 B14R0.337 CCN(C)CCCCCCCCCCO 2230a_100000225621_100009813290 [0,2,0,0,0,0|0,0,0]=2 18076 B14R0.337 CCN(C)CCCCCCCCCCO 269982a_100000225621_100009813290 [0,2,0,0,0,0|0,0,0]=2 18077 B14R0.337 CCN(C)CCCNCCCCCCO 2230a_100000686447_100015186262 [0,2,0,0,0,0|1,0,0]=3 18078 B14R0.337 CCN(C)CCCNCCCCCOC 2230a_100000747528_100015186262 [0,2,0,0,0,0|2,0,0]=4 18079 B14R0.337 CCN(C)CCCOCCCCCCBr 7a_100011215345_100015186262 [0,2,0,0,0,0|2,0,0]=4 18080 B14R0.337 CCN(C)CCCOCCCCCCCl 7a_100000766143_100015186262 [0,2,0,0,0,0|2,0,0]=4 18081 B14R0.337 CCN(C)CCCOCCCCCCF 7a_100000732779_100015186262 [0,2,0,0,0,0|2,0,0]=4 18082 B14R0.337 CCN(C)CCCSCCCCCCF 62a_100015922095_100015186262 [0,2,0,0,0,0|2,0,0]=4 18083 B14R0.337 CCN(C)CCCSCCCCCCO 62a_100000766143_100015186262 [0,2,0,0,0,0|1,0,0]=3 18084 B14R0.337 CCNCCCCCCCCC(=O)OC 2230a_100015525214_100010282707 [0,2,0,0,0,0|1,0,1]=4 18085 B14R0.337 CCOCCCCCCCCC(=O)OC 34a_100000035544_100000210202 [0,2,0,0,0,0|1,0,1]=4 18086 B14R0.337 CCOCCCCCCCCC(=O)OC 34a_100121572206_100010282707 [0,2,0,0,0,0|1,0,1]=4 18087 B14R0.337 CCOCCCCCCCCC(=O)OC 7a_100000035544_100000210202 [0,2,0,0,0,0|1,0,1]=4 18088 B14R0.337 CCOCCOCCCCCC(C)CC 7a_200000035636_100011215890 [0,2,0,0,0,0|2,0,0]=4 18089 B14R0.337 CCOCCOCCNCCC(C)CO 2230a_106354213184_100011211534 [0,2,0,0,0,0|2,0,0]=4 18090 B14R0.337 CCOCCOCCNCCC(C)CO 34a_106354213184_100011211534 [0,2,0,0,0,0|2,0,0]=4 18091 B14R0.337 CCSCCCCCCCCC(=O)OC 62a_100000210202_100010282707 [0,2,0,0,0,0|1,0,1]=4 18092 B14R0.337 CCSCCCCCCCCC(=O)OC 62a_100010282707_100000210202 [0,2,0,0,0,0|1,0,1]=4 18093 B14R0.337 CCSCCOCCCCCC(C)CC 7a_200000035636_100000757381 [0,2,0,0,0,0|2,0,0]=4 18094 B14R0.337 CC[C@H](C)CNCCCCCCCCO 2230a_102515433106_100009816398 [0,2,0,0,0,0|0,0,0]=2 18095 B14R0.337 CC[C@H](C)CNCCCCCCCCO 34a_102515433106_100009816398 [0,2,0,0,0,0|0,0,0]=2 18096 B14R0.337 CC[C@H](C)CNCCOCCOCCO 2230a_100011998139_100009816398 [0,2,0,0,0,0|2,0,0]=4 18097 B14R0.337 CC[C@H](C)CNCCOCCOCCO 34a_100011998139_100009816398 [0,2,0,0,0,0|2,0,0]=4 18098 B14R0.337 CC[C@H](C)COCCCCCCCCBr 34a_100009813846_100009816398 [0,2,0,0,0,0|1,0,0]=3 18099 B14R0.337 CC[C@H](C)COCCCCCCCCBr 7a_100009813846_100009816398 [0,2,0,0,0,0|1,0,0]=3 18100 B14R0.337 CC[C@H](C)COCCCCCCCCCl 34a_100000033203_100009816398 [0,2,0,0,0,0|1,0,0]=3 18101 B14R0.337 CC[C@H](C)COCCCCCCCCCl 7a_100000033203_100009816398 [0,2,0,0,0,0|1,0,0]=3 18102 B14R0.337 CC[C@H](C)COCCCCCCCCN 34a_102515433106_100009816398 [0,2,0,0,0,0|1,0,0]=3 18103 B14R0.337 CC[C@H](C)COCCCCCCCCO 7a_100009816381_100000033203 [0,2,0,0,0,0|0,0,0]=2 18104 B14R0.337 CC[C@H](C)COCCCCCNCCN 34a_103619048469_100009816398 [0,2,0,0,0,0|2,0,0]=4 18105 B14R0.337 CC[C@H](C)COCCCOCCCOC 34a_200011215475_100009816398 [0,2,0,0,0,0|2,0,0]=4 18106 B14R0.337 CC[C@H](C)COCCCOCCCOC 7a_200011215475_100009816398 [0,2,0,0,0,0|2,0,0]=4 18107 B14R0.337 CC[C@H](C)COCCOCCOCCO 7a_100009816381_100000032323 [0,2,0,0,0,0|2,0,0]=4 18108 B14R0.337 CC[C@H](C)CSCCCCCCCCO 62a_100000033203_100009816398 [0,2,0,0,0,0|0,0,0]=2 18109 B14R0.337 CC[C@H](C)CSCCCCCCCCO 62a_100009816398_100000033203 [0,2,0,0,0,0|0,0,0]=2 18110 B14R0.337 CC[C@H](C)CSCCOCCOCCO 62a_100000032323_100009816398 [0,2,0,0,0,0|2,0,0]=4 18111 B14R0.337 CC[C@H](C)CSCCOCCOCCO 62a_100009816398_100000032323 [0,2,0,0,0,0|2,0,0]=4 18112 B14R0.337 CNC(=O)CCCCCCCCCCO 240690a_100102657272_200000016029 [0,2,0,0,0,0|0,0,1]=3 18113 B14R0.337 CNC(=O)CCCNCCCCCCO 2230a_100000686447_100000741757 [0,2,0,0,0,0|1,0,1]=4 18114 B14R0.337 CNC(=O)CCCNCCCCCCO 2230a_100000740002_100000766143 [0,2,0,0,0,0|1,0,1]=4 18115 B14R0.337 CNC(=O)CCCNCCCCCCO 34a_100000686447_100000741757 [0,2,0,0,0,0|1,0,1]=4 18116 B14R0.337 CNC(=O)CCCNCCCCCCO 34a_100000740002_100000766143 [0,2,0,0,0,0|1,0,1]=4 18117 B14R0.337 CNC(=O)CCCSCCCCCCO 62a_100000741757_100000766143 [0,2,0,0,0,0|1,0,1]=4 18118 B14R0.337 CNC(=O)CCCSCCCCCCO 62a_100000766143_100000741757 [0,2,0,0,0,0|1,0,1]=4 18119 B14R0.337 CNC(=O)CCNCCCCCCCO 2230a_100000738227_100000760002 [0,2,0,0,0,0|1,0,1]=4 18120 B14R0.337 CNC(=O)CCNCCCCCCCO 2230a_100011996573_100000737683 [0,2,0,0,0,0|1,0,1]=4 18121 B14R0.337 CNC(=O)CCNCCCCCCCO 34a_100000738227_100000760002 [0,2,0,0,0,0|1,0,1]=4 18122 B14R0.337 CNC(=O)CCNCCCCCCCO 34a_100011996573_100012179268 [0,2,0,0,0,0|1,0,1]=4 18123 B14R0.337 CNC(=O)CCOCCCCCCCO 34a_100000754576_100000760002 [0,2,0,0,0,0|1,0,1]=4 18124 B14R0.337 CNC(=O)CCSCCCCCCCO 62a_100000737683_100000760002 [0,2,0,0,0,0|1,0,1]=4 18125 B14R0.337 CNC(=O)CCSCCCCCCCO 62a_100000760002_100000737683 [0,2,0,0,0,0|1,0,1]=4 18126 B14R0.337 CNC(=O)CNCCCCCCCCO 2230a_100000693194_100000033203 [0,2,0,0,0,0|1,0,1]=4 18127 B14R0.337 CNC(=O)CNCCCCCCCCO 2230a_102515433106_100000183359 [0,2,0,0,0,0|1,0,1]=4 18128 B14R0.337 CNC(=O)CNCCCCCCCCO 34a_102515433106_100000183359 [0,2,0,0,0,0|1,0,1]=4 18129 B14R0.337 CNC(=O)COCCCCCCCCO 34a_100000750040_100000033203 [0,2,0,0,0,0|1,0,1]=4 18130 B14R0.337 CNC(=O)CSCCCCCCCCO 62a_100000033203_100000183359 [0,2,0,0,0,0|1,0,1]=4 18131 B14R0.337 CNC(=O)CSCCCCCCCCO 62a_100000183359_100000033203 [0,2,0,0,0,0|1,0,1]=4 18132 B14R0.337 CNC(=O)NCCCCCCCCCO 2708a_100000078944_106832991635 [0,2,0,0,0,0|1,0,1]=4 18133 B14R0.337 CNC(=O)NCCCCCCCCCO 2708a_100102657272_100000078944 [0,2,0,0,0,0|1,0,1]=4 18134 B14R0.337 CNC(=O)NCCCCCCCCCO 273464a_100000078944_100102657272 [0,2,0,0,0,0|1,0,1]=4 18135 B14R0.337 CNC(=O)NCCCCCCCCCO 273464a_100102657272_100000078944 [0,2,0,0,0,0|1,0,1]=4 18136 B14R0.337 CNC(=O)NCCCCCCCCCO 512a_100000078944_100102657272 [0,2,0,0,0,0|1,0,1]=4 18137 B14R0.337 CNC(=O)NCCCCCCCCCO 512a_106832991638_100000078944 [0,2,0,0,0,0|1,0,1]=4 18138 B14R0.337 CNCCCCCCCCCC(=O)OC 2230a_106832991635_100009813843 [0,2,0,0,0,0|1,0,1]=4 18139 B14R0.337 CNCCCCCCCCCC(=O)OC 34a_100102657272_100009813843 [0,2,0,0,0,0|1,0,1]=4 18140 B14R0.337 CNCCCCCCCCCC(=O)OC 7a_106832991635_100009813843 [0,2,0,0,0,0|1,0,1]=4 18141 B14R0.337 COC(=O)CCCCCCCCCSC 62a_200000210301_100009813843 [0,2,0,0,0,0|1,0,1]=4 18142 B14R0.337 COC(=O)CCCCCCCCCS[13CH3] 62a_200025704644_100009813843 [0,2,0,0,0,0|1,0,1]=4 18143 B14R0.337 COC(=O)CCCCCCCNCCO 2230a_100016997473_100010004213 [0,2,0,0,0,0|1,0,1]=4 18144 B14R0.337 COC(=O)CCCCCCCNCCO 34a_100016990907_100010004213 [0,2,0,0,0,0|1,0,1]=4 18145 B14R0.337 COC(=O)CCCCCCCOCCO 34a_100011022521_100000211926 [0,2,0,0,0,0|1,0,1]=4 18146 B14R0.337 COC(=O)CCCCCCCOCCO 7a_100011022521_100000211926 [0,2,0,0,0,0|1,0,1]=4 18147 B14R0.337 COC(=O)CCCCCCCSCCO 62a_100000211926_100010004213 [0,2,0,0,0,0|1,0,1]=4 18148 B14R0.337 COC(=O)CCCCCCCSCCO 62a_100010004213_100000211926 [0,2,0,0,0,0|1,0,1]=4 18149 B14R0.337 COC(=O)CCCCCCOCCCO 34a_100009863599_100000230001 [0,2,0,0,0,0|1,0,1]=4 18150 B14R0.337 COC(=O)CCCCCCOCCCO 7a_100009863599_100011215043 [0,2,0,0,0,0|1,0,1]=4 18151 B14R0.337 COC(=O)CCCCCCSCCCO 62a_100009815986_100011215043 [0,2,0,0,0,0|1,0,1]=4 18152 B14R0.337 COC(=O)CCCCCCSCCCO 62a_100011215043_100009815986 [0,2,0,0,0,0|1,0,1]=4 18153 B14R0.337 COC(=O)CCCCCNCCCCO 2230a_100000750430_100009816466 [0,2,0,0,0,0|1,0,1]=4 18154 B14R0.337 COC(=O)CCCCCNCCCCO 34a_100000750430_100009816466 [0,2,0,0,0,0|1,0,1]=4 18155 B14R0.337 COC(=O)CCCCCOCCCCO 34a_100000074720_100011216708 [0,2,0,0,0,0|1,0,1]=4 18156 B14R0.337 COC(=O)CCCCCOCCCCO 7a_100000074720_100000210776 [0,2,0,0,0,0|1,0,1]=4 18157 B14R0.337 COC(=O)CCCCCSCCCCO 62a_100000210776_100009816466 [0,2,0,0,0,0|1,0,1]=4 18158 B14R0.337 COC(=O)CCCCCSCCCCO 62a_100009816466_100000210776 [0,2,0,0,0,0|1,0,1]=4 18159 B14R0.337 COC(=O)CCCCNCCCCCO 2230a_100000762737_100000204269 [0,2,0,0,0,0|1,0,1]=4 18160 B14R0.337 COC(=O)CCCCNCCCCCO 34a_100000762737_100000204269 [0,2,0,0,0,0|1,0,1]=4 18161 B14R0.337 COC(=O)CCCCOCCCCCO 34a_100000059025_100000746330 [0,2,0,0,0,0|1,0,1]=4 18162 B14R0.337 COC(=O)CCCCOCCCCCO 7a_100000059025_100000746330 [0,2,0,0,0,0|1,0,1]=4 18163 B14R0.337 COC(=O)CCCCSCCCCCO 62a_100000204269_100000746330 [0,2,0,0,0,0|1,0,1]=4 18164 B14R0.337 COC(=O)CCCCSCCCCCO 62a_100000746330_100000204269 [0,2,0,0,0,0|1,0,1]=4 18165 B14R0.337 COC(=O)CCCNCCCCCCO 2230a_100000686447_100011218270 [0,2,0,0,0,0|1,0,1]=4 18166 B14R0.337 COC(=O)CCCNCCCCCCO 34a_100000686447_100000742333 [0,2,0,0,0,0|1,0,1]=4 18167 B14R0.337 COC(=O)CCCSCCCCCCO 62a_100000766143_100011218270 [0,2,0,0,0,0|1,0,1]=4 18168 B14R0.337 COC(=O)CCCSCCCCCCO 62a_100011218270_100000766143 [0,2,0,0,0,0|1,0,1]=4 18169 B14R0.337 COC(=O)CCNCCCCCCCO 2230a_100011996573_100000204255 [0,2,0,0,0,0|1,0,1]=4 18170 B14R0.337 COC(=O)CCNCCCCCCCO 34a_100011996573_100000742370 [0,2,0,0,0,0|1,0,1]=4 18171 B14R0.337 COC(=O)CCSCCCCCCCO 62a_100000204255_100000760002 [0,2,0,0,0,0|1,0,1]=4 18172 B14R0.337 COC(=O)CCSCCCCCCCO 62a_100000760002_100000204255 [0,2,0,0,0,0|1,0,1]=4 18173 B14R0.337 COC(=O)CNCCCCCCCCO 2230a_102515433106_100000747449 [0,2,0,0,0,0|1,0,1]=4 18174 B14R0.337 COC(=O)CNCCCCCCCCO 34a_102515433106_100000747449 [0,2,0,0,0,0|1,0,1]=4 18175 B14R0.337 COC(=O)CSCCCCCCCCO 62a_100000033203_100000747449 [0,2,0,0,0,0|1,0,1]=4 18176 B14R0.337 COC(=O)CSCCCCCCCCO 62a_100000747449_100000033203 [0,2,0,0,0,0|1,0,1]=4 18177 B14R0.337 COC(C)CCOCCCCCCCO 7a_100000764861_100000760002 [0,2,0,0,0,0|1,0,0]=3 18178 B14R0.337 COC(C)COCCCCCCCCO 34a_100000690652_100000033203 [0,2,0,0,0,0|1,0,0]=3 18179 B14R0.337 COC(C)SCCCCCCCCCO 62a_100009813782_100009879195 [0,2,0,0,0,0|1,0,0]=3 18180 B14R0.337 COC(C)SCCCCCCCCCO 62a_100009879195_100009813782 [0,2,0,0,0,0|1,0,0]=3 18181 B14R0.337 COCCCCCCCCCC(=O)OC 34a_100138415774_100009813843 [0,2,0,0,0,0|1,0,1]=4 18182 B14R0.337 COCCCCCCNCCC(C)CO 2230a_106354213184_100011998445 [0,2,0,0,0,0|1,0,0]=3 18183 B14R0.337 COCCCCCCNCCC(C)CO 34a_106354213184_100011998445 [0,2,0,0,0,0|1,0,0]=3 18184 B14R0.337 COCCCCCCOCCC(C)OC 7a_100000764861_100011998445 [0,2,0,0,0,0|2,0,0]=4 18185 B14R0.337 COCCCOCCCOCC(O)CO 34a_200011215475_100011219619 [0,2,0,0,0,0|2,0,0]=4 18186 B14R0.337 COCCCOCCCOCC(O)CO 7a_200011215475_100011219619 [0,2,0,0,0,0|2,0,0]=4 18187 B14R0.337 COCCCOCCCOC[C@@H](C)CO 34a_200011215475_100000059175 [0,2,0,0,0,0|2,0,0]=4 18188 B14R0.337 COCCCOCCCOC[C@@H](C)CO 7a_200011215475_100000059175 [0,2,0,0,0,0|2,0,0]=4 18189 B14R0.337 COCCCOCCCOC[C@@H](O)CO 34a_200011215475_100009815848 [0,2,0,0,0,0|2,0,0]=4 18190 B14R0.337 COCCCOCCCOC[C@@H](O)CO 7a_200011215475_100009815848 [0,2,0,0,0,0|2,0,0]=4 18191 B14R0.337 COCCOCCCNCCC(C)CO 2230a_106354213184_100011216529 [0,2,0,0,0,0|2,0,0]=4 18192 B14R0.337 COCCOCCCNCCC(C)CO 34a_106354213184_100011216529 [0,2,0,0,0,0|2,0,0]=4 18193 B14R0.337 CO[C@H](C)CNCCCCCCCCO 2230a_100020591295_100000033203 [0,2,0,0,0,0|1,0,0]=3 18194 B14R0.337 C[C@@H](CN)CCCOCCCCCCF 34a_100160569302_100015922095 [0,2,0,0,0,0|2,0,0]=4 18195 B14R0.337 C[C@@H](CN)CCCOCCCCCCO 34a_100160569302_100000766143 [0,2,0,0,0,0|1,0,0]=3 18196 B14R0.337 C[C@@H](CO)CNCCCCCCCCO 2230a_102515433106_100000059175 [0,2,0,0,0,0|1,0,0]=3 18197 B14R0.337 C[C@@H](CO)CNCCCCCCCCO 34a_102515433106_100000059175 [0,2,0,0,0,0|1,0,0]=3 18198 B14R0.337 C[C@@H](CO)COCCCCCCCCBr 34a_100009813846_100000059175 [0,2,0,0,0,0|1,0,0]=3 18199 B14R0.337 C[C@@H](CO)COCCCCCCCCBr 7a_100009813846_100000059175 [0,2,0,0,0,0|1,0,0]=3 18200 B14R0.337 C[C@@H](CO)COCCCCCCCCCl 34a_100000033203_100000059175 [0,2,0,0,0,0|1,0,0]=3 18201 B14R0.337 C[C@@H](CO)COCCCCCCCCCl 7a_100000033203_100000059175 [0,2,0,0,0,0|1,0,0]=3 18202 B14R0.337 C[C@@H](CO)COCCCCCCCCN 34a_102515433106_100000059175 [0,2,0,0,0,0|1,0,0]=3 18203 B14R0.337 C[C@@H](CO)COCCCCCNCCN 34a_103619048469_100000059175 [0,2,0,0,0,0|2,0,0]=4 18204 B14R0.337 C[C@@H](CO)CSCCCCCCCCO 62a_100000033203_100000059175 [0,2,0,0,0,0|1,0,0]=3 18205 B14R0.337 C[C@@H](CO)CSCCCCCCCCO 62a_100000059175_100000033203 [0,2,0,0,0,0|1,0,0]=3 18206 B14R0.337 C[C@H](CO)NCCCCCCCCCO 2230a_100000737577_100009813782 [0,2,0,0,0,0|1,0,0]=3 18207 B14R0.337 C[C@H](CO)SCCCCCCCCCO 62a_100009813782_100016084084 [0,2,0,0,0,0|1,0,0]=3 18208 B14R0.337 C[C@H](CO)SCCCCCCCCCO 62a_100016084084_100009813782 [0,2,0,0,0,0|1,0,0]=3 18209 B14R0.337 N#CC(F)SCCCCCCCCCO 62a_100009813782_200000117898 [0,2,0,0,0,0|1,0,1]=4 18210 B14R0.337 N#CC(F)SCCCCCCCCCO 62a_200000117898_100009813782 [0,2,0,0,0,0|1,0,1]=4 18211 B14R0.337 NCCCCCCCCOCC(O)CO 34a_102515433106_100011219619 [0,2,0,0,0,0|1,0,0]=3 18212 B14R0.337 NCCCCCCCCOC[C@@H](O)CF 34a_102515433106_100015614560 [0,2,0,0,0,0|2,0,0]=4 18213 B14R0.337 NCCCCCCCCOC[C@@H](O)CO 34a_102515433106_100009815848 [0,2,0,0,0,0|1,0,0]=3 18214 B14R0.337 NCCNCCCCCOCC(O)CO 34a_103619048469_100011219619 [0,2,0,0,0,0|2,0,0]=4 18215 B14R0.337 NCCNCCCCCOC[C@@H](O)CO 34a_103619048469_100009815848 [0,2,0,0,0,0|2,0,0]=4 18216 B14R0.337 NC[C@@H](F)COCCCCCCCCO 34a_100015665980_100000033203 [0,2,0,0,0,0|1,0,0]=3 18217 B14R0.337 O=C(CO)CCCCCCCCCCO 1458a_100000210174_100009813290 [0,2,0,0,0,0|0,0,1]=3 18218 B14R0.337 O=C(CO)NCCCCCCCCCO 240690a_100000078944_100000210174 [0,2,0,0,0,0|1,0,1]=4 18219 B14R0.337 OCC(O)COCCCCCCCCBr 34a_100009813846_100011219619 [0,2,0,0,0,0|1,0,0]=3 18220 B14R0.337 OCC(O)COCCCCCCCCBr 7a_100009813846_100011219619 [0,2,0,0,0,0|1,0,0]=3 18221 B14R0.337 OCC(O)COCCCCCCCCCl 34a_100000033203_100011219619 [0,2,0,0,0,0|1,0,0]=3 18222 B14R0.337 OCC(O)COCCCCCCCCCl 7a_100000033203_100011219619 [0,2,0,0,0,0|1,0,0]=3 18223 B14R0.337 OCCCCCCCCNCC(O)CO 2230a_102515433106_100011219619 [0,2,0,0,0,0|1,0,0]=3 18224 B14R0.337 OCCCCCCCCNCC(O)CO 34a_102515433106_100011219619 [0,2,0,0,0,0|1,0,0]=3 18225 B14R0.337 OCCCCCCCCNC[C@@H](F)CO 34a_100015665980_100000033203 [0,2,0,0,0,0|1,0,0]=3 18226 B14R0.337 OCCCCCCCCNC[C@@H](O)CF 2230a_102515433106_100015614560 [0,2,0,0,0,0|1,0,0]=3 18227 B14R0.337 OCCCCCCCCNC[C@@H](O)CF 34a_102515433106_100015614560 [0,2,0,0,0,0|1,0,0]=3 18228 B14R0.337 OCCCCCCCCNC[C@@H](O)CO 2230a_102515433106_100009815848 [0,2,0,0,0,0|1,0,0]=3 18229 B14R0.337 OCCCCCCCCNC[C@@H](O)CO 34a_102515433106_100009815848 [0,2,0,0,0,0|1,0,0]=3 18230 B14R0.337 OCCCCCCCCNC[C@H](O)CO 2230a_100020644852_100000033203 [0,2,0,0,0,0|1,0,0]=3 18231 B14R0.337 OCCCCCCCCOCC(Cl)CCl 34a_100000033668_100000033203 [0,2,0,0,0,0|1,0,0]=3 18232 B14R0.337 OCCCCCCCCSCC(O)CO 62a_100000033203_100011219619 [0,2,0,0,0,0|1,0,0]=3 18233 B14R0.337 OCCCCCCCCSCC(O)CO 62a_100011219619_100000033203 [0,2,0,0,0,0|1,0,0]=3 18234 B14R0.337 OCCCCCCCCSC[C@@H](O)CF 62a_100000033203_100015614560 [0,2,0,0,0,0|1,0,0]=3 18235 B14R0.337 OCCCCCCCCSC[C@@H](O)CF 62a_100015614560_100000033203 [0,2,0,0,0,0|1,0,0]=3 18236 B14R0.337 OCCCCCCCCSC[C@@H](O)CO 62a_100000033203_100009815848 [0,2,0,0,0,0|1,0,0]=3 18237 B14R0.337 OCCCCCCCCSC[C@@H](O)CO 62a_100009815848_100000033203 [0,2,0,0,0,0|1,0,0]=3 18238 B14R0.337 OC[C@H](O)COCCCCCCCCBr 34a_100009813846_100009815848 [0,2,0,0,0,0|1,0,0]=3 18239 B14R0.337 OC[C@H](O)COCCCCCCCCBr 7a_100009813846_100009815848 [0,2,0,0,0,0|1,0,0]=3 18240 B14R0.337 OC[C@H](O)COCCCCCCCCCl 34a_100000033203_100009815848 [0,2,0,0,0,0|1,0,0]=3 18241 B14R0.337 OC[C@H](O)COCCCCCCCCCl 7a_100000033203_100009815848 [0,2,0,0,0,0|1,0,0]=3 18242 B14R0.337 O[C@@H](CF)COCCCCCCCCBr 34a_100009813846_100015614560 [0,2,0,0,0,0|2,0,0]=4 18243 B14R0.337 O[C@@H](CF)COCCCCCCCCBr 7a_100009813846_100015614560 [0,2,0,0,0,0|2,0,0]=4 18244 B14R0.337 O[C@@H](CF)COCCCCCCCCCl 34a_100000033203_100015614560 [0,2,0,0,0,0|2,0,0]=4 18245 B14R0.337 O[C@@H](CF)COCCCCCCCCCl 7a_100000033203_100015614560 [0,2,0,0,0,0|2,0,0]=4 18246 B14R0.340 C=C(C)C(=O)CCCCCCCCCO 1458a_100000185857_100009813782 [0,2,0,0,0,0|0,0,2]=4 18247 B14R0.340 C=C(C)C(C)NCCCCCCCCO 269862a_102515433106_100011216138 [0,2,0,0,0,0|1,0,1]=4 18248 B14R0.340 CC(=O)C(C)COCCCCCCCO 34a_100000032740_100000760002 [0,2,0,0,0,0|1,0,1]=4 18249 B14R0.340 CC(=O)C(C)COCCCCCCCO 7a_100000032740_100000760002 [0,2,0,0,0,0|1,0,1]=4 18250 B14R0.340 CC(=O)C(C)NCCCCCCCCO 2230a_102515433106_100009814033 [0,2,0,0,0,0|1,0,1]=4 18251 B14R0.340 CC(=O)C(C)OCCCCCCCCO 34a_100000212229_100000033203 [0,2,0,0,0,0|1,0,1]=4 18252 B14R0.340 CC(=O)C(C)SCCCCCCCCO 62a_100000033203_100009814033 [0,2,0,0,0,0|1,0,1]=4 18253 B14R0.340 CC(=O)C(C)SCCCCCCCCO 62a_100009814033_100000033203 [0,2,0,0,0,0|1,0,1]=4 18254 B14R0.340 CC(C)C(=O)CCCCCCCCCF 1458a_200009909015_100000210206 [0,2,0,0,0,0|1,0,1]=4 18255 B14R0.340 CC(C)C(=O)CCCCCCCCCO 1458a_100000210198_100009813782 [0,2,0,0,0,0|0,0,1]=3 18256 B14R0.340 CC(C)C(=O)CNCCCCCCCO 2230a_100011996573_100000753385 [0,2,0,0,0,0|1,0,1]=4 18257 B14R0.340 CC(C)C(=O)CNCCCCCCCO 34a_100011996573_100000753385 [0,2,0,0,0,0|1,0,1]=4 18258 B14R0.340 CC(C)C(=O)CSCCCCCCCO 62a_100000753385_100000760002 [0,2,0,0,0,0|1,0,1]=4 18259 B14R0.340 CC(C)C(=O)CSCCCCCCCO 62a_100000760002_100000753385 [0,2,0,0,0,0|1,0,1]=4 18260 B14R0.340 CC(C)C(=O)NCCCCCCCCO 240690a_102515433106_100000210198 [0,2,0,0,0,0|1,0,1]=4 18261 B14R0.340 CC(C)C(C)NCCCCCCCCO 2230a_100000211541_100000033203 [0,2,0,0,0,0|1,0,0]=3 18262 B14R0.340 CC(C)C(C)OCCCCCCCCO 7a_100000748068_100000033203 [0,2,0,0,0,0|1,0,0]=3 18263 B14R0.340 CC(C)C(N)CCOCCCCCCF 34a_100161115045_100015922095 [0,2,0,0,0,0|2,0,0]=4 18264 B14R0.340 CC(C)C(N)CCOCCCCCCO 34a_100161115045_100000766143 [0,2,0,0,0,0|1,0,0]=3 18265 B14R0.340 CC(C)C(O)CNCCCCCCCO 2230a_100000759067_100000760002 [0,2,0,0,0,0|1,0,0]=3 18266 B14R0.340 CC(C)C(O)CNCCCCCCCO 34a_100000759067_100000760002 [0,2,0,0,0,0|1,0,0]=3 18267 B14R0.340 CC(C)N(C)CCCCCCCCCO 269982a_200000211004_100009813782 [0,2,0,0,0,0|1,0,0]=3 18268 B14R0.340 CC(C)[C@@H](N)COCCCCCCCO 34a_100011830312_100000760002 [0,2,0,0,0,0|1,0,0]=3 18269 B14R0.340 CC(F)C(=O)CCCCCCCCCO 1458a_100000062450_100009813782 [0,2,0,0,0,0|0,0,1]=3 18270 B14R0.340 CC(F)C(=O)NCCCCCCCCO 240690a_102515433106_100000062450 [0,2,0,0,0,0|1,0,1]=4 18271 B14R0.340 CCCCCCCCCCC(=O)C(C)C 1458a_100000210198_100000210319 [0,2,0,0,0,0|1,0,1]=4 18272 B14R0.340 CCCCCCCCCCC(=O)C(C)C 1458a_100000210375_100000210206 [0,2,0,0,0,0|1,0,1]=4 18273 B14R0.340 CCCCCCCCCCC(=O)C(C)F 1458a_100000062450_100000210319 [0,2,0,0,0,0|1,0,1]=4 18274 B14R0.340 CCCCCCCCCCC(=O)C(O)O 1458a_100000233687_100000210319 [0,2,0,0,0,0|0,0,1]=3 18275 B14R0.340 CCCCCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100000210319 [0,2,0,0,0,0|0,0,1]=3 18276 B14R0.340 CCCCCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100000210319 [0,2,0,0,0,0|0,0,1]=3 18277 B14R0.340 CCCCCCCCCCC(C)N(C)C 270004a_100102631434_200011219864 [0,2,0,0,0,0|2,0,0]=4 18278 B14R0.340 CCCCCCCCCCN(C)C(C)C 2230a_100000207566_100000210206 [0,2,0,0,0,0|2,0,0]=4 18279 B14R0.340 CCCCCCCCCCN(C)C(C)C 269982a_100000207566_100000210206 [0,2,0,0,0,0|2,0,0]=4 18280 B14R0.340 CCCCCCCCCCN(C)C(C)C 269982a_200000211004_100000210320 [0,2,0,0,0,0|2,0,0]=4 18281 B14R0.340 CCCCCCCCCNC(=O)C(O)O 240690a_100000212291_100000233687 [0,2,0,0,0,0|1,0,1]=4 18282 B14R0.340 CCCCCCCCCNC(=O)[C@@H](C)O 240690a_100000212291_100000717761 [0,2,0,0,0,0|1,0,1]=4 18283 B14R0.340 CCCCCCCCCNC(=O)[C@H](C)O 1626a_100000212291_217856618621 [0,2,0,0,0,0|1,0,1]=4 18284 B14R0.340 CCCCCCCCCNC(=O)[C@H](C)O 240690a_100000212291_217856618621 [0,2,0,0,0,0|1,0,1]=4 18285 B14R0.340 CCCCCCCCCNC(C)C(C)C 2230a_100000211541_100011214924 [0,2,0,0,0,0|2,0,0]=4 18286 B14R0.340 CCCCCCCCCN[C@@H](C)C(=O)O 269956a_100000743915_100000210670 [0,2,0,0,0,0|1,0,1]=4 18287 B14R0.340 CCCCCCCCCOC(C)C(C)C 7a_100000748068_100000210328 [0,2,0,0,0,0|2,0,0]=4 18288 B14R0.340 CCCCCCCCNCC(C)C(=O)O 269956a_100000749485_100000210759 [0,2,0,0,0,0|1,0,1]=4 18289 B14R0.340 CCCCCCCCNCC(F)C(=O)O 269956a_100000084737_100000210759 [0,2,0,0,0,0|1,0,1]=4 18290 B14R0.340 CCCCCCCCNCC(O)C(C)C 2230a_100000759067_100000210759 [0,2,0,0,0,0|2,0,0]=4 18291 B14R0.340 CCCCCCCCNCC(O)C(C)C 34a_100000759067_100000210759 [0,2,0,0,0,0|2,0,0]=4 18292 B14R0.340 CCCCCCCCOC[C@H](N)C(C)C 34a_100011830312_100000210759 [0,2,0,0,0,0|2,0,0]=4 18293 B14R0.340 CCCCCCCOCCC(N)C(C)C 34a_100161115045_100000210614 [0,2,0,0,0,0|2,0,0]=4 18294 B14R0.340 CN(C)C(=O)CCCCCCCCCO 240690a_100102631434_100000032657 [0,2,0,0,0,0|1,0,1]=4 18295 B14R0.340 C[C@@H](O)C(=O)CCCCCCCCCO 1458a_100000717761_100009813782 [0,2,0,0,0,0|0,0,1]=3 18296 B14R0.340 C[C@@H](O)C(=O)NCCCCCCCCO 240690a_102515433106_100000717761 [0,2,0,0,0,0|1,0,1]=4 18297 B14R0.340 C[C@H](O)C(=O)CCCCCCCCCO 1458a_217856618621_100009813782 [0,2,0,0,0,0|0,0,1]=3 18298 B14R0.340 C[C@H](O)C(=O)NCCCCCCCCO 240690a_102515433106_217856618621 [0,2,0,0,0,0|1,0,1]=4 18299 B14R0.340 O=C(CCCCCCCCCO)C(O)O 1458a_100000233687_100009813782 [0,2,0,0,0,0|1,0,1]=4 18300 B14R0.344 C=C(C)CCC(=O)CCCCCCCO 1458a_100011219782_100000730704 [0,2,0,0,0,0|0,0,2]=4 18301 B14R0.344 C=C(C)CCC(=O)CCCCCCCO 1458a_200000688413_100000760002 [0,2,0,0,0,0|0,0,2]=4 18302 B14R0.344 C=C(C)CCC(C)NCCCCCCO 270004a_100000686447_100011215600 [0,2,0,0,0,0|1,0,1]=4 18303 B14R0.344 CC(C)CCC(=O)CCCCCCCO 1458a_100000181311_100000760002 [0,2,0,0,0,0|0,0,1]=3 18304 B14R0.344 CC(C)CCC(=O)CCCCCCCO 1458a_100011219782_100000210312 [0,2,0,0,0,0|0,0,1]=3 18305 B14R0.344 CC(C)CCC(=O)NCCCCCCO 240690a_100000686447_100000181311 [0,2,0,0,0,0|1,0,1]=4 18306 B14R0.344 CC(C)CCC(=O)NCCCCCCO 527a_100000686447_100000181311 [0,2,0,0,0,0|1,0,1]=4 18307 B14R0.344 CC(C)CCC(C)NCCCCCCF 2230a_100138410893_100015922095 [0,2,0,0,0,0|2,0,0]=4 18308 B14R0.344 CC(C)CCC(C)NCCCCCCO 2230a_100000686447_100011261404 [0,2,0,0,0,0|1,0,0]=3 18309 B14R0.344 CC(C)CCC(C)NCCCCCCO 2230a_100138410893_100000766143 [0,2,0,0,0,0|1,0,0]=3 18310 B14R0.344 CC(C)CCC(C)NCCCCCCO 270004a_100000686447_100000210476 [0,2,0,0,0,0|1,0,0]=3 18311 B14R0.344 CC(C)CCC(C)NCCCCCCO 34a_100000686447_100011261404 [0,2,0,0,0,0|1,0,0]=3 18312 B14R0.344 CC(C)CCC(C)OCCCCCCBr 34a_100011215345_100011261404 [0,2,0,0,0,0|2,0,0]=4 18313 B14R0.344 CC(C)CCC(C)OCCCCCCCl 34a_100000766143_100011261404 [0,2,0,0,0,0|2,0,0]=4 18314 B14R0.344 CC(C)CCC(C)OCCCCCCF 34a_100000732779_100011261404 [0,2,0,0,0,0|2,0,0]=4 18315 B14R0.344 CC(C)CCC(C)OCCCCCCF 34a_100011215350_100015922095 [0,2,0,0,0,0|2,0,0]=4 18316 B14R0.344 CC(C)CCC(C)OCCCCCCF 7a_100011215350_100015922095 [0,2,0,0,0,0|2,0,0]=4 18317 B14R0.344 CC(C)CCC(C)OCCCCCCN 34a_100000686447_100011261404 [0,2,0,0,0,0|2,0,0]=4 18318 B14R0.344 CC(C)CCC(C)OCCCCCCO 34a_100011215350_100000766143 [0,2,0,0,0,0|1,0,0]=3 18319 B14R0.344 CC(C)CCC(C)OCCCCCCO 7a_100011215350_100000766143 [0,2,0,0,0,0|1,0,0]=3 18320 B14R0.344 CC(C)CCC(C)SCCCCCCF 62a_100011261404_100015922095 [0,2,0,0,0,0|2,0,0]=4 18321 B14R0.344 CC(C)CCC(C)SCCCCCCF 62a_100015922095_100011261404 [0,2,0,0,0,0|2,0,0]=4 18322 B14R0.344 CC(C)CCC(C)SCCCCCCO 62a_100000766143_100011261404 [0,2,0,0,0,0|1,0,0]=3 18323 B14R0.344 CC(C)CCC(C)SCCCCCCO 62a_100011261404_100000766143 [0,2,0,0,0,0|1,0,0]=3 18324 B14R0.344 CC(C)CCN(C)CCCCCCCO 2230a_100000742789_100000760002 [0,2,0,0,0,0|1,0,0]=3 18325 B14R0.344 CC(C)CCN(C)CCCCCCCO 269982a_100000742789_100000760002 [0,2,0,0,0,0|1,0,0]=3 18326 B14R0.344 CC(C)CNC(=O)CCCCCCCO 240690a_100000210953_100011219782 [0,2,0,0,0,0|1,0,1]=4 18327 B14R0.344 CC(C)OCC(=O)CCCCCCCO 1458a_100000745533_100000760002 [0,2,0,0,0,0|1,0,1]=4 18328 B14R0.344 CC(C)SCC(=O)CCCCCCCO 1458a_100000241585_100000760002 [0,2,0,0,0,0|1,0,1]=4 18329 B14R0.344 CC(O)CCC(=O)CCCCCCCO 1458a_100011219782_100012276601 [0,2,0,0,0,0|0,0,1]=3 18330 B14R0.344 CC(O)CNC(=O)CCCCCCCO 240690a_100000210904_100011219782 [0,2,0,0,0,0|1,0,1]=4 18331 B14R0.344 CCCCCCCCC(=O)CCC(C)C 1458a_100000181311_100000210759 [0,2,0,0,0,0|1,0,1]=4 18332 B14R0.344 CCCCCCCCC(=O)CCC(C)C 1458a_100000210188_100000210312 [0,2,0,0,0,0|1,0,1]=4 18333 B14R0.344 CCCCCCCCC(=O)CCC(C)O 1458a_100000210188_100012276601 [0,2,0,0,0,0|0,0,1]=3 18334 B14R0.344 CCCCCCCCC(=O)NCC(C)O 11a_100000210904_100000210188 [0,2,0,0,0,0|1,0,1]=4 18335 B14R0.344 CCCCCCCCC(=O)NCC(C)O 240690a_100000210904_100000210188 [0,2,0,0,0,0|1,0,1]=4 18336 B14R0.344 CCCCCCCCC(=O)NCC(C)O 527a_100000210904_100000210188 [0,2,0,0,0,0|1,0,1]=4 18337 B14R0.344 CCCCCCCCC(C)COC(C)C 34a_200012125181_100000210206 [0,2,0,0,0,0|2,0,0]=4 18338 B14R0.344 CCCCCCCCC(C)COC(C)C 7a_200012125181_100000210206 [0,2,0,0,0,0|2,0,0]=4 18339 B14R0.344 CCCCCCCCC(C)NCC(C)C 270004a_100000210953_100011216694 [0,2,0,0,0,0|2,0,0]=4 18340 B14R0.344 CCCCCCCCC(C)NCC(C)O 270004a_100000210904_100011216694 [0,2,0,0,0,0|1,0,0]=3 18341 B14R0.344 CCCCCCCCC(C)NCC(F)F 270004a_100000765723_100011216694 [0,2,0,0,0,0|2,0,0]=4 18342 B14R0.344 CCCCCCCCC(C)OCC(C)C 34a_100000210740_100000210624 [0,2,0,0,0,0|2,0,0]=4 18343 B14R0.344 CCCCCCCCC(C)OCC(C)C 7a_100000210740_100000210760 [0,2,0,0,0,0|2,0,0]=4 18344 B14R0.344 CCCCCCCCC(C)OCC(C)O 34a_100000210740_100011218427 [0,2,0,0,0,0|1,0,0]=3 18345 B14R0.344 CCCCCCCCC(C)OCC(C)O 7a_100000210740_100011218427 [0,2,0,0,0,0|1,0,0]=3 18346 B14R0.344 CCCCCCCCC(C)OCC(F)F 34a_100000210740_100011934356 [0,2,0,0,0,0|2,0,0]=4 18347 B14R0.344 CCCCCCCCC(C)OCC(F)F 7a_100000210740_100011934356 [0,2,0,0,0,0|2,0,0]=4 18348 B14R0.344 CCCCCCCCC(C)OC[C@@H](C)O 34a_100000210740_100009817552 [0,2,0,0,0,0|1,0,0]=3 18349 B14R0.344 CCCCCCCCC(C)OC[C@@H](C)O 7a_100000210740_100009817552 [0,2,0,0,0,0|1,0,0]=3 18350 B14R0.344 CCCCCCCCN(C)CCC(C)C 2230a_100000207567_100000210312 [0,2,0,0,0,0|2,0,0]=4 18351 B14R0.344 CCCCCCCCN(C)CCC(C)C 2230a_100000742789_100000210759 [0,2,0,0,0,0|2,0,0]=4 18352 B14R0.344 CCCCCCCCN(C)CCC(C)C 269982a_100000207567_100000210312 [0,2,0,0,0,0|2,0,0]=4 18353 B14R0.344 CCCCCCCCN(C)CCC(C)C 269982a_100000742789_100000210759 [0,2,0,0,0,0|2,0,0]=4 18354 B14R0.344 CCCCCCCCN(C)CCC(C)O 2230a_100000207567_100012276601 [0,2,0,0,0,0|1,0,0]=3 18355 B14R0.344 CCCCCCCCN(C)CCC(C)O 269982a_100000207567_100012276601 [0,2,0,0,0,0|1,0,0]=3 18356 B14R0.344 CCCCCCCNC(=O)CCC(C)O 1626a_100000229938_100000718519 [0,2,0,0,0,0|1,0,1]=4 18357 B14R0.344 CCCCCCCNC(C)CCC(C)C 2230a_100000229938_100011261404 [0,2,0,0,0,0|2,0,0]=4 18358 B14R0.344 CCCCCCCNC(C)CCC(C)C 2230a_100138410893_100000210681 [0,2,0,0,0,0|2,0,0]=4 18359 B14R0.344 CCCCCCCNC(C)CCC(C)C 270004a_100000229938_100000210476 [0,2,0,0,0,0|2,0,0]=4 18360 B14R0.344 CCCCCCCOC(C)CCC(C)C 34a_100000210272_100011261404 [0,2,0,0,0,0|2,0,0]=4 18361 B14R0.344 CCCCCCCOC(C)CCC(C)C 34a_100011215350_100000210614 [0,2,0,0,0,0|2,0,0]=4 18362 B14R0.344 CCCCCCCOC(C)CCC(C)C 7a_100011215350_100000210614 [0,2,0,0,0,0|2,0,0]=4 18363 B14R0.344 CCCCCCCSC(C)CCC(C)C 62a_100000210614_100011261404 [0,2,0,0,0,0|2,0,0]=4 18364 B14R0.344 CCCCCCCSC(C)CCC(C)C 62a_100011261404_100000210316 [0,2,0,0,0,0|2,0,0]=4 18365 B14R0.344 CN(C)CCN(C)CCCCCCCO 269982a_100000225618_100000760002 [0,2,0,0,0,0|2,0,0]=4 18366 B14R0.344 C[S+](C)CCC(=O)CCCCCCCO 1458a_100009452791_100000760002 [0,2,0,0,0,0|1,0,1]=4 18367 B14R0.394 C#CCCCCCCCCCOC(C)C 34a_100000034437_100000210206 [0,2,0,0,0,0|1,0,1]=4 18368 B14R0.394 C#CCCCCCCCCCOC(C)C 7a_100000034437_100000210206 [0,2,0,0,0,0|1,0,1]=4 18369 B14R0.394 C#CCCCCCCCCOCC(C)C 34a_100000065265_100000210624 [0,2,0,0,0,0|1,0,1]=4 18370 B14R0.394 C#CCCCCCCCCOCC(C)C 7a_100000065265_100000210760 [0,2,0,0,0,0|1,0,1]=4 18371 B14R0.394 C#CCCCCCCCCOCC(C)O 34a_100000065265_100011218427 [0,2,0,0,0,0|0,0,2]=4 18372 B14R0.394 C#CCCCCCCCCOCC(C)O 7a_100000065265_100011218427 [0,2,0,0,0,0|0,0,2]=4 18373 B14R0.394 C#CCCCCCCCCOC[C@@H](C)O 34a_100000065265_100009817552 [0,2,0,0,0,0|0,0,2]=4 18374 B14R0.394 C#CCCCCCCCCOC[C@@H](C)O 7a_100000065265_100009817552 [0,2,0,0,0,0|0,0,2]=4 18375 B14R0.394 C#CCCCCCCCNCCC(C)O 2230a_200000755665_100153394163 [0,2,0,0,0,0|0,0,2]=4 18376 B14R0.394 C#CCCCCCCCOCCC(C)Br 34a_100009893172_100153394163 [0,2,0,0,0,0|1,0,1]=4 18377 B14R0.394 C#CCCCCCCCOCCC(C)C 34a_100000054614_100000210312 [0,2,0,0,0,0|1,0,1]=4 18378 B14R0.394 C#CCCCCCCCOCCC(C)C 34a_100000210254_100153394163 [0,2,0,0,0,0|1,0,1]=4 18379 B14R0.394 C#CCCCCCCCOCCC(C)C 7a_100000054614_100000210626 [0,2,0,0,0,0|1,0,1]=4 18380 B14R0.394 C#CCCCCCCCOCCC(C)C 7a_100000210254_100153394163 [0,2,0,0,0,0|1,0,1]=4 18381 B14R0.394 C#CCCCCCCCOCCC(C)O 34a_100000054614_100012276601 [0,2,0,0,0,0|0,0,2]=4 18382 B14R0.394 C#CCCCCCCCOCCC(C)O 7a_100000054614_100012276601 [0,2,0,0,0,0|0,0,2]=4 18383 B14R0.394 C#CCCCCCCCOCC[C@@H](C)N 34a_100000706166_100153394163 [0,2,0,0,0,0|1,0,1]=4 18384 B14R0.394 C#CCCCCCCCSCCC(C)C 62a_100000210312_100153394163 [0,2,0,0,0,0|1,0,1]=4 18385 B14R0.394 C#CCCCCCCCSCCC(C)C 62a_100153394163_100000210312 [0,2,0,0,0,0|1,0,1]=4 18386 B14R0.394 C#CCCCCCCCSCCC(C)O 62a_100012276601_100153394163 [0,2,0,0,0,0|0,0,2]=4 18387 B14R0.394 C#CCCCCCCCSCCC(C)O 62a_100153394163_100012276601 [0,2,0,0,0,0|0,0,2]=4 18388 B14R0.394 C#CCCCCCCNCCCC(C)C 2230a_200000737386_100012276617 [0,2,0,0,0,0|1,0,1]=4 18389 B14R0.394 C#CCCCCCCNCCCC(C)C 34a_200000737386_100012276617 [0,2,0,0,0,0|1,0,1]=4 18390 B14R0.394 C#CCCCCCCOCCCC(C)C 34a_100000210774_100012276617 [0,2,0,0,0,0|1,0,1]=4 18391 B14R0.394 C#CCCCCCCOCCCC(C)C 34a_100011217361_100011214892 [0,2,0,0,0,0|1,0,1]=4 18392 B14R0.394 C#CCCCCCCOCCCC(C)C 7a_100000210774_100012276617 [0,2,0,0,0,0|1,0,1]=4 18393 B14R0.394 C#CCCCCCCOCCCC(C)C 7a_100011217361_100011214892 [0,2,0,0,0,0|1,0,1]=4 18394 B14R0.394 C#CCCCCCCOCCCC(C)O 34a_100011217361_200000718107 [0,2,0,0,0,0|0,0,2]=4 18395 B14R0.394 C#CCCCCCCOCCCC(C)O 7a_100011217361_200000718107 [0,2,0,0,0,0|0,0,2]=4 18396 B14R0.394 C#CCCCCCCSCCCC(C)C 62a_100011214892_100012276617 [0,2,0,0,0,0|1,0,1]=4 18397 B14R0.394 C#CCCCCCCSCCCC(C)C 62a_100012276617_100011214892 [0,2,0,0,0,0|1,0,1]=4 18398 B14R0.394 C#CCCCCCCSCCCC(C)O 62a_100012276617_200000718107 [0,2,0,0,0,0|0,0,2]=4 18399 B14R0.394 C#CCCCCCCSCCCC(C)O 62a_200000718107_100012276617 [0,2,0,0,0,0|0,0,2]=4 18400 B14R0.394 C#CCCCCCOCCCCC(C)C 34a_100000766912_100011216152 [0,2,0,0,0,0|1,0,1]=4 18401 B14R0.394 C#CCCCCCOCCCCC(C)C 34a_100011214890_100012094781 [0,2,0,0,0,0|1,0,1]=4 18402 B14R0.394 C#CCCCCCOCCCCC(C)C 7a_100000766912_100011216152 [0,2,0,0,0,0|1,0,1]=4 18403 B14R0.394 C#CCCCCCOCCCCC(C)C 7a_100011214890_100012094781 [0,2,0,0,0,0|1,0,1]=4 18404 B14R0.394 C#CCCCCCSCCCCC(C)C 62a_100011216152_100012094781 [0,2,0,0,0,0|1,0,1]=4 18405 B14R0.394 C#CCCCCCSCCCCC(C)C 62a_100012094781_100011216152 [0,2,0,0,0,0|1,0,1]=4 18406 B14R0.394 C#CCCCCNCCCCCC(C)C 2230a_100000706060_100000210682 [0,2,0,0,0,0|1,0,1]=4 18407 B14R0.394 C#CCCCCNCCCCCC(C)C 2230a_100011290863_100010269958 [0,2,0,0,0,0|1,0,1]=4 18408 B14R0.394 C#CCCCCNCCCCCC(C)C 34a_100000706060_100000210682 [0,2,0,0,0,0|1,0,1]=4 18409 B14R0.394 C#CCCCCNCCCCCC(C)C 34a_100011290863_100010269958 [0,2,0,0,0,0|1,0,1]=4 18410 B14R0.394 C#CCCCCOCCCCCC(C)C 34a_100000766709_100000210682 [0,2,0,0,0,0|1,0,1]=4 18411 B14R0.394 C#CCCCCOCCCCCC(C)C 34a_100011995859_100010269958 [0,2,0,0,0,0|1,0,1]=4 18412 B14R0.394 C#CCCCCOCCCCCC(C)C 7a_100000766709_100000210682 [0,2,0,0,0,0|1,0,1]=4 18413 B14R0.394 C#CCCCCOCCCCCC(C)C 7a_100011995859_100010269958 [0,2,0,0,0,0|1,0,1]=4 18414 B14R0.394 C#CCCCCSCCCCCC(C)C 62a_100000210682_100010269958 [0,2,0,0,0,0|1,0,1]=4 18415 B14R0.394 C#CCCCCSCCCCCC(C)C 62a_100010269958_100000210682 [0,2,0,0,0,0|1,0,1]=4 18416 B14R0.394 C#CCCCNCCCCCCC(C)C 2230a_100000211014_100000731252 [0,2,0,0,0,0|1,0,1]=4 18417 B14R0.394 C#CCCCNCCCCCCC(C)C 34a_100000211014_100000695029 [0,2,0,0,0,0|1,0,1]=4 18418 B14R0.394 C#CCCOCCCCCCCC(C)C 34a_200000210741_100000688953 [0,2,0,0,0,0|1,0,1]=4 18419 B14R0.394 C#CCCOCCCCCCCC(C)C 7a_200000210741_100000688953 [0,2,0,0,0,0|1,0,1]=4 18420 B14R0.394 C=C(Br)CCOCCCCCCCCC 34a_100009813270_100011214924 [0,2,0,0,0,0|1,0,1]=4 18421 B14R0.394 C=C(Br)CCOCCCCCCCCO 34a_100009813270_100000033203 [0,2,0,0,0,0|0,0,2]=4 18422 B14R0.394 C=C(C)CCNCCCCCCCCC 2230a_100000212291_100000730704 [0,2,0,0,0,0|1,0,1]=4 18423 B14R0.394 C=C(C)CCNCCCCCCCCC 34a_100000212291_100000730704 [0,2,0,0,0,0|1,0,1]=4 18424 B14R0.394 C=C(C)CCNCCCCCCCCO 2230a_102515433106_100000730704 [0,2,0,0,0,0|0,0,1]=3 18425 B14R0.394 C=C(C)CCNCCCCCCCCO 34a_102515433106_100000730704 [0,2,0,0,0,0|0,0,1]=3 18426 B14R0.394 C=C(C)CCOCCCCCCCCBr 34a_100009813846_100000730704 [0,2,0,0,0,0|1,0,1]=4 18427 B14R0.394 C=C(C)CCOCCCCCCCCBr 7a_100009813846_100000730704 [0,2,0,0,0,0|1,0,1]=4 18428 B14R0.394 C=C(C)CCOCCCCCCCCC 34a_100000210712_100000730704 [0,2,0,0,0,0|1,0,1]=4 18429 B14R0.394 C=C(C)CCOCCCCCCCCC 34a_100000764851_100011214924 [0,2,0,0,0,0|1,0,1]=4 18430 B14R0.394 C=C(C)CCOCCCCCCCCC 7a_100000210712_100000730704 [0,2,0,0,0,0|1,0,1]=4 18431 B14R0.394 C=C(C)CCOCCCCCCCCCl 34a_100000033203_100000730704 [0,2,0,0,0,0|1,0,1]=4 18432 B14R0.394 C=C(C)CCOCCCCCCCCCl 7a_100000033203_100000730704 [0,2,0,0,0,0|1,0,1]=4 18433 B14R0.394 C=C(C)CCOCCCCCCCCN 34a_102515433106_100000730704 [0,2,0,0,0,0|1,0,1]=4 18434 B14R0.394 C=C(C)CCOCCCCCCCCO 34a_100000764851_100000033203 [0,2,0,0,0,0|0,0,1]=3 18435 B14R0.394 C=C(C)CCSCCCCCCCCC 62a_100000730704_100000210670 [0,2,0,0,0,0|1,0,1]=4 18436 B14R0.394 C=C(C)CCSCCCCCCCCO 62a_100000033203_100000730704 [0,2,0,0,0,0|0,0,1]=3 18437 B14R0.394 C=C(C)CCSCCCCCCCCO 62a_100000730704_100000033203 [0,2,0,0,0,0|0,0,1]=3 18438 B14R0.394 C=C(C)CNCCCCCCCCCC 2230a_100000684558_100000748629 [0,2,0,0,0,0|1,0,1]=4 18439 B14R0.394 C=C(C)CNCCCCCCCCCC 34a_100000684558_100000748629 [0,2,0,0,0,0|1,0,1]=4 18440 B14R0.394 C=C(C)CNCCCCCCCCCO 2230a_100000078944_100000748629 [0,2,0,0,0,0|0,0,1]=3 18441 B14R0.394 C=C(C)CNCCCCCCCCCO 34a_100000078944_100000748629 [0,2,0,0,0,0|0,0,1]=3 18442 B14R0.394 C=C(C)COCCCCCCCCCBr 34a_100009813782_100000748629 [0,2,0,0,0,0|1,0,1]=4 18443 B14R0.394 C=C(C)COCCCCCCCCCBr 7a_100009813782_100000748629 [0,2,0,0,0,0|1,0,1]=4 18444 B14R0.394 C=C(C)COCCCCCCCCCC 34a_100000210245_100000210320 [0,2,0,0,0,0|1,0,1]=4 18445 B14R0.394 C=C(C)COCCCCCCCCCC 34a_100000210711_100000748629 [0,2,0,0,0,0|1,0,1]=4 18446 B14R0.394 C=C(C)COCCCCCCCCCC 7a_100000210711_100000748629 [0,2,0,0,0,0|1,0,1]=4 18447 B14R0.394 C=C(C)COCCCCCCCCCCl 34a_100009868337_100000748629 [0,2,0,0,0,0|1,0,1]=4 18448 B14R0.394 C=C(C)COCCCCCCCCCCl 7a_100009868337_100000748629 [0,2,0,0,0,0|1,0,1]=4 18449 B14R0.394 C=C(C)COCCCCCCCCCN 34a_100000078944_100000748629 [0,2,0,0,0,0|1,0,1]=4 18450 B14R0.394 C=C(C)COCCCCCCCCCO 34a_100000210245_100009813782 [0,2,0,0,0,0|0,0,1]=3 18451 B14R0.394 C=C(C)CSCCCCCCCCCC 62a_100000748629_100000210320 [0,2,0,0,0,0|1,0,1]=4 18452 B14R0.394 C=C(C)CSCCCCCCCCCO 62a_100000748629_100009813782 [0,2,0,0,0,0|0,0,1]=3 18453 B14R0.394 C=C(C)CSCCCCCCCCCO 62a_100009813782_100000211660 [0,2,0,0,0,0|0,0,1]=3 18454 B14R0.394 C=C(F)CNCCCCCCCCCC 2230a_100000684558_100009893438 [0,2,0,0,0,0|1,0,1]=4 18455 B14R0.394 C=C(F)CNCCCCCCCCCC 34a_100000684558_100009893438 [0,2,0,0,0,0|1,0,1]=4 18456 B14R0.394 C=C(F)CNCCCCCCCCCO 2230a_100000078944_100009893438 [0,2,0,0,0,0|0,0,2]=4 18457 B14R0.394 C=C(F)CNCCCCCCCCCO 34a_100000078944_100009893438 [0,2,0,0,0,0|0,0,2]=4 18458 B14R0.394 C=C(F)COCCCCCCCCCC 34a_100000210711_100009893438 [0,2,0,0,0,0|1,0,1]=4 18459 B14R0.394 C=C(F)COCCCCCCCCCC 34a_200010262243_100000210320 [0,2,0,0,0,0|1,0,1]=4 18460 B14R0.394 C=C(F)COCCCCCCCCCC 7a_100000210711_100000042424 [0,2,0,0,0,0|1,0,1]=4 18461 B14R0.394 C=C(F)COCCCCCCCCCO 34a_200010262243_100009813782 [0,2,0,0,0,0|0,0,2]=4 18462 B14R0.394 C=C(F)CSCCCCCCCCCC 62a_100000042424_100000210320 [0,2,0,0,0,0|1,0,1]=4 18463 B14R0.394 C=C(F)CSCCCCCCCCCO 62a_100000042424_100009813782 [0,2,0,0,0,0|0,0,2]=4 18464 B14R0.394 C=C(F)CSCCCCCCCCCO 62a_100009813782_100000042424 [0,2,0,0,0,0|0,0,2]=4 18465 B14R0.394 C=CCCCCCCCCCCC(=O)C 1458a_100000070787_100011093070 [0,2,0,0,0,0|1,0,1]=4 18466 B14R0.394 C=CCCCCCCCCCCN(C)C 2230a_100102631434_100011093070 [0,2,0,0,0,0|1,0,1]=4 18467 B14R0.394 C=CCCCCCCCCCCN(C)C 269982a_100102631434_100011093070 [0,2,0,0,0,0|1,0,1]=4 18468 B14R0.394 C=CCCCCCCCCCNC(C)C 2230a_100000081888_100000210206 [0,2,0,0,0,0|1,0,1]=4 18469 B14R0.394 C=CCCCCCCCCCNC(C)C 2230a_100138425928_100009814027 [0,2,0,0,0,0|1,0,1]=4 18470 B14R0.394 C=CCCCCCCCCCNC(C)C 34a_100000081888_100000210206 [0,2,0,0,0,0|1,0,1]=4 18471 B14R0.394 C=CCCCCCCCCCNC(C)C 34a_100138425928_100009814027 [0,2,0,0,0,0|1,0,1]=4 18472 B14R0.394 C=CCCCCCCCCCOC(C)C 34a_100000038209_100000210206 [0,2,0,0,0,0|1,0,1]=4 18473 B14R0.394 C=CCCCCCCCCCOC(C)C 34a_100000212225_100009814027 [0,2,0,0,0,0|1,0,1]=4 18474 B14R0.394 C=CCCCCCCCCCOC(C)C 7a_100000038209_100000210206 [0,2,0,0,0,0|1,0,1]=4 18475 B14R0.394 C=CCCCCCCCCCSC(C)C 62a_100000210206_100009814027 [0,2,0,0,0,0|1,0,1]=4 18476 B14R0.394 C=CCCCCCCCCCSC(C)C 62a_100009814027_100000210206 [0,2,0,0,0,0|1,0,1]=4 18477 B14R0.394 C=CCCCCCCCCNCC(C)C 2230a_100000210953_100011933949 [0,2,0,0,0,0|1,0,1]=4 18478 B14R0.394 C=CCCCCCCCCNCC(C)C 34a_100000210953_100011933949 [0,2,0,0,0,0|1,0,1]=4 18479 B14R0.394 C=CCCCCCCCCNCC(C)O 2230a_100000210904_100011933949 [0,2,0,0,0,0|0,0,2]=4 18480 B14R0.394 C=CCCCCCCCCNCC(C)O 34a_100000210904_100011933949 [0,2,0,0,0,0|0,0,2]=4 18481 B14R0.394 C=CCCCCCCCCOCC(C)Br 34a_100012180447_100011933949 [0,2,0,0,0,0|1,0,1]=4 18482 B14R0.394 C=CCCCCCCCCOCC(C)C 34a_100000210257_100011933949 [0,2,0,0,0,0|1,0,1]=4 18483 B14R0.394 C=CCCCCCCCCOCC(C)C 34a_100011215194_100000210624 [0,2,0,0,0,0|1,0,1]=4 18484 B14R0.394 C=CCCCCCCCCOCC(C)C 7a_100011215194_100000210760 [0,2,0,0,0,0|1,0,1]=4 18485 B14R0.394 C=CCCCCCCCCOCC(C)F 34a_100015925927_100011933949 [0,2,0,0,0,0|1,0,1]=4 18486 B14R0.394 C=CCCCCCCCCOCC(C)O 34a_100011215194_100011218427 [0,2,0,0,0,0|0,0,2]=4 18487 B14R0.394 C=CCCCCCCCCOCC(C)O 7a_100011215194_100011218427 [0,2,0,0,0,0|0,0,2]=4 18488 B14R0.394 C=CCCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100011933949 [0,2,0,0,0,0|1,0,1]=4 18489 B14R0.394 C=CCCCCCCCCOC[C@@H](C)N 34a_100000737577_100011933949 [0,2,0,0,0,0|1,0,1]=4 18490 B14R0.394 C=CCCCCCCCCOC[C@@H](C)O 34a_100011215194_100009817552 [0,2,0,0,0,0|0,0,2]=4 18491 B14R0.394 C=CCCCCCCCCOC[C@@H](C)O 7a_100011215194_100009817552 [0,2,0,0,0,0|0,0,2]=4 18492 B14R0.394 C=CCCCCCCCCSCC(C)C 62a_100000210624_100011933949 [0,2,0,0,0,0|1,0,1]=4 18493 B14R0.394 C=CCCCCCCCCSCC(C)C 62a_100011933949_100000210760 [0,2,0,0,0,0|1,0,1]=4 18494 B14R0.394 C=CCCCCCCCCSCC(C)O 62a_100011218427_100011933949 [0,2,0,0,0,0|0,0,2]=4 18495 B14R0.394 C=CCCCCCCCCSCC(C)O 62a_100011933949_100011218427 [0,2,0,0,0,0|0,0,2]=4 18496 B14R0.394 C=CCCCCCCCCSC[C@@H](C)O 62a_100009817552_100011933949 [0,2,0,0,0,0|0,0,2]=4 18497 B14R0.394 C=CCCCCCCCCSC[C@@H](C)O 62a_100011933949_100009817552 [0,2,0,0,0,0|0,0,2]=4 18498 B14R0.394 C=CCCCCCCCNCCC(C)O 2230a_200000755665_100012355270 [0,2,0,0,0,0|0,0,2]=4 18499 B14R0.394 C=CCCCCCCCOCCC(C)Br 34a_100009893172_100012355270 [0,2,0,0,0,0|1,0,1]=4 18500 B14R0.394 C=CCCCCCCCOCCC(C)C 34a_100000210254_100012355270 [0,2,0,0,0,0|1,0,1]=4 18501 B14R0.394 C=CCCCCCCCOCCC(C)C 34a_100000730831_100000210312 [0,2,0,0,0,0|1,0,1]=4 18502 B14R0.394 C=CCCCCCCCOCCC(C)C 7a_100000210254_100012355270 [0,2,0,0,0,0|1,0,1]=4 18503 B14R0.394 C=CCCCCCCCOCCC(C)C 7a_100000730831_100000210626 [0,2,0,0,0,0|1,0,1]=4 18504 B14R0.394 C=CCCCCCCCOCCC(C)O 34a_100000730831_100012276601 [0,2,0,0,0,0|0,0,2]=4 18505 B14R0.394 C=CCCCCCCCOCCC(C)O 7a_100000730831_100012276601 [0,2,0,0,0,0|0,0,2]=4 18506 B14R0.394 C=CCCCCCCCOCC[C@@H](C)N 34a_100000706166_100012355270 [0,2,0,0,0,0|1,0,1]=4 18507 B14R0.394 C=CCCCCCCCSCCC(C)C 62a_100000210312_100012355270 [0,2,0,0,0,0|1,0,1]=4 18508 B14R0.394 C=CCCCCCCCSCCC(C)C 62a_100012355270_100000210312 [0,2,0,0,0,0|1,0,1]=4 18509 B14R0.394 C=CCCCCCCCSCCC(C)O 62a_100012276601_100012355270 [0,2,0,0,0,0|0,0,2]=4 18510 B14R0.394 C=CCCCCCCCSCCC(C)O 62a_100012355270_100012276601 [0,2,0,0,0,0|0,0,2]=4 18511 B14R0.394 C=CCCCCCCNCCCC(C)C 2230a_200000737386_100011215473 [0,2,0,0,0,0|1,0,1]=4 18512 B14R0.394 C=CCCCCCCNCCCC(C)C 34a_200000737386_100011215473 [0,2,0,0,0,0|1,0,1]=4 18513 B14R0.394 C=CCCCCCCOCCCC(C)C 34a_100000210774_100011215473 [0,2,0,0,0,0|1,0,1]=4 18514 B14R0.394 C=CCCCCCCOCCCC(C)C 34a_200011216477_100011214892 [0,2,0,0,0,0|1,0,1]=4 18515 B14R0.394 C=CCCCCCCOCCCC(C)C 7a_100000210774_100011215473 [0,2,0,0,0,0|1,0,1]=4 18516 B14R0.394 C=CCCCCCCOCCCC(C)C 7a_200011216477_100011214892 [0,2,0,0,0,0|1,0,1]=4 18517 B14R0.394 C=CCCCCCCOCCCC(C)O 34a_200011216477_200000718107 [0,2,0,0,0,0|0,0,2]=4 18518 B14R0.394 C=CCCCCCCOCCCC(C)O 7a_200011216477_200000718107 [0,2,0,0,0,0|0,0,2]=4 18519 B14R0.394 C=CCCCCCCSCCCC(C)C 62a_100011214892_100011215473 [0,2,0,0,0,0|1,0,1]=4 18520 B14R0.394 C=CCCCCCCSCCCC(C)C 62a_100011215473_100011214892 [0,2,0,0,0,0|1,0,1]=4 18521 B14R0.394 C=CCCCCCCSCCCC(C)O 62a_100011215473_200000718107 [0,2,0,0,0,0|0,0,2]=4 18522 B14R0.394 C=CCCCCCCSCCCC(C)O 62a_200000718107_100011215473 [0,2,0,0,0,0|0,0,2]=4 18523 B14R0.394 C=CCCCCCOCCCCC(C)C 34a_100011214890_100000700193 [0,2,0,0,0,0|1,0,1]=4 18524 B14R0.394 C=CCCCCCOCCCCC(C)C 34a_100011216702_100011216152 [0,2,0,0,0,0|1,0,1]=4 18525 B14R0.394 C=CCCCCCOCCCCC(C)C 7a_100011214890_100000700193 [0,2,0,0,0,0|1,0,1]=4 18526 B14R0.394 C=CCCCCCOCCCCC(C)C 7a_100011216702_100011216152 [0,2,0,0,0,0|1,0,1]=4 18527 B14R0.394 C=CCCCCCSCCCCC(C)C 62a_100000700193_100011216152 [0,2,0,0,0,0|1,0,1]=4 18528 B14R0.394 C=CCCCCCSCCCCC(C)C 62a_100011216152_100000700193 [0,2,0,0,0,0|1,0,1]=4 18529 B14R0.394 C=CCCCCNCCCCCC(C)C 2230a_100000703577_100000210682 [0,2,0,0,0,0|1,0,1]=4 18530 B14R0.394 C=CCCCCNCCCCCC(C)C 2230a_100011290863_100011215482 [0,2,0,0,0,0|1,0,1]=4 18531 B14R0.394 C=CCCCCNCCCCCC(C)C 34a_100000703577_100000210682 [0,2,0,0,0,0|1,0,1]=4 18532 B14R0.394 C=CCCCCNCCCCCC(C)C 34a_100011290863_100011215482 [0,2,0,0,0,0|1,0,1]=4 18533 B14R0.394 C=CCCCCOCCCCCC(C)C 34a_100000766645_100000210682 [0,2,0,0,0,0|1,0,1]=4 18534 B14R0.394 C=CCCCCOCCCCCC(C)C 34a_100011995859_100011215482 [0,2,0,0,0,0|1,0,1]=4 18535 B14R0.394 C=CCCCCOCCCCCC(C)C 7a_100000766645_100000210682 [0,2,0,0,0,0|1,0,1]=4 18536 B14R0.394 C=CCCCCOCCCCCC(C)C 7a_100011995859_100011215482 [0,2,0,0,0,0|1,0,1]=4 18537 B14R0.394 C=CCCCCSCCCCCC(C)C 62a_100000210682_100011215482 [0,2,0,0,0,0|1,0,1]=4 18538 B14R0.394 C=CCCCCSCCCCCC(C)C 62a_100011215482_100000210682 [0,2,0,0,0,0|1,0,1]=4 18539 B14R0.394 C=CCCCNCCCCCCC(C)C 2230a_100000211014_100011713584 [0,2,0,0,0,0|1,0,1]=4 18540 B14R0.394 C=CCCCNCCCCCCC(C)C 34a_100000211014_100000757094 [0,2,0,0,0,0|1,0,1]=4 18541 B14R0.394 C=CCCOCCCCCCCC(C)C 34a_200000210741_100000754431 [0,2,0,0,0,0|1,0,1]=4 18542 B14R0.394 C=CCCOCCCCCCCC(C)C 7a_200000210741_100000754431 [0,2,0,0,0,0|1,0,1]=4 18543 B14R0.394 CC(=CCCNCCCCCCCO)C 2230a_100011996573_100011217483 [0,2,0,0,0,0|0,0,2]=4 18544 B14R0.394 CC(=CCCNCCCCCCCO)C 34a_100011996573_100011217483 [0,2,0,0,0,0|0,0,2]=4 18545 B14R0.394 CC(=CCCSCCCCCCCO)C 62a_100000760002_100011217483 [0,2,0,0,0,0|0,0,2]=4 18546 B14R0.394 CC(=CCCSCCCCCCCO)C 62a_100011217483_100000760002 [0,2,0,0,0,0|0,0,2]=4 18547 B14R0.394 CC(=CCNCCCCCCCCO)C 2230a_102515433106_100000761012 [0,2,0,0,0,0|0,0,2]=4 18548 B14R0.394 CC(=CCNCCCCCCCCO)C 34a_100000718196_100000033203 [0,2,0,0,0,0|0,0,2]=4 18549 B14R0.394 CC(=CCNCCCCCCCCO)C 34a_102515433106_100000761012 [0,2,0,0,0,0|0,0,2]=4 18550 B14R0.394 CC(=CCOCCCCCCCCO)C 34a_100000753907_100000033203 [0,2,0,0,0,0|0,0,2]=4 18551 B14R0.394 CC(=CCSCCCCCCCCO)C 62a_100000033203_100000761012 [0,2,0,0,0,0|0,0,2]=4 18552 B14R0.394 CC(=CCSCCCCCCCCO)C 62a_100000761012_100000033203 [0,2,0,0,0,0|0,0,2]=4 18553 B14R0.394 CC(=O)CCCCCCCCCCCO 1458a_100000070787_100009812471 [0,2,0,0,0,0|0,0,0]=2 18554 B14R0.394 CC(=O)CCCCNCCCCCCO 34a_100000686447_100009817362 [0,2,0,0,0,0|0,0,1]=3 18555 B14R0.394 CC(=O)CCCCOCCCCCCBr 34a_100011215345_100009817362 [0,2,0,0,0,0|1,0,1]=4 18556 B14R0.394 CC(=O)CCCCOCCCCCCBr 7a_100011215345_100000735457 [0,2,0,0,0,0|1,0,1]=4 18557 B14R0.394 CC(=O)CCCCOCCCCCCCl 34a_100000766143_100009817362 [0,2,0,0,0,0|1,0,1]=4 18558 B14R0.394 CC(=O)CCCCOCCCCCCCl 7a_100000766143_100000735457 [0,2,0,0,0,0|1,0,1]=4 18559 B14R0.394 CC(=O)CCCCOCCCCCCF 34a_100000732779_100009817362 [0,2,0,0,0,0|1,0,1]=4 18560 B14R0.394 CC(=O)CCCCOCCCCCCF 7a_100000732779_100000735457 [0,2,0,0,0,0|1,0,1]=4 18561 B14R0.394 CC(=O)CCCCOCCCCCCN 34a_100000686447_100009817362 [0,2,0,0,0,0|1,0,1]=4 18562 B14R0.394 CC(=O)CCCCSCCCCCCF 62a_100000735457_100015922095 [0,2,0,0,0,0|1,0,1]=4 18563 B14R0.394 CC(=O)CCCCSCCCCCCF 62a_100015922095_100000735457 [0,2,0,0,0,0|1,0,1]=4 18564 B14R0.394 CC(=O)CCCCSCCCCCCO 62a_100000735457_100000766143 [0,2,0,0,0,0|0,0,1]=3 18565 B14R0.394 CC(=O)CCCCSCCCCCCO 62a_100000766143_100000735457 [0,2,0,0,0,0|0,0,1]=3 18566 B14R0.394 CC(=O)CCCNCCCCCCCO 34a_100011996573_100000685027 [0,2,0,0,0,0|0,0,1]=3 18567 B14R0.394 CC(=O)CCCNCCCOCCCO 34a_100011310245_100000685027 [0,2,0,0,0,0|1,0,1]=4 18568 B14R0.394 CC(=O)CCCOCCCCCCCBr 34a_100000760002_100000685027 [0,2,0,0,0,0|1,0,1]=4 18569 B14R0.394 CC(=O)CCCOCCCCCCCBr 7a_100000760002_100011215641 [0,2,0,0,0,0|1,0,1]=4 18570 B14R0.394 CC(=O)CCCOCCCCCCCN 34a_100011996573_100000685027 [0,2,0,0,0,0|1,0,1]=4 18571 B14R0.394 CC(=O)CCCOCCCCCCCO 34a_100000759063_100000760002 [0,2,0,0,0,0|0,0,1]=3 18572 B14R0.394 CC(=O)CCCOCCCCCCCO 7a_100000759063_100000760002 [0,2,0,0,0,0|0,0,1]=3 18573 B14R0.394 CC(=O)CCCSCCCCCCCO 62a_100000760002_100011215641 [0,2,0,0,0,0|0,0,1]=3 18574 B14R0.394 CC(=O)CCCSCCCCCCCO 62a_100011215641_100000760002 [0,2,0,0,0,0|0,0,1]=3 18575 B14R0.394 CC(=O)CCOCCCCCCCCBr 7a_100009813846_100000053229 [0,2,0,0,0,0|1,0,1]=4 18576 B14R0.394 CC(=O)CCOCCCCCCCCCl 7a_100000033203_100000053229 [0,2,0,0,0,0|1,0,1]=4 18577 B14R0.394 CC(=O)CCOCCCCCCCCO 34a_100000759926_100000033203 [0,2,0,0,0,0|0,0,1]=3 18578 B14R0.394 CC(=O)CCOCCCCCCCCO 7a_100000759926_100000033203 [0,2,0,0,0,0|0,0,1]=3 18579 B14R0.394 CC(=O)CCSCCCCCCCCO 62a_100000033203_100000053229 [0,2,0,0,0,0|0,0,1]=3 18580 B14R0.394 CC(=O)CCSCCCCCCCCO 62a_100000053229_100000033203 [0,2,0,0,0,0|0,0,1]=3 18581 B14R0.394 CC(=O)COCCCCCCCCCO 34a_100000211253_100009813782 [0,2,0,0,0,0|0,0,1]=3 18582 B14R0.394 CC(=O)NCCCCCCCCCCO 240690a_100000066964_100015343762 [0,2,0,0,0,0|0,0,1]=3 18583 B14R0.394 CC(=O)NCCCCCCNCCCO 2230a_200011996284_100000230001 [0,2,0,0,0,0|1,0,1]=4 18584 B14R0.394 CC(=O)NCCCCCCNCCCO 34a_200011996284_100000230001 [0,2,0,0,0,0|1,0,1]=4 18585 B14R0.394 CC(=O)NCCCCCNCCCCO 2230a_200012022750_100000210776 [0,2,0,0,0,0|1,0,1]=4 18586 B14R0.394 CC(=O)NCCCCCNCCCCO 34a_200012022750_100011216708 [0,2,0,0,0,0|1,0,1]=4 18587 B14R0.394 CC(=O)NCCCCNCCCCCO 2230a_200011368371_100000746330 [0,2,0,0,0,0|1,0,1]=4 18588 B14R0.394 CC(=O)NCCCCNCCCCCO 34a_200011368371_100000746330 [0,2,0,0,0,0|1,0,1]=4 18589 B14R0.394 CC(=O)NCCCNCCCCCCO 34a_100000736810_100000766143 [0,2,0,0,0,0|1,0,1]=4 18590 B14R0.394 CC(=O)NCCCOCCCCCCO 34a_100000752032_100000766143 [0,2,0,0,0,0|1,0,1]=4 18591 B14R0.394 CC(=O)NCCNCCCCCCCO 2230a_100000209853_100000760002 [0,2,0,0,0,0|1,0,1]=4 18592 B14R0.394 CC(=O)NCCNCCCCCCCO 2230a_100011996573_100000189650 [0,2,0,0,0,0|1,0,1]=4 18593 B14R0.394 CC(=O)NCCOCCCCCCCO 34a_100000158858_100000760002 [0,2,0,0,0,0|1,0,1]=4 18594 B14R0.394 CC(=O)NCCSCCCCCCCO 62a_100000189650_100000760002 [0,2,0,0,0,0|1,0,1]=4 18595 B14R0.394 CC(=O)NCCSCCCCCCCO 62a_100000760002_100000189650 [0,2,0,0,0,0|1,0,1]=4 18596 B14R0.394 CC(=O)OCCCCCNCCCCO 2230a_100000750430_100009813381 [0,2,0,0,0,0|1,0,1]=4 18597 B14R0.394 CC(=O)OCCCCCNCCCCO 34a_100000750430_100000033007 [0,2,0,0,0,0|1,0,1]=4 18598 B14R0.394 CC(=O)OCCCCCSCCCCO 62a_100000033007_100000210776 [0,2,0,0,0,0|1,0,1]=4 18599 B14R0.394 CC(=O)OCCCCCSCCCCO 62a_100000210776_100000033007 [0,2,0,0,0,0|1,0,1]=4 18600 B14R0.394 CC(=O)OCCCCNCCCCCO 34a_100000762737_100000033659 [0,2,0,0,0,0|1,0,1]=4 18601 B14R0.394 CC(=O)OCCCCOCCCCCO 34a_100000073216_100000746330 [0,2,0,0,0,0|1,0,1]=4 18602 B14R0.394 CC(=O)OCCCCOCCCCCO 7a_100000073216_100000746330 [0,2,0,0,0,0|1,0,1]=4 18603 B14R0.394 CC(=O)OCCCCSCCCCCO 62a_100000033659_100000746330 [0,2,0,0,0,0|1,0,1]=4 18604 B14R0.394 CC(=O)OCCCCSCCCCCO 62a_100000746330_100000033659 [0,2,0,0,0,0|1,0,1]=4 18605 B14R0.394 CC(=O)OCCCNCCCCCCO 34a_100000686447_100000042594 [0,2,0,0,0,0|1,0,1]=4 18606 B14R0.394 CC(=O)OCCCSCCCCCCO 62a_100000042594_100000766143 [0,2,0,0,0,0|1,0,1]=4 18607 B14R0.394 CC(=O)OCCCSCCCCCCO 62a_100000766143_100000042594 [0,2,0,0,0,0|1,0,1]=4 18608 B14R0.394 CC(=O)OCCNCCCCCCCO 34a_100011996573_100009814007 [0,2,0,0,0,0|1,0,1]=4 18609 B14R0.394 CC(=O)OCCSCCCCCCCO 62a_100000760002_100009814007 [0,2,0,0,0,0|1,0,1]=4 18610 B14R0.394 CC(=O)OCCSCCCCCCCO 62a_100009814007_100000760002 [0,2,0,0,0,0|1,0,1]=4 18611 B14R0.394 CC(=O)OCNCCCCCCCCO 34a_102515433106_100009813279 [0,2,0,0,0,0|1,0,1]=4 18612 B14R0.394 CC(=O)OCSCCCCCCCCO 62a_100000033203_100000076356 [0,2,0,0,0,0|1,0,1]=4 18613 B14R0.394 CC(=O)OCSCCCCCCCCO 62a_100000076356_100000033203 [0,2,0,0,0,0|1,0,1]=4 18614 B14R0.394 CC(=O)SCCCCNCCCCCO 2230a_100000762737_200010402107 [0,2,0,0,0,0|1,0,1]=4 18615 B14R0.394 CC(=O)SCCCCNCCCCCO 34a_100000762737_200010402107 [0,2,0,0,0,0|1,0,1]=4 18616 B14R0.394 CC(=O)SCCCCSCCCCCO 62a_100000746330_200010402107 [0,2,0,0,0,0|1,0,1]=4 18617 B14R0.394 CC(=O)SCCCCSCCCCCO 62a_200010402107_100000746330 [0,2,0,0,0,0|1,0,1]=4 18618 B14R0.394 CC(=O)SCCCNCCCCCCO 2230a_100000686447_100000038929 [0,2,0,0,0,0|1,0,1]=4 18619 B14R0.394 CC(=O)SCCCNCCCCCCO 34a_100000686447_100000038929 [0,2,0,0,0,0|1,0,1]=4 18620 B14R0.394 CC(=O)SCCCSCCCCCCO 62a_100000038929_100000766143 [0,2,0,0,0,0|1,0,1]=4 18621 B14R0.394 CC(=O)SCCCSCCCCCCO 62a_100000766143_100000038929 [0,2,0,0,0,0|1,0,1]=4 18622 B14R0.394 CC(=S)OCCCNCCCCCCO 2230a_100000686447_200135323944 [0,2,0,0,0,0|1,0,1]=4 18623 B14R0.394 CC(=S)OCCCNCCCCCCO 34a_100000686447_200135323944 [0,2,0,0,0,0|1,0,1]=4 18624 B14R0.394 CC(=S)OCCCSCCCCCCO 62a_100000766143_200135323944 [0,2,0,0,0,0|1,0,1]=4 18625 B14R0.394 CC(=S)OCCCSCCCCCCO 62a_200135323944_100000766143 [0,2,0,0,0,0|1,0,1]=4 18626 B14R0.394 CC(Br)CCOCCCCCCCCO 34a_100009893172_100000033203 [0,2,0,0,0,0|0,0,0]=2 18627 B14R0.394 CC(Br)CCOCCOCCOCCO 34a_100009893172_100000032323 [0,2,0,0,0,0|2,0,0]=4 18628 B14R0.394 CC(Br)COCCCCCCCCCO 34a_100012180447_100009813782 [0,2,0,0,0,0|0,0,0]=2 18629 B14R0.394 CC(C)CCCCCCCOCCC#N 7a_200000210741_100000184422 [0,2,0,0,0,0|1,0,1]=4 18630 B14R0.394 CC(C)CCCCCCCOCCCF 34a_200000210741_100011934791 [0,2,0,0,0,0|1,0,0]=3 18631 B14R0.394 CC(C)CCCCCCCOCCCF 7a_200000210741_100011934791 [0,2,0,0,0,0|1,0,0]=3 18632 B14R0.394 CC(C)CCCCCCCOCCCO 34a_200000210741_100000230001 [0,2,0,0,0,0|0,0,0]=2 18633 B14R0.394 CC(C)CCCCCCCOCCCO 7a_200000210741_100011215043 [0,2,0,0,0,0|0,0,0]=2 18634 B14R0.394 CC(C)CCCCCCNCC#CCO 2230a_100000211014_200000047223 [0,2,0,0,0,0|0,0,2]=4 18635 B14R0.394 CC(C)CCCCCCNCC#CCO 34a_100000211014_200000047223 [0,2,0,0,0,0|0,0,2]=4 18636 B14R0.394 CC(C)CCCCCCNCCCC#N 2230a_100000211014_100000687738 [0,2,0,0,0,0|1,0,1]=4 18637 B14R0.394 CC(C)CCCCCCNCCCC=O 2230a_100000211014_200011292268 [0,2,0,0,0,0|0,0,2]=4 18638 B14R0.394 CC(C)CCCCCCNCCCCF 2230a_100000211014_100000729493 [0,2,0,0,0,0|1,0,0]=3 18639 B14R0.394 CC(C)CCCCCCNCCCCF 34a_100000211014_100000729493 [0,2,0,0,0,0|1,0,0]=3 18640 B14R0.394 CC(C)CCCCCCNCCCCO 2230a_100000211014_100000210776 [0,2,0,0,0,0|0,0,0]=2 18641 B14R0.394 CC(C)CCCCCCNCCCCO 34a_100000211014_100011216708 [0,2,0,0,0,0|0,0,0]=2 18642 B14R0.394 CC(C)CCCCCNCCCCC#N 2230a_100011290863_100000211819 [0,2,0,0,0,0|1,0,1]=4 18643 B14R0.394 CC(C)CCCCCNCCCCC=O 2230a_100011290863_100000139335 [0,2,0,0,0,0|0,0,2]=4 18644 B14R0.394 CC(C)CCCCCNCCCCCF 2230a_100011290863_100000729378 [0,2,0,0,0,0|1,0,0]=3 18645 B14R0.394 CC(C)CCCCCNCCCCCF 34a_100011290863_100000729378 [0,2,0,0,0,0|1,0,0]=3 18646 B14R0.394 CC(C)CCCCCNCCCCCO 2230a_100000762737_100000210682 [0,2,0,0,0,0|0,0,0]=2 18647 B14R0.394 CC(C)CCCCCNCCCCCO 2230a_100011290863_100000746330 [0,2,0,0,0,0|0,0,0]=2 18648 B14R0.394 CC(C)CCCCCNCCCCCO 34a_100000762737_100000210682 [0,2,0,0,0,0|0,0,0]=2 18649 B14R0.394 CC(C)CCCCCNCCCCCO 34a_100011290863_100000746330 [0,2,0,0,0,0|0,0,0]=2 18650 B14R0.394 CC(C)CCCCCNCCOCCO 2230a_100000211614_100000210682 [0,2,0,0,0,0|1,0,0]=3 18651 B14R0.394 CC(C)CCCCCNCCOCCO 2230a_100011290863_100011215305 [0,2,0,0,0,0|1,0,0]=3 18652 B14R0.394 CC(C)CCCCCNCCOCCO 34a_100000211614_100000210682 [0,2,0,0,0,0|1,0,0]=3 18653 B14R0.394 CC(C)CCCCCNCCOCCO 34a_100011290863_100000692535 [0,2,0,0,0,0|1,0,0]=3 18654 B14R0.394 CC(C)CCCCCNCCSCCO 2230a_100011219999_100000210682 [0,2,0,0,0,0|1,0,0]=3 18655 B14R0.394 CC(C)CCCCCOCCCCC#N 7a_100011995859_100000211819 [0,2,0,0,0,0|1,0,1]=4 18656 B14R0.394 CC(C)CCCCCOCCCCC=O 7a_100011995859_100000139335 [0,2,0,0,0,0|0,0,2]=4 18657 B14R0.394 CC(C)CCCCCOCCCCCBr 34a_100000746331_100000210682 [0,2,0,0,0,0|1,0,0]=3 18658 B14R0.394 CC(C)CCCCCOCCCCCBr 7a_100000746331_100000210682 [0,2,0,0,0,0|1,0,0]=3 18659 B14R0.394 CC(C)CCCCCOCCCCCCl 34a_100000746330_100000210682 [0,2,0,0,0,0|1,0,0]=3 18660 B14R0.394 CC(C)CCCCCOCCCCCCl 7a_100000746330_100000210682 [0,2,0,0,0,0|1,0,0]=3 18661 B14R0.394 CC(C)CCCCCOCCCCCF 34a_100011995859_100000729378 [0,2,0,0,0,0|1,0,0]=3 18662 B14R0.394 CC(C)CCCCCOCCCCCF 7a_100011995859_100000729378 [0,2,0,0,0,0|1,0,0]=3 18663 B14R0.394 CC(C)CCCCCOCCCCCI 34a_200012148887_100000210682 [0,2,0,0,0,0|1,0,0]=3 18664 B14R0.394 CC(C)CCCCCOCCCCCI 7a_200012148887_100000210682 [0,2,0,0,0,0|1,0,0]=3 18665 B14R0.394 CC(C)CCCCCOCCCCCN 34a_100000762737_100000210682 [0,2,0,0,0,0|1,0,0]=3 18666 B14R0.394 CC(C)CCCCCOCCCCCO 34a_100011995859_100000746330 [0,2,0,0,0,0|0,0,0]=2 18667 B14R0.394 CC(C)CCCCCOCCCCCO 7a_100011995859_100000746330 [0,2,0,0,0,0|0,0,0]=2 18668 B14R0.394 CC(C)CCCCCOCCOCCBr 34a_100000692535_100000210682 [0,2,0,0,0,0|2,0,0]=4 18669 B14R0.394 CC(C)CCCCCOCCOCCBr 7a_100000692535_100000210682 [0,2,0,0,0,0|2,0,0]=4 18670 B14R0.394 CC(C)CCCCCOCCOCCCl 34a_100011215305_100000210682 [0,2,0,0,0,0|2,0,0]=4 18671 B14R0.394 CC(C)CCCCCOCCOCCCl 7a_100011215305_100000210682 [0,2,0,0,0,0|2,0,0]=4 18672 B14R0.394 CC(C)CCCCCOCCOCCF 34a_200015357709_100000210682 [0,2,0,0,0,0|2,0,0]=4 18673 B14R0.394 CC(C)CCCCCOCCOCCF 7a_200015357709_100000210682 [0,2,0,0,0,0|2,0,0]=4 18674 B14R0.394 CC(C)CCCCCOCCOCCI 34a_100012149058_100000210682 [0,2,0,0,0,0|2,0,0]=4 18675 B14R0.394 CC(C)CCCCCOCCOCCI 7a_100012149058_100000210682 [0,2,0,0,0,0|2,0,0]=4 18676 B14R0.394 CC(C)CCCCCOCCOCCN 34a_100000211614_100000210682 [0,2,0,0,0,0|2,0,0]=4 18677 B14R0.394 CC(C)CCCCCOCCOCCO 34a_100011995859_100000692535 [0,2,0,0,0,0|1,0,0]=3 18678 B14R0.394 CC(C)CCCCCOCCOCCO 7a_100011995859_100011215305 [0,2,0,0,0,0|1,0,0]=3 18679 B14R0.394 CC(C)CCCCCSCCCCC#N 62a_100000210682_100000211819 [0,2,0,0,0,0|1,0,1]=4 18680 B14R0.394 CC(C)CCCCCSCCCCC#N 62a_100011219923_100000210682 [0,2,0,0,0,0|1,0,1]=4 18681 B14R0.394 CC(C)CCCCCSCCCCC=O 62a_100000139335_100000210682 [0,2,0,0,0,0|0,0,2]=4 18682 B14R0.394 CC(C)CCCCCSCCCCC=O 62a_100000210682_100000139335 [0,2,0,0,0,0|0,0,2]=4 18683 B14R0.394 CC(C)CCCCCSCCCCCF 62a_100000210682_100000729378 [0,2,0,0,0,0|1,0,0]=3 18684 B14R0.394 CC(C)CCCCCSCCCCCF 62a_100000729378_100000210682 [0,2,0,0,0,0|1,0,0]=3 18685 B14R0.394 CC(C)CCCCCSCCCCCO 62a_100000210682_100000746330 [0,2,0,0,0,0|0,0,0]=2 18686 B14R0.394 CC(C)CCCCCSCCCCCO 62a_100000746330_100000210682 [0,2,0,0,0,0|0,0,0]=2 18687 B14R0.394 CC(C)CCCCCSCCOCCO 62a_100000210682_100011215305 [0,2,0,0,0,0|1,0,0]=3 18688 B14R0.394 CC(C)CCCCCSCCOCCO 62a_100011215305_100000210682 [0,2,0,0,0,0|1,0,0]=3 18689 B14R0.394 CC(C)CCCCNCCCCCCO 2230a_100000686447_100011216152 [0,2,0,0,0,0|0,0,0]=2 18690 B14R0.394 CC(C)CCCCNCCCCCCO 34a_100000686447_100011216152 [0,2,0,0,0,0|0,0,0]=2 18691 B14R0.394 CC(C)CCCCOCCCCCC#N 7a_100011214890_100009813376 [0,2,0,0,0,0|1,0,1]=4 18692 B14R0.394 CC(C)CCCCOCCCCCC=O 7a_100011214890_100000139337 [0,2,0,0,0,0|0,0,2]=4 18693 B14R0.394 CC(C)CCCCOCCCCCCBr 34a_100011215345_100011216152 [0,2,0,0,0,0|1,0,0]=3 18694 B14R0.394 CC(C)CCCCOCCCCCCBr 7a_100011215345_100011216152 [0,2,0,0,0,0|1,0,0]=3 18695 B14R0.394 CC(C)CCCCOCCCCCCCl 34a_100000766143_100011216152 [0,2,0,0,0,0|1,0,0]=3 18696 B14R0.394 CC(C)CCCCOCCCCCCCl 7a_100000766143_100011216152 [0,2,0,0,0,0|1,0,0]=3 18697 B14R0.394 CC(C)CCCCOCCCCCCF 34a_100000732779_100011216152 [0,2,0,0,0,0|1,0,0]=3 18698 B14R0.394 CC(C)CCCCOCCCCCCF 34a_100011214890_100015922095 [0,2,0,0,0,0|1,0,0]=3 18699 B14R0.394 CC(C)CCCCOCCCCCCF 7a_100000732779_100011216152 [0,2,0,0,0,0|1,0,0]=3 18700 B14R0.394 CC(C)CCCCOCCCCCCF 7a_100011214890_100015922095 [0,2,0,0,0,0|1,0,0]=3 18701 B14R0.394 CC(C)CCCCOCCCCCCN 34a_100000686447_100011216152 [0,2,0,0,0,0|1,0,0]=3 18702 B14R0.394 CC(C)CCCCOCCCCCCO 34a_100011214890_100000766143 [0,2,0,0,0,0|0,0,0]=2 18703 B14R0.394 CC(C)CCCCOCCCCCCO 7a_100011214890_100000766143 [0,2,0,0,0,0|0,0,0]=2 18704 B14R0.394 CC(C)CCCCSCCCCCC#N 62a_100009813376_100011216152 [0,2,0,0,0,0|1,0,1]=4 18705 B14R0.394 CC(C)CCCCSCCCCCC#N 62a_100011216152_100009813376 [0,2,0,0,0,0|1,0,1]=4 18706 B14R0.394 CC(C)CCCCSCCCCCC=O 62a_100000139337_100011216152 [0,2,0,0,0,0|0,0,2]=4 18707 B14R0.394 CC(C)CCCCSCCCCCC=O 62a_100011216152_100000139337 [0,2,0,0,0,0|0,0,2]=4 18708 B14R0.394 CC(C)CCCCSCCCCCCF 62a_100011216152_100015922095 [0,2,0,0,0,0|1,0,0]=3 18709 B14R0.394 CC(C)CCCCSCCCCCCF 62a_100015922095_100011216152 [0,2,0,0,0,0|1,0,0]=3 18710 B14R0.394 CC(C)CCCCSCCCCCCO 62a_100000766143_100011216152 [0,2,0,0,0,0|0,0,0]=2 18711 B14R0.394 CC(C)CCCCSCCCCCCO 62a_100011216152_100000766143 [0,2,0,0,0,0|0,0,0]=2 18712 B14R0.394 CC(C)CCCNCCCCCCC#N 2230a_200000737386_100009813337 [0,2,0,0,0,0|1,0,1]=4 18713 B14R0.394 CC(C)CCCNCCCCCCCO 2230a_100011996573_100011214892 [0,2,0,0,0,0|0,0,0]=2 18714 B14R0.394 CC(C)CCCNCCCCCCCO 2230a_200000737386_100000760002 [0,2,0,0,0,0|0,0,0]=2 18715 B14R0.394 CC(C)CCCNCCCCCCCO 34a_100011996573_100011214892 [0,2,0,0,0,0|0,0,0]=2 18716 B14R0.394 CC(C)CCCNCCCCCCCO 34a_200000737386_100000760002 [0,2,0,0,0,0|0,0,0]=2 18717 B14R0.394 CC(C)CCCNCCCOCCCO 2230a_100011310245_100011214892 [0,2,0,0,0,0|1,0,0]=3 18718 B14R0.394 CC(C)CCCNCCCOCCCO 34a_100011310245_100011214892 [0,2,0,0,0,0|1,0,0]=3 18719 B14R0.394 CC(C)CCCOCCCCCCC#N 7a_100000210774_100009813337 [0,2,0,0,0,0|1,0,1]=4 18720 B14R0.394 CC(C)CCCOCCCCCCCBr 34a_100000760002_100011214892 [0,2,0,0,0,0|1,0,0]=3 18721 B14R0.394 CC(C)CCCOCCCCCCCBr 7a_100000760002_100011214892 [0,2,0,0,0,0|1,0,0]=3 18722 B14R0.394 CC(C)CCCOCCCCCCCN 34a_100011996573_100011214892 [0,2,0,0,0,0|1,0,0]=3 18723 B14R0.394 CC(C)CCCOCCCCCCCO 34a_100000210774_100000760002 [0,2,0,0,0,0|0,0,0]=2 18724 B14R0.394 CC(C)CCCOCCCCCCCO 7a_100000210774_100000760002 [0,2,0,0,0,0|0,0,0]=2 18725 B14R0.394 CC(C)CCCOCCCOCCCN 34a_100011310245_100011214892 [0,2,0,0,0,0|2,0,0]=4 18726 B14R0.394 CC(C)CCCSCCCCCCC#N 62a_100009813337_100011214892 [0,2,0,0,0,0|1,0,1]=4 18727 B14R0.394 CC(C)CCCSCCCCCCC#N 62a_100011214892_100009813337 [0,2,0,0,0,0|1,0,1]=4 18728 B14R0.394 CC(C)CCCSCCCCCCCO 62a_100000760002_100011214892 [0,2,0,0,0,0|0,0,0]=2 18729 B14R0.394 CC(C)CCCSCCCCCCCO 62a_100011214892_100000760002 [0,2,0,0,0,0|0,0,0]=2 18730 B14R0.394 CC(C)CCNCCCCCCCCO 2230a_102515433106_100000210312 [0,2,0,0,0,0|0,0,0]=2 18731 B14R0.394 CC(C)CCNCCCCCCCCO 269862a_102515433106_100000185833 [0,2,0,0,0,0|0,0,0]=2 18732 B14R0.394 CC(C)CCNCCCCCCCCO 34a_102515433106_100000210312 [0,2,0,0,0,0|0,0,0]=2 18733 B14R0.394 CC(C)CCNCCOCCOCCO 2230a_100011998139_100000210312 [0,2,0,0,0,0|2,0,0]=4 18734 B14R0.394 CC(C)CCNCCOCCOCCO 269862a_100011998139_100000185833 [0,2,0,0,0,0|2,0,0]=4 18735 B14R0.394 CC(C)CCNCCOCCOCCO 34a_100011998139_100000210312 [0,2,0,0,0,0|2,0,0]=4 18736 B14R0.394 CC(C)CCOCCCCCCCCBr 34a_100009813846_100000210312 [0,2,0,0,0,0|1,0,0]=3 18737 B14R0.394 CC(C)CCOCCCCCCCCBr 7a_100009813846_100000210626 [0,2,0,0,0,0|1,0,0]=3 18738 B14R0.394 CC(C)CCOCCCCCCCCCl 34a_100000033203_100000210312 [0,2,0,0,0,0|1,0,0]=3 18739 B14R0.394 CC(C)CCOCCCCCCCCCl 7a_100000033203_100000210626 [0,2,0,0,0,0|1,0,0]=3 18740 B14R0.394 CC(C)CCOCCCCCCCCN 34a_102515433106_100000210312 [0,2,0,0,0,0|1,0,0]=3 18741 B14R0.394 CC(C)CCOCCCCCCCCO 34a_100000210254_100000033203 [0,2,0,0,0,0|0,0,0]=2 18742 B14R0.394 CC(C)CCOCCCCCCCCO 7a_100000210254_100000033203 [0,2,0,0,0,0|0,0,0]=2 18743 B14R0.394 CC(C)CCOCCCCCNCCN 34a_103619048469_100000210312 [0,2,0,0,0,0|2,0,0]=4 18744 B14R0.394 CC(C)CCOCCOCCOCCO 34a_100000210254_100000032323 [0,2,0,0,0,0|2,0,0]=4 18745 B14R0.394 CC(C)CCOCCOCCOCCO 7a_100000210254_100000032323 [0,2,0,0,0,0|2,0,0]=4 18746 B14R0.394 CC(C)CCSCCCCCCCCO 62a_100000033203_100000210312 [0,2,0,0,0,0|0,0,0]=2 18747 B14R0.394 CC(C)CCSCCCCCCCCO 62a_100000210312_100000033203 [0,2,0,0,0,0|0,0,0]=2 18748 B14R0.394 CC(C)CCSCCOCCOCCO 62a_100000032323_100000210312 [0,2,0,0,0,0|2,0,0]=4 18749 B14R0.394 CC(C)CCSCCOCCOCCO 62a_100000210312_100000032323 [0,2,0,0,0,0|2,0,0]=4 18750 B14R0.394 CC(C)CNCCCCCCCCCO 2230a_100000078944_100000210760 [0,2,0,0,0,0|0,0,0]=2 18751 B14R0.394 CC(C)CNCCCCCCCCCO 2230a_100000210953_100009813782 [0,2,0,0,0,0|0,0,0]=2 18752 B14R0.394 CC(C)CNCCCCCCCCCO 270004a_100000078944_100000210432 [0,2,0,0,0,0|0,0,0]=2 18753 B14R0.394 CC(C)CNCCCCCCCCCO 34a_100000078944_100000210624 [0,2,0,0,0,0|0,0,0]=2 18754 B14R0.394 CC(C)CNCCCCCCCCCO 34a_100000210953_100009813782 [0,2,0,0,0,0|0,0,0]=2 18755 B14R0.394 CC(C)CNCCCOCCOCCO 2230a_100011996194_100000210760 [0,2,0,0,0,0|2,0,0]=4 18756 B14R0.394 CC(C)CNCCCOCCOCCO 270004a_100011996194_100000210432 [0,2,0,0,0,0|2,0,0]=4 18757 B14R0.394 CC(C)CNCCCOCCOCCO 34a_100011996194_100000210624 [0,2,0,0,0,0|2,0,0]=4 18758 B14R0.394 CC(C)CNCCOCCCCCCF 34a_100015185251_100015922095 [0,2,0,0,0,0|2,0,0]=4 18759 B14R0.394 CC(C)CNCCOCCCCCCO 34a_100015185251_100000766143 [0,2,0,0,0,0|1,0,0]=3 18760 B14R0.394 CC(C)COCCCCCCCCCBr 34a_100009813782_100000210624 [0,2,0,0,0,0|1,0,0]=3 18761 B14R0.394 CC(C)COCCCCCCCCCBr 7a_100009813782_100000210760 [0,2,0,0,0,0|1,0,0]=3 18762 B14R0.394 CC(C)COCCCCCCCCCCl 34a_100009868337_100000210624 [0,2,0,0,0,0|1,0,0]=3 18763 B14R0.394 CC(C)COCCCCCCCCCCl 7a_100009868337_100000210760 [0,2,0,0,0,0|1,0,0]=3 18764 B14R0.394 CC(C)COCCCCCCCCCN 34a_100000078944_100000210624 [0,2,0,0,0,0|1,0,0]=3 18765 B14R0.394 CC(C)COCCCCCCCCCO 34a_100000210257_100009813782 [0,2,0,0,0,0|0,0,0]=2 18766 B14R0.394 CC(C)COCCCNCCCCCF 2230a_100000205972_100000729378 [0,2,0,0,0,0|2,0,0]=4 18767 B14R0.394 CC(C)COCCCNCCCCCF 34a_100000205972_100000729378 [0,2,0,0,0,0|2,0,0]=4 18768 B14R0.394 CC(C)COCCCNCCCCCO 2230a_100000205972_100000746330 [0,2,0,0,0,0|1,0,0]=3 18769 B14R0.394 CC(C)COCCCNCCCCCO 34a_100000205972_100000746330 [0,2,0,0,0,0|1,0,0]=3 18770 B14R0.394 CC(C)COCCCNCCOCCO 2230a_100000205972_100011215305 [0,2,0,0,0,0|2,0,0]=4 18771 B14R0.394 CC(C)COCCCNCCOCCO 34a_100000205972_100000692535 [0,2,0,0,0,0|2,0,0]=4 18772 B14R0.394 CC(C)COCCOCCCCCCF 34a_100000703358_100015922095 [0,2,0,0,0,0|2,0,0]=4 18773 B14R0.394 CC(C)COCCOCCCCCCF 7a_100000703358_100015922095 [0,2,0,0,0,0|2,0,0]=4 18774 B14R0.394 CC(C)COCCOCCCCCCO 34a_100000703358_100000766143 [0,2,0,0,0,0|1,0,0]=3 18775 B14R0.394 CC(C)COCCOCCCCCCO 7a_100000703358_100000766143 [0,2,0,0,0,0|1,0,0]=3 18776 B14R0.394 CC(C)CSCCCCCCCCCO 62a_100000210624_100009813782 [0,2,0,0,0,0|0,0,0]=2 18777 B14R0.394 CC(C)CSCCCCCCCCCO 62a_100009813782_100000210760 [0,2,0,0,0,0|0,0,0]=2 18778 B14R0.394 CC(C)CSCCOCCCCCCF 34a_200000230437_100015922095 [0,2,0,0,0,0|2,0,0]=4 18779 B14R0.394 CC(C)CSCCOCCCCCCF 7a_200000230437_100015922095 [0,2,0,0,0,0|2,0,0]=4 18780 B14R0.394 CC(C)CSCCOCCCCCCO 34a_200000230437_100000766143 [0,2,0,0,0,0|1,0,0]=3 18781 B14R0.394 CC(C)CSCCOCCCCCCO 7a_200000230437_100000766143 [0,2,0,0,0,0|1,0,0]=3 18782 B14R0.394 CC(C)NCCCCCCCCCCO 2230a_100000066964_100000210206 [0,2,0,0,0,0|0,0,0]=2 18783 B14R0.394 CC(C)NCCCCCCCCCCO 2230a_100138425928_100009813290 [0,2,0,0,0,0|0,0,0]=2 18784 B14R0.394 CC(C)NCCCCCCCCCCO 34a_100000066964_100000210206 [0,2,0,0,0,0|0,0,0]=2 18785 B14R0.394 CC(C)NCCCCCCCCCCO 34a_100138425928_100009813290 [0,2,0,0,0,0|0,0,0]=2 18786 B14R0.394 CC(C)NCCCCCOCCCCF 34a_100011629493_100000729493 [0,2,0,0,0,0|2,0,0]=4 18787 B14R0.394 CC(C)NCCCCCOCCCCO 34a_100011629493_100011216708 [0,2,0,0,0,0|1,0,0]=3 18788 B14R0.394 CC(C)NCCCCOCCCCCF 34a_100011521146_100000729378 [0,2,0,0,0,0|2,0,0]=4 18789 B14R0.394 CC(C)NCCCCOCCCCCO 34a_100011521146_100000746330 [0,2,0,0,0,0|1,0,0]=3 18790 B14R0.394 CC(C)NCCCCOCCOCCO 34a_100011521146_100000692535 [0,2,0,0,0,0|2,0,0]=4 18791 B14R0.394 CC(C)NCCCOCCCCCCF 34a_100000182298_100015922095 [0,2,0,0,0,0|2,0,0]=4 18792 B14R0.394 CC(C)NCCCOCCCCCCO 34a_100000182298_100000766143 [0,2,0,0,0,0|1,0,0]=3 18793 B14R0.394 CC(C)NCCOCCCCCCCO 34a_100000224655_100000760002 [0,2,0,0,0,0|1,0,0]=3 18794 B14R0.394 CC(C)OCCCCCCCCCCBr 34a_100009813290_100000210206 [0,2,0,0,0,0|1,0,0]=3 18795 B14R0.394 CC(C)OCCCCCCCCCCBr 7a_100009813290_100000210206 [0,2,0,0,0,0|1,0,0]=3 18796 B14R0.394 CC(C)OCCCCCCCCCCCl 34a_200000033068_100000210206 [0,2,0,0,0,0|1,0,0]=3 18797 B14R0.394 CC(C)OCCCCCCCCCCCl 7a_200000033068_100000210206 [0,2,0,0,0,0|1,0,0]=3 18798 B14R0.394 CC(C)OCCCCCCCCCCN 34a_100000066964_100000210206 [0,2,0,0,0,0|1,0,0]=3 18799 B14R0.394 CC(C)OCCCCCCCCCCO 34a_100000212225_100009813290 [0,2,0,0,0,0|0,0,0]=2 18800 B14R0.394 CC(C)OCCCNCCCCCCF 2230a_100000737246_100015922095 [0,2,0,0,0,0|2,0,0]=4 18801 B14R0.394 CC(C)OCCCNCCCCCCF 34a_100000737246_100015922095 [0,2,0,0,0,0|2,0,0]=4 18802 B14R0.394 CC(C)OCCCNCCCCCCO 2230a_100000737246_100000766143 [0,2,0,0,0,0|1,0,0]=3 18803 B14R0.394 CC(C)OCCCNCCCCCCO 34a_100000737246_100000766143 [0,2,0,0,0,0|1,0,0]=3 18804 B14R0.394 CC(C)OCCNCCCCCCCO 2230a_100000701111_100000760002 [0,2,0,0,0,0|1,0,0]=3 18805 B14R0.394 CC(C)OCCNCCCCCCCO 2230a_100011996573_100000211751 [0,2,0,0,0,0|1,0,0]=3 18806 B14R0.394 CC(C)OCCNCCCCCCCO 34a_100000701111_100000760002 [0,2,0,0,0,0|1,0,0]=3 18807 B14R0.394 CC(C)OCCNCCCCCCCO 34a_100011996573_100000211751 [0,2,0,0,0,0|1,0,0]=3 18808 B14R0.394 CC(C)OCCNCCCOCCCO 2230a_100011310245_100000211751 [0,2,0,0,0,0|2,0,0]=4 18809 B14R0.394 CC(C)OCCNCCCOCCCO 34a_100011310245_100000211751 [0,2,0,0,0,0|2,0,0]=4 18810 B14R0.394 CC(C)OCCOCCCCCCCBr 34a_100000760002_100000211751 [0,2,0,0,0,0|2,0,0]=4 18811 B14R0.394 CC(C)OCCOCCCCCCCBr 7a_100000760002_100000211751 [0,2,0,0,0,0|2,0,0]=4 18812 B14R0.394 CC(C)OCCOCCCCCCCN 34a_100011996573_100000211751 [0,2,0,0,0,0|2,0,0]=4 18813 B14R0.394 CC(C)OCCOCCCCCCCO 34a_100000211219_100000760002 [0,2,0,0,0,0|1,0,0]=3 18814 B14R0.394 CC(C)OCCOCCCCCCCO 7a_100000211219_100000760002 [0,2,0,0,0,0|1,0,0]=3 18815 B14R0.394 CC(C)OCCSCCCCCCCO 62a_100000211751_100000760002 [0,2,0,0,0,0|1,0,0]=3 18816 B14R0.394 CC(C)OCCSCCCCCCCO 62a_100000760002_100000211751 [0,2,0,0,0,0|1,0,0]=3 18817 B14R0.394 CC(C)OCNCCCCCCCCO 2230a_102515433106_100000709892 [0,2,0,0,0,0|1,0,0]=3 18818 B14R0.394 CC(C)OCNCCCCCCCCO 34a_102515433106_100000709892 [0,2,0,0,0,0|1,0,0]=3 18819 B14R0.394 CC(C)OCOCCCCCCCCBr 34a_100009813846_100000709892 [0,2,0,0,0,0|2,0,0]=4 18820 B14R0.394 CC(C)OCOCCCCCCCCCl 34a_100000033203_100000709892 [0,2,0,0,0,0|2,0,0]=4 18821 B14R0.394 CC(C)OCOCCCCCCCCN 34a_102515433106_100000709892 [0,2,0,0,0,0|2,0,0]=4 18822 B14R0.394 CC(C)OCSCCCCCCCCO 62a_100000033203_100000709892 [0,2,0,0,0,0|1,0,0]=3 18823 B14R0.394 CC(C)OCSCCCCCCCCO 62a_100000709892_100000033203 [0,2,0,0,0,0|1,0,0]=3 18824 B14R0.394 CC(C)SCCCCCCCCCCO 62a_100000210206_200000033068 [0,2,0,0,0,0|0,0,0]=2 18825 B14R0.394 CC(C)SCCCCCCCCCCO 62a_100009813290_100000210206 [0,2,0,0,0,0|0,0,0]=2 18826 B14R0.394 CC(C)SCCNCCCCCCCO 2230a_100000731138_100000760002 [0,2,0,0,0,0|1,0,0]=3 18827 B14R0.394 CC(C)SCCNCCCCCCCO 2230a_100011996573_100000730970 [0,2,0,0,0,0|1,0,0]=3 18828 B14R0.394 CC(C)SCCNCCCCCCCO 34a_100000731138_100000760002 [0,2,0,0,0,0|1,0,0]=3 18829 B14R0.394 CC(C)SCCNCCCCCCCO 34a_100011996573_100000730970 [0,2,0,0,0,0|1,0,0]=3 18830 B14R0.394 CC(C)SCCNCCCOCCCO 2230a_100011310245_100000730970 [0,2,0,0,0,0|2,0,0]=4 18831 B14R0.394 CC(C)SCCNCCCOCCCO 34a_100011310245_100000730970 [0,2,0,0,0,0|2,0,0]=4 18832 B14R0.394 CC(C)SCCOCCCCCCCBr 34a_100000760002_100000730970 [0,2,0,0,0,0|2,0,0]=4 18833 B14R0.394 CC(C)SCCOCCCCCCCBr 7a_100000760002_100000730970 [0,2,0,0,0,0|2,0,0]=4 18834 B14R0.394 CC(C)SCCOCCCCCCCN 34a_100011996573_100000730970 [0,2,0,0,0,0|2,0,0]=4 18835 B14R0.394 CC(C)SCCOCCCCCCCO 34a_200011212901_100000760002 [0,2,0,0,0,0|1,0,0]=3 18836 B14R0.394 CC(C)SCCOCCCCCCCO 7a_200011212901_100000760002 [0,2,0,0,0,0|1,0,0]=3 18837 B14R0.394 CC(C)SCCSCCCCCCCO 62a_100000730970_100000760002 [0,2,0,0,0,0|1,0,0]=3 18838 B14R0.394 CC(C)SCCSCCCCCCCO 62a_100000760002_100000730970 [0,2,0,0,0,0|1,0,0]=3 18839 B14R0.394 CC(F)COCCCCCCCCCO 34a_100015925927_100009813782 [0,2,0,0,0,0|0,0,0]=2 18840 B14R0.394 CC(O)CCCNCCCCCCCO 2230a_100011996573_200000718107 [0,2,0,0,0,0|0,0,0]=2 18841 B14R0.394 CC(O)CCCNCCCCCCCO 34a_100011996573_200000718107 [0,2,0,0,0,0|0,0,0]=2 18842 B14R0.394 CC(O)CCCNCCCOCCCO 2230a_100011310245_200000718107 [0,2,0,0,0,0|1,0,0]=3 18843 B14R0.394 CC(O)CCCNCCCOCCCO 34a_100011310245_200000718107 [0,2,0,0,0,0|1,0,0]=3 18844 B14R0.394 CC(O)CCCOCCCCCCCBr 34a_100000760002_200000718107 [0,2,0,0,0,0|1,0,0]=3 18845 B14R0.394 CC(O)CCCOCCCCCCCBr 7a_100000760002_200000718107 [0,2,0,0,0,0|1,0,0]=3 18846 B14R0.394 CC(O)CCCOCCCCCCCN 34a_100011996573_200000718107 [0,2,0,0,0,0|1,0,0]=3 18847 B14R0.394 CC(O)CCCOCCCOCCCN 34a_100011310245_200000718107 [0,2,0,0,0,0|2,0,0]=4 18848 B14R0.394 CC(O)CCCSCCCCCCC#N 62a_100009813337_200000718107 [0,2,0,0,0,0|1,0,1]=4 18849 B14R0.394 CC(O)CCCSCCCCCCC#N 62a_200000718107_100009813337 [0,2,0,0,0,0|1,0,1]=4 18850 B14R0.394 CC(O)CCCSCCCCCCCO 62a_100000760002_200000718107 [0,2,0,0,0,0|0,0,0]=2 18851 B14R0.394 CC(O)CCCSCCCCCCCO 62a_200000718107_100000760002 [0,2,0,0,0,0|0,0,0]=2 18852 B14R0.394 CC(O)CCNCCCCCCCCO 2230a_102515433106_100012276601 [0,2,0,0,0,0|0,0,0]=2 18853 B14R0.394 CC(O)CCNCCCCCCCCO 2230a_200000755665_100000033203 [0,2,0,0,0,0|0,0,0]=2 18854 B14R0.394 CC(O)CCNCCCCCCCCO 34a_102515433106_100012276601 [0,2,0,0,0,0|0,0,0]=2 18855 B14R0.394 CC(O)CCNCCOCCOCCO 2230a_100011998139_100012276601 [0,2,0,0,0,0|2,0,0]=4 18856 B14R0.394 CC(O)CCNCCOCCOCCO 2230a_200000755665_100000032323 [0,2,0,0,0,0|2,0,0]=4 18857 B14R0.394 CC(O)CCNCCOCCOCCO 34a_100011998139_100012276601 [0,2,0,0,0,0|2,0,0]=4 18858 B14R0.394 CC(O)CCOCCCCCCCCBr 34a_100009813846_100012276601 [0,2,0,0,0,0|1,0,0]=3 18859 B14R0.394 CC(O)CCOCCCCCCCCBr 7a_100009813846_100012276601 [0,2,0,0,0,0|1,0,0]=3 18860 B14R0.394 CC(O)CCOCCCCCCCCCl 34a_100000033203_100012276601 [0,2,0,0,0,0|1,0,0]=3 18861 B14R0.394 CC(O)CCOCCCCCCCCCl 7a_100000033203_100012276601 [0,2,0,0,0,0|1,0,0]=3 18862 B14R0.394 CC(O)CCOCCCCCCCCN 34a_102515433106_100012276601 [0,2,0,0,0,0|1,0,0]=3 18863 B14R0.394 CC(O)CCOCCCCCNCCN 34a_103619048469_100012276601 [0,2,0,0,0,0|2,0,0]=4 18864 B14R0.394 CC(O)CCSCCCCCCCCO 62a_100000033203_100012276601 [0,2,0,0,0,0|0,0,0]=2 18865 B14R0.394 CC(O)CCSCCCCCCCCO 62a_100012276601_100000033203 [0,2,0,0,0,0|0,0,0]=2 18866 B14R0.394 CC(O)CCSCCOCCOCCO 62a_100000032323_100012276601 [0,2,0,0,0,0|2,0,0]=4 18867 B14R0.394 CC(O)CCSCCOCCOCCO 62a_100012276601_100000032323 [0,2,0,0,0,0|2,0,0]=4 18868 B14R0.394 CC(O)CNCCCCCCCCCO 2230a_100000078944_100011218427 [0,2,0,0,0,0|0,0,0]=2 18869 B14R0.394 CC(O)CNCCCCCCCCCO 2230a_100000210904_100009813782 [0,2,0,0,0,0|0,0,0]=2 18870 B14R0.394 CC(O)CNCCCCCCCCCO 34a_100000078944_100011218427 [0,2,0,0,0,0|0,0,0]=2 18871 B14R0.394 CC(O)CNCCCCCCCCCO 34a_100000210904_100009813782 [0,2,0,0,0,0|0,0,0]=2 18872 B14R0.394 CC(O)CNCCCOCCOCCO 2230a_100011996194_100011218427 [0,2,0,0,0,0|2,0,0]=4 18873 B14R0.394 CC(O)CNCCCOCCOCCO 34a_100011996194_100011218427 [0,2,0,0,0,0|2,0,0]=4 18874 B14R0.394 CC(O)COCCCCCCCCCBr 34a_100009813782_100011218427 [0,2,0,0,0,0|1,0,0]=3 18875 B14R0.394 CC(O)COCCCCCCCCCBr 7a_100009813782_100011218427 [0,2,0,0,0,0|1,0,0]=3 18876 B14R0.394 CC(O)COCCCCCCCCCCl 34a_100009868337_100011218427 [0,2,0,0,0,0|1,0,0]=3 18877 B14R0.394 CC(O)COCCCCCCCCCCl 7a_100009868337_100011218427 [0,2,0,0,0,0|1,0,0]=3 18878 B14R0.394 CC(O)COCCCCCCCCCN 34a_100000078944_100011218427 [0,2,0,0,0,0|1,0,0]=3 18879 B14R0.394 CC(O)CSCCCCCCCCCO 62a_100009813782_100011218427 [0,2,0,0,0,0|0,0,0]=2 18880 B14R0.394 CC(O)CSCCCCCCCCCO 62a_100011218427_100009813782 [0,2,0,0,0,0|0,0,0]=2 18881 B14R0.394 CC/C=C\CCCCCNCCC(C)O 269862a_200000755665_100016288537 [0,2,0,0,0,0|0,0,2]=4 18882 B14R0.394 CC/C=C\CCCCCOCCC(C)O 34a_100016268722_100012276601 [0,2,0,0,0,0|0,0,2]=4 18883 B14R0.394 CC/C=C\CCCCCOCCC(C)O 7a_100016268722_100012276601 [0,2,0,0,0,0|0,0,2]=4 18884 B14R0.394 CC/C=C\CCCCOCCCC(C)O 34a_100016287862_200000718107 [0,2,0,0,0,0|0,0,2]=4 18885 B14R0.394 CC/C=C\CCCCOCCCC(C)O 7a_100016287862_200000718107 [0,2,0,0,0,0|0,0,2]=4 18886 B14R0.394 CCC#CCCCCCCNCC(C)O 2230a_100000210904_200000036426 [0,2,0,0,0,0|0,0,2]=4 18887 B14R0.394 CCC#CCCCCCCNCC(C)O 34a_100000210904_200000036426 [0,2,0,0,0,0|0,0,2]=4 18888 B14R0.394 CCC#CCCCCCCSCC(C)O 62a_100011218427_200000036426 [0,2,0,0,0,0|0,0,2]=4 18889 B14R0.394 CCC#CCCCCCCSCC(C)O 62a_200000036426_100011218427 [0,2,0,0,0,0|0,0,2]=4 18890 B14R0.394 CCC#CCCCCCCSC[C@@H](C)O 62a_100009817552_200000036426 [0,2,0,0,0,0|0,0,2]=4 18891 B14R0.394 CCC#CCCCCCCSC[C@@H](C)O 62a_200000036426_100009817552 [0,2,0,0,0,0|0,0,2]=4 18892 B14R0.394 CCCC/C=C/CCCCOCC(C)O 34a_200020645093_100011218427 [0,2,0,0,0,0|0,0,2]=4 18893 B14R0.394 CCCC/C=C/CCCCOCC(C)O 7a_200020645093_100011218427 [0,2,0,0,0,0|0,0,2]=4 18894 B14R0.394 CCCC/C=C/CCCCOC[C@@H](C)O 34a_200020645093_100009817552 [0,2,0,0,0,0|0,0,2]=4 18895 B14R0.394 CCCC/C=C/CCCCOC[C@@H](C)O 7a_200020645093_100009817552 [0,2,0,0,0,0|0,0,2]=4 18896 B14R0.394 CCCC/C=C\CCOCCCC(C)O 34a_200016286491_200000718107 [0,2,0,0,0,0|0,0,2]=4 18897 B14R0.394 CCCC/C=C\CCOCCCC(C)O 7a_200016286491_200000718107 [0,2,0,0,0,0|0,0,2]=4 18898 B14R0.394 CCCCC#CCCCCOCC(C)O 34a_200000066234_100011218427 [0,2,0,0,0,0|0,0,2]=4 18899 B14R0.394 CCCCC#CCCCCOCC(C)O 7a_200000066234_100011218427 [0,2,0,0,0,0|0,0,2]=4 18900 B14R0.394 CCCCC#CCCCCOC[C@@H](C)O 34a_200000066234_100009817552 [0,2,0,0,0,0|0,0,2]=4 18901 B14R0.394 CCCCC#CCCCCOC[C@@H](C)O 7a_200000066234_100009817552 [0,2,0,0,0,0|0,0,2]=4 18902 B14R0.394 CCCCC#CCCCNCCC(C)O 2230a_200000755665_200000047210 [0,2,0,0,0,0|0,0,2]=4 18903 B14R0.394 CCCCC#CCCCSCCC(C)O 62a_100012276601_200000047210 [0,2,0,0,0,0|0,0,2]=4 18904 B14R0.394 CCCCC#CCCCSCCC(C)O 62a_200000047210_100012276601 [0,2,0,0,0,0|0,0,2]=4 18905 B14R0.394 CCCCC#CCCOCCCC(C)O 34a_100000037610_200000718107 [0,2,0,0,0,0|0,0,2]=4 18906 B14R0.394 CCCCC#CCCOCCCC(C)O 7a_100000037610_200000718107 [0,2,0,0,0,0|0,0,2]=4 18907 B14R0.394 CCCCC/C=C/COCCCC(C)O 34a_100016258190_200000718107 [0,2,0,0,0,0|0,0,2]=4 18908 B14R0.394 CCCCC/C=C/COCCCC(C)O 7a_100016258190_200000718107 [0,2,0,0,0,0|0,0,2]=4 18909 B14R0.394 CCCCC/C=C\CCCOCC(C)O 34a_100020655193_100011218427 [0,2,0,0,0,0|0,0,2]=4 18910 B14R0.394 CCCCC/C=C\CCCOCC(C)O 7a_100020655193_100011218427 [0,2,0,0,0,0|0,0,2]=4 18911 B14R0.394 CCCCC/C=C\CCCOC[C@@H](C)O 34a_100020655193_100009817552 [0,2,0,0,0,0|0,0,2]=4 18912 B14R0.394 CCCCC/C=C\CCCOC[C@@H](C)O 7a_100020655193_100009817552 [0,2,0,0,0,0|0,0,2]=4 18913 B14R0.394 CCCCC/C=C\CCOCCC(C)O 34a_100016277358_100012276601 [0,2,0,0,0,0|0,0,2]=4 18914 B14R0.394 CCCCC/C=C\CCOCCC(C)O 7a_100016277358_100012276601 [0,2,0,0,0,0|0,0,2]=4 18915 B14R0.394 CCCCCC#CCCOCCC(C)O 34a_200000042877_100012276601 [0,2,0,0,0,0|0,0,2]=4 18916 B14R0.394 CCCCCC#CCCOCCC(C)O 7a_200000042877_100012276601 [0,2,0,0,0,0|0,0,2]=4 18917 B14R0.394 CCCCCC#CCOCCCC(C)O 34a_200000033628_200000718107 [0,2,0,0,0,0|0,0,2]=4 18918 B14R0.394 CCCCCC#CCOCCCC(C)O 7a_200000033628_200000718107 [0,2,0,0,0,0|0,0,2]=4 18919 B14R0.394 CCCCCC#CCSCCCC(C)O 62a_100009816472_200000718107 [0,2,0,0,0,0|0,0,2]=4 18920 B14R0.394 CCCCCC#CCSCCCC(C)O 62a_200000718107_100009816472 [0,2,0,0,0,0|0,0,2]=4 18921 B14R0.394 CCCCCC/C=C/COCCC(C)O 34a_200016276170_100012276601 [0,2,0,0,0,0|0,0,2]=4 18922 B14R0.394 CCCCCC/C=C/COCCC(C)O 7a_200016276170_100012276601 [0,2,0,0,0,0|0,0,2]=4 18923 B14R0.394 CCCCCCC#CCCOCC(C)O 34a_200000033163_100011218427 [0,2,0,0,0,0|0,0,2]=4 18924 B14R0.394 CCCCCCC#CCCOCC(C)O 7a_200000033163_100011218427 [0,2,0,0,0,0|0,0,2]=4 18925 B14R0.394 CCCCCCC#CCCOC[C@@H](C)O 34a_200000033163_100009817552 [0,2,0,0,0,0|0,0,2]=4 18926 B14R0.394 CCCCCCC#CCCOC[C@@H](C)O 7a_200000033163_100009817552 [0,2,0,0,0,0|0,0,2]=4 18927 B14R0.394 CCCCCCC#CCOCCC(C)O 34a_200000037284_100012276601 [0,2,0,0,0,0|0,0,2]=4 18928 B14R0.394 CCCCCCC#CCOCCC(C)O 7a_200000037284_100012276601 [0,2,0,0,0,0|0,0,2]=4 18929 B14R0.394 CCCCCCCC#CCOCC(C)O 34a_200000061759_100011218427 [0,2,0,0,0,0|0,0,2]=4 18930 B14R0.394 CCCCCCCC#CCOCC(C)O 7a_200000061759_100011218427 [0,2,0,0,0,0|0,0,2]=4 18931 B14R0.394 CCCCCCCC#CCOC[C@@H](C)O 34a_200000061759_100009817552 [0,2,0,0,0,0|0,0,2]=4 18932 B14R0.394 CCCCCCCC#CCOC[C@@H](C)O 7a_200000061759_100009817552 [0,2,0,0,0,0|0,0,2]=4 18933 B14R0.394 CCCCCCCCC=NNCC(C)O 4a_200000730056_100011218696 [0,2,0,0,0,0|1,0,1]=4 18934 B14R0.394 CCCCCCCCCCCCC(=O)C 1458a_100000070787_100000759014 [0,2,0,0,0,0|0,0,1]=3 18935 B14R0.394 CCCCCCCCCCCCC(=O)C 1458a_100011215791_200000210301 [0,2,0,0,0,0|0,0,1]=3 18936 B14R0.394 CCCCCCCCCCCCC(=O)[13CH3] 1458a_100011215791_200025704644 [0,2,0,0,0,0|0,0,1]=3 18937 B14R0.394 CCCCCCCCCCCCN(C)C 2230a_100000227908_200000210301 [0,2,0,0,0,0|1,0,0]=3 18938 B14R0.394 CCCCCCCCCCCCN(C)C 2230a_100102631434_100011215052 [0,2,0,0,0,0|1,0,0]=3 18939 B14R0.394 CCCCCCCCCCCCN(C)C 269982a_100000227908_200000210301 [0,2,0,0,0,0|1,0,0]=3 18940 B14R0.394 CCCCCCCCCCCCN(C)C 269982a_100102631434_100000759014 [0,2,0,0,0,0|1,0,0]=3 18941 B14R0.394 CCCCCCCCCCCCN(C)C 270004a_100102631434_100011218549 [0,2,0,0,0,0|1,0,0]=3 18942 B14R0.394 CCCCCCCCCCCCN(C)[13CH3] 2230a_100000227908_200025704644 [0,2,0,0,0,0|1,0,0]=3 18943 B14R0.394 CCCCCCCCCCCCN(C)[13CH3] 269982a_100000227908_200025704644 [0,2,0,0,0,0|1,0,0]=3 18944 B14R0.394 CCCCCCCCCCCNC(=O)C 11a_200011215754_100015343762 [0,2,0,0,0,0|0,0,2]=4 18945 B14R0.394 CCCCCCCCCCCNC(=O)C 1626a_200011215754_100015343762 [0,2,0,0,0,0|0,0,2]=4 18946 B14R0.394 CCCCCCCCCCCNC(=O)C 240690a_200011215754_100015343762 [0,2,0,0,0,0|0,0,2]=4 18947 B14R0.394 CCCCCCCCCCCNC(=O)C 527a_200011215754_100103153847 [0,2,0,0,0,0|0,0,2]=4 18948 B14R0.394 CCCCCCCCCCCNC(C)C 2230a_100138425928_100011215454 [0,2,0,0,0,0|1,0,0]=3 18949 B14R0.394 CCCCCCCCCCCNC(C)C 2230a_200011215754_100000210206 [0,2,0,0,0,0|1,0,0]=3 18950 B14R0.394 CCCCCCCCCCCNC(C)C 34a_100138425928_100011215454 [0,2,0,0,0,0|1,0,0]=3 18951 B14R0.394 CCCCCCCCCCCNC(C)C 34a_200011215754_100000210206 [0,2,0,0,0,0|1,0,0]=3 18952 B14R0.394 CCCCCCCCCCCOC(C)C 34a_100000210809_100000210206 [0,2,0,0,0,0|1,0,0]=3 18953 B14R0.394 CCCCCCCCCCCOC(C)C 34a_100000212225_100011215454 [0,2,0,0,0,0|1,0,0]=3 18954 B14R0.394 CCCCCCCCCCCOC(C)C 7a_100000210809_100000210206 [0,2,0,0,0,0|1,0,0]=3 18955 B14R0.394 CCCCCCCCCCCSC(C)C 62a_100000210206_100011215454 [0,2,0,0,0,0|1,0,0]=3 18956 B14R0.394 CCCCCCCCCCNCC(=O)N 2230a_100000684558_100000747473 [0,2,0,0,0,0|0,0,2]=4 18957 B14R0.394 CCCCCCCCCCNCC(=O)N 2230a_100000711301_100000210320 [0,2,0,0,0,0|0,0,2]=4 18958 B14R0.394 CCCCCCCCCCNCC(=O)N 34a_100000684558_100000187820 [0,2,0,0,0,0|0,0,2]=4 18959 B14R0.394 CCCCCCCCCCNCC(=O)O 269956a_100016091260_100000210320 [0,2,0,0,0,0|0,0,1]=3 18960 B14R0.394 CCCCCCCCCCNCC(=O)[O-] 34a_100000684558_100020667443 [0,2,0,0,0,0|0,0,2]=4 18961 B14R0.394 CCCCCCCCCCNCC(C)C 2230a_100000210953_100000210320 [0,2,0,0,0,0|1,0,0]=3 18962 B14R0.394 CCCCCCCCCCNCC(C)C 2230a_100000684558_100000210760 [0,2,0,0,0,0|1,0,0]=3 18963 B14R0.394 CCCCCCCCCCNCC(C)C 270004a_100000684558_100000210432 [0,2,0,0,0,0|1,0,0]=3 18964 B14R0.394 CCCCCCCCCCNCC(C)C 34a_100000210953_100000210320 [0,2,0,0,0,0|1,0,0]=3 18965 B14R0.394 CCCCCCCCCCNCC(C)C 34a_100000684558_100000210624 [0,2,0,0,0,0|1,0,0]=3 18966 B14R0.394 CCCCCCCCCCNCC(C)O 2230a_100000210904_100000210320 [0,2,0,0,0,0|0,0,0]=2 18967 B14R0.394 CCCCCCCCCCNCC(C)O 2230a_100000684558_100011218427 [0,2,0,0,0,0|0,0,0]=2 18968 B14R0.394 CCCCCCCCCCNCC(C)O 34a_100000210904_100000210320 [0,2,0,0,0,0|0,0,0]=2 18969 B14R0.394 CCCCCCCCCCNCC(C)O 34a_100000684558_100011218427 [0,2,0,0,0,0|0,0,0]=2 18970 B14R0.394 CCCCCCCCCCNCC(F)F 2230a_100000684558_100011934356 [0,2,0,0,0,0|1,0,0]=3 18971 B14R0.394 CCCCCCCCCCNCC(F)F 34a_100000684558_100011934356 [0,2,0,0,0,0|1,0,0]=3 18972 B14R0.394 CCCCCCCCCCNCC(F)F 34a_100000765723_100000210320 [0,2,0,0,0,0|1,0,0]=3 18973 B14R0.394 CCCCCCCCCCNC[C@@H](C)O 2230a_100000684558_100009817552 [0,2,0,0,0,0|0,0,0]=2 18974 B14R0.394 CCCCCCCCCCNC[C@@H](C)O 34a_100000684558_100009817552 [0,2,0,0,0,0|0,0,0]=2 18975 B14R0.394 CCCCCCCCCCNC[N+](=O)[O-] 34a_100000684558_100000761209 [0,2,0,0,0,0|1,0,1]=4 18976 B14R0.394 CCCCCCCCCCOCC(=O)C 34a_100000211253_100000210320 [0,2,0,0,0,0|0,0,2]=4 18977 B14R0.394 CCCCCCCCCCOCC(=O)N 34a_100000210711_100000187820 [0,2,0,0,0,0|0,0,2]=4 18978 B14R0.394 CCCCCCCCCCOCC(=O)N 7a_100000210711_100000187820 [0,2,0,0,0,0|0,0,2]=4 18979 B14R0.394 CCCCCCCCCCOCC(=O)[O-] 34a_100000210711_100020667443 [0,2,0,0,0,0|0,0,2]=4 18980 B14R0.394 CCCCCCCCCCOCC(C)Br 34a_100012180447_100000210320 [0,2,0,0,0,0|1,0,0]=3 18981 B14R0.394 CCCCCCCCCCOCC(C)C 34a_100000210257_100000210320 [0,2,0,0,0,0|1,0,0]=3 18982 B14R0.394 CCCCCCCCCCOCC(C)C 34a_100000210711_100000210624 [0,2,0,0,0,0|1,0,0]=3 18983 B14R0.394 CCCCCCCCCCOCC(C)C 7a_100000210711_100000210760 [0,2,0,0,0,0|1,0,0]=3 18984 B14R0.394 CCCCCCCCCCOCC(C)F 34a_100015925927_100000210320 [0,2,0,0,0,0|1,0,0]=3 18985 B14R0.394 CCCCCCCCCCOCC(C)O 34a_100000210711_100011218427 [0,2,0,0,0,0|0,0,0]=2 18986 B14R0.394 CCCCCCCCCCOCC(C)O 7a_100000210711_100011218427 [0,2,0,0,0,0|0,0,0]=2 18987 B14R0.394 CCCCCCCCCCOCC(F)F 34a_100000210711_100011934356 [0,2,0,0,0,0|1,0,0]=3 18988 B14R0.394 CCCCCCCCCCOCC(F)F 34a_100000743014_100000210320 [0,2,0,0,0,0|1,0,0]=3 18989 B14R0.394 CCCCCCCCCCOCC(F)F 7a_100000210711_100011934356 [0,2,0,0,0,0|1,0,0]=3 18990 B14R0.394 CCCCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100000210320 [0,2,0,0,0,0|1,0,0]=3 18991 B14R0.394 CCCCCCCCCCOC[C@@H](C)N 34a_100000737577_100000210320 [0,2,0,0,0,0|1,0,0]=3 18992 B14R0.394 CCCCCCCCCCOC[C@@H](C)O 34a_100000210711_100009817552 [0,2,0,0,0,0|0,0,0]=2 18993 B14R0.394 CCCCCCCCCCOC[C@@H](C)O 7a_100000210711_100009817552 [0,2,0,0,0,0|0,0,0]=2 18994 B14R0.394 CCCCCCCCCCOC[N+](=O)[O-] 34a_100000210711_100000761209 [0,2,0,0,0,0|1,0,1]=4 18995 B14R0.394 CCCCCCCCCCSCC(=O)N 62a_100000747473_100000210320 [0,2,0,0,0,0|0,0,2]=4 18996 B14R0.394 CCCCCCCCCCSCC(=O)[O-] 62a_100020667443_100000210320 [0,2,0,0,0,0|0,0,2]=4 18997 B14R0.394 CCCCCCCCCCSCC(C)C 62a_100000210624_100000210320 [0,2,0,0,0,0|1,0,0]=3 18998 B14R0.394 CCCCCCCCCCSCC(C)O 62a_100011218427_100000210320 [0,2,0,0,0,0|0,0,0]=2 18999 B14R0.394 CCCCCCCCCCSCC(F)F 62a_100011934356_100000210320 [0,2,0,0,0,0|1,0,0]=3 19000 B14R0.394 CCCCCCCCCCSC[C@@H](C)O 62a_100009817552_100000210320 [0,2,0,0,0,0|0,0,0]=2 19001 B14R0.394 CCCCCCCCCNCCC(=O)N 2230a_100000212291_100000744528 [0,2,0,0,0,0|0,0,2]=4 19002 B14R0.394 CCCCCCCCCNCCC(=O)N 34a_100000212291_100000731001 [0,2,0,0,0,0|0,0,2]=4 19003 B14R0.394 CCCCCCCCCNCCC(C)C 2230a_100000212291_100000210312 [0,2,0,0,0,0|1,0,0]=3 19004 B14R0.394 CCCCCCCCCNCCC(C)C 269862a_100000212291_100000185833 [0,2,0,0,0,0|1,0,0]=3 19005 B14R0.394 CCCCCCCCCNCCC(C)C 34a_100000212291_100000210312 [0,2,0,0,0,0|1,0,0]=3 19006 B14R0.394 CCCCCCCCCNCCC(C)O 2230a_100000212291_100012276601 [0,2,0,0,0,0|0,0,0]=2 19007 B14R0.394 CCCCCCCCCNCCC(C)O 2230a_200000755665_100011214924 [0,2,0,0,0,0|0,0,0]=2 19008 B14R0.394 CCCCCCCCCNCCC(C)O 34a_100000212291_100012276601 [0,2,0,0,0,0|0,0,0]=2 19009 B14R0.394 CCCCCCCCCNCOC(C)C 2230a_100000212291_100000709892 [0,2,0,0,0,0|2,0,0]=4 19010 B14R0.394 CCCCCCCCCNCOC(C)C 34a_100000212291_100000709892 [0,2,0,0,0,0|2,0,0]=4 19011 B14R0.394 CCCCCCCCCNOCC(=O)O 269956a_100000106656_100000210670 [0,2,0,0,0,0|1,0,1]=4 19012 B14R0.394 CCCCCCCCCOCCC(=O)C 34a_100000759926_100011214924 [0,2,0,0,0,0|0,0,2]=4 19013 B14R0.394 CCCCCCCCCOCCC(=O)C 7a_100000210712_100000053229 [0,2,0,0,0,0|0,0,2]=4 19014 B14R0.394 CCCCCCCCCOCCC(=O)C 7a_100000759926_100000210328 [0,2,0,0,0,0|0,0,2]=4 19015 B14R0.394 CCCCCCCCCOCCC(=O)N 34a_100000210712_100000731001 [0,2,0,0,0,0|0,0,2]=4 19016 B14R0.394 CCCCCCCCCOCCC(=O)N 34a_100000757172_100011214924 [0,2,0,0,0,0|0,0,2]=4 19017 B14R0.394 CCCCCCCCCOCCC(=O)N 7a_100000210712_100000744528 [0,2,0,0,0,0|0,0,2]=4 19018 B14R0.394 CCCCCCCCCOCCC(=O)N 7a_100000757172_100000210328 [0,2,0,0,0,0|0,0,2]=4 19019 B14R0.394 CCCCCCCCCOCCC(C)Br 34a_100009893172_100011214924 [0,2,0,0,0,0|1,0,0]=3 19020 B14R0.394 CCCCCCCCCOCCC(C)C 34a_100000210254_100011214924 [0,2,0,0,0,0|1,0,0]=3 19021 B14R0.394 CCCCCCCCCOCCC(C)C 34a_100000210712_100000210312 [0,2,0,0,0,0|1,0,0]=3 19022 B14R0.394 CCCCCCCCCOCCC(C)C 7a_100000210254_100000210328 [0,2,0,0,0,0|1,0,0]=3 19023 B14R0.394 CCCCCCCCCOCCC(C)C 7a_100000210712_100000210626 [0,2,0,0,0,0|1,0,0]=3 19024 B14R0.394 CCCCCCCCCOCCC(C)O 34a_100000210712_100012276601 [0,2,0,0,0,0|0,0,0]=2 19025 B14R0.394 CCCCCCCCCOCCC(C)O 7a_100000210712_100012276601 [0,2,0,0,0,0|0,0,0]=2 19026 B14R0.394 CCCCCCCCCOCCC(F)F 34a_100103093639_100011214924 [0,2,0,0,0,0|1,0,0]=3 19027 B14R0.394 CCCCCCCCCOCCN(C)C 7a_100000210712_100000755713 [0,2,0,0,0,0|2,0,0]=4 19028 B14R0.394 CCCCCCCCCOCC[C@@H](C)N 34a_100000706166_100011214924 [0,2,0,0,0,0|1,0,0]=3 19029 B14R0.394 CCCCCCCCCOCOC(C)C 34a_100000210712_100000709892 [0,2,0,0,0,0|2,0,0]=4 19030 B14R0.394 CCCCCCCCCSCCC(=O)C 62a_100000053229_100000210670 [0,2,0,0,0,0|0,0,2]=4 19031 B14R0.394 CCCCCCCCCSCCC(=O)N 62a_100000744528_100000210670 [0,2,0,0,0,0|0,0,2]=4 19032 B14R0.394 CCCCCCCCCSCCC(C)C 62a_100000210312_100000210670 [0,2,0,0,0,0|1,0,0]=3 19033 B14R0.394 CCCCCCCCCSCCC(C)O 62a_100012276601_100000210670 [0,2,0,0,0,0|0,0,0]=2 19034 B14R0.394 CCCCCCCCCSCOC(C)C 62a_100000709892_100000210670 [0,2,0,0,0,0|2,0,0]=4 19035 B14R0.394 CCCCCCCCNCCCC(=O)C 34a_100000229939_100000685027 [0,2,0,0,0,0|0,0,2]=4 19036 B14R0.394 CCCCCCCCNCCCC(=O)N 34a_100000229939_100102525003 [0,2,0,0,0,0|0,0,2]=4 19037 B14R0.394 CCCCCCCCNCCCC(=O)N 34a_100000739312_100000210759 [0,2,0,0,0,0|0,0,2]=4 19038 B14R0.394 CCCCCCCCNCCCC(C)C 2230a_100000229939_100011214892 [0,2,0,0,0,0|1,0,0]=3 19039 B14R0.394 CCCCCCCCNCCCC(C)C 2230a_200000737386_100000210759 [0,2,0,0,0,0|1,0,0]=3 19040 B14R0.394 CCCCCCCCNCCCC(C)C 34a_100000229939_100011214892 [0,2,0,0,0,0|1,0,0]=3 19041 B14R0.394 CCCCCCCCNCCCC(C)C 34a_200000737386_100000210759 [0,2,0,0,0,0|1,0,0]=3 19042 B14R0.394 CCCCCCCCNCCCC(C)O 2230a_100000229939_200000718107 [0,2,0,0,0,0|0,0,0]=2 19043 B14R0.394 CCCCCCCCNCCCC(C)O 34a_100000229939_200000718107 [0,2,0,0,0,0|0,0,0]=2 19044 B14R0.394 CCCCCCCCNCCCS(=O)C 2230a_200000753449_100000210759 [0,2,0,0,0,0|1,0,1]=4 19045 B14R0.394 CCCCCCCCNCCOC(C)C 2230a_100000229939_100000211751 [0,2,0,0,0,0|2,0,0]=4 19046 B14R0.394 CCCCCCCCNCCOC(C)C 2230a_100000701111_100000210759 [0,2,0,0,0,0|2,0,0]=4 19047 B14R0.394 CCCCCCCCNCCOC(C)C 34a_100000229939_100000211751 [0,2,0,0,0,0|2,0,0]=4 19048 B14R0.394 CCCCCCCCNCCOC(C)C 34a_100000701111_100000210759 [0,2,0,0,0,0|2,0,0]=4 19049 B14R0.394 CCCCCCCCNCCSC(C)C 2230a_100000229939_100000730970 [0,2,0,0,0,0|2,0,0]=4 19050 B14R0.394 CCCCCCCCNCCSC(C)C 2230a_100000731138_100000210759 [0,2,0,0,0,0|2,0,0]=4 19051 B14R0.394 CCCCCCCCNCCSC(C)C 34a_100000229939_100000730970 [0,2,0,0,0,0|2,0,0]=4 19052 B14R0.394 CCCCCCCCNCCSC(C)C 34a_100000731138_100000210759 [0,2,0,0,0,0|2,0,0]=4 19053 B14R0.394 CCCCCCCCOCCCC(=O)C 34a_100000210232_100000685027 [0,2,0,0,0,0|0,0,2]=4 19054 B14R0.394 CCCCCCCCOCCCC(=O)C 34a_100000759063_100000210759 [0,2,0,0,0,0|0,0,2]=4 19055 B14R0.394 CCCCCCCCOCCCC(=O)C 7a_100000210232_100011215641 [0,2,0,0,0,0|0,0,2]=4 19056 B14R0.394 CCCCCCCCOCCCC(=O)C 7a_100000759063_100000210759 [0,2,0,0,0,0|0,0,2]=4 19057 B14R0.394 CCCCCCCCOCCCC(=O)N 34a_100000210232_100102525003 [0,2,0,0,0,0|0,0,2]=4 19058 B14R0.394 CCCCCCCCOCCCC(=O)N 7a_100000210232_100102525003 [0,2,0,0,0,0|0,0,2]=4 19059 B14R0.394 CCCCCCCCOCCCC(C)C 34a_100000210232_100011214892 [0,2,0,0,0,0|1,0,0]=3 19060 B14R0.394 CCCCCCCCOCCCC(C)C 34a_100000210774_100000210759 [0,2,0,0,0,0|1,0,0]=3 19061 B14R0.394 CCCCCCCCOCCCC(C)C 7a_100000210232_100011214892 [0,2,0,0,0,0|1,0,0]=3 19062 B14R0.394 CCCCCCCCOCCCC(C)C 7a_100000210774_100000210759 [0,2,0,0,0,0|1,0,0]=3 19063 B14R0.394 CCCCCCCCOCCCC(C)O 34a_100000210232_200000718107 [0,2,0,0,0,0|0,0,0]=2 19064 B14R0.394 CCCCCCCCOCCCC(C)O 7a_100000210232_200000718107 [0,2,0,0,0,0|0,0,0]=2 19065 B14R0.394 CCCCCCCCOCCCN(C)C 7a_100000210232_100000757444 [0,2,0,0,0,0|2,0,0]=4 19066 B14R0.394 CCCCCCCCOCCC[N+](=O)[O-] 34a_200000037920_100000210759 [0,2,0,0,0,0|1,0,1]=4 19067 B14R0.394 CCCCCCCCOCCNC(C)C 34a_100000224655_100000210759 [0,2,0,0,0,0|2,0,0]=4 19068 B14R0.394 CCCCCCCCOCCOC(C)C 34a_100000210232_100000211751 [0,2,0,0,0,0|2,0,0]=4 19069 B14R0.394 CCCCCCCCOCCOC(C)C 34a_100000211219_100000210759 [0,2,0,0,0,0|2,0,0]=4 19070 B14R0.394 CCCCCCCCOCCOC(C)C 7a_100000210232_100000211751 [0,2,0,0,0,0|2,0,0]=4 19071 B14R0.394 CCCCCCCCOCCOC(C)C 7a_100000211219_100000210759 [0,2,0,0,0,0|2,0,0]=4 19072 B14R0.394 CCCCCCCCOCCSC(C)C 34a_100000210232_100000730970 [0,2,0,0,0,0|2,0,0]=4 19073 B14R0.394 CCCCCCCCOCCSC(C)C 34a_200011212901_100000210759 [0,2,0,0,0,0|2,0,0]=4 19074 B14R0.394 CCCCCCCCOCCSC(C)C 7a_100000210232_100000730970 [0,2,0,0,0,0|2,0,0]=4 19075 B14R0.394 CCCCCCCCOCCSC(C)C 7a_200011212901_100000210759 [0,2,0,0,0,0|2,0,0]=4 19076 B14R0.394 CCCCCCCCSCCCC(=O)C 62a_100000210759_100011215641 [0,2,0,0,0,0|0,0,2]=4 19077 B14R0.394 CCCCCCCCSCCCC(=O)C 62a_100011215641_100000210317 [0,2,0,0,0,0|0,0,2]=4 19078 B14R0.394 CCCCCCCCSCCCC(=O)N 62a_100000210759_100102525003 [0,2,0,0,0,0|0,0,2]=4 19079 B14R0.394 CCCCCCCCSCCCC(=O)N 62a_100102525003_100000210317 [0,2,0,0,0,0|0,0,2]=4 19080 B14R0.394 CCCCCCCCSCCCC(C)C 62a_100000210759_100011214892 [0,2,0,0,0,0|1,0,0]=3 19081 B14R0.394 CCCCCCCCSCCCC(C)C 62a_100011214892_100000210317 [0,2,0,0,0,0|1,0,0]=3 19082 B14R0.394 CCCCCCCCSCCCC(C)O 62a_100000210759_200000718107 [0,2,0,0,0,0|0,0,0]=2 19083 B14R0.394 CCCCCCCCSCCCC(C)O 62a_200000718107_100000210317 [0,2,0,0,0,0|0,0,0]=2 19084 B14R0.394 CCCCCCCCSCCCN(C)C 62a_100000210759_100000757444 [0,2,0,0,0,0|2,0,0]=4 19085 B14R0.394 CCCCCCCCSCCOC(C)C 62a_100000210759_100000211751 [0,2,0,0,0,0|2,0,0]=4 19086 B14R0.394 CCCCCCCCSCCOC(C)C 62a_100000211751_100000210317 [0,2,0,0,0,0|2,0,0]=4 19087 B14R0.394 CCCCCCCCSCCSC(C)C 62a_100000210759_100000730970 [0,2,0,0,0,0|2,0,0]=4 19088 B14R0.394 CCCCCCCCSCCSC(C)C 62a_100000730970_100000210317 [0,2,0,0,0,0|2,0,0]=4 19089 B14R0.394 CCCCCCCNCCCCB(O)O 2230a_100000229938_200009817182 [0,2,0,0,0,0|1,0,0]=3 19090 B14R0.394 CCCCCCCNCCCCC(=O)N 34a_100000696515_100000210614 [0,2,0,0,0,0|0,0,2]=4 19091 B14R0.394 CCCCCCCNCCCCC(C)C 2230a_100000229938_100011216152 [0,2,0,0,0,0|1,0,0]=3 19092 B14R0.394 CCCCCCCNCCCOC(C)C 2230a_100000737246_100000210681 [0,2,0,0,0,0|2,0,0]=4 19093 B14R0.394 CCCCCCCNCCCOC(C)C 34a_100000737246_100000210614 [0,2,0,0,0,0|2,0,0]=4 19094 B14R0.394 CCCCCCCNCCOCC(=O)O 269956a_100000700818_100000210614 [0,2,0,0,0,0|1,0,1]=4 19095 B14R0.394 CCCCCCCNCCOCC(F)F 2230a_100000229938_200012177212 [0,2,0,0,0,0|2,0,0]=4 19096 B14R0.394 CCCCCCCOCCCCB(O)O 34a_100000210272_200009817182 [0,2,0,0,0,0|1,0,0]=3 19097 B14R0.394 CCCCCCCOCCCCB(O)O 7a_100000210272_200009817182 [0,2,0,0,0,0|1,0,0]=3 19098 B14R0.394 CCCCCCCOCCCCC(=O)C 34a_100000210272_100009817362 [0,2,0,0,0,0|0,0,2]=4 19099 B14R0.394 CCCCCCCOCCCCC(=O)C 7a_100000210272_100000735457 [0,2,0,0,0,0|0,0,2]=4 19100 B14R0.394 CCCCCCCOCCCCC(=O)N 34a_100012022536_100000210614 [0,2,0,0,0,0|0,0,2]=4 19101 B14R0.394 CCCCCCCOCCCCC(=O)N 7a_100012022536_100000210614 [0,2,0,0,0,0|0,0,2]=4 19102 B14R0.394 CCCCCCCOCCCCC(C)C 34a_100000210272_100011216152 [0,2,0,0,0,0|1,0,0]=3 19103 B14R0.394 CCCCCCCOCCCCC(C)C 34a_100011214890_100000210614 [0,2,0,0,0,0|1,0,0]=3 19104 B14R0.394 CCCCCCCOCCCCC(C)C 7a_100000210272_100011216152 [0,2,0,0,0,0|1,0,0]=3 19105 B14R0.394 CCCCCCCOCCCCC(C)C 7a_100011214890_100000210614 [0,2,0,0,0,0|1,0,0]=3 19106 B14R0.394 CCCCCCCOCCCC[N+](=O)[O-] 34a_200015379883_100000210614 [0,2,0,0,0,0|1,0,1]=4 19107 B14R0.394 CCCCCCCOCCCC[N+](=O)[O-] 7a_200015379883_100000210614 [0,2,0,0,0,0|1,0,1]=4 19108 B14R0.394 CCCCCCCOCCCNC(C)C 34a_100000182298_100000210614 [0,2,0,0,0,0|2,0,0]=4 19109 B14R0.394 CCCCCCCOCCNCC(C)C 34a_100015185251_100000210614 [0,2,0,0,0,0|2,0,0]=4 19110 B14R0.394 CCCCCCCOCCOCC(C)C 34a_100000703358_100000210614 [0,2,0,0,0,0|2,0,0]=4 19111 B14R0.394 CCCCCCCOCCOCC(C)C 7a_100000703358_100000210614 [0,2,0,0,0,0|2,0,0]=4 19112 B14R0.394 CCCCCCCOCCOCC(F)F 34a_100000210272_200012177212 [0,2,0,0,0,0|2,0,0]=4 19113 B14R0.394 CCCCCCCOCCOCC(F)F 34a_100000704375_100000210614 [0,2,0,0,0,0|2,0,0]=4 19114 B14R0.394 CCCCCCCOCCOCC(F)F 7a_100000210272_200012177212 [0,2,0,0,0,0|2,0,0]=4 19115 B14R0.394 CCCCCCCOCCOCC(F)F 7a_100000704375_100000210614 [0,2,0,0,0,0|2,0,0]=4 19116 B14R0.394 CCCCCCCOCCSCC(C)C 34a_200000230437_100000210614 [0,2,0,0,0,0|2,0,0]=4 19117 B14R0.394 CCCCCCCOCCSCC(C)C 7a_200000230437_100000210614 [0,2,0,0,0,0|2,0,0]=4 19118 B14R0.394 CCCCCCCSCCCCB(O)O 62a_100000210614_200009817182 [0,2,0,0,0,0|1,0,0]=3 19119 B14R0.394 CCCCCCCSCCCCB(O)O 62a_200009817182_100000210316 [0,2,0,0,0,0|1,0,0]=3 19120 B14R0.394 CCCCCCCSCCCCC(=O)C 62a_100000210614_100000735457 [0,2,0,0,0,0|0,0,2]=4 19121 B14R0.394 CCCCCCCSCCCCC(=O)C 62a_100000735457_100000210316 [0,2,0,0,0,0|0,0,2]=4 19122 B14R0.394 CCCCCCCSCCCCC(C)C 62a_100000210614_100011216152 [0,2,0,0,0,0|1,0,0]=3 19123 B14R0.394 CCCCCCCSCCCCC(C)C 62a_100011216152_100000210316 [0,2,0,0,0,0|1,0,0]=3 19124 B14R0.394 CCCCCCCSCCCCN(C)C 62a_100000210614_100000690147 [0,2,0,0,0,0|2,0,0]=4 19125 B14R0.394 CCCCCCCSCCOCC(F)F 62a_100000210614_200012177212 [0,2,0,0,0,0|2,0,0]=4 19126 B14R0.394 CCCCCCCSCCOCC(F)F 62a_200012177212_100000210316 [0,2,0,0,0,0|2,0,0]=4 19127 B14R0.394 CCCCCCNCCCCCB(O)O 2230a_100000210581_200009817188 [0,2,0,0,0,0|1,0,0]=3 19128 B14R0.394 CCCCCCNCCCCCC(=O)N 2230a_100000210581_100009817443 [0,2,0,0,0,0|0,0,2]=4 19129 B14R0.394 CCCCCCNCCCCCC(C)C 2230a_100000210581_100000210682 [0,2,0,0,0,0|1,0,0]=3 19130 B14R0.394 CCCCCCNCCCCCC(C)C 2230a_100011290863_100000210314 [0,2,0,0,0,0|1,0,0]=3 19131 B14R0.394 CCCCCCNCCCCCC(C)C 34a_100011290863_100000210314 [0,2,0,0,0,0|1,0,0]=3 19132 B14R0.394 CCCCCCNCCCOCC(C)C 2230a_100000205972_100000210314 [0,2,0,0,0,0|2,0,0]=4 19133 B14R0.394 CCCCCCNCCCOCC(C)C 34a_100000205972_100000210314 [0,2,0,0,0,0|2,0,0]=4 19134 B14R0.394 CCCCCCOCCCCCB(O)O 34a_100000210259_200009817188 [0,2,0,0,0,0|1,0,0]=3 19135 B14R0.394 CCCCCCOCCCCCB(O)O 7a_100000210259_200009817188 [0,2,0,0,0,0|1,0,0]=3 19136 B14R0.394 CCCCCCOCCCCCC(=O)N 34a_100000123541_100000210314 [0,2,0,0,0,0|0,0,2]=4 19137 B14R0.394 CCCCCCOCCCCCC(=O)N 34a_100000210259_100009817443 [0,2,0,0,0,0|0,0,2]=4 19138 B14R0.394 CCCCCCOCCCCCC(=O)N 7a_100000123541_100000210314 [0,2,0,0,0,0|0,0,2]=4 19139 B14R0.394 CCCCCCOCCCCCC(=O)N 7a_100000210259_100009817443 [0,2,0,0,0,0|0,0,2]=4 19140 B14R0.394 CCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210314 [0,2,0,0,0,0|0,0,2]=4 19141 B14R0.394 CCCCCCOCCCCCC(C)C 34a_100000210259_100000210682 [0,2,0,0,0,0|1,0,0]=3 19142 B14R0.394 CCCCCCOCCCCCC(C)C 34a_100011995859_100000210314 [0,2,0,0,0,0|1,0,0]=3 19143 B14R0.394 CCCCCCOCCCCCC(C)C 7a_100000210259_100000210682 [0,2,0,0,0,0|1,0,0]=3 19144 B14R0.394 CCCCCCOCCCCCC(C)C 7a_100011995859_100000210314 [0,2,0,0,0,0|1,0,0]=3 19145 B14R0.394 CCCCCCOCCCCNC(C)C 34a_100011521146_100000210314 [0,2,0,0,0,0|2,0,0]=4 19146 B14R0.394 CCCCCCOCCOCCC(C)C 34a_100000691444_100000210312 [0,2,0,0,0,0|2,0,0]=4 19147 B14R0.394 CCCCCCOCCOCCC(C)C 7a_100000691444_100000210626 [0,2,0,0,0,0|2,0,0]=4 19148 B14R0.394 CCCCCCOCCOCCC(C)O 34a_100000691444_100012276601 [0,2,0,0,0,0|1,0,0]=3 19149 B14R0.394 CCCCCCOCCOCCC(C)O 7a_100000691444_100012276601 [0,2,0,0,0,0|1,0,0]=3 19150 B14R0.394 CCCCCCSCCCCCB(O)O 62a_100000210314_200009817188 [0,2,0,0,0,0|1,0,0]=3 19151 B14R0.394 CCCCCCSCCCCCB(O)O 62a_200009817188_100000210757 [0,2,0,0,0,0|1,0,0]=3 19152 B14R0.394 CCCCCCSCCCCCC(=O)N 62a_100000210314_100009817443 [0,2,0,0,0,0|0,0,2]=4 19153 B14R0.394 CCCCCCSCCCCCC(=O)N 62a_100009817443_100000210757 [0,2,0,0,0,0|0,0,2]=4 19154 B14R0.394 CCCCCCSCCCCCC(C)C 62a_100000210314_100000210682 [0,2,0,0,0,0|1,0,0]=3 19155 B14R0.394 CCCCCCSCCCCCC(C)C 62a_100000210682_100000210757 [0,2,0,0,0,0|1,0,0]=3 19156 B14R0.394 CCCCCNCCCCCCB(O)O 2230a_100000209983_100009817187 [0,2,0,0,0,0|1,0,0]=3 19157 B14R0.394 CCCCCNCCCCCCC(C)C 2230a_100000211014_100000210326 [0,2,0,0,0,0|1,0,0]=3 19158 B14R0.394 CCCCCNCCCCCCC(C)C 34a_100000211014_100000718602 [0,2,0,0,0,0|1,0,0]=3 19159 B14R0.394 CCCCCNCCOCCCC(C)C 34a_100000224656_100011214892 [0,2,0,0,0,0|2,0,0]=4 19160 B14R0.394 CCCCCNCCOCCCC(C)O 34a_100000224656_200000718107 [0,2,0,0,0,0|1,0,0]=3 19161 B14R0.394 CCCCCOCCCCCCB(O)O 34a_100000210253_100009817187 [0,2,0,0,0,0|1,0,0]=3 19162 B14R0.394 CCCCCOCCCCCCB(O)O 7a_100000210253_100009817187 [0,2,0,0,0,0|1,0,0]=3 19163 B14R0.394 CCCCCOCCCCCNC(C)C 34a_100011629493_100000718602 [0,2,0,0,0,0|2,0,0]=4 19164 B14R0.394 CCCCCOCCOCCCC(C)C 34a_100011215259_100011214892 [0,2,0,0,0,0|2,0,0]=4 19165 B14R0.394 CCCCCOCCOCCCC(C)C 7a_100011215259_100011214892 [0,2,0,0,0,0|2,0,0]=4 19166 B14R0.394 CCCCCOCCOCCCC(C)O 34a_100011215259_200000718107 [0,2,0,0,0,0|1,0,0]=3 19167 B14R0.394 CCCCCOCCOCCCC(C)O 7a_100011215259_200000718107 [0,2,0,0,0,0|1,0,0]=3 19168 B14R0.394 CCCCCSCCCCCCB(O)O 62a_100000210326_100009817187 [0,2,0,0,0,0|1,0,0]=3 19169 B14R0.394 CCCCCSCCCCCCB(O)O 62a_100009817187_100000210326 [0,2,0,0,0,0|1,0,0]=3 19170 B14R0.394 CCCCNCCCCOCCC(C)C 34a_200011216965_100000210312 [0,2,0,0,0,0|2,0,0]=4 19171 B14R0.394 CCCCNCCCCOCCC(C)O 34a_200011216965_100012276601 [0,2,0,0,0,0|1,0,0]=3 19172 B14R0.394 CCCCOCCCCCCCC(C)C 34a_200000210741_100000210210 [0,2,0,0,0,0|1,0,0]=3 19173 B14R0.394 CCCCOCCCCCCCC(C)C 7a_200000210741_100000210211 [0,2,0,0,0,0|1,0,0]=3 19174 B14R0.394 CCCCOCCCCOCCC(C)C 34a_200000760531_100000210312 [0,2,0,0,0,0|2,0,0]=4 19175 B14R0.394 CCCCOCCCCOCCC(C)C 7a_200000760531_100000210626 [0,2,0,0,0,0|2,0,0]=4 19176 B14R0.394 CCCCOCCCCOCCC(C)O 34a_200000760531_100012276601 [0,2,0,0,0,0|1,0,0]=3 19177 B14R0.394 CCCCOCCCCOCCC(C)O 7a_200000760531_100012276601 [0,2,0,0,0,0|1,0,0]=3 19178 B14R0.394 CCCCOCCCNCCCC(C)C 2230a_200000211371_100011214892 [0,2,0,0,0,0|2,0,0]=4 19179 B14R0.394 CCCCOCCCNCCCC(C)C 34a_200000211371_100011214892 [0,2,0,0,0,0|2,0,0]=4 19180 B14R0.394 CCCCOCCCNCCCC(C)O 2230a_200000211371_200000718107 [0,2,0,0,0,0|1,0,0]=3 19181 B14R0.394 CCCCOCCCNCCCC(C)O 34a_200000211371_200000718107 [0,2,0,0,0,0|1,0,0]=3 19182 B14R0.394 CCCCOCCCOCCCC(C)C 34a_200011215613_100011214892 [0,2,0,0,0,0|2,0,0]=4 19183 B14R0.394 CCCCOCCCOCCCC(C)C 7a_200011215613_100011214892 [0,2,0,0,0,0|2,0,0]=4 19184 B14R0.394 CCCCOCCCOCCCC(C)O 34a_200011215613_200000718107 [0,2,0,0,0,0|1,0,0]=3 19185 B14R0.394 CCCCOCCCOCCCC(C)O 7a_200011215613_200000718107 [0,2,0,0,0,0|1,0,0]=3 19186 B14R0.394 CCCCOCCOCCCCB(O)O 34a_100000210238_200009817182 [0,2,0,0,0,0|2,0,0]=4 19187 B14R0.394 CCCCOCCOCCCCB(O)O 7a_100000210238_200009817182 [0,2,0,0,0,0|2,0,0]=4 19188 B14R0.394 CCCCOCCOCCCCC(C)C 34a_100000210238_100011216152 [0,2,0,0,0,0|2,0,0]=4 19189 B14R0.394 CCCCOCCOCCCCC(C)C 34a_100011214890_100000743108 [0,2,0,0,0,0|2,0,0]=4 19190 B14R0.394 CCCCOCCOCCCCC(C)C 7a_100000210238_100011216152 [0,2,0,0,0,0|2,0,0]=4 19191 B14R0.394 CCCCOCCOCCCCC(C)C 7a_100011214890_100000743108 [0,2,0,0,0,0|2,0,0]=4 19192 B14R0.394 CCCCOCCOCCOCC(C)O 34a_100011215186_100011218427 [0,2,0,0,0,0|2,0,0]=4 19193 B14R0.394 CCCCOCCOCCOCC(C)O 7a_100011215186_100011218427 [0,2,0,0,0,0|2,0,0]=4 19194 B14R0.394 CCCCOCCOCCOC[C@@H](C)O 34a_100011215186_100009817552 [0,2,0,0,0,0|2,0,0]=4 19195 B14R0.394 CCCCOCCOCCOC[C@@H](C)O 7a_100011215186_100009817552 [0,2,0,0,0,0|2,0,0]=4 19196 B14R0.394 CCCCOCCSCCCCB(O)O 62a_100000743108_200009817182 [0,2,0,0,0,0|2,0,0]=4 19197 B14R0.394 CCCCOCCSCCCCB(O)O 62a_200009817182_100000743108 [0,2,0,0,0,0|2,0,0]=4 19198 B14R0.394 CCCCOCCSCCCCC(C)C 62a_100000743108_100011216152 [0,2,0,0,0,0|2,0,0]=4 19199 B14R0.394 CCCCOCCSCCCCC(C)C 62a_100011216152_100000743108 [0,2,0,0,0,0|2,0,0]=4 19200 B14R0.394 CCCCOCNCCCCCC(C)C 2230a_100011290863_100011995733 [0,2,0,0,0,0|2,0,0]=4 19201 B14R0.394 CCCCOCNCCCCCC(C)C 34a_100011290863_100011995733 [0,2,0,0,0,0|2,0,0]=4 19202 B14R0.394 CCCCOCOCCCCCC(C)C 34a_100011995859_100011995733 [0,2,0,0,0,0|2,0,0]=4 19203 B14R0.394 CCCCOCSCCCCCB(O)O 62a_100011995733_200009817188 [0,2,0,0,0,0|2,0,0]=4 19204 B14R0.394 CCCCOCSCCCCCB(O)O 62a_200009817188_100011995733 [0,2,0,0,0,0|2,0,0]=4 19205 B14R0.394 CCCCOCSCCCCCC(C)C 62a_100000210682_100011995733 [0,2,0,0,0,0|2,0,0]=4 19206 B14R0.394 CCCCOCSCCCCCC(C)C 62a_100011995733_100000210682 [0,2,0,0,0,0|2,0,0]=4 19207 B14R0.394 CCCCSCCNCCCCB(O)O 2230a_100025743550_200009817182 [0,2,0,0,0,0|2,0,0]=4 19208 B14R0.394 CCCCSCCNCCCCC(C)C 2230a_100025743550_100011216152 [0,2,0,0,0,0|2,0,0]=4 19209 B14R0.394 CCCCSCCOCCCCB(O)O 34a_200000230436_200009817182 [0,2,0,0,0,0|2,0,0]=4 19210 B14R0.394 CCCCSCCOCCCCB(O)O 7a_200000230436_200009817182 [0,2,0,0,0,0|2,0,0]=4 19211 B14R0.394 CCCCSCCOCCCCC(C)C 34a_200000230436_100011216152 [0,2,0,0,0,0|2,0,0]=4 19212 B14R0.394 CCCCSCCOCCCCC(C)C 7a_200000230436_100011216152 [0,2,0,0,0,0|2,0,0]=4 19213 B14R0.394 CCCOCCCNCCCCB(O)O 2230a_100011217757_200009817182 [0,2,0,0,0,0|2,0,0]=4 19214 B14R0.394 CCCOCCCNCCCCB(O)O 34a_100011217757_200009817182 [0,2,0,0,0,0|2,0,0]=4 19215 B14R0.394 CCCOCCCNCCCCC(C)C 2230a_100011217757_100011216152 [0,2,0,0,0,0|2,0,0]=4 19216 B14R0.394 CCCOCCCNCCCCC(C)C 34a_100011217757_100011216152 [0,2,0,0,0,0|2,0,0]=4 19217 B14R0.394 CCCOCCNCCCCCB(O)O 2230a_100161115042_200009817188 [0,2,0,0,0,0|2,0,0]=4 19218 B14R0.394 CCCOCCNCCCCCB(O)O 34a_100161115042_200009817188 [0,2,0,0,0,0|2,0,0]=4 19219 B14R0.394 CCCOCCNCCCCCC(C)C 2230a_100011290863_100011215938 [0,2,0,0,0,0|2,0,0]=4 19220 B14R0.394 CCCOCCNCCCCCC(C)C 2230a_100161115042_100000210682 [0,2,0,0,0,0|2,0,0]=4 19221 B14R0.394 CCCOCCNCCCCCC(C)C 34a_100011290863_100011215938 [0,2,0,0,0,0|2,0,0]=4 19222 B14R0.394 CCCOCCNCCCCCC(C)C 34a_100161115042_100000210682 [0,2,0,0,0,0|2,0,0]=4 19223 B14R0.394 CCCOCCOCCCCCB(O)O 34a_100000752267_200009817188 [0,2,0,0,0,0|2,0,0]=4 19224 B14R0.394 CCCOCCOCCCCCB(O)O 7a_100000752267_200009817188 [0,2,0,0,0,0|2,0,0]=4 19225 B14R0.394 CCCOCCOCCCCCC(C)C 34a_100000752267_100000210682 [0,2,0,0,0,0|2,0,0]=4 19226 B14R0.394 CCCOCCOCCCCCC(C)C 34a_100011995859_100011215938 [0,2,0,0,0,0|2,0,0]=4 19227 B14R0.394 CCCOCCOCCCCCC(C)C 7a_100000752267_100000210682 [0,2,0,0,0,0|2,0,0]=4 19228 B14R0.394 CCCOCCOCCCCCC(C)C 7a_100011995859_100011215938 [0,2,0,0,0,0|2,0,0]=4 19229 B14R0.394 CCCOCCOCCNCCC(C)O 2230a_200011904461_100012276601 [0,2,0,0,0,0|2,0,0]=4 19230 B14R0.394 CCCOCCOCCNCCC(C)O 34a_200011904461_100012276601 [0,2,0,0,0,0|2,0,0]=4 19231 B14R0.394 CCCOCCSCCCCCB(O)O 62a_100011215938_200009817188 [0,2,0,0,0,0|2,0,0]=4 19232 B14R0.394 CCCOCCSCCCCCB(O)O 62a_200009817188_100011215938 [0,2,0,0,0,0|2,0,0]=4 19233 B14R0.394 CCCOCCSCCCCCC(C)C 62a_100000210682_100011215938 [0,2,0,0,0,0|2,0,0]=4 19234 B14R0.394 CCCOCCSCCCCCC(C)C 62a_100011215938_100000210682 [0,2,0,0,0,0|2,0,0]=4 19235 B14R0.394 CCCSCCNCCCCCB(O)O 2230a_100020603323_200009817188 [0,2,0,0,0,0|2,0,0]=4 19236 B14R0.394 CCCSCCNCCCCCC(C)C 2230a_100020603323_100000210682 [0,2,0,0,0,0|2,0,0]=4 19237 B14R0.394 CCCSCCOCCCCCB(O)O 34a_200000230433_200009817188 [0,2,0,0,0,0|2,0,0]=4 19238 B14R0.394 CCCSCCOCCCCCB(O)O 7a_200000230433_200009817188 [0,2,0,0,0,0|2,0,0]=4 19239 B14R0.394 CCCSCCOCCCCCC(C)C 34a_200000230433_100000210682 [0,2,0,0,0,0|2,0,0]=4 19240 B14R0.394 CCCSCCOCCCCCC(C)C 7a_200000230433_100000210682 [0,2,0,0,0,0|2,0,0]=4 19241 B14R0.394 CCOCCCNCCCCCB(O)O 2230a_100000210961_200009817188 [0,2,0,0,0,0|2,0,0]=4 19242 B14R0.394 CCOCCCNCCCCCB(O)O 34a_100000210961_200009817188 [0,2,0,0,0,0|2,0,0]=4 19243 B14R0.394 CCOCCCNCCCCCC(C)C 2230a_100000210961_100000210682 [0,2,0,0,0,0|2,0,0]=4 19244 B14R0.394 CCOCCCNCCCCCC(C)C 2230a_100011290863_100012232248 [0,2,0,0,0,0|2,0,0]=4 19245 B14R0.394 CCOCCCNCCCCCC(C)C 34a_100000210961_100000210682 [0,2,0,0,0,0|2,0,0]=4 19246 B14R0.394 CCOCCCNCCCCCC(C)C 34a_100011290863_100012232248 [0,2,0,0,0,0|2,0,0]=4 19247 B14R0.394 CCOCCCOCCCCCB(O)O 34a_100000757476_200009817188 [0,2,0,0,0,0|2,0,0]=4 19248 B14R0.394 CCOCCCOCCCCCB(O)O 7a_100000757476_200009817188 [0,2,0,0,0,0|2,0,0]=4 19249 B14R0.394 CCOCCCOCCCCCC(C)C 34a_100000757476_100000210682 [0,2,0,0,0,0|2,0,0]=4 19250 B14R0.394 CCOCCCOCCCCCC(C)C 34a_100011995859_100012232248 [0,2,0,0,0,0|2,0,0]=4 19251 B14R0.394 CCOCCCOCCCCCC(C)C 7a_100000757476_100000210682 [0,2,0,0,0,0|2,0,0]=4 19252 B14R0.394 CCOCCCOCCCCCC(C)C 7a_100011995859_100012232248 [0,2,0,0,0,0|2,0,0]=4 19253 B14R0.394 CCOCCCSCCCCCB(O)O 62a_100012232248_200009817188 [0,2,0,0,0,0|2,0,0]=4 19254 B14R0.394 CCOCCCSCCCCCB(O)O 62a_200009817188_100012232248 [0,2,0,0,0,0|2,0,0]=4 19255 B14R0.394 CCOCCCSCCCCCC(C)C 62a_100000210682_100012232248 [0,2,0,0,0,0|2,0,0]=4 19256 B14R0.394 CCOCCCSCCCCCC(C)C 62a_100012232248_100000210682 [0,2,0,0,0,0|2,0,0]=4 19257 B14R0.394 CCOCCNCCCCCCB(O)O 2230a_102516460346_100009817187 [0,2,0,0,0,0|2,0,0]=4 19258 B14R0.394 CCOCCNCCCCCCB(O)O 34a_102516460346_100009817187 [0,2,0,0,0,0|2,0,0]=4 19259 B14R0.394 CCOCCNCCCCCCC(C)C 2230a_100000211014_100011215890 [0,2,0,0,0,0|2,0,0]=4 19260 B14R0.394 CCOCCNCCCCCCC(C)C 34a_100000211014_100000210147 [0,2,0,0,0,0|2,0,0]=4 19261 B14R0.394 CCOCCOCCCCCCB(O)O 34a_100000210136_100009817187 [0,2,0,0,0,0|2,0,0]=4 19262 B14R0.394 CCOCCOCCCCCCB(O)O 7a_100000210136_100009817187 [0,2,0,0,0,0|2,0,0]=4 19263 B14R0.394 CCOCCOCCNCCCC(C)O 2230a_100102712874_200000718107 [0,2,0,0,0,0|2,0,0]=4 19264 B14R0.394 CCOCCOCCNCCCC(C)O 34a_100102712874_200000718107 [0,2,0,0,0,0|2,0,0]=4 19265 B14R0.394 CCOCCOCCOCCCC(C)O 34a_100000210240_200000718107 [0,2,0,0,0,0|2,0,0]=4 19266 B14R0.394 CCOCCOCCOCCCC(C)O 7a_100000210240_200000718107 [0,2,0,0,0,0|2,0,0]=4 19267 B14R0.394 CCOCCOCCSCCCC(C)O 62a_100011211534_200000718107 [0,2,0,0,0,0|2,0,0]=4 19268 B14R0.394 CCOCCOCCSCCCC(C)O 62a_200000718107_100011211534 [0,2,0,0,0,0|2,0,0]=4 19269 B14R0.394 CCOCCSCCCCCCB(O)O 62a_100000210147_100009817187 [0,2,0,0,0,0|2,0,0]=4 19270 B14R0.394 CCOCCSCCCCCCB(O)O 62a_100009817187_100011215890 [0,2,0,0,0,0|2,0,0]=4 19271 B14R0.394 CCSCCCOCCCCCB(O)O 34a_100011216438_200009817188 [0,2,0,0,0,0|2,0,0]=4 19272 B14R0.394 CCSCCCOCCCCCB(O)O 7a_100011216438_200009817188 [0,2,0,0,0,0|2,0,0]=4 19273 B14R0.394 CCSCCCOCCCCCC(C)C 34a_100011216438_100000210682 [0,2,0,0,0,0|2,0,0]=4 19274 B14R0.394 CCSCCCOCCCCCC(C)C 7a_100011216438_100000210682 [0,2,0,0,0,0|2,0,0]=4 19275 B14R0.394 CCSCCNCCCCCCB(O)O 2230a_100000106463_100009817187 [0,2,0,0,0,0|2,0,0]=4 19276 B14R0.394 CCSCCNCCCCCCC(C)C 2230a_100000211014_100000757381 [0,2,0,0,0,0|2,0,0]=4 19277 B14R0.394 CCSCCNCCCCCCC(C)C 34a_100000211014_100000757381 [0,2,0,0,0,0|2,0,0]=4 19278 B14R0.394 CCSCCOCCCCCCB(O)O 34a_100000212035_100009817187 [0,2,0,0,0,0|2,0,0]=4 19279 B14R0.394 CCSCCOCCCCCCB(O)O 7a_100000212035_100009817187 [0,2,0,0,0,0|2,0,0]=4 19280 B14R0.394 CCSCCSCCCCCCB(O)O 62a_100000757381_100009817187 [0,2,0,0,0,0|2,0,0]=4 19281 B14R0.394 CCSCCSCCCCCCB(O)O 62a_100009817187_100000757381 [0,2,0,0,0,0|2,0,0]=4 19282 B14R0.394 CN(C)CCCCCCCCCCCO 2230a_100102631434_100009812471 [0,2,0,0,0,0|0,0,0]=2 19283 B14R0.394 CN(C)CCCCCCCCCCCO 269982a_100102631434_100009812471 [0,2,0,0,0,0|0,0,0]=2 19284 B14R0.394 CN(C)CCCCSCCCCCCF 62a_100015922095_100000690147 [0,2,0,0,0,0|2,0,0]=4 19285 B14R0.394 CN(C)CCCCSCCCCCCO 62a_100000766143_100000690147 [0,2,0,0,0,0|1,0,0]=3 19286 B14R0.394 CN(C)CCCOCCCCCCCBr 7a_100000760002_100000757444 [0,2,0,0,0,0|2,0,0]=4 19287 B14R0.394 CN(C)CCCSCCCCCCCO 62a_100000760002_100000757444 [0,2,0,0,0,0|1,0,0]=3 19288 B14R0.394 CN(C)CCOCCCCCCCCBr 7a_100009813846_100000755713 [0,2,0,0,0,0|2,0,0]=4 19289 B14R0.394 CN(C)CCOCCCCCCCCCl 7a_100000033203_100000755713 [0,2,0,0,0,0|2,0,0]=4 19290 B14R0.394 CN(C)CCSCCCCCCCCO 62a_100000033203_100000755713 [0,2,0,0,0,0|1,0,0]=3 19291 B14R0.394 CNCCCCCCCCCCC(=O)N 2230a_106832991635_200010167045 [0,2,0,0,0,0|0,0,2]=4 19292 B14R0.394 CNCCCCCCCCCCC(=O)N 34a_100102657272_200010167045 [0,2,0,0,0,0|0,0,2]=4 19293 B14R0.394 CNCCCCCCCCCCC(=O)N 7a_106832991635_200010167045 [0,2,0,0,0,0|0,0,2]=4 19294 B14R0.394 CNCCCCCOCCCCB(O)O 34a_100000722520_200009817182 [0,2,0,0,0,0|2,0,0]=4 19295 B14R0.394 CNCCCCCOCCCCC(C)C 34a_100000722520_100011216152 [0,2,0,0,0,0|2,0,0]=4 19296 B14R0.394 CNCCCOCCCCCCB(O)O 34a_100000213112_100009817187 [0,2,0,0,0,0|2,0,0]=4 19297 B14R0.394 COCCCCCCCCCCC(=O)N 34a_100138415774_200010167045 [0,2,0,0,0,0|0,0,2]=4 19298 B14R0.394 COCCCCCCNCCCC(C)C 2230a_200000737386_100011998445 [0,2,0,0,0,0|1,0,0]=3 19299 B14R0.394 COCCCCCCNCCCC(C)C 34a_200000737386_100011998445 [0,2,0,0,0,0|1,0,0]=3 19300 B14R0.394 COCCCCCCNCCCS(=O)C 2230a_200000753449_100011998445 [0,2,0,0,0,0|2,0,0]=4 19301 B14R0.394 COCCCCCCNCCOC(C)C 2230a_100000701111_100011998445 [0,2,0,0,0,0|2,0,0]=4 19302 B14R0.394 COCCCCCCNCCOC(C)C 34a_100000701111_100011998445 [0,2,0,0,0,0|2,0,0]=4 19303 B14R0.394 COCCCCCCNCCSC(C)C 2230a_100000731138_100011998445 [0,2,0,0,0,0|2,0,0]=4 19304 B14R0.394 COCCCCCCNCCSC(C)C 34a_100000731138_100011998445 [0,2,0,0,0,0|2,0,0]=4 19305 B14R0.394 COCCCCCCOCCCC(=O)C 34a_100000759063_100011998445 [0,2,0,0,0,0|1,0,1]=4 19306 B14R0.394 COCCCCCCOCCCC(=O)C 34a_200012092642_100000685027 [0,2,0,0,0,0|1,0,1]=4 19307 B14R0.394 COCCCCCCOCCCC(=O)C 7a_100000759063_100011998445 [0,2,0,0,0,0|1,0,1]=4 19308 B14R0.394 COCCCCCCOCCCC(=O)C 7a_200012092642_100011215641 [0,2,0,0,0,0|1,0,1]=4 19309 B14R0.394 COCCCCCCOCCCC(C)C 34a_100000210774_100011998445 [0,2,0,0,0,0|1,0,0]=3 19310 B14R0.394 COCCCCCCOCCCC(C)C 34a_200012092642_100011214892 [0,2,0,0,0,0|1,0,0]=3 19311 B14R0.394 COCCCCCCOCCCC(C)C 7a_100000210774_100011998445 [0,2,0,0,0,0|1,0,0]=3 19312 B14R0.394 COCCCCCCOCCCC(C)C 7a_200012092642_100011214892 [0,2,0,0,0,0|1,0,0]=3 19313 B14R0.394 COCCCCCCOCCCC(C)O 34a_200012092642_200000718107 [0,2,0,0,0,0|1,0,0]=3 19314 B14R0.394 COCCCCCCOCCCC(C)O 7a_200012092642_200000718107 [0,2,0,0,0,0|1,0,0]=3 19315 B14R0.394 COCCCCCCOCCCN(C)C 7a_200012092642_100000757444 [0,2,0,0,0,0|2,0,0]=4 19316 B14R0.394 COCCCCCCOCCNC(C)C 34a_100000224655_100011998445 [0,2,0,0,0,0|2,0,0]=4 19317 B14R0.394 COCCCCCCOCCOC(C)C 34a_100000211219_100011998445 [0,2,0,0,0,0|2,0,0]=4 19318 B14R0.394 COCCCCCCOCCOC(C)C 34a_200012092642_100000211751 [0,2,0,0,0,0|2,0,0]=4 19319 B14R0.394 COCCCCCCOCCOC(C)C 7a_100000211219_100011998445 [0,2,0,0,0,0|2,0,0]=4 19320 B14R0.394 COCCCCCCOCCOC(C)C 7a_200012092642_100000211751 [0,2,0,0,0,0|2,0,0]=4 19321 B14R0.394 COCCCCCCOCCSC(C)C 34a_200011212901_100011998445 [0,2,0,0,0,0|2,0,0]=4 19322 B14R0.394 COCCCCCCOCCSC(C)C 34a_200012092642_100000730970 [0,2,0,0,0,0|2,0,0]=4 19323 B14R0.394 COCCCCCCOCCSC(C)C 7a_200011212901_100011998445 [0,2,0,0,0,0|2,0,0]=4 19324 B14R0.394 COCCCCCCOCCSC(C)C 7a_200012092642_100000730970 [0,2,0,0,0,0|2,0,0]=4 19325 B14R0.394 COCCCCCCSCCCC(=O)C 62a_100011215641_100011998445 [0,2,0,0,0,0|1,0,1]=4 19326 B14R0.394 COCCCCCCSCCCC(=O)C 62a_100011998445_100011215641 [0,2,0,0,0,0|1,0,1]=4 19327 B14R0.394 COCCCCCCSCCCC(C)C 62a_100011214892_100011998445 [0,2,0,0,0,0|1,0,0]=3 19328 B14R0.394 COCCCCCCSCCCC(C)C 62a_100011998445_100011214892 [0,2,0,0,0,0|1,0,0]=3 19329 B14R0.394 COCCCCCCSCCCC(C)O 62a_100011998445_200000718107 [0,2,0,0,0,0|1,0,0]=3 19330 B14R0.394 COCCCCCCSCCCC(C)O 62a_200000718107_100011998445 [0,2,0,0,0,0|1,0,0]=3 19331 B14R0.394 COCCCCCCSCCCN(C)C 62a_100011998445_100000757444 [0,2,0,0,0,0|2,0,0]=4 19332 B14R0.394 COCCCCCCSCCOC(C)C 62a_100000211751_100011998445 [0,2,0,0,0,0|2,0,0]=4 19333 B14R0.394 COCCCCCCSCCOC(C)C 62a_100011998445_100000211751 [0,2,0,0,0,0|2,0,0]=4 19334 B14R0.394 COCCCCCCSCCSC(C)C 62a_100000730970_100011998445 [0,2,0,0,0,0|2,0,0]=4 19335 B14R0.394 COCCCCCCSCCSC(C)C 62a_100011998445_100000730970 [0,2,0,0,0,0|2,0,0]=4 19336 B14R0.394 COCCCCCNCCCCB(O)O 2230a_100000747528_200009817182 [0,2,0,0,0,0|2,0,0]=4 19337 B14R0.394 COCCCCCNCCCCB(O)O 34a_100000747528_200009817182 [0,2,0,0,0,0|2,0,0]=4 19338 B14R0.394 COCCCCCNCCCCC(=O)C 34a_100000747528_100009817362 [0,2,0,0,0,0|1,0,1]=4 19339 B14R0.394 COCCCCCNCCCCC(C)C 2230a_100000747528_100011216152 [0,2,0,0,0,0|1,0,0]=3 19340 B14R0.394 COCCCCCNCCCCC(C)C 34a_100000747528_100011216152 [0,2,0,0,0,0|1,0,0]=3 19341 B14R0.394 COCCCCNCCCCCC(C)C 2230a_100011290863_100000730899 [0,2,0,0,0,0|1,0,0]=3 19342 B14R0.394 COCCCCNCCCCCC(C)C 34a_100011290863_100000755781 [0,2,0,0,0,0|1,0,0]=3 19343 B14R0.394 COCCCCNCCCOCC(C)C 2230a_100000205972_100000730899 [0,2,0,0,0,0|2,0,0]=4 19344 B14R0.394 COCCCCNCCCOCC(C)C 34a_100000205972_100000755781 [0,2,0,0,0,0|2,0,0]=4 19345 B14R0.394 COCCCCOCCCCCB(O)O 34a_100000740925_200009817188 [0,2,0,0,0,0|2,0,0]=4 19346 B14R0.394 COCCCCOCCCCCC(C)C 34a_100000740925_100000210682 [0,2,0,0,0,0|1,0,0]=3 19347 B14R0.394 COCCCCOCCCCCC(C)C 34a_100011995859_100000755781 [0,2,0,0,0,0|1,0,0]=3 19348 B14R0.394 COCCCCOCCCCCC(C)C 7a_100011995859_100000730899 [0,2,0,0,0,0|1,0,0]=3 19349 B14R0.394 COCCCCOCCCCNC(C)C 34a_100011521146_100000755781 [0,2,0,0,0,0|2,0,0]=4 19350 B14R0.394 COCCCCSCCCCCB(O)O 62a_100000730899_200009817188 [0,2,0,0,0,0|2,0,0]=4 19351 B14R0.394 COCCCCSCCCCCB(O)O 62a_200009817188_100000730899 [0,2,0,0,0,0|2,0,0]=4 19352 B14R0.394 COCCCCSCCCCCC(C)C 62a_100000210682_100000730899 [0,2,0,0,0,0|1,0,0]=3 19353 B14R0.394 COCCCCSCCCCCC(C)C 62a_100000730899_100000210682 [0,2,0,0,0,0|1,0,0]=3 19354 B14R0.394 COCCCNCCCCCCB(O)O 34a_100150723488_100009817187 [0,2,0,0,0,0|2,0,0]=4 19355 B14R0.394 COCCCNCCCCCCC(C)C 2230a_100000211014_100000740836 [0,2,0,0,0,0|1,0,0]=3 19356 B14R0.394 COCCCNCCCCCCC(C)C 34a_100000211014_100000740836 [0,2,0,0,0,0|1,0,0]=3 19357 B14R0.394 COCCCOCCCCCCB(O)O 34a_100000740835_100009817187 [0,2,0,0,0,0|2,0,0]=4 19358 B14R0.394 COCCCOCCCCCNC(C)C 34a_100011629493_100000740836 [0,2,0,0,0,0|2,0,0]=4 19359 B14R0.394 COCCCOCCCOCCC(C)C 34a_200011215475_100000210312 [0,2,0,0,0,0|2,0,0]=4 19360 B14R0.394 COCCCOCCCOCCC(C)C 7a_200011215475_100000210626 [0,2,0,0,0,0|2,0,0]=4 19361 B14R0.394 COCCCOCCCOCCC(C)O 34a_200011215475_100012276601 [0,2,0,0,0,0|2,0,0]=4 19362 B14R0.394 COCCCOCCCOCCC(C)O 7a_200011215475_100012276601 [0,2,0,0,0,0|2,0,0]=4 19363 B14R0.394 COCCCSCCCCCCB(O)O 62a_100000709357_100009817187 [0,2,0,0,0,0|2,0,0]=4 19364 B14R0.394 COCCCSCCCCCCB(O)O 62a_100009817187_100000709357 [0,2,0,0,0,0|2,0,0]=4 19365 B14R0.394 COCCOCCCCCCCC(C)C 34a_200000210741_100011201679 [0,2,0,0,0,0|1,0,0]=3 19366 B14R0.394 COCCOCCCCCCCC(C)C 7a_200000210741_100000233755 [0,2,0,0,0,0|1,0,0]=3 19367 B14R0.394 COCCOCCCNCCCC(C)C 2230a_100000206027_100011214892 [0,2,0,0,0,0|2,0,0]=4 19368 B14R0.394 COCCOCCCNCCCC(C)C 2230a_200000737386_100011216529 [0,2,0,0,0,0|2,0,0]=4 19369 B14R0.394 COCCOCCCNCCCC(C)C 34a_100000206027_100011214892 [0,2,0,0,0,0|2,0,0]=4 19370 B14R0.394 COCCOCCCNCCCC(C)C 34a_200000737386_100011216529 [0,2,0,0,0,0|2,0,0]=4 19371 B14R0.394 COCCOCCCNCCCC(C)O 2230a_100000206027_200000718107 [0,2,0,0,0,0|2,0,0]=4 19372 B14R0.394 COCCOCCCNCCCC(C)O 34a_100000206027_200000718107 [0,2,0,0,0,0|2,0,0]=4 19373 B14R0.394 COCCOCCCOCCCC(C)C 34a_100000210774_100011216529 [0,2,0,0,0,0|2,0,0]=4 19374 B14R0.394 COCCOCCCOCCCC(C)C 7a_100000210774_100011216529 [0,2,0,0,0,0|2,0,0]=4 19375 B14R0.394 COCCOCCCSCCCC(C)C 62a_100011214892_100011216529 [0,2,0,0,0,0|2,0,0]=4 19376 B14R0.394 COCCOCCCSCCCC(C)C 62a_100011216529_100011214892 [0,2,0,0,0,0|2,0,0]=4 19377 B14R0.394 COCCOCCCSCCCC(C)O 62a_100011216529_200000718107 [0,2,0,0,0,0|2,0,0]=4 19378 B14R0.394 COCCOCCCSCCCC(C)O 62a_200000718107_100011216529 [0,2,0,0,0,0|2,0,0]=4 19379 B14R0.394 COCCOCCNCCCCC(C)C 2230a_100000745349_100011216152 [0,2,0,0,0,0|2,0,0]=4 19380 B14R0.394 COCCOCCNCCCCC(C)C 34a_100000745349_100011216152 [0,2,0,0,0,0|2,0,0]=4 19381 B14R0.394 COCCOCCOCCCCC(C)C 34a_100011214890_100000695917 [0,2,0,0,0,0|2,0,0]=4 19382 B14R0.394 COCCOCCOCCCCC(C)C 34a_100011215163_100011216152 [0,2,0,0,0,0|2,0,0]=4 19383 B14R0.394 COCCOCCOCCCCC(C)C 7a_100011214890_100000695917 [0,2,0,0,0,0|2,0,0]=4 19384 B14R0.394 COCCOCCOCCCCC(C)C 7a_100011215163_100011216152 [0,2,0,0,0,0|2,0,0]=4 19385 B14R0.394 COCCOCCSCCCCC(C)C 62a_100000695917_100011216152 [0,2,0,0,0,0|2,0,0]=4 19386 B14R0.394 COCCOCCSCCCCC(C)C 62a_100011216152_100000695917 [0,2,0,0,0,0|2,0,0]=4 19387 B14R0.394 COCCOCNCCCCCC(C)C 2230a_100011290863_100000231047 [0,2,0,0,0,0|2,0,0]=4 19388 B14R0.394 COCCOCSCCCCCC(C)C 62a_100000210682_100000231047 [0,2,0,0,0,0|2,0,0]=4 19389 B14R0.394 COCCOCSCCCCCC(C)C 62a_100000231047_100000210682 [0,2,0,0,0,0|2,0,0]=4 19390 B14R0.394 CS(=O)CCCNCCCCCCCO 2230a_200000753449_100000760002 [0,2,0,0,0,0|1,0,0]=3 19391 B14R0.394 CSCCCCCCCCCCC(=O)N 62a_200000210301_200010167045 [0,2,0,0,0,0|0,0,2]=4 19392 B14R0.394 CSCCCCCCCCCCC(=O)N 62a_200010167045_200000210301 [0,2,0,0,0,0|0,0,2]=4 19393 B14R0.394 CSCCCCOCCCCCB(O)O 34a_100011217163_200009817188 [0,2,0,0,0,0|2,0,0]=4 19394 B14R0.394 CSCCCCOCCCCCB(O)O 7a_100011217163_200009817188 [0,2,0,0,0,0|2,0,0]=4 19395 B14R0.394 CSCCCCOCCCCCC(C)C 34a_100011217163_100000210682 [0,2,0,0,0,0|1,1,0]=4 19396 B14R0.394 CSCCCCOCCCCCC(C)C 7a_100011217163_100000210682 [0,2,0,0,0,0|1,1,0]=4 19397 B14R0.394 CSCCCNCCCCCCB(O)O 2230a_100000749238_100009817187 [0,2,0,0,0,0|2,0,0]=4 19398 B14R0.394 CSCCCOCCCCCCB(O)O 34a_100000690336_100009817187 [0,2,0,0,0,0|2,0,0]=4 19399 B14R0.394 CSCCCOCCCCCCB(O)O 7a_100000690336_100009817187 [0,2,0,0,0,0|2,0,0]=4 19400 B14R0.394 CSCCOCCCCCCCC(C)C 34a_200000210741_100000212216 [0,2,0,0,0,0|1,1,0]=4 19401 B14R0.394 CSCCOCCCCCCCC(C)C 7a_200000210741_100000212216 [0,2,0,0,0,0|1,1,0]=4 19402 B14R0.394 C[C@@H](Cl)COCCCCCCCCCO 34a_100016084084_100009813782 [0,2,0,0,0,0|0,0,0]=2 19403 B14R0.394 C[C@@H](N)CCOCCCCCCCCO 34a_100000706166_100000033203 [0,2,0,0,0,0|0,0,0]=2 19404 B14R0.394 C[C@@H](N)CCOCCOCCOCCO 34a_100000706166_100000032323 [0,2,0,0,0,0|2,0,0]=4 19405 B14R0.394 C[C@@H](N)COCCCCCCCCCO 34a_100000737577_100009813782 [0,2,0,0,0,0|0,0,0]=2 19406 B14R0.394 C[C@@H](O)CNCCCCCCCCCO 2230a_100000078944_100009817552 [0,2,0,0,0,0|0,0,0]=2 19407 B14R0.394 C[C@@H](O)CNCCCCCCCCCO 34a_100000078944_100009817552 [0,2,0,0,0,0|0,0,0]=2 19408 B14R0.394 C[C@@H](O)CNCCCOCCOCCO 2230a_100011996194_100009817552 [0,2,0,0,0,0|2,0,0]=4 19409 B14R0.394 C[C@@H](O)CNCCCOCCOCCO 34a_100011996194_100009817552 [0,2,0,0,0,0|2,0,0]=4 19410 B14R0.394 C[C@@H](O)COCCCCCCCCCBr 34a_100009813782_100009817552 [0,2,0,0,0,0|1,0,0]=3 19411 B14R0.394 C[C@@H](O)COCCCCCCCCCBr 7a_100009813782_100009817552 [0,2,0,0,0,0|1,0,0]=3 19412 B14R0.394 C[C@@H](O)COCCCCCCCCCCl 34a_100009868337_100009817552 [0,2,0,0,0,0|1,0,0]=3 19413 B14R0.394 C[C@@H](O)COCCCCCCCCCCl 7a_100009868337_100009817552 [0,2,0,0,0,0|1,0,0]=3 19414 B14R0.394 C[C@@H](O)COCCCCCCCCCN 34a_100000078944_100009817552 [0,2,0,0,0,0|1,0,0]=3 19415 B14R0.394 C[C@@H](O)CSCCCCCCCCCO 62a_100009813782_100009817552 [0,2,0,0,0,0|0,0,0]=2 19416 B14R0.394 C[C@@H](O)CSCCCCCCCCCO 62a_100009817552_100009813782 [0,2,0,0,0,0|0,0,0]=2 19417 B14R0.394 FC(F)COCCCCCCCCCBr 34a_100009813782_100011934356 [0,2,0,0,0,0|2,0,0]=4 19418 B14R0.394 FC(F)COCCCCCCCCCBr 7a_100009813782_100011934356 [0,2,0,0,0,0|2,0,0]=4 19419 B14R0.394 FC(F)COCCCCCCCCCCl 34a_100009868337_100011934356 [0,2,0,0,0,0|2,0,0]=4 19420 B14R0.394 FC(F)COCCCCCCCCCCl 7a_100009868337_100011934356 [0,2,0,0,0,0|2,0,0]=4 19421 B14R0.394 NC(=O)CCCCCNCCCCCO 2230a_100000762737_100009817443 [0,2,0,0,0,0|1,0,1]=4 19422 B14R0.394 NC(=O)CCCCCNCCCCCO 34a_100000762737_100009817443 [0,2,0,0,0,0|1,0,1]=4 19423 B14R0.394 NC(=O)CCCCCOCCCCCO 34a_100000123541_100000746330 [0,2,0,0,0,0|1,0,1]=4 19424 B14R0.394 NC(=O)CCCCCOCCCCCO 7a_100000123541_100000746330 [0,2,0,0,0,0|1,0,1]=4 19425 B14R0.394 NC(=O)CCCCCSCCCCCO 62a_100000746330_100009817443 [0,2,0,0,0,0|1,0,1]=4 19426 B14R0.394 NC(=O)CCCCCSCCCCCO 62a_100009817443_100000746330 [0,2,0,0,0,0|1,0,1]=4 19427 B14R0.394 NC(=O)CCCCNCCCCCCO 34a_100000696515_100000766143 [0,2,0,0,0,0|1,0,1]=4 19428 B14R0.394 NC(=O)CCCCOCCCCCCO 34a_100012022536_100000766143 [0,2,0,0,0,0|1,0,1]=4 19429 B14R0.394 NC(=O)CCCCOCCCCCCO 7a_100012022536_100000766143 [0,2,0,0,0,0|1,0,1]=4 19430 B14R0.394 NC(=O)CCCNCCCCCCCO 34a_100000739312_100000760002 [0,2,0,0,0,0|1,0,1]=4 19431 B14R0.394 NC(=O)CCCNCCCCCCCO 34a_100011996573_100102525003 [0,2,0,0,0,0|1,0,1]=4 19432 B14R0.394 NC(=O)CCCSCCCCCCCO 62a_100000760002_100102525003 [0,2,0,0,0,0|1,0,1]=4 19433 B14R0.394 NC(=O)CCCSCCCCCCCO 62a_100102525003_100000760002 [0,2,0,0,0,0|1,0,1]=4 19434 B14R0.394 NC(=O)CCNCCCCCCCCO 2230a_102515433106_100000744528 [0,2,0,0,0,0|1,0,1]=4 19435 B14R0.394 NC(=O)CCNCCCCCCCCO 34a_102515433106_100000731001 [0,2,0,0,0,0|1,0,1]=4 19436 B14R0.394 NC(=O)CCOCCCCCCCCO 34a_100000757172_100000033203 [0,2,0,0,0,0|1,0,1]=4 19437 B14R0.394 NC(=O)CCOCCCCCCCCO 7a_100000757172_100000033203 [0,2,0,0,0,0|1,0,1]=4 19438 B14R0.394 NC(=O)CCSCCCCCCCCO 62a_100000033203_100000744528 [0,2,0,0,0,0|1,0,1]=4 19439 B14R0.394 NC(=O)CCSCCCCCCCCO 62a_100000744528_100000033203 [0,2,0,0,0,0|1,0,1]=4 19440 B14R0.394 NC(=O)CNCCCCCCCCCO 2230a_100000078944_100000747473 [0,2,0,0,0,0|1,0,1]=4 19441 B14R0.394 NC(=O)CNCCCCCCCCCO 2230a_100000711301_100009813782 [0,2,0,0,0,0|1,0,1]=4 19442 B14R0.394 NC(=O)CNCCCCCCCCCO 34a_100000078944_100000187820 [0,2,0,0,0,0|1,0,1]=4 19443 B14R0.394 NC(=O)CSCCCCCCCCCO 62a_100000747473_100009813782 [0,2,0,0,0,0|1,0,1]=4 19444 B14R0.394 NC(=O)CSCCCCCCCCCO 62a_100009813782_100000747473 [0,2,0,0,0,0|1,0,1]=4 19445 B14R0.394 NCCCCCCCCCOCC(F)F 34a_100000078944_100011934356 [0,2,0,0,0,0|2,0,0]=4 19446 B14R0.394 NCCCCCCOCCCCB(O)O 34a_100000686447_200009817182 [0,2,0,0,0,0|2,0,0]=4 19447 B14R0.394 NCCCCCOCCCCCB(O)O 34a_100000762737_200009817188 [0,2,0,0,0,0|2,0,0]=4 19448 B14R0.394 NCCCCOCCCCCCB(O)O 34a_100000750430_100009817187 [0,2,0,0,0,0|2,0,0]=4 19449 B14R0.394 O=C(O)CNCCCCCCCCCO 269956a_100016091260_100009813782 [0,2,0,0,0,0|1,0,1]=4 19450 B14R0.394 O=C([O-])CCCCCOCCCCCO 7a_100102619762_100000746330 [0,2,0,0,0,0|1,0,1]=4 19451 B14R0.394 O=C([O-])CNCCCCCCCCCO 34a_100000078944_100020667443 [0,2,0,0,0,0|1,0,1]=4 19452 B14R0.394 O=C([O-])CSCCCCCCCCCO 62a_100009813782_100020667443 [0,2,0,0,0,0|1,0,1]=4 19453 B14R0.394 O=C([O-])CSCCCCCCCCCO 62a_100020667443_100009813782 [0,2,0,0,0,0|1,0,1]=4 19454 B14R0.394 O=[N+]([O-])CCCCOCCCCCCO 34a_200015379883_100000766143 [0,2,0,0,0,0|2,0,0]=4 19455 B14R0.394 O=[N+]([O-])CCCCOCCCCCCO 7a_200015379883_100000766143 [0,2,0,0,0,0|2,0,0]=4 19456 B14R0.394 O=[N+]([O-])CCCOCCCCCCCO 34a_200000037920_100000760002 [0,2,0,0,0,0|2,0,0]=4 19457 B14R0.394 O=[N+]([O-])CNCCCCCCCCCO 34a_100000078944_100000761209 [0,2,0,0,0,0|2,0,0]=4 19458 B14R0.394 O=[N+]([O-])CSCCCCCCCCCO 62a_100009813782_100000761209 [0,2,0,0,0,0|2,0,0]=4 19459 B14R0.394 OB(O)CCCCCCOCCCCBr 34a_100011216708_100009817187 [0,2,0,0,0,0|2,0,0]=4 19460 B14R0.394 OB(O)CCCCCCOCCCCCl 34a_100000210776_100009817187 [0,2,0,0,0,0|2,0,0]=4 19461 B14R0.394 OB(O)CCCCCCOCCCCCl 7a_100000210776_100009817187 [0,2,0,0,0,0|2,0,0]=4 19462 B14R0.394 OB(O)CCCCCCOCCCCF 34a_100011995726_100009817187 [0,2,0,0,0,0|2,0,0]=4 19463 B14R0.394 OB(O)CCCCCCOCCCCF 7a_100011995726_100009817187 [0,2,0,0,0,0|2,0,0]=4 19464 B14R0.394 OB(O)CCCCCCOCCCCI 34a_200012148704_100009817187 [0,2,0,0,0,0|2,0,0]=4 19465 B14R0.394 OB(O)CCCCCCSCCCCF 62a_100000729493_100009817187 [0,2,0,0,0,0|2,0,0]=4 19466 B14R0.394 OB(O)CCCCCCSCCCCF 62a_100009817187_100000729493 [0,2,0,0,0,0|2,0,0]=4 19467 B14R0.394 OB(O)CCCCCOCCCCCBr 34a_100000746331_200009817188 [0,2,0,0,0,0|2,0,0]=4 19468 B14R0.394 OB(O)CCCCCOCCCCCBr 7a_100000746331_200009817188 [0,2,0,0,0,0|2,0,0]=4 19469 B14R0.394 OB(O)CCCCCOCCCCCCl 34a_100000746330_200009817188 [0,2,0,0,0,0|2,0,0]=4 19470 B14R0.394 OB(O)CCCCCOCCCCCCl 7a_100000746330_200009817188 [0,2,0,0,0,0|2,0,0]=4 19471 B14R0.394 OB(O)CCCCCOCCCCCI 34a_200012148887_200009817188 [0,2,0,0,0,0|2,0,0]=4 19472 B14R0.394 OB(O)CCCCCOCCCCCI 7a_200012148887_200009817188 [0,2,0,0,0,0|2,0,0]=4 19473 B14R0.394 OB(O)CCCCCSCCCCCF 62a_100000729378_200009817188 [0,2,0,0,0,0|2,0,0]=4 19474 B14R0.394 OB(O)CCCCCSCCCCCF 62a_200009817188_100000729378 [0,2,0,0,0,0|2,0,0]=4 19475 B14R0.394 OB(O)CCCCOCCCCCCBr 34a_100011215345_200009817182 [0,2,0,0,0,0|2,0,0]=4 19476 B14R0.394 OB(O)CCCCOCCCCCCBr 7a_100011215345_200009817182 [0,2,0,0,0,0|2,0,0]=4 19477 B14R0.394 OB(O)CCCCOCCCCCCCl 34a_100000766143_200009817182 [0,2,0,0,0,0|2,0,0]=4 19478 B14R0.394 OB(O)CCCCOCCCCCCCl 7a_100000766143_200009817182 [0,2,0,0,0,0|2,0,0]=4 19479 B14R0.394 OB(O)CCCCOCCCCCCF 34a_100000732779_200009817182 [0,2,0,0,0,0|2,0,0]=4 19480 B14R0.394 OB(O)CCCCOCCCCCCF 7a_100000732779_200009817182 [0,2,0,0,0,0|2,0,0]=4 19481 B14R0.394 OB(O)CCCCSCCCCCCF 62a_100015922095_200009817182 [0,2,0,0,0,0|2,0,0]=4 19482 B14R0.394 OB(O)CCCCSCCCCCCF 62a_200009817182_100015922095 [0,2,0,0,0,0|2,0,0]=4 19483 B14R0.394 OCCCCCCCCCNCC(F)F 2230a_100000078944_100011934356 [0,2,0,0,0,0|1,0,0]=3 19484 B14R0.394 OCCCCCCCCCNCC(F)F 34a_100000078944_100011934356 [0,2,0,0,0,0|1,0,0]=3 19485 B14R0.394 OCCCCCCCCCNCC(F)F 34a_100000765723_100009813782 [0,2,0,0,0,0|1,0,0]=3 19486 B14R0.394 OCCCCCCCCCOCC(F)F 34a_100000743014_100009813782 [0,2,0,0,0,0|1,0,0]=3 19487 B14R0.394 OCCCCCCCCCSCC(F)F 62a_100009813782_100011934356 [0,2,0,0,0,0|1,0,0]=3 19488 B14R0.394 OCCCCCCCCCSCC(F)F 62a_100011934356_100009813782 [0,2,0,0,0,0|1,0,0]=3 19489 B14R0.394 OCCCCCCCCOCCC(F)F 34a_100103093639_100000033203 [0,2,0,0,0,0|1,0,0]=3 19490 B14R0.394 OCCCCCCNCCCCB(O)O 2230a_100000686447_200009817182 [0,2,0,0,0,0|2,0,0]=4 19491 B14R0.394 OCCCCCCNCCCCB(O)O 34a_100000686447_200009817182 [0,2,0,0,0,0|2,0,0]=4 19492 B14R0.394 OCCCCCCNCCOCC(F)F 2230a_100000686447_200012177212 [0,2,0,0,0,0|2,0,0]=4 19493 B14R0.394 OCCCCCCNCCOCC(F)F 34a_100000686447_200012177212 [0,2,0,0,0,0|2,0,0]=4 19494 B14R0.394 OCCCCCCOCCOCC(F)F 34a_100000704375_100000766143 [0,2,0,0,0,0|2,0,0]=4 19495 B14R0.394 OCCCCCCOCCOCC(F)F 7a_100000704375_100000766143 [0,2,0,0,0,0|2,0,0]=4 19496 B14R0.394 OCCCCCCSCCCCB(O)O 62a_100000766143_200009817182 [0,2,0,0,0,0|2,0,0]=4 19497 B14R0.394 OCCCCCCSCCCCB(O)O 62a_200009817182_100000766143 [0,2,0,0,0,0|2,0,0]=4 19498 B14R0.394 OCCCCCCSCCOCC(F)F 62a_100000766143_200012177212 [0,2,0,0,0,0|2,0,0]=4 19499 B14R0.394 OCCCCCCSCCOCC(F)F 62a_200012177212_100000766143 [0,2,0,0,0,0|2,0,0]=4 19500 B14R0.394 OCCCCCNCCCCCB(O)O 2230a_100000762737_200009817188 [0,2,0,0,0,0|2,0,0]=4 19501 B14R0.394 OCCCCCNCCCCCB(O)O 34a_100000762737_200009817188 [0,2,0,0,0,0|2,0,0]=4 19502 B14R0.394 OCCCCCSCCCCCB(O)O 62a_100000746330_200009817188 [0,2,0,0,0,0|2,0,0]=4 19503 B14R0.394 OCCCCCSCCCCCB(O)O 62a_200009817188_100000746330 [0,2,0,0,0,0|2,0,0]=4 19504 B14R0.394 OCCCCNCCCCCCB(O)O 2230a_100000750430_100009817187 [0,2,0,0,0,0|2,0,0]=4 19505 B14R0.394 OCCCCNCCCCCCB(O)O 34a_100000750430_100009817187 [0,2,0,0,0,0|2,0,0]=4 19506 B14R0.394 OCCCCSCCCCCCB(O)O 62a_100000210776_100009817187 [0,2,0,0,0,0|2,0,0]=4 19507 B14R0.394 OCCCCSCCCCCCB(O)O 62a_100009817187_100000210776 [0,2,0,0,0,0|2,0,0]=4 19508 B14R0.394 [13CH3]SCCCCCCCCCCC(=O)N 62a_200010167045_200025704644 [0,2,0,0,0,0|0,0,2]=4 19509 B14R0.394 [13CH3]SCCCCCCCCCCC(=O)N 62a_200025704644_200010167045 [0,2,0,0,0,0|0,0,2]=4 19510 B14R0.2224 CC(=O)CCCCC(=O)CCCCCO 1458a_100102619762_100000735457 [0,2,0,0,0,0|0,0,2]=4 19511 B14R0.2224 CC(=O)CCCCN(C)CCCCCO 269982a_100000722520_100000735457 [0,2,0,0,0,0|1,0,1]=4 19512 B14R0.2224 CC(C)CCCCC(=O)CCCCCF 1458a_100011933920_100000729378 [0,2,0,0,0,0|1,0,1]=4 19513 B14R0.2224 CC(C)CCCCC(=O)CCCCCO 1458a_100011933920_100000746330 [0,2,0,0,0,0|0,0,1]=3 19514 B14R0.2224 CC(C)CCCCC(=O)CCCCCO 1458a_100102619762_100011216152 [0,2,0,0,0,0|0,0,1]=3 19515 B14R0.2224 CC(C)CCCCC(=O)CCOCCO 1458a_100011229844_100011216152 [0,2,0,0,0,0|1,0,1]=4 19516 B14R0.2224 CC(C)CCCCC(=O)CCOCCO 1458a_100011933920_100011215305 [0,2,0,0,0,0|1,0,1]=4 19517 B14R0.2224 CC(C)CCCCC(=O)NCCCCO 240690a_100000750430_100011933920 [0,2,0,0,0,0|1,0,1]=4 19518 B14R0.2224 CC(C)CCCCC(=O)NCCCCO 527a_100000750430_100011933920 [0,2,0,0,0,0|1,0,1]=4 19519 B14R0.2224 CC(C)CCCCN(C)CCCCCO 2230a_100000722520_100011216152 [0,2,0,0,0,0|1,0,0]=3 19520 B14R0.2224 CC(C)CCCCN(C)CCCCCO 269982a_100000722520_100011216152 [0,2,0,0,0,0|1,0,0]=3 19521 B14R0.2224 CC(C)CCCCN(C)CCOCCO 2230a_100000228057_100011216152 [0,2,0,0,0,0|2,0,0]=4 19522 B14R0.2224 CC(C)CCCCN(C)CCOCCO 269982a_100000228057_100011216152 [0,2,0,0,0,0|2,0,0]=4 19523 B14R0.2224 CC(C)CCCNC(=O)CCCCCO 240690a_200000737386_100102619762 [0,2,0,0,0,0|1,0,1]=4 19524 B14R0.2224 CC(C)COCCC(C)NCCCCO 270004a_100000750430_200011216429 [0,2,0,0,0,0|2,0,0]=4 19525 B14R0.2224 CCCCCCC(=O)CCCCB(O)O 1458a_100102632555_200009817182 [0,2,0,0,0,0|1,0,1]=4 19526 B14R0.2224 CCCCCCC(=O)CCCCC(C)C 1458a_100011933920_100000210757 [0,2,0,0,0,0|1,0,1]=4 19527 B14R0.2224 CCCCCCC(=O)CCCCC(C)C 1458a_100102632555_100011216152 [0,2,0,0,0,0|1,0,1]=4 19528 B14R0.2224 CCCCCCC(C)CCOCC(C)C 34a_200011024964_100000210624 [0,2,0,0,0,0|2,0,0]=4 19529 B14R0.2224 CCCCCCC(C)CCOCC(C)C 7a_200011024964_100000210760 [0,2,0,0,0,0|2,0,0]=4 19530 B14R0.2224 CCCCCCC(C)CCOCC(C)O 34a_200011024964_100011218427 [0,2,0,0,0,0|1,0,0]=3 19531 B14R0.2224 CCCCCCC(C)CCOCC(C)O 7a_200011024964_100011218427 [0,2,0,0,0,0|1,0,0]=3 19532 B14R0.2224 CCCCCCC(C)CCOCC(F)F 34a_200011024964_100011934356 [0,2,0,0,0,0|2,0,0]=4 19533 B14R0.2224 CCCCCCC(C)CCOCC(F)F 7a_200011024964_100011934356 [0,2,0,0,0,0|2,0,0]=4 19534 B14R0.2224 CCCCCCC(C)CCOC[C@@H](C)O 34a_200011024964_100009817552 [0,2,0,0,0,0|1,0,0]=3 19535 B14R0.2224 CCCCCCC(C)CCOC[C@@H](C)O 7a_200011024964_100009817552 [0,2,0,0,0,0|1,0,0]=3 19536 B14R0.2224 CCCCCCC(C)NCCCC(C)C 2230a_100000210919_100011214892 [0,2,0,0,0,0|2,0,0]=4 19537 B14R0.2224 CCCCCCC(C)NCCCC(C)C 2230a_200000737386_100011215978 [0,2,0,0,0,0|2,0,0]=4 19538 B14R0.2224 CCCCCCC(C)NCCCC(C)C 270004a_200000737386_100000210826 [0,2,0,0,0,0|2,0,0]=4 19539 B14R0.2224 CCCCCCC(C)NCCCC(C)C 34a_100000210919_100011214892 [0,2,0,0,0,0|2,0,0]=4 19540 B14R0.2224 CCCCCCC(C)NCCCC(C)C 34a_200000737386_100011215978 [0,2,0,0,0,0|2,0,0]=4 19541 B14R0.2224 CCCCCCC(C)NCCCC(C)O 2230a_100000210919_200000718107 [0,2,0,0,0,0|1,0,0]=3 19542 B14R0.2224 CCCCCCC(C)NCCCC(C)O 34a_100000210919_200000718107 [0,2,0,0,0,0|1,0,0]=3 19543 B14R0.2224 CCCCCCC(C)OCCCC(C)C 34a_100000210265_100011214892 [0,2,0,0,0,0|2,0,0]=4 19544 B14R0.2224 CCCCCCC(C)OCCCC(C)C 34a_100000210774_100011215978 [0,2,0,0,0,0|2,0,0]=4 19545 B14R0.2224 CCCCCCC(C)OCCCC(C)C 7a_100000210265_100011214892 [0,2,0,0,0,0|2,0,0]=4 19546 B14R0.2224 CCCCCCC(C)OCCCC(C)C 7a_100000210774_100011215978 [0,2,0,0,0,0|2,0,0]=4 19547 B14R0.2224 CCCCCCC(C)OCCCC(C)O 34a_100000210265_200000718107 [0,2,0,0,0,0|1,0,0]=3 19548 B14R0.2224 CCCCCCC(C)OCCCC(C)O 7a_100000210265_200000718107 [0,2,0,0,0,0|1,0,0]=3 19549 B14R0.2224 CCCCCCC(C)SCCCC(C)C 62a_100011214892_100011215978 [0,2,0,0,0,0|2,0,0]=4 19550 B14R0.2224 CCCCCCC(C)SCCCC(C)C 62a_100011215978_100011214892 [0,2,0,0,0,0|2,0,0]=4 19551 B14R0.2224 CCCCCCC(C)SCCCC(C)O 62a_100011215978_200000718107 [0,2,0,0,0,0|1,0,0]=3 19552 B14R0.2224 CCCCCCC(C)SCCCC(C)O 62a_200000718107_100011215978 [0,2,0,0,0,0|1,0,0]=3 19553 B14R0.2224 CCCCCCN(C)CCCCB(O)O 2230a_106256046315_200009817182 [0,2,0,0,0,0|2,0,0]=4 19554 B14R0.2224 CCCCCCN(C)CCCCB(O)O 269982a_106256046315_200009817182 [0,2,0,0,0,0|2,0,0]=4 19555 B14R0.2224 CCCCCCN(C)CCCCC(C)C 2230a_106256046315_100011216152 [0,2,0,0,0,0|2,0,0]=4 19556 B14R0.2224 CCCCCCN(C)CCCCC(C)C 269982a_106256046315_100011216152 [0,2,0,0,0,0|2,0,0]=4 19557 B14R0.2224 CCCCOCC(C)OCCCC(C)O 34a_100011217071_200000718107 [0,2,0,0,0,0|2,0,0]=4 19558 B14R0.2224 CCCCOCC(C)OCCCC(C)O 7a_100011217071_200000718107 [0,2,0,0,0,0|2,0,0]=4 19559 B14R0.2224 CN(C)CCCCN(C)CCCCCO 269982a_100000722520_100000690147 [0,2,0,0,0,0|2,0,0]=4 19560 B14R0.80 C#CC(CCCC)OCCCCCCC 34a_200011217967_100000210614 [0,2,0,0,0,0|2,0,0]=4 19561 B14R0.80 C#CC(CCCC)OCCCCCCC 7a_200011217967_100000210614 [0,2,0,0,0,0|2,0,0]=4 19562 B14R0.80 C#CC(CCCC)OCCCCCCF 34a_200011217967_100015922095 [0,2,0,0,0,0|2,0,0]=4 19563 B14R0.80 C#CC(CCCC)OCCCCCCF 7a_200011217967_100015922095 [0,2,0,0,0,0|2,0,0]=4 19564 B14R0.80 C#CC(CCCC)OCCCCCCO 34a_200011217967_100000766143 [0,2,0,0,0,0|1,0,0]=3 19565 B14R0.80 C#CC(CCCC)OCCCCCCO 7a_200011217967_100000766143 [0,2,0,0,0,0|1,0,0]=3 19566 B14R0.80 C=CC(CCCC)OCCCCCCC 34a_200011215037_100000210614 [0,2,0,0,0,0|2,0,0]=4 19567 B14R0.80 C=CC(CCCC)OCCCCCCC 7a_200011215037_100000210614 [0,2,0,0,0,0|2,0,0]=4 19568 B14R0.80 C=CC(CCCC)OCCCCCCF 34a_200011215037_100015922095 [0,2,0,0,0,0|2,0,0]=4 19569 B14R0.80 C=CC(CCCC)OCCCCCCF 7a_200011215037_100015922095 [0,2,0,0,0,0|2,0,0]=4 19570 B14R0.80 C=CC(CCCC)OCCCCCCO 34a_200011215037_100000766143 [0,2,0,0,0,0|1,0,0]=3 19571 B14R0.80 C=CC(CCCC)OCCCCCCO 7a_200011215037_100000766143 [0,2,0,0,0,0|1,0,0]=3 19572 B14R0.80 CCCCC(CC)CCCCNCCF 34a_100000724931_200012094884 [0,2,0,0,0,0|2,0,0]=4 19573 B14R0.80 CCCCC(CC)CCCCNCCO 2230a_100016997473_200012094884 [0,2,0,0,0,0|1,0,0]=3 19574 B14R0.80 CCCCC(CC)CCCCNCCO 34a_100016990907_200012094884 [0,2,0,0,0,0|1,0,0]=3 19575 B14R0.80 CCCCC(CC)CCCCOCCBr 34a_100000211926_200012094884 [0,2,0,0,0,0|2,0,0]=4 19576 B14R0.80 CCCCC(CC)CCCCOCCC 34a_100000210258_200012094884 [0,2,0,0,0,0|2,0,0]=4 19577 B14R0.80 CCCCC(CC)CCCCOCCN 34a_100000210304_200012094884 [0,2,0,0,0,0|2,0,0]=4 19578 B14R0.80 CCCCC(CC)CCCCSCCC 62a_100000210303_200012094884 [0,2,0,0,0,0|2,0,0]=4 19579 B14R0.80 CCCCC(CC)CCCCSCCC 62a_200012094884_100000210303 [0,2,0,0,0,0|2,0,0]=4 19580 B14R0.80 CCCCC(CC)CCCCSCCF 62a_100011217306_200012094884 [0,2,0,0,0,0|2,0,0]=4 19581 B14R0.80 CCCCC(CC)CCCCSCCF 62a_200012094884_100011217306 [0,2,0,0,0,0|2,0,0]=4 19582 B14R0.80 CCCCC(CC)CCCCSCCO 62a_100000211926_200012094884 [0,2,0,0,0,0|1,0,0]=3 19583 B14R0.80 CCCCC(CC)CCCCSCCO 62a_200012094884_100000211926 [0,2,0,0,0,0|1,0,0]=3 19584 B14R0.80 CCCCC(CC)CNCCCCCF 2230a_100000209976_100000729378 [0,2,0,0,0,0|2,0,0]=4 19585 B14R0.80 CCCCC(CC)CNCCCCCO 2230a_100000209976_100000746330 [0,2,0,0,0,0|1,0,0]=3 19586 B14R0.80 CCCCC(CC)CNCCCCCO 2230a_100000762737_100000211942 [0,2,0,0,0,0|1,0,0]=3 19587 B14R0.80 CCCCC(CC)CNCCCCCO 269862a_100000762737_100011219736 [0,2,0,0,0,0|1,0,0]=3 19588 B14R0.80 CCCCC(CC)CNCCCCCO 270004a_100000762737_100011219736 [0,2,0,0,0,0|1,0,0]=3 19589 B14R0.80 CCCCC(CC)CNCCCCCO 34a_100000762737_100000211942 [0,2,0,0,0,0|1,0,0]=3 19590 B14R0.80 CCCCC(CC)CNCCOCCO 2230a_100000209976_100011215305 [0,2,0,0,0,0|2,0,0]=4 19591 B14R0.80 CCCCC(CC)CNCCOCCO 2230a_100000211614_100000211942 [0,2,0,0,0,0|2,0,0]=4 19592 B14R0.80 CCCCC(CC)CNCCOCCO 269862a_100000211614_100011219736 [0,2,0,0,0,0|2,0,0]=4 19593 B14R0.80 CCCCC(CC)CNCCOCCO 270004a_100000211614_100011219736 [0,2,0,0,0,0|2,0,0]=4 19594 B14R0.80 CCCCC(CC)CNCCOCCO 34a_100000211614_100000211942 [0,2,0,0,0,0|2,0,0]=4 19595 B14R0.80 CCCCC(CC)CNCCSCCO 2230a_100011219999_100000211942 [0,2,0,0,0,0|2,0,0]=4 19596 B14R0.80 CCCCC(CC)CNCCSCCO 269862a_100011219999_100011219736 [0,2,0,0,0,0|2,0,0]=4 19597 B14R0.80 CCCCC(CC)CNCCSCCO 270004a_100011219999_100011219736 [0,2,0,0,0,0|2,0,0]=4 19598 B14R0.80 CCCCC(CC)COCCCCCBr 34a_100000746331_100000211942 [0,2,0,0,0,0|2,0,0]=4 19599 B14R0.80 CCCCC(CC)COCCCCCBr 7a_100000746331_100000211942 [0,2,0,0,0,0|2,0,0]=4 19600 B14R0.80 CCCCC(CC)COCCCCCCl 34a_100000746330_100000211942 [0,2,0,0,0,0|2,0,0]=4 19601 B14R0.80 CCCCC(CC)COCCCCCCl 7a_100000746330_100000211942 [0,2,0,0,0,0|2,0,0]=4 19602 B14R0.80 CCCCC(CC)COCCCCCF 34a_100000210273_100000729378 [0,2,0,0,0,0|2,0,0]=4 19603 B14R0.80 CCCCC(CC)COCCCCCF 7a_100000210273_100000729378 [0,2,0,0,0,0|2,0,0]=4 19604 B14R0.80 CCCCC(CC)COCCCCCI 34a_200012148887_100000211942 [0,2,0,0,0,0|2,0,0]=4 19605 B14R0.80 CCCCC(CC)COCCCCCI 7a_200012148887_100000211942 [0,2,0,0,0,0|2,0,0]=4 19606 B14R0.80 CCCCC(CC)COCCCCCN 34a_100000762737_100000211942 [0,2,0,0,0,0|2,0,0]=4 19607 B14R0.80 CCCCC(CC)COCCCCCO 34a_100000210273_100000746330 [0,2,0,0,0,0|1,0,0]=3 19608 B14R0.80 CCCCC(CC)COCCCCCO 7a_100000210273_100000746330 [0,2,0,0,0,0|1,0,0]=3 19609 B14R0.80 CCCCC(CC)COCCOCCO 34a_100000210273_100000692535 [0,2,0,0,0,0|2,0,0]=4 19610 B14R0.80 CCCCC(CC)COCCOCCO 7a_100000210273_100011215305 [0,2,0,0,0,0|2,0,0]=4 19611 B14R0.80 CCCCC(CC)CSCCCCCF 62a_100000211942_100000729378 [0,2,0,0,0,0|2,0,0]=4 19612 B14R0.80 CCCCC(CC)CSCCCCCF 62a_100000729378_100000211942 [0,2,0,0,0,0|2,0,0]=4 19613 B14R0.80 CCCCC(CC)CSCCCCCO 62a_100000211942_100000746330 [0,2,0,0,0,0|1,0,0]=3 19614 B14R0.80 CCCCC(CC)CSCCCCCO 62a_100000746330_100000211942 [0,2,0,0,0,0|1,0,0]=3 19615 B14R0.80 CCCCC(CC)CSCCOCCO 62a_100000211942_100011215305 [0,2,0,0,0,0|2,0,0]=4 19616 B14R0.80 CCCCC(CC)CSCCOCCO 62a_100011215305_100000211942 [0,2,0,0,0,0|2,0,0]=4 19617 B14R0.80 CCCCC(CC)NCCCCCCO 270004a_100000686447_100000753412 [0,2,0,0,0,0|1,0,0]=3 19618 B14R0.80 CCCCC(CC)NCCCCCCO 34a_100000686447_200011216223 [0,2,0,0,0,0|1,0,0]=3 19619 B14R0.80 CCCCC(CC)OCCCCCCBr 34a_100011215345_200011216223 [0,2,0,0,0,0|2,0,0]=4 19620 B14R0.80 CCCCC(CC)OCCCCCCBr 7a_100011215345_200011216223 [0,2,0,0,0,0|2,0,0]=4 19621 B14R0.80 CCCCC(CC)OCCCCCCCl 34a_100000766143_200011216223 [0,2,0,0,0,0|2,0,0]=4 19622 B14R0.80 CCCCC(CC)OCCCCCCCl 7a_100000766143_200011216223 [0,2,0,0,0,0|2,0,0]=4 19623 B14R0.80 CCCCC(CC)OCCCCCCF 34a_100000732779_200011216223 [0,2,0,0,0,0|2,0,0]=4 19624 B14R0.80 CCCCC(CC)OCCCCCCF 34a_100011215227_100015922095 [0,2,0,0,0,0|2,0,0]=4 19625 B14R0.80 CCCCC(CC)OCCCCCCF 7a_100000732779_200011216223 [0,2,0,0,0,0|2,0,0]=4 19626 B14R0.80 CCCCC(CC)OCCCCCCF 7a_100011215227_100015922095 [0,2,0,0,0,0|2,0,0]=4 19627 B14R0.80 CCCCC(CC)OCCCCCCN 34a_100000686447_200011216223 [0,2,0,0,0,0|2,0,0]=4 19628 B14R0.80 CCCCC(CC)OCCCCCCO 34a_100011215227_100000766143 [0,2,0,0,0,0|1,0,0]=3 19629 B14R0.80 CCCCC(CC)OCCCCCCO 7a_100011215227_100000766143 [0,2,0,0,0,0|1,0,0]=3 19630 B14R0.80 CCCCC(CC)SCCCCCCF 62a_100015922095_200011216223 [0,2,0,0,0,0|2,0,0]=4 19631 B14R0.80 CCCCC(CC)SCCCCCCF 62a_200011216223_100015922095 [0,2,0,0,0,0|2,0,0]=4 19632 B14R0.80 CCCCC(CC)SCCCCCCO 62a_100000766143_200011216223 [0,2,0,0,0,0|1,0,0]=3 19633 B14R0.80 CCCCC(CC)SCCCCCCO 62a_200011216223_100000766143 [0,2,0,0,0,0|1,0,0]=3 19634 B14R0.80 CCCCCCCCC(CC)NCCC 270004a_100020643023_200011217995 [0,2,0,0,0,0|2,0,0]=4 19635 B14R0.80 CCCCCCCCC(CC)NCCO 270004a_100000210304_200011217995 [0,2,0,0,0,0|1,0,0]=3 19636 B14R0.80 CCCCCCCCC(CC)OCCC 34a_200011216270_100000210303 [0,2,0,0,0,0|2,0,0]=4 19637 B14R0.80 CCCCCCCCC(CC)OCCC 7a_200011216270_100000210303 [0,2,0,0,0,0|2,0,0]=4 19638 B14R0.80 CCCCCCCCC(CC)OCCF 34a_200011216270_100011217306 [0,2,0,0,0,0|2,0,0]=4 19639 B14R0.80 CCCCCCCCC(CC)OCCF 7a_200011216270_100011217306 [0,2,0,0,0,0|2,0,0]=4 19640 B14R0.80 CCCCCCCCC(CC)OCCO 34a_200011216270_100000211926 [0,2,0,0,0,0|1,0,0]=3 19641 B14R0.80 CCCCCCCCC(CC)OCCO 7a_200011216270_100000211926 [0,2,0,0,0,0|1,0,0]=3 19642 B14R0.80 CCCCCCCCN(CC)CCCC 2230a_100000207695_100000210759 [0,2,0,0,0,0|2,0,0]=4 19643 B14R0.80 CCCCCCCCN(CC)CCCC 269982a_100000207695_100000210759 [0,2,0,0,0,0|2,0,0]=4 19644 B14R0.80 CCCCCCCNC(CC)CCCC 270004a_100000229938_100000753412 [0,2,0,0,0,0|2,0,0]=4 19645 B14R0.80 CCCCCCCN[C@H](CO)CCCC 2230a_100011934283_100000210681 [0,2,0,0,0,0|2,0,0]=4 19646 B14R0.80 CCCCCCCN[C@H](CO)CCCC 34a_100011934283_100000210614 [0,2,0,0,0,0|2,0,0]=4 19647 B14R0.80 CCCCCCCOC(CC)CCCC 34a_100000210272_200011216223 [0,2,0,0,0,0|2,0,0]=4 19648 B14R0.80 CCCCCCCOC(CC)CCCC 34a_100011215227_100000210614 [0,2,0,0,0,0|2,0,0]=4 19649 B14R0.80 CCCCCCCOC(CC)CCCC 7a_100000210272_200011216223 [0,2,0,0,0,0|2,0,0]=4 19650 B14R0.80 CCCCCCCOC(CC)CCCC 7a_100011215227_100000210614 [0,2,0,0,0,0|2,0,0]=4 19651 B14R0.80 CCCCCCCSC(CC)CCCC 62a_100000210614_200011216223 [0,2,0,0,0,0|2,0,0]=4 19652 B14R0.80 CCCCCCCSC(CC)CCCC 62a_200011216223_100000210316 [0,2,0,0,0,0|2,0,0]=4 19653 B14R0.80 CCCCCCNCC(CC)CCCC 2230a_100000209976_100000210314 [0,2,0,0,0,0|2,0,0]=4 19654 B14R0.80 CCCCCCNCC(CC)CCCC 2230a_100000210581_100000211942 [0,2,0,0,0,0|2,0,0]=4 19655 B14R0.80 CCCCCCNCC(CC)CCCC 269862a_100000210581_100011219736 [0,2,0,0,0,0|2,0,0]=4 19656 B14R0.80 CCCCCCNCC(CC)CCCC 270004a_100000210581_100011219736 [0,2,0,0,0,0|2,0,0]=4 19657 B14R0.80 CCCCCCOCC(CC)CCCC 34a_100000210259_100000211942 [0,2,0,0,0,0|2,0,0]=4 19658 B14R0.80 CCCCCCOCC(CC)CCCC 34a_100000210273_100000210314 [0,2,0,0,0,0|2,0,0]=4 19659 B14R0.80 CCCCCCOCC(CC)CCCC 7a_100000210259_100000211942 [0,2,0,0,0,0|2,0,0]=4 19660 B14R0.80 CCCCCCOCC(CC)CCCC 7a_100000210273_100000210314 [0,2,0,0,0,0|2,0,0]=4 19661 B14R0.80 CCCCCCSCC(CC)CCCC 62a_100000210314_100000211942 [0,2,0,0,0,0|2,0,0]=4 19662 B14R0.80 CCCCCCSCC(CC)CCCC 62a_100000211942_100000210757 [0,2,0,0,0,0|2,0,0]=4 19663 B14R0.80 CCCCN(CC)CCCCCCCO 2230a_100000207695_100000760002 [0,2,0,0,0,0|1,0,0]=3 19664 B14R0.80 CCCCN(CC)CCCCCCCO 269982a_100000207695_100000760002 [0,2,0,0,0,0|1,0,0]=3 19665 B14R0.80 CCCCN(CC)CCNCCCCO 2230a_200011208488_100000210776 [0,2,0,0,0,0|2,0,0]=4 19666 B14R0.80 CCCCN(CCCCOCCO)N=O 34a_200000034022_100000211926 [0,2,0,0,0,0|2,0,0]=4 19667 B14R0.80 CCCCN(CCCCOCCO)N=O 7a_200000034022_100000211926 [0,2,0,0,0,0|2,0,0]=4 19668 B14R0.80 CCCC[C@@H](CO)NCCCCCCF 2230a_100011934283_100015922095 [0,2,0,0,0,0|2,0,0]=4 19669 B14R0.80 CCCC[C@@H](CO)NCCCCCCF 34a_100011934283_100015922095 [0,2,0,0,0,0|2,0,0]=4 19670 B14R0.80 CCCC[C@@H](CO)NCCCCCCO 2230a_100011934283_100000766143 [0,2,0,0,0,0|1,0,0]=3 19671 B14R0.80 CCCC[C@@H](CO)NCCCCCCO 34a_100011934283_100000766143 [0,2,0,0,0,0|1,0,0]=3 19672 B14R0.80 CCN(CCCCCCCO)CCOC 2230a_100000731262_100000760002 [0,2,0,0,0,0|2,0,0]=4 19673 B14R0.80 CCN(CCCCCCCO)CCOC 269982a_100000731262_100000760002 [0,2,0,0,0,0|2,0,0]=4 19674 B14R0.80 CCOCC(CN)OCCCCCCO 34a_102515437182_100000766143 [0,2,0,0,0,0|2,0,0]=4 19675 B14R0.80 CSCC[C@@H](CO)NCCCCCCO 2230a_100011827619_100000766143 [0,2,0,0,0,0|2,0,0]=4 19676 B14R0.82 CCC(=O)CC(=O)CCCCCCCO 1458a_100011219782_100000747405 [0,2,0,0,0,0|0,0,2]=4 19677 B14R0.82 CCC(C)CC(=O)CCCCCCCO 1458a_100000708755_100000760002 [0,2,0,0,0,0|0,0,1]=3 19678 B14R0.82 CCC(C)CC(=O)CCCCCCCO 1458a_100011219782_100000748023 [0,2,0,0,0,0|0,0,1]=3 19679 B14R0.82 CCC(C)CC(=O)NCCCCCCO 240690a_100000686447_100000708755 [0,2,0,0,0,0|1,0,1]=4 19680 B14R0.82 CCC(C)CC(=O)NCCCCCCO 527a_100000686447_100000708755 [0,2,0,0,0,0|1,0,1]=4 19681 B14R0.82 CCC(C)CC(C)NCCCCCCF 2230a_100000763565_100015922095 [0,2,0,0,0,0|2,0,0]=4 19682 B14R0.82 CCC(C)CC(C)NCCCCCCO 2230a_100000763565_100000766143 [0,2,0,0,0,0|1,0,0]=3 19683 B14R0.82 CCC(C)CC(C)NCCCCCCO 270004a_100000686447_100011710205 [0,2,0,0,0,0|1,0,0]=3 19684 B14R0.82 CCC(C)CN(C)CCCCCCCO 2230a_100000753921_100000760002 [0,2,0,0,0,0|1,0,0]=3 19685 B14R0.82 CCC(C)CN(C)CCCCCCCO 269982a_100000753921_100000760002 [0,2,0,0,0,0|1,0,0]=3 19686 B14R0.82 CCC(C)NC(=O)CCCCCCCO 240690a_100000209981_100011219782 [0,2,0,0,0,0|1,0,1]=4 19687 B14R0.82 CCC(O)CC(=O)CCCCCCCO 1458a_100011219782_100011218378 [0,2,0,0,0,0|0,0,1]=3 19688 B14R0.82 CCC(O)CC(=O)CCCCCCCO 1458a_100011667805_100000760002 [0,2,0,0,0,0|0,0,1]=3 19689 B14R0.82 CCC(O)CC(=O)NCCCCCCO 240690a_100000686447_100011667805 [0,2,0,0,0,0|1,0,1]=4 19690 B14R0.82 CCCCCCCCC(=O)CC(C)CC 1458a_100000210188_100000748023 [0,2,0,0,0,0|1,0,1]=4 19691 B14R0.82 CCCCCCCCC(=O)CC(C)CC 1458a_100000708755_100000210759 [0,2,0,0,0,0|1,0,1]=4 19692 B14R0.82 CCCCCCCCC(=O)CC(O)CC 1458a_100000210188_100011218378 [0,2,0,0,0,0|1,0,1]=4 19693 B14R0.82 CCCCCCCCC(=O)CC(O)CC 1458a_100011667805_100000210759 [0,2,0,0,0,0|1,0,1]=4 19694 B14R0.82 CCCCCCCCC(=O)C[C@@H](C)CC 1458a_100000210188_100009816398 [0,2,0,0,0,0|1,0,1]=4 19695 B14R0.82 CCCCCCCCC(=O)C[C@@H](C)CO 1458a_100000210188_100000059175 [0,2,0,0,0,0|0,0,1]=3 19696 B14R0.82 CCCCCCCCC(=O)N[C@H](C)CO 240690a_100000737577_100000210188 [0,2,0,0,0,0|1,0,1]=4 19697 B14R0.82 CCCCCCCCC(=O)N[C@H](C)CO 527a_100000737577_100000210188 [0,2,0,0,0,0|1,0,1]=4 19698 B14R0.82 CCCCCCCCC(C)NC(C)CC 270004a_100000209981_100011216694 [0,2,0,0,0,0|2,0,0]=4 19699 B14R0.82 CCCCCCCCC(C)N[C@H](C)CF 270004a_100102880703_100011216694 [0,2,0,0,0,0|2,0,0]=4 19700 B14R0.82 CCCCCCCCC(C)N[C@H](C)CO 270004a_100000737577_100011216694 [0,2,0,0,0,0|1,0,0]=3 19701 B14R0.82 CCCCCCCCC(C)OC(C)CC 34a_100000210740_100011215416 [0,2,0,0,0,0|2,0,0]=4 19702 B14R0.82 CCCCCCCCC(C)OC(C)CC 7a_100000210740_100000758301 [0,2,0,0,0,0|2,0,0]=4 19703 B14R0.82 CCCCCCCCC(C)OC(C)CO 34a_100000210740_100012180447 [0,2,0,0,0,0|1,0,0]=3 19704 B14R0.82 CCCCCCCCC(C)OC(C)CO 7a_100000210740_100012180447 [0,2,0,0,0,0|1,0,0]=3 19705 B14R0.82 CCCCCCCCN(C)CC(C)CC 2230a_100000207567_100000748023 [0,2,0,0,0,0|2,0,0]=4 19706 B14R0.82 CCCCCCCCN(C)CC(C)CC 2230a_100000753921_100000210759 [0,2,0,0,0,0|2,0,0]=4 19707 B14R0.82 CCCCCCCCN(C)CC(C)CC 269982a_100000207567_100000748023 [0,2,0,0,0,0|2,0,0]=4 19708 B14R0.82 CCCCCCCCN(C)CC(C)CC 269982a_100000753921_100000210759 [0,2,0,0,0,0|2,0,0]=4 19709 B14R0.82 CCCCCCCCN(C)CC(C)CC 270004a_100000207567_100000243153 [0,2,0,0,0,0|2,0,0]=4 19710 B14R0.82 CCCCCCCCN(C)CC(O)CC 2230a_100000207567_100011218378 [0,2,0,0,0,0|2,0,0]=4 19711 B14R0.82 CCCCCCCCN(C)CC(O)CC 269982a_100000207567_100011218378 [0,2,0,0,0,0|2,0,0]=4 19712 B14R0.82 CCCCCCCCN(C)CC(O)CO 2230a_100000207567_100011219619 [0,2,0,0,0,0|1,0,0]=3 19713 B14R0.82 CCCCCCCCN(C)CC(O)CO 2230a_100011216503_100000210759 [0,2,0,0,0,0|1,0,0]=3 19714 B14R0.82 CCCCCCCCN(C)CC(O)CO 269982a_100011216503_100000210759 [0,2,0,0,0,0|1,0,0]=3 19715 B14R0.82 CCCCCCCCN(C)C[C@@H](C)CC 2230a_100000207567_100009816398 [0,2,0,0,0,0|2,0,0]=4 19716 B14R0.82 CCCCCCCCN(C)C[C@@H](C)CC 269982a_100000207567_100009816398 [0,2,0,0,0,0|2,0,0]=4 19717 B14R0.82 CCCCCCCCN(C)C[C@@H](C)CO 2230a_100000207567_100000059175 [0,2,0,0,0,0|1,0,0]=3 19718 B14R0.82 CCCCCCCCN(C)C[C@@H](C)CO 269982a_100000207567_100000059175 [0,2,0,0,0,0|1,0,0]=3 19719 B14R0.82 CCCCCCCCN(C)C[C@@H](O)CF 2230a_100000207567_100015614560 [0,2,0,0,0,0|2,0,0]=4 19720 B14R0.82 CCCCCCCCN(C)C[C@@H](O)CO 2230a_100000207567_100009815848 [0,2,0,0,0,0|1,0,0]=3 19721 B14R0.82 CCCCCCCNC(C)CC(C)CC 2230a_100000763565_100000210681 [0,2,0,0,0,0|2,0,0]=4 19722 B14R0.82 CCCCCCCNC(C)CC(C)CC 270004a_100000229938_100011710205 [0,2,0,0,0,0|2,0,0]=4 19723 B14R0.82 CCN(C)CC(=O)CCCCCCCO 1458a_100116209913_100000760002 [0,2,0,0,0,0|1,0,1]=4 19724 B14R0.82 CC[C@H](C)CC(=O)CCCCCCCO 1458a_100011219782_100009816398 [0,2,0,0,0,0|0,0,1]=3 19725 B14R0.82 CN(CCCCCCCO)CC(O)CO 2230a_100011216503_100000760002 [0,2,0,0,0,0|2,0,0]=4 19726 B14R0.82 CN(CCCCCCCO)CC(O)CO 269982a_100011216503_100000760002 [0,2,0,0,0,0|2,0,0]=4 19727 B14R0.82 COCCCCCCN(C)CC(O)CO 2230a_100011216503_100011998445 [0,2,0,0,0,0|2,0,0]=4 19728 B14R0.82 COCCCCCCN(C)CC(O)CO 269982a_100011216503_100011998445 [0,2,0,0,0,0|2,0,0]=4 19729 B14R0.82 C[C@@H](CO)CC(=O)CCCCCCCO 1458a_100011219782_100000059175 [0,2,0,0,0,0|1,0,1]=4 19730 B14R0.152 CCCCC(C)CCCCOC(C)CC 34a_200011021034_100011215416 [0,2,0,0,0,0|2,0,0]=4 19731 B14R0.152 CCCCC(C)CCCCOC(C)CC 7a_200011021034_100000758301 [0,2,0,0,0,0|2,0,0]=4 19732 B14R0.152 CCCCC(C)CCCCOC(C)CO 34a_200011021034_100012180447 [0,2,0,0,0,0|1,0,0]=3 19733 B14R0.152 CCCCC(C)CCCCOC(C)CO 7a_200011021034_100012180447 [0,2,0,0,0,0|1,0,0]=3 19734 B14R0.152 CCN(C)CCCNC[C@H](C)CCCO 2230a_100160569302_100015186262 [0,2,0,0,0,0|2,0,0]=4 19735 B14R0.179 C#CCCCC(=O)CCCCCCCC 1458a_100000210188_100000731252 [0,2,0,0,0,0|1,0,1]=4 19736 B14R0.179 C#CCCCC(=O)CCCCCCCC 1458a_100000690238_100000210759 [0,2,0,0,0,0|1,0,1]=4 19737 B14R0.179 C#CCCCC(=O)CCCCCCCO 1458a_100000690238_100000760002 [0,2,0,0,0,0|0,0,2]=4 19738 B14R0.179 C#CCCCC(=O)CCCCCCCO 1458a_100011219782_100000731252 [0,2,0,0,0,0|0,0,2]=4 19739 B14R0.179 C#CCCCCCCC(=O)CCCCC 1458a_100000034748_100000210326 [0,2,0,0,0,0|1,0,1]=4 19740 B14R0.179 C#CCCCCCCC(=O)CCCCC 1458a_100000212188_100012276617 [0,2,0,0,0,0|1,0,1]=4 19741 B14R0.179 C#CCCCCCCC(=O)CCCCO 1458a_100000034748_100000210776 [0,2,0,0,0,0|0,0,2]=4 19742 B14R0.179 C#CCCCCCCC(=O)CCCCO 1458a_100000695505_100012276617 [0,2,0,0,0,0|0,0,2]=4 19743 B14R0.179 C#CCCCCCCN(C)CCCCC 2230a_100000223495_100012276617 [0,2,0,0,0,0|1,0,1]=4 19744 B14R0.179 C#CCCCCCCN(C)CCCCC 269982a_100000223495_100012276617 [0,2,0,0,0,0|1,0,1]=4 19745 B14R0.179 C#CCCCCCCN(C)CCCCO 2230a_100000717598_100012276617 [0,2,0,0,0,0|0,0,2]=4 19746 B14R0.179 C#CCCCCCCN(C)CCCCO 269982a_100000717598_100012276617 [0,2,0,0,0,0|0,0,2]=4 19747 B14R0.179 C#CCCCCCNC(C)CCCCC 2230a_100000211957_100012094781 [0,2,0,0,0,0|1,0,1]=4 19748 B14R0.179 C#CCCCCCOC(C)CCCCC 34a_100000766912_200011218191 [0,2,0,0,0,0|1,0,1]=4 19749 B14R0.179 C#CCCCCCOC(C)CCCCC 34a_100011215632_100012094781 [0,2,0,0,0,0|1,0,1]=4 19750 B14R0.179 C#CCCCCCOC(C)CCCCC 7a_100000766912_200011218191 [0,2,0,0,0,0|1,0,1]=4 19751 B14R0.179 C#CCCCCCOC(C)CCCCC 7a_100011215632_100012094781 [0,2,0,0,0,0|1,0,1]=4 19752 B14R0.179 C#CCCCCCSC(C)CCCCC 62a_100012094781_200011218191 [0,2,0,0,0,0|1,0,1]=4 19753 B14R0.179 C#CCCCCCSC(C)CCCCC 62a_200011218191_100012094781 [0,2,0,0,0,0|1,0,1]=4 19754 B14R0.179 C#CCCCN(C)CCCCCCCC 2230a_100000207567_100000731252 [0,2,0,0,0,0|1,0,1]=4 19755 B14R0.179 C#CCCCN(C)CCCCCCCC 269982a_100000207567_100011215417 [0,2,0,0,0,0|1,0,1]=4 19756 B14R0.179 C#CCCOC(C)CCCCCCCC 34a_100000210740_100000688953 [0,2,0,0,0,0|1,0,1]=4 19757 B14R0.179 C#CCCOC(C)CCCCCCCC 7a_100000210740_100000688953 [0,2,0,0,0,0|1,0,1]=4 19758 B14R0.179 C#CCOCC(C)CCCCCCCC 34a_200012125181_100000184674 [0,2,0,0,0,0|1,0,1]=4 19759 B14R0.179 C#CCOCC(C)CCCCCCCC 7a_200012125181_100000038162 [0,2,0,0,0,0|1,0,1]=4 19760 B14R0.179 C=CCCCC(=O)CCCCCCCC 1458a_100000210188_100000757094 [0,2,0,0,0,0|1,0,1]=4 19761 B14R0.179 C=CCCCC(=O)CCCCCCCC 1458a_100000766728_100000210759 [0,2,0,0,0,0|1,0,1]=4 19762 B14R0.179 C=CCCCC(=O)CCCCCCCO 1458a_100000766728_100000760002 [0,2,0,0,0,0|0,0,2]=4 19763 B14R0.179 C=CCCCC(=O)CCCCCCCO 1458a_100011219782_100000757094 [0,2,0,0,0,0|0,0,2]=4 19764 B14R0.179 C=CCCCCCCC(=O)CCCCC 1458a_100000212188_100011215473 [0,2,0,0,0,0|1,0,1]=4 19765 B14R0.179 C=CCCCCCCC(=O)CCCCC 1458a_100011809334_100000210326 [0,2,0,0,0,0|1,0,1]=4 19766 B14R0.179 C=CCCCCCCC(=O)CCCCO 1458a_100000695505_100011215473 [0,2,0,0,0,0|0,0,2]=4 19767 B14R0.179 C=CCCCCCCC(=O)CCCCO 1458a_100011809334_100000210776 [0,2,0,0,0,0|0,0,2]=4 19768 B14R0.179 C=CCCCCCCN(C)CCCCC 2230a_100000223495_100011215473 [0,2,0,0,0,0|1,0,1]=4 19769 B14R0.179 C=CCCCCCCN(C)CCCCC 269982a_100000223495_100011215473 [0,2,0,0,0,0|1,0,1]=4 19770 B14R0.179 C=CCCCCCCN(C)CCCCO 2230a_100000717598_100011215473 [0,2,0,0,0,0|0,0,2]=4 19771 B14R0.179 C=CCCCCCCN(C)CCCCO 269982a_100000717598_100011215473 [0,2,0,0,0,0|0,0,2]=4 19772 B14R0.179 C=CCCCCCNC(C)CCCCC 2230a_100000211957_100000700193 [0,2,0,0,0,0|1,0,1]=4 19773 B14R0.179 C=CCCCCCOC(C)CCCCC 34a_100011215632_100000700193 [0,2,0,0,0,0|1,0,1]=4 19774 B14R0.179 C=CCCCCCOC(C)CCCCC 34a_100011216702_200011218191 [0,2,0,0,0,0|1,0,1]=4 19775 B14R0.179 C=CCCCCCOC(C)CCCCC 7a_100011215632_100000700193 [0,2,0,0,0,0|1,0,1]=4 19776 B14R0.179 C=CCCCCCOC(C)CCCCC 7a_100011216702_200011218191 [0,2,0,0,0,0|1,0,1]=4 19777 B14R0.179 C=CCCCCCSC(C)CCCCC 62a_100000700193_200011218191 [0,2,0,0,0,0|1,0,1]=4 19778 B14R0.179 C=CCCCCCSC(C)CCCCC 62a_200011218191_100000700193 [0,2,0,0,0,0|1,0,1]=4 19779 B14R0.179 C=CCCCN(C)CCCCCCCC 2230a_100000207567_100011713584 [0,2,0,0,0,0|1,0,1]=4 19780 B14R0.179 C=CCCCN(C)CCCCCCCC 269982a_100000207567_100000757094 [0,2,0,0,0,0|1,0,1]=4 19781 B14R0.179 C=CCCNC(C)CCCCCCCC 270004a_100015191253_100011216694 [0,2,0,0,0,0|1,0,1]=4 19782 B14R0.179 C=CCCOC(C)CCCCCCCC 34a_100000210740_100000754431 [0,2,0,0,0,0|1,0,1]=4 19783 B14R0.179 C=CCCOC(C)CCCCCCCC 7a_100000210740_100000754431 [0,2,0,0,0,0|1,0,1]=4 19784 B14R0.179 C=CCNCC(C)CCCCCCCC 270004a_100020586998_100011995885 [0,2,0,0,0,0|1,0,1]=4 19785 B14R0.179 C=CCOCC(C)CCCCCCCC 34a_200012125181_100015514636 [0,2,0,0,0,0|1,0,1]=4 19786 B14R0.179 C=CCOCC(C)CCCCCCCC 7a_200012125181_100015514636 [0,2,0,0,0,0|1,0,1]=4 19787 B14R0.179 CC(CCCC#N)NCCCCCCO 270004a_100000686447_200000032708 [0,2,0,0,0,0|1,0,1]=4 19788 B14R0.179 CC/C=C/CC(=O)CCCCCCCO 1458a_100016274230_100000760002 [0,2,0,0,0,0|0,0,2]=4 19789 B14R0.179 CC/C=C\CC(=O)CCCCCCCO 1458a_100011219782_100103147603 [0,2,0,0,0,0|0,0,2]=4 19790 B14R0.179 CCC#CCC(=O)CCCCCCCO 1458a_100011219782_100009813939 [0,2,0,0,0,0|0,0,2]=4 19791 B14R0.179 CCC#CCC(C)OCCCCCCO 34a_200000035118_100000766143 [0,2,0,0,0,0|0,0,2]=4 19792 B14R0.179 CCC#CCC(C)OCCCCCCO 7a_200000035118_100000766143 [0,2,0,0,0,0|0,0,2]=4 19793 B14R0.179 CCCC#CC(=O)CCCCCCCO 1458a_200011218047_100000760002 [0,2,0,0,0,0|0,0,2]=4 19794 B14R0.179 CCCC=CC(=O)CCCCCCCO 1458a_100000212230_100000760002 [0,2,0,0,0,0|0,0,2]=4 19795 B14R0.179 CCCCC/C=C/CC(=O)CCCCO 1458a_100020675968_100000210776 [0,2,0,0,0,0|0,0,2]=4 19796 B14R0.179 CCCCCC#CCC(=O)CCCCO 1458a_100000695505_100009816472 [0,2,0,0,0,0|0,0,2]=4 19797 B14R0.179 CCCCCC#CCN(C)CCCCO 2230a_100000717598_100009816472 [0,2,0,0,0,0|0,0,2]=4 19798 B14R0.179 CCCCCC#CCN(C)CCCCO 269982a_100000717598_100009816472 [0,2,0,0,0,0|0,0,2]=4 19799 B14R0.179 CCCCCC(=O)CCCCCCC#N 1458a_100000212188_100009813337 [0,2,0,0,0,0|1,0,1]=4 19800 B14R0.179 CCCCCC(=O)CCCCCCCO 1458a_100000212188_100000760002 [0,2,0,0,0,0|0,0,0]=2 19801 B14R0.179 CCCCCC(=O)CCCCCCCO 1458a_100011219782_100000210326 [0,2,0,0,0,0|0,0,0]=2 19802 B14R0.179 CCCCCC(=O)CCCCCCOC 1458a_100000212188_100011998445 [0,2,0,0,0,0|0,0,1]=3 19803 B14R0.179 CCCCCC(=O)CCCOCCOC 1458a_100000212188_100011216529 [0,2,0,0,0,0|1,0,1]=4 19804 B14R0.179 CCCCCC(=O)CNCCCCCO 2230a_100000762737_200012276598 [0,2,0,0,0,0|0,0,1]=3 19805 B14R0.179 CCCCCC(=O)CNCCCCCO 34a_100000762737_200012276598 [0,2,0,0,0,0|0,0,1]=3 19806 B14R0.179 CCCCCC(=O)CNCCOCCO 2230a_100000211614_200012276598 [0,2,0,0,0,0|1,0,1]=4 19807 B14R0.179 CCCCCC(=O)CNCCOCCO 34a_100000211614_200012276598 [0,2,0,0,0,0|1,0,1]=4 19808 B14R0.179 CCCCCC(=O)CNCCSCCO 2230a_100011219999_200012276598 [0,2,0,0,0,0|1,0,1]=4 19809 B14R0.179 CCCCCC(=O)COCCCCCBr 34a_100000746331_200012276598 [0,2,0,0,0,0|1,0,1]=4 19810 B14R0.179 CCCCCC(=O)COCCCCCBr 7a_100000746331_200012276598 [0,2,0,0,0,0|1,0,1]=4 19811 B14R0.179 CCCCCC(=O)COCCCCCCl 34a_100000746330_200012276598 [0,2,0,0,0,0|1,0,1]=4 19812 B14R0.179 CCCCCC(=O)COCCCCCCl 7a_100000746330_200012276598 [0,2,0,0,0,0|1,0,1]=4 19813 B14R0.179 CCCCCC(=O)COCCCCCI 34a_200012148887_200012276598 [0,2,0,0,0,0|1,0,1]=4 19814 B14R0.179 CCCCCC(=O)COCCCCCI 7a_200012148887_200012276598 [0,2,0,0,0,0|1,0,1]=4 19815 B14R0.179 CCCCCC(=O)COCCCCCN 34a_100000762737_200012276598 [0,2,0,0,0,0|1,0,1]=4 19816 B14R0.179 CCCCCC(=O)COCCCCOC 34a_100000740925_200012276598 [0,2,0,0,0,0|1,0,1]=4 19817 B14R0.179 CCCCCC(=O)COCCOCCO 1458a_106645077154_100000210326 [0,2,0,0,0,0|1,0,1]=4 19818 B14R0.179 CCCCCC(=O)CSCCCCCF 62a_100000729378_200012276598 [0,2,0,0,0,0|1,0,1]=4 19819 B14R0.179 CCCCCC(=O)CSCCCCCF 62a_200012276598_100000729378 [0,2,0,0,0,0|1,0,1]=4 19820 B14R0.179 CCCCCC(=O)CSCCCCCO 62a_100000746330_200012276598 [0,2,0,0,0,0|0,0,1]=3 19821 B14R0.179 CCCCCC(=O)CSCCCCCO 62a_200012276598_100000746330 [0,2,0,0,0,0|0,0,1]=3 19822 B14R0.179 CCCCCC(=O)CSCCCCOC 62a_100000730899_200012276598 [0,2,0,0,0,0|1,0,1]=4 19823 B14R0.179 CCCCCC(=O)CSCCCCOC 62a_200012276598_100000730899 [0,2,0,0,0,0|1,0,1]=4 19824 B14R0.179 CCCCCC(=O)CSCCOCCO 62a_100011215305_200012276598 [0,2,0,0,0,0|1,0,1]=4 19825 B14R0.179 CCCCCC(=O)CSCCOCCO 62a_200012276598_100011215305 [0,2,0,0,0,0|1,0,1]=4 19826 B14R0.179 CCCCCC(=O)NCCCCCCO 240690a_100000686447_100000212188 [0,2,0,0,0,0|0,0,1]=3 19827 B14R0.179 CCCCCC(=O)NCCCCCCO 527a_100000686447_100000212188 [0,2,0,0,0,0|0,0,1]=3 19828 B14R0.179 CCCCCC(=O)NCCCCCOC 11a_100000747528_100000212188 [0,2,0,0,0,0|1,0,1]=4 19829 B14R0.179 CCCCCC(=O)NCCCCCOC 1626a_100000747528_100000212188 [0,2,0,0,0,0|1,0,1]=4 19830 B14R0.179 CCCCCC(=O)NCCCCCOC 240690a_100000747528_100000212188 [0,2,0,0,0,0|1,0,1]=4 19831 B14R0.179 CCCCCC(=O)NCCCCCOC 527a_100000747528_100000212188 [0,2,0,0,0,0|1,0,1]=4 19832 B14R0.179 CCCCCC(C)NCCCCCC#N 2230a_100000211957_100009813376 [0,2,0,0,0,0|1,0,1]=4 19833 B14R0.179 CCCCCC(C)NCCCCCC#N 270004a_100000061152_100000211708 [0,2,0,0,0,0|1,0,1]=4 19834 B14R0.179 CCCCCC(C)NCCCCCC=O 2230a_100000211957_100000139337 [0,2,0,0,0,0|0,0,2]=4 19835 B14R0.179 CCCCCC(C)NCCCCCCF 2230a_100000211957_100015922095 [0,2,0,0,0,0|1,0,0]=3 19836 B14R0.179 CCCCCC(C)NCCCCCCO 2230a_100000211957_100000766143 [0,2,0,0,0,0|0,0,0]=2 19837 B14R0.179 CCCCCC(C)NCCCCCCO 2230a_100000686447_200011218191 [0,2,0,0,0,0|0,0,0]=2 19838 B14R0.179 CCCCCC(C)NCCCCCCO 270004a_100000686447_100000211708 [0,2,0,0,0,0|0,0,0]=2 19839 B14R0.179 CCCCCC(C)NCCCCCCO 34a_100000686447_200011218191 [0,2,0,0,0,0|0,0,0]=2 19840 B14R0.179 CCCCCC(C)NCCCCCOC 2230a_100000747528_200011218191 [0,2,0,0,0,0|1,0,0]=3 19841 B14R0.179 CCCCCC(C)NCCCCCOC 270004a_100000747528_100000211708 [0,2,0,0,0,0|1,0,0]=3 19842 B14R0.179 CCCCCC(C)NCCCCCOC 34a_100000747528_200011218191 [0,2,0,0,0,0|1,0,0]=3 19843 B14R0.179 CCCCCC(C)NCCCOCCC 2230a_100011217757_200011218191 [0,2,0,0,0,0|2,0,0]=4 19844 B14R0.179 CCCCCC(C)NCCCOCCC 270004a_100011217757_100000211708 [0,2,0,0,0,0|2,0,0]=4 19845 B14R0.179 CCCCCC(C)NCCCOCCC 34a_100011217757_200011218191 [0,2,0,0,0,0|2,0,0]=4 19846 B14R0.179 CCCCCC(C)NCCOCCCC 2230a_100000211957_100000743108 [0,2,0,0,0,0|2,0,0]=4 19847 B14R0.179 CCCCCC(C)NCCOCCOC 2230a_100000211957_100000695917 [0,2,0,0,0,0|2,0,0]=4 19848 B14R0.179 CCCCCC(C)NCCOCCOC 2230a_100000745349_200011218191 [0,2,0,0,0,0|2,0,0]=4 19849 B14R0.179 CCCCCC(C)NCCOCCOC 270004a_100000745349_100000211708 [0,2,0,0,0,0|2,0,0]=4 19850 B14R0.179 CCCCCC(C)NCCOCCOC 34a_100000745349_200011218191 [0,2,0,0,0,0|2,0,0]=4 19851 B14R0.179 CCCCCC(C)NCCSCCCC 2230a_100025743550_200011218191 [0,2,0,0,0,0|2,0,0]=4 19852 B14R0.179 CCCCCC(C)NCCSCCCC 270004a_100025743550_100000211708 [0,2,0,0,0,0|2,0,0]=4 19853 B14R0.179 CCCCCC(C)OCCCCCC#N 7a_100011215632_100009813376 [0,2,0,0,0,0|1,0,1]=4 19854 B14R0.179 CCCCCC(C)OCCCCCC=O 7a_100011215632_100000139337 [0,2,0,0,0,0|0,0,2]=4 19855 B14R0.179 CCCCCC(C)OCCCCCCBr 34a_100011215345_200011218191 [0,2,0,0,0,0|1,0,0]=3 19856 B14R0.179 CCCCCC(C)OCCCCCCBr 7a_100011215345_200011218191 [0,2,0,0,0,0|1,0,0]=3 19857 B14R0.179 CCCCCC(C)OCCCCCCCl 34a_100000766143_200011218191 [0,2,0,0,0,0|1,0,0]=3 19858 B14R0.179 CCCCCC(C)OCCCCCCCl 7a_100000766143_200011218191 [0,2,0,0,0,0|1,0,0]=3 19859 B14R0.179 CCCCCC(C)OCCCCCCF 34a_100000732779_200011218191 [0,2,0,0,0,0|1,0,0]=3 19860 B14R0.179 CCCCCC(C)OCCCCCCF 34a_100011215632_100015922095 [0,2,0,0,0,0|1,0,0]=3 19861 B14R0.179 CCCCCC(C)OCCCCCCF 7a_100000732779_200011218191 [0,2,0,0,0,0|1,0,0]=3 19862 B14R0.179 CCCCCC(C)OCCCCCCF 7a_100011215632_100015922095 [0,2,0,0,0,0|1,0,0]=3 19863 B14R0.179 CCCCCC(C)OCCCCCCN 34a_100000686447_200011218191 [0,2,0,0,0,0|1,0,0]=3 19864 B14R0.179 CCCCCC(C)OCCCCCCO 34a_100011215632_100000766143 [0,2,0,0,0,0|0,0,0]=2 19865 B14R0.179 CCCCCC(C)OCCCCCCO 7a_100011215632_100000766143 [0,2,0,0,0,0|0,0,0]=2 19866 B14R0.179 CCCCCC(C)OCCCCCNC 34a_100000722520_200011218191 [0,2,0,0,0,0|2,0,0]=4 19867 B14R0.179 CCCCCC(C)OCCOCCCC 34a_100000210238_200011218191 [0,2,0,0,0,0|2,0,0]=4 19868 B14R0.179 CCCCCC(C)OCCOCCCC 34a_100011215632_100000743108 [0,2,0,0,0,0|2,0,0]=4 19869 B14R0.179 CCCCCC(C)OCCOCCCC 7a_100000210238_200011218191 [0,2,0,0,0,0|2,0,0]=4 19870 B14R0.179 CCCCCC(C)OCCOCCCC 7a_100011215632_100000743108 [0,2,0,0,0,0|2,0,0]=4 19871 B14R0.179 CCCCCC(C)OCCOCCOC 34a_100011215163_200011218191 [0,2,0,0,0,0|2,0,0]=4 19872 B14R0.179 CCCCCC(C)OCCOCCOC 34a_100011215632_100000695917 [0,2,0,0,0,0|2,0,0]=4 19873 B14R0.179 CCCCCC(C)OCCOCCOC 7a_100011215163_200011218191 [0,2,0,0,0,0|2,0,0]=4 19874 B14R0.179 CCCCCC(C)OCCOCCOC 7a_100011215632_100000695917 [0,2,0,0,0,0|2,0,0]=4 19875 B14R0.179 CCCCCC(C)OCCSCCCC 34a_200000230436_200011218191 [0,2,0,0,0,0|2,0,0]=4 19876 B14R0.179 CCCCCC(C)OCCSCCCC 7a_200000230436_200011218191 [0,2,0,0,0,0|2,0,0]=4 19877 B14R0.179 CCCCCC(C)SCCCCCC#N 62a_100009813376_200011218191 [0,2,0,0,0,0|1,0,1]=4 19878 B14R0.179 CCCCCC(C)SCCCCCC#N 62a_200011218191_100009813376 [0,2,0,0,0,0|1,0,1]=4 19879 B14R0.179 CCCCCC(C)SCCCCCC=O 62a_100000139337_200011218191 [0,2,0,0,0,0|0,0,2]=4 19880 B14R0.179 CCCCCC(C)SCCCCCC=O 62a_200011218191_100000139337 [0,2,0,0,0,0|0,0,2]=4 19881 B14R0.179 CCCCCC(C)SCCCCCCF 62a_100015922095_200011218191 [0,2,0,0,0,0|1,0,0]=3 19882 B14R0.179 CCCCCC(C)SCCCCCCF 62a_200011218191_100015922095 [0,2,0,0,0,0|1,0,0]=3 19883 B14R0.179 CCCCCC(C)SCCCCCCO 62a_100000766143_200011218191 [0,2,0,0,0,0|0,0,0]=2 19884 B14R0.179 CCCCCC(C)SCCCCCCO 62a_200011218191_100000766143 [0,2,0,0,0,0|0,0,0]=2 19885 B14R0.179 CCCCCC(C)SCCOCCCC 62a_100000743108_200011218191 [0,2,0,0,0,0|2,0,0]=4 19886 B14R0.179 CCCCCC(C)SCCOCCCC 62a_200011218191_100000743108 [0,2,0,0,0,0|2,0,0]=4 19887 B14R0.179 CCCCCC(C)SCCOCCOC 62a_100000695917_200011218191 [0,2,0,0,0,0|2,0,0]=4 19888 B14R0.179 CCCCCC(C)SCCOCCOC 62a_200011218191_100000695917 [0,2,0,0,0,0|2,0,0]=4 19889 B14R0.179 CCCCCCC=CC(=O)CCCCO 1458a_200015324643_100000210776 [0,2,0,0,0,0|0,0,2]=4 19890 B14R0.179 CCCCCCCCC(=NNCCO)C 4a_100000210001_100011216694 [0,2,0,0,0,0|1,0,1]=4 19891 B14R0.179 CCCCCCCCC(=O)CC#CCO 1458a_100000210188_200000047223 [0,2,0,0,0,0|0,0,2]=4 19892 B14R0.179 CCCCCCCCC(=O)CCCC#N 1458a_100000075515_100000210759 [0,2,0,0,0,0|1,0,1]=4 19893 B14R0.179 CCCCCCCCC(=O)CCCC#N 1458a_100000210188_100000211468 [0,2,0,0,0,0|1,0,1]=4 19894 B14R0.179 CCCCCCCCC(=O)CCCCC 1458a_100000210188_100000210326 [0,2,0,0,0,0|1,0,0]=3 19895 B14R0.179 CCCCCCCCC(=O)CCCCC 1458a_100000212188_100000210759 [0,2,0,0,0,0|1,0,0]=3 19896 B14R0.179 CCCCCCCCC(=O)CCCCF 1458a_100000210188_100000729493 [0,2,0,0,0,0|1,0,0]=3 19897 B14R0.179 CCCCCCCCC(=O)CCCCO 1458a_100000210188_100000210776 [0,2,0,0,0,0|0,0,0]=2 19898 B14R0.179 CCCCCCCCC(=O)CCCCO 1458a_100000695505_100000210759 [0,2,0,0,0,0|0,0,0]=2 19899 B14R0.179 CCCCCCCCC(=O)CCCOC 1458a_100000210188_100000740836 [0,2,0,0,0,0|0,0,1]=3 19900 B14R0.179 CCCCCCCCC(=O)CCCOC 1458a_100000741012_100000210759 [0,2,0,0,0,0|0,0,1]=3 19901 B14R0.179 CCCCCCCCC(=O)CCCSC 1458a_100000173376_100000210759 [0,2,0,0,0,0|0,1,1]=4 19902 B14R0.179 CCCCCCCCC(=O)CCOCC 1458a_100000210188_100011215890 [0,2,0,0,0,0|1,0,1]=4 19903 B14R0.179 CCCCCCCCC(=O)CCOCC 1458a_100000749530_100000210759 [0,2,0,0,0,0|1,0,1]=4 19904 B14R0.179 CCCCCCCCC(=O)CCSCC 1458a_100000210188_100000757381 [0,2,0,0,0,0|1,0,1]=4 19905 B14R0.179 CCCCCCCCC(=O)CCSCC 1458a_100000230768_100000210759 [0,2,0,0,0,0|1,0,1]=4 19906 B14R0.179 CCCCCCCCC(=O)COCCC 1458a_100000745993_100000210759 [0,2,0,0,0,0|1,0,1]=4 19907 B14R0.179 CCCCCCCCC(=O)COCCO 1458a_100000708028_100000210759 [0,2,0,0,0,0|0,0,1]=3 19908 B14R0.179 CCCCCCCCC(=O)CSCCC 1458a_100000217233_100000210759 [0,2,0,0,0,0|1,0,1]=4 19909 B14R0.179 CCCCCCCCC(=O)NCCCC 11a_100000102301_100000210188 [0,2,0,0,0,0|1,0,1]=4 19910 B14R0.179 CCCCCCCCC(=O)NCCCC 1626a_100000102301_100000210188 [0,2,0,0,0,0|1,0,1]=4 19911 B14R0.179 CCCCCCCCC(=O)NCCCC 240690a_100000102301_100000210188 [0,2,0,0,0,0|1,0,1]=4 19912 B14R0.179 CCCCCCCCC(=O)NCCCC 527a_100000102301_100000210188 [0,2,0,0,0,0|1,0,1]=4 19913 B14R0.179 CCCCCCCCC(=O)NCCCF 11a_100015189416_100000210188 [0,2,0,0,0,0|1,0,1]=4 19914 B14R0.179 CCCCCCCCC(=O)NCCCF 1626a_100015189416_100000210188 [0,2,0,0,0,0|1,0,1]=4 19915 B14R0.179 CCCCCCCCC(=O)NCCCF 240690a_100015189416_100000210188 [0,2,0,0,0,0|1,0,1]=4 19916 B14R0.179 CCCCCCCCC(=O)NCCCF 527a_100015189416_100000210188 [0,2,0,0,0,0|1,0,1]=4 19917 B14R0.179 CCCCCCCCC(=O)NCCCO 240690a_100000182051_100000210188 [0,2,0,0,0,0|0,0,1]=3 19918 B14R0.179 CCCCCCCCC(=O)NCCCO 527a_100000182051_100000210188 [0,2,0,0,0,0|0,0,1]=3 19919 B14R0.179 CCCCCCCCC(=O)NCCOC 1626a_100000209980_100000210188 [0,2,0,0,0,0|1,0,1]=4 19920 B14R0.179 CCCCCCCCC(=O)NCCOC 240690a_100000209980_100000210188 [0,2,0,0,0,0|1,0,1]=4 19921 B14R0.179 CCCCCCCCC(=O)NCCOC 527a_100000209980_100000210188 [0,2,0,0,0,0|1,0,1]=4 19922 B14R0.179 CCCCCCCCC(=O)NNCCO 22a_100000210001_100000210188 [0,2,0,0,0,0|1,0,1]=4 19923 B14R0.179 CCCCCCCCC(C)CNCCC 270004a_100020643023_100011995885 [0,2,0,0,0,0|1,0,0]=3 19924 B14R0.179 CCCCCCCCC(C)CNCCO 270004a_100000210304_100011995885 [0,2,0,0,0,0|0,0,0]=2 19925 B14R0.179 CCCCCCCCC(C)COCC#N 7a_200012125181_100011215382 [0,2,0,0,0,0|1,0,1]=4 19926 B14R0.179 CCCCCCCCC(C)COCC=O 34a_200012125181_200009817547 [0,2,0,0,0,0|0,0,2]=4 19927 B14R0.179 CCCCCCCCC(C)COCC=O 7a_200012125181_200015260668 [0,2,0,0,0,0|0,0,2]=4 19928 B14R0.179 CCCCCCCCC(C)COCCC 34a_200012125181_100000210303 [0,2,0,0,0,0|1,0,0]=3 19929 B14R0.179 CCCCCCCCC(C)COCCC 7a_200012125181_100000210303 [0,2,0,0,0,0|1,0,0]=3 19930 B14R0.179 CCCCCCCCC(C)COCCF 34a_200012125181_100011217306 [0,2,0,0,0,0|1,0,0]=3 19931 B14R0.179 CCCCCCCCC(C)COCCF 7a_200012125181_100011217306 [0,2,0,0,0,0|1,0,0]=3 19932 B14R0.179 CCCCCCCCC(C)COCCO 34a_200012125181_100000211926 [0,2,0,0,0,0|0,0,0]=2 19933 B14R0.179 CCCCCCCCC(C)COCCO 7a_200012125181_100000211926 [0,2,0,0,0,0|0,0,0]=2 19934 B14R0.179 CCCCCCCCC(C)COCSC 34a_200012125181_100011218213 [0,2,0,0,0,0|1,1,0]=4 19935 B14R0.179 CCCCCCCCC(C)NCCC#N 270004a_100000720768_100011216694 [0,2,0,0,0,0|1,0,1]=4 19936 B14R0.179 CCCCCCCCC(C)NCCCC 270004a_100000102301_100011216694 [0,2,0,0,0,0|1,0,0]=3 19937 B14R0.179 CCCCCCCCC(C)NCCCF 270004a_100015189416_100011216694 [0,2,0,0,0,0|1,0,0]=3 19938 B14R0.179 CCCCCCCCC(C)NCCCO 270004a_100000182051_100011216694 [0,2,0,0,0,0|0,0,0]=2 19939 B14R0.179 CCCCCCCCC(C)NCCOC 270004a_100000209980_100011216694 [0,2,0,0,0,0|1,0,0]=3 19940 B14R0.179 CCCCCCCCC(C)NCCSC 270004a_100020590264_100011216694 [0,2,0,0,0,0|1,1,0]=4 19941 B14R0.179 CCCCCCCCC(C)OCCC#N 7a_100000210740_100000184422 [0,2,0,0,0,0|1,0,1]=4 19942 B14R0.179 CCCCCCCCC(C)OCCCC 34a_100000210740_100000210210 [0,2,0,0,0,0|1,0,0]=3 19943 B14R0.179 CCCCCCCCC(C)OCCCC 7a_100000210740_100000210211 [0,2,0,0,0,0|1,0,0]=3 19944 B14R0.179 CCCCCCCCC(C)OCCCF 34a_100000210740_100011934791 [0,2,0,0,0,0|1,0,0]=3 19945 B14R0.179 CCCCCCCCC(C)OCCCF 7a_100000210740_100011934791 [0,2,0,0,0,0|1,0,0]=3 19946 B14R0.179 CCCCCCCCC(C)OCCCO 34a_100000210740_100000230001 [0,2,0,0,0,0|0,0,0]=2 19947 B14R0.179 CCCCCCCCC(C)OCCCO 7a_100000210740_100011215043 [0,2,0,0,0,0|0,0,0]=2 19948 B14R0.179 CCCCCCCCC(C)OCCOC 34a_100000210740_100011201679 [0,2,0,0,0,0|1,0,0]=3 19949 B14R0.179 CCCCCCCCC(C)OCCOC 7a_100000210740_100000233755 [0,2,0,0,0,0|1,0,0]=3 19950 B14R0.179 CCCCCCCCC(C)OCCSC 34a_100000210740_100000212216 [0,2,0,0,0,0|1,1,0]=4 19951 B14R0.179 CCCCCCCCC(C)OCCSC 7a_100000210740_100000212216 [0,2,0,0,0,0|1,1,0]=4 19952 B14R0.179 CCCCCCCCN(C)CC#CCO 2230a_100000207567_200000047223 [0,2,0,0,0,0|0,0,2]=4 19953 B14R0.179 CCCCCCCCN(C)CCCC#N 2230a_100000207567_100000687738 [0,2,0,0,0,0|1,0,1]=4 19954 B14R0.179 CCCCCCCCN(C)CCCC#N 269982a_100000207567_100000687738 [0,2,0,0,0,0|1,0,1]=4 19955 B14R0.179 CCCCCCCCN(C)CCCC=O 2230a_100000207567_200011292268 [0,2,0,0,0,0|0,0,2]=4 19956 B14R0.179 CCCCCCCCN(C)CCCC=O 269982a_100000207567_200011292268 [0,2,0,0,0,0|0,0,2]=4 19957 B14R0.179 CCCCCCCCN(C)CCCCC 2230a_100000207567_100000210326 [0,2,0,0,0,0|1,0,0]=3 19958 B14R0.179 CCCCCCCCN(C)CCCCC 2230a_100000223495_100000210759 [0,2,0,0,0,0|1,0,0]=3 19959 B14R0.179 CCCCCCCCN(C)CCCCC 2230a_200000207366_200000210301 [0,2,0,0,0,0|1,0,0]=3 19960 B14R0.179 CCCCCCCCN(C)CCCCC 269982a_100000207567_100000210215 [0,2,0,0,0,0|1,0,0]=3 19961 B14R0.179 CCCCCCCCN(C)CCCCC 269982a_100000223495_100000210759 [0,2,0,0,0,0|1,0,0]=3 19962 B14R0.179 CCCCCCCCN(C)CCCCC 269982a_200000207366_200000210301 [0,2,0,0,0,0|1,0,0]=3 19963 B14R0.179 CCCCCCCCN(C)CCCCF 2230a_100000207567_100000729493 [0,2,0,0,0,0|1,0,0]=3 19964 B14R0.179 CCCCCCCCN(C)CCCCF 269982a_100000207567_100000729493 [0,2,0,0,0,0|1,0,0]=3 19965 B14R0.179 CCCCCCCCN(C)CCCCO 2230a_100000207567_100000210776 [0,2,0,0,0,0|0,0,0]=2 19966 B14R0.179 CCCCCCCCN(C)CCCCO 2230a_100000717598_100000210759 [0,2,0,0,0,0|0,0,0]=2 19967 B14R0.179 CCCCCCCCN(C)CCCCO 269982a_100000207567_100000210776 [0,2,0,0,0,0|0,0,0]=2 19968 B14R0.179 CCCCCCCCN(C)CCCCO 269982a_100000717598_100000210759 [0,2,0,0,0,0|0,0,0]=2 19969 B14R0.179 CCCCCCCCN(C)CCCOC 2230a_100000207567_100000740836 [0,2,0,0,0,0|1,0,0]=3 19970 B14R0.179 CCCCCCCCN(C)CCCOC 2230a_100000224831_100000210759 [0,2,0,0,0,0|1,0,0]=3 19971 B14R0.179 CCCCCCCCN(C)CCCOC 269982a_100000207567_100000740836 [0,2,0,0,0,0|1,0,0]=3 19972 B14R0.179 CCCCCCCCN(C)CCCOC 269982a_100000224831_100000210759 [0,2,0,0,0,0|1,0,0]=3 19973 B14R0.179 CCCCCCCCN(C)CCOCC 2230a_100000207567_100011215890 [0,2,0,0,0,0|2,0,0]=4 19974 B14R0.179 CCCCCCCCN(C)CCOCC 269982a_100000207567_100011215890 [0,2,0,0,0,0|2,0,0]=4 19975 B14R0.179 CCCCCCCCN(C)CCSCC 2230a_100000207567_100000757381 [0,2,0,0,0,0|2,0,0]=4 19976 B14R0.179 CCCCCCCCN(C)CCSCC 269982a_100000207567_100000757381 [0,2,0,0,0,0|2,0,0]=4 19977 B14R0.179 CCCCCCCCN([13CH3])CCCCC 2230a_200000207366_200025704644 [0,2,0,0,0,0|1,0,0]=3 19978 B14R0.179 CCCCCCCCN([13CH3])CCCCC 269982a_200000207366_200025704644 [0,2,0,0,0,0|1,0,0]=3 19979 B14R0.179 CCCCCCCNC(=O)CCCCC 11a_100000229938_100000212188 [0,2,0,0,0,0|1,0,1]=4 19980 B14R0.179 CCCCCCCNC(=O)CCCCC 1626a_100000229938_100000212188 [0,2,0,0,0,0|1,0,1]=4 19981 B14R0.179 CCCCCCCNC(=O)CCCCC 240690a_100000229938_100000212188 [0,2,0,0,0,0|1,0,1]=4 19982 B14R0.179 CCCCCCCNC(=O)CCCCC 527a_100000229938_100000212188 [0,2,0,0,0,0|1,0,1]=4 19983 B14R0.179 CCCCCCCNC(=O)CCCCO 1626a_100000229938_100000695505 [0,2,0,0,0,0|0,0,1]=3 19984 B14R0.179 CCCCCCCNC(=O)CCCOC 11a_100000229938_100000741012 [0,2,0,0,0,0|1,0,1]=4 19985 B14R0.179 CCCCCCCNC(=O)CCCOC 1626a_100000229938_100000741012 [0,2,0,0,0,0|1,0,1]=4 19986 B14R0.179 CCCCCCCNC(=O)CCCOC 240690a_100000229938_100000741012 [0,2,0,0,0,0|1,0,1]=4 19987 B14R0.179 CCCCCCCNC(=O)CCCOC 527a_100000229938_100000741012 [0,2,0,0,0,0|1,0,1]=4 19988 B14R0.179 CCCCCCCNC(=O)COCCO 1626a_100000229938_100000708028 [0,2,0,0,0,0|1,0,1]=4 19989 B14R0.179 CCCCCCCNC(=O)COCCO 240690a_100000229938_100000708028 [0,2,0,0,0,0|1,0,1]=4 19990 B14R0.179 CCCCCCCNC(=O)NCCCO 2708a_100000229938_100000182051 [0,2,0,0,0,0|1,0,1]=4 19991 B14R0.179 CCCCCCCNC(=O)NCCCO 273464a_100000182051_100000229938 [0,2,0,0,0,0|1,0,1]=4 19992 B14R0.179 CCCCCCCNC(=O)NCCCO 273464a_100000229938_100000182051 [0,2,0,0,0,0|1,0,1]=4 19993 B14R0.179 CCCCCCCNC(=O)NCCCO 512a_100000229938_100000182051 [0,2,0,0,0,0|1,0,1]=4 19994 B14R0.179 CCCCCCCNC(C)CCCC#N 270004a_100000229938_200000032708 [0,2,0,0,0,0|1,0,1]=4 19995 B14R0.179 CCCCCCCNC(C)CCCCC 2230a_100000211957_100000210681 [0,2,0,0,0,0|1,0,0]=3 19996 B14R0.179 CCCCCCCNC(C)CCCCC 2230a_100000229938_200011218191 [0,2,0,0,0,0|1,0,0]=3 19997 B14R0.179 CCCCCCCNC(C)CCCCC 270004a_100000229938_100000211708 [0,2,0,0,0,0|1,0,0]=3 19998 B14R0.179 CCCCCCCNC(C)CCCSC 270004a_100000229938_100011399439 [0,2,0,0,0,0|1,1,0]=4 19999 B14R0.179 CCCCCCCNC(C)CCOCC 270004a_100000229938_200011216536 [0,2,0,0,0,0|2,0,0]=4 20000 B14R0.179 CCCCCCCNC(C)CSCCC 270004a_100000229938_100011343953 [0,2,0,0,0,0|2,0,0]=4 20001 B14R0.179 CCCCCCCOC(C)CCCCC 34a_100000210272_200011218191 [0,2,0,0,0,0|1,0,0]=3 20002 B14R0.179 CCCCCCCOC(C)CCCCC 34a_100011215632_100000210614 [0,2,0,0,0,0|1,0,0]=3 20003 B14R0.179 CCCCCCCOC(C)CCCCC 7a_100000210272_200011218191 [0,2,0,0,0,0|1,0,0]=3 20004 B14R0.179 CCCCCCCOC(C)CCCCC 7a_100011215632_100000210614 [0,2,0,0,0,0|1,0,0]=3 20005 B14R0.179 CCCCCCCOC(C)CCCOC 34a_200011539412_100000210614 [0,2,0,0,0,0|1,0,0]=3 20006 B14R0.179 CCCCCCCOC(C)CCCOC 7a_200011539412_100000210614 [0,2,0,0,0,0|1,0,0]=3 20007 B14R0.179 CCCCCCCSC(C)CCCCC 62a_100000210614_200011218191 [0,2,0,0,0,0|1,0,0]=3 20008 B14R0.179 CCCCCCCSC(C)CCCCC 62a_200011218191_100000210316 [0,2,0,0,0,0|1,0,0]=3 20009 B14R0.179 CCCCCCNCC(=O)CCCCC 2230a_100000210581_200012276598 [0,2,0,0,0,0|1,0,1]=4 20010 B14R0.179 CCCCCCOCC(=O)CCCCC 34a_100000210259_200012276598 [0,2,0,0,0,0|1,0,1]=4 20011 B14R0.179 CCCCCCOCC(=O)CCCCC 7a_100000210259_200012276598 [0,2,0,0,0,0|1,0,1]=4 20012 B14R0.179 CCCCCCOC[C@@H](N)CCCCN 34a_100016993712_100000210314 [0,2,0,0,0,0|1,0,0]=3 20013 B14R0.179 CCCCCCSCC(=O)CCCCC 62a_100000210314_200012276598 [0,2,0,0,0,0|1,0,1]=4 20014 B14R0.179 CCCCCCSCC(=O)CCCCC 62a_200012276598_100000210757 [0,2,0,0,0,0|1,0,1]=4 20015 B14R0.179 CCCCCN(C)CCCCCCC#N 2230a_100000223495_100009813337 [0,2,0,0,0,0|1,0,1]=4 20016 B14R0.179 CCCCCN(C)CCCCCCC#N 269982a_100000223495_100009813337 [0,2,0,0,0,0|1,0,1]=4 20017 B14R0.179 CCCCCN(C)CCCCCCCO 2230a_100000223495_100000760002 [0,2,0,0,0,0|0,0,0]=2 20018 B14R0.179 CCCCCN(C)CCCCCCCO 269982a_100000223495_100000760002 [0,2,0,0,0,0|0,0,0]=2 20019 B14R0.179 CCCCCN(C)CCCCCCOC 2230a_100000223495_100011998445 [0,2,0,0,0,0|1,0,0]=3 20020 B14R0.179 CCCCCN(C)CCCCCCOC 269982a_100000223495_100011998445 [0,2,0,0,0,0|1,0,0]=3 20021 B14R0.179 CCCCCN(C)CCCOCCOC 2230a_100000223495_100011216529 [0,2,0,0,0,0|2,0,0]=4 20022 B14R0.179 CCCCCN(C)CCCOCCOC 269982a_100000223495_100011216529 [0,2,0,0,0,0|2,0,0]=4 20023 B14R0.179 CCCCNC(=O)CCCCCCCO 240690a_100000102301_100011219782 [0,2,0,0,0,0|0,0,1]=3 20024 B14R0.179 CCCCNC(=O)CNCCCCCO 2230a_100000762737_100000182744 [0,2,0,0,0,0|1,0,1]=4 20025 B14R0.179 CCCCNC(=O)CNCCCCCO 34a_100000762737_100000182744 [0,2,0,0,0,0|1,0,1]=4 20026 B14R0.179 CCCCNC(=O)CSCCCCCO 62a_100000182744_100000746330 [0,2,0,0,0,0|1,0,1]=4 20027 B14R0.179 CCCCNC(=O)CSCCCCCO 62a_100000746330_100000182744 [0,2,0,0,0,0|1,0,1]=4 20028 B14R0.179 CCCCNC(=O)NCCCCCCO 2708a_100000102301_100000686447 [0,2,0,0,0,0|1,0,1]=4 20029 B14R0.179 CCCCNC(=O)NCCCCCCO 273464a_100000102301_100000686447 [0,2,0,0,0,0|1,0,1]=4 20030 B14R0.179 CCCCNC(=O)NCCCCCCO 273464a_100000686447_100000102301 [0,2,0,0,0,0|1,0,1]=4 20031 B14R0.179 CCCCNC(=O)NCCCCCCO 512a_100000102301_100000686447 [0,2,0,0,0,0|1,0,1]=4 20032 B14R0.179 CCCCNC(=O)NCCCCCCO 512a_100000686447_100000102301 [0,2,0,0,0,0|1,0,1]=4 20033 B14R0.179 CCCCOC(=O)CNCCCCCO 2230a_100000762737_100000211628 [0,2,0,0,0,0|1,0,1]=4 20034 B14R0.179 CCCCOC(=O)CNCCCCCO 34a_100000762737_100000211628 [0,2,0,0,0,0|1,0,1]=4 20035 B14R0.179 CCCCOC(=O)CSCCCCCO 62a_100000211628_100000746330 [0,2,0,0,0,0|1,0,1]=4 20036 B14R0.179 CCCCOC(=O)CSCCCCCO 62a_100000746330_100000211628 [0,2,0,0,0,0|1,0,1]=4 20037 B14R0.179 CCCCOCCOC(C)CCCOC 34a_200011539412_100000743108 [0,2,0,0,0,0|2,0,0]=4 20038 B14R0.179 CCCCOCCOC(C)CCCOC 7a_200011539412_100000743108 [0,2,0,0,0,0|2,0,0]=4 20039 B14R0.179 CCCCOCOC[C@@H](N)CCCCN 34a_100016993712_100011995733 [0,2,0,0,0,0|2,0,0]=4 20040 B14R0.179 CCCCSCCNC(=O)CCCCO 1626a_100025743550_100000695505 [0,2,0,0,0,0|1,0,1]=4 20041 B14R0.179 CCCNNC(=O)CCCCCCCO 22a_100000740057_100011219782 [0,2,0,0,0,0|1,0,1]=4 20042 B14R0.179 CCCOCC(=O)CCCCCCCO 1458a_100000745993_100000760002 [0,2,0,0,0,0|0,0,1]=3 20043 B14R0.179 CCCOCC(=O)CCCCCCOC 1458a_100000745993_100011998445 [0,2,0,0,0,0|1,0,1]=4 20044 B14R0.179 CCCOCC(=O)NCCCCCCO 240690a_100000686447_100000745993 [0,2,0,0,0,0|1,0,1]=4 20045 B14R0.179 CCCOCC(=O)NCCCCCCO 527a_100000686447_100000745993 [0,2,0,0,0,0|1,0,1]=4 20046 B14R0.179 CCCOCCCNC(=O)CCCCO 1626a_100011217757_100000695505 [0,2,0,0,0,0|1,0,1]=4 20047 B14R0.179 CCCOCCOC[C@@H](N)CCCCN 34a_100016993712_100011215938 [0,2,0,0,0,0|2,0,0]=4 20048 B14R0.179 CCCSCC(=O)CCCCCCCO 1458a_100000217233_100000760002 [0,2,0,0,0,0|0,0,1]=3 20049 B14R0.179 CCCSCC(=O)CCCCCCOC 1458a_100000217233_100011998445 [0,2,0,0,0,0|1,0,1]=4 20050 B14R0.179 CCCSCC(=O)NCCCCCCO 240690a_100000686447_100000217233 [0,2,0,0,0,0|1,0,1]=4 20051 B14R0.179 CCCSCC(=O)NCCCCCCO 527a_100000686447_100000217233 [0,2,0,0,0,0|1,0,1]=4 20052 B14R0.179 CCCSCC(C)NCCCCCCO 270004a_100000686447_100011343953 [0,2,0,0,0,0|1,0,0]=3 20053 B14R0.179 CCCSCC(C)NCCCCCOC 270004a_100000747528_100011343953 [0,2,0,0,0,0|2,0,0]=4 20054 B14R0.179 CCOCCC(=O)CCCCCCCO 1458a_100000749530_100000760002 [0,2,0,0,0,0|0,0,1]=3 20055 B14R0.179 CCOCCC(=O)CCCCCCCO 1458a_100011219782_100011215890 [0,2,0,0,0,0|0,0,1]=3 20056 B14R0.179 CCOCCC(=O)CCCCCCOC 1458a_100000749530_100011998445 [0,2,0,0,0,0|1,0,1]=4 20057 B14R0.179 CCOCCC(=O)NCCCCCCO 240690a_100000686447_100000749530 [0,2,0,0,0,0|1,0,1]=4 20058 B14R0.179 CCOCCC(=O)NCCCCCCO 527a_100000686447_100000749530 [0,2,0,0,0,0|1,0,1]=4 20059 B14R0.179 CCOCCC(C)NCCCCCCO 270004a_100000686447_200011216536 [0,2,0,0,0,0|1,0,0]=3 20060 B14R0.179 CCOCCC(C)NCCCCCOC 270004a_100000747528_200011216536 [0,2,0,0,0,0|2,0,0]=4 20061 B14R0.179 CCOCCCOC[C@@H](N)CCCCN 34a_100016993712_100012232248 [0,2,0,0,0,0|2,0,0]=4 20062 B14R0.179 CCOCCOCCC(=O)CCCCO 1458a_100000695505_100011211534 [0,2,0,0,0,0|1,0,1]=4 20063 B14R0.179 CCOCCOCCN(C)CCCCO 2230a_100000717598_100011211534 [0,2,0,0,0,0|2,0,0]=4 20064 B14R0.179 CCOCCOCCN(C)CCCCO 269982a_100000717598_100011211534 [0,2,0,0,0,0|2,0,0]=4 20065 B14R0.179 CCSCCC(=O)CCCCCCCO 1458a_100000230768_100000760002 [0,2,0,0,0,0|0,0,1]=3 20066 B14R0.179 CCSCCC(=O)CCCCCCCO 1458a_100011219782_100000757381 [0,2,0,0,0,0|0,0,1]=3 20067 B14R0.179 CCSCCC(=O)CCCCCCOC 1458a_100000230768_100011998445 [0,2,0,0,0,0|1,0,1]=4 20068 B14R0.179 CCSCCC(=O)NCCCCCCO 240690a_100000686447_100000230768 [0,2,0,0,0,0|1,0,1]=4 20069 B14R0.179 CCSCCC(=O)NCCCCCCO 527a_100000686447_100000230768 [0,2,0,0,0,0|1,0,1]=4 20070 B14R0.179 CN(CCCCO)CCCCCCC#N 2230a_100000717598_100009813337 [0,2,0,0,0,0|1,0,1]=4 20071 B14R0.179 CN(CCCCO)CCCCCCC#N 269982a_100000717598_100009813337 [0,2,0,0,0,0|1,0,1]=4 20072 B14R0.179 CN(CCCCO)CCCCCCCO 2230a_100000717598_100000760002 [0,2,0,0,0,0|1,0,0]=3 20073 B14R0.179 CN(CCCCO)CCCCCCCO 269982a_100000717598_100000760002 [0,2,0,0,0,0|1,0,0]=3 20074 B14R0.179 COCCCC(=O)CCCCCCCO 1458a_100000741012_100000760002 [0,2,0,0,0,0|0,0,1]=3 20075 B14R0.179 COCCCC(=O)CCCCCCCO 1458a_100011219782_100000740836 [0,2,0,0,0,0|0,0,1]=3 20076 B14R0.179 COCCCC(=O)NCCCCCCO 240690a_100000686447_100000741012 [0,2,0,0,0,0|1,0,1]=4 20077 B14R0.179 COCCCC(=O)NCCCCCCO 527a_100000686447_100000741012 [0,2,0,0,0,0|1,0,1]=4 20078 B14R0.179 COCCCC(C)OCCCCCCF 34a_200011539412_100015922095 [0,2,0,0,0,0|2,0,0]=4 20079 B14R0.179 COCCCC(C)OCCCCCCF 7a_200011539412_100015922095 [0,2,0,0,0,0|2,0,0]=4 20080 B14R0.179 COCCCC(C)OCCCCCCO 34a_200011539412_100000766143 [0,2,0,0,0,0|1,0,0]=3 20081 B14R0.179 COCCCC(C)OCCCCCCO 7a_200011539412_100000766143 [0,2,0,0,0,0|1,0,0]=3 20082 B14R0.179 COCCCCCCC(=O)CCCCO 1458a_100000695505_100011998445 [0,2,0,0,0,0|0,0,1]=3 20083 B14R0.179 COCCCCCCC(=O)CCCOC 1458a_100000741012_100011998445 [0,2,0,0,0,0|1,0,1]=4 20084 B14R0.179 COCCCCCCC(=O)CCCSC 1458a_100000173376_100011998445 [0,2,0,0,0,0|1,0,1]=4 20085 B14R0.179 COCCCCCCC(=O)COCCO 1458a_100000708028_100011998445 [0,2,0,0,0,0|1,0,1]=4 20086 B14R0.179 COCCCCCCN(C)CCCCO 2230a_100000717598_100011998445 [0,2,0,0,0,0|1,0,0]=3 20087 B14R0.179 COCCCCCCN(C)CCCCO 269982a_100000717598_100011998445 [0,2,0,0,0,0|1,0,0]=3 20088 B14R0.179 COCCCCCCN(C)CCCOC 2230a_100000224831_100011998445 [0,2,0,0,0,0|2,0,0]=4 20089 B14R0.179 COCCCCCCN(C)CCCOC 269982a_100000224831_100011998445 [0,2,0,0,0,0|2,0,0]=4 20090 B14R0.179 COCCCCCNC(=O)CCCCO 1626a_100000747528_100000695505 [0,2,0,0,0,0|1,0,1]=4 20091 B14R0.179 COCCCCCNC(C)CCCSC 270004a_100000747528_100011399439 [0,2,0,0,0,0|2,0,0]=4 20092 B14R0.179 COCCCCOC[C@@H](N)CCCCN 34a_100016993712_100000755781 [0,2,0,0,0,0|2,0,0]=4 20093 B14R0.179 COCCCN(C)CCCCCCCO 2230a_100000224831_100000760002 [0,2,0,0,0,0|1,0,0]=3 20094 B14R0.179 COCCCN(C)CCCCCCCO 269982a_100000224831_100000760002 [0,2,0,0,0,0|1,0,0]=3 20095 B14R0.179 COCCNC(=O)CCCCCCCO 240690a_100000209980_100011219782 [0,2,0,0,0,0|1,0,1]=4 20096 B14R0.179 COCCOCCCC(=O)CCCCO 1458a_100000695505_100011216529 [0,2,0,0,0,0|1,0,1]=4 20097 B14R0.179 COCCOCCCN(C)CCCCO 2230a_100000717598_100011216529 [0,2,0,0,0,0|2,0,0]=4 20098 B14R0.179 COCCOCCCN(C)CCCCO 269982a_100000717598_100011216529 [0,2,0,0,0,0|2,0,0]=4 20099 B14R0.179 CSCCCC(=O)CCCCCCCO 1458a_100000173376_100000760002 [0,2,0,0,0,0|0,0,1]=3 20100 B14R0.179 CSCCCC(=O)NCCCCCCO 240690a_100000686447_100000173376 [0,2,0,0,0,0|1,0,1]=4 20101 B14R0.179 CSCCCC(=O)NCCCCCCO 527a_100000686447_100000173376 [0,2,0,0,0,0|1,0,1]=4 20102 B14R0.179 CSCCCC(C)NCCCCCCO 270004a_100000686447_100011399439 [0,2,0,0,0,0|1,0,0]=3 20103 B14R0.179 CSCCNC(=O)CCCCCCCO 240690a_100020590264_100011219782 [0,2,0,0,0,0|1,0,1]=4 20104 B14R0.179 N#CCCCC(=O)CCCCCCCO 1458a_100000075515_100000760002 [0,2,0,0,0,0|0,0,2]=4 20105 B14R0.179 N#CCCCC(=O)CCCCCCCO 1458a_100011219782_100000211468 [0,2,0,0,0,0|0,0,2]=4 20106 B14R0.179 N#CCCCCCCC(=O)CCCCO 1458a_100000695505_100009813337 [0,2,0,0,0,0|0,0,2]=4 20107 B14R0.179 NCCCC[C@H](N)COCCCCCF 34a_100016993712_100000729378 [0,2,0,0,0,0|2,0,0]=4 20108 B14R0.179 NCCCC[C@H](N)COCCCCCO 34a_100016993712_100000746330 [0,2,0,0,0,0|1,0,0]=3 20109 B14R0.179 NCCCC[C@H](N)COCCOCCO 34a_100016993712_100000692535 [0,2,0,0,0,0|2,0,0]=4 20110 B14R0.179 O=C(CCCCCCCO)COCCO 1458a_100000708028_100000760002 [0,2,0,0,0,0|1,0,1]=4 20111 B14R0.179 O=C(CCCCCCCO)NCCCF 240690a_100015189416_100011219782 [0,2,0,0,0,0|1,0,1]=4 20112 B14R0.179 O=C(CCCCCCCO)NCCCO 240690a_100000182051_100011219782 [0,2,0,0,0,0|1,0,1]=4 20113 B14R0.179 O=C(CCCCF)CCCCCCCO 1458a_100011219782_100000729493 [0,2,0,0,0,0|0,0,1]=3 20114 B14R0.179 O=C(CCCCO)CCCCCCCO 1458a_100000695505_100000760002 [0,2,0,0,0,0|0,0,1]=3 20115 B14R0.179 O=C(CCCCO)CCCCCCCO 1458a_100011219782_100000210776 [0,2,0,0,0,0|0,0,1]=3 20116 B14R0.203 CCCCC(C)NC(=O)CCCCCO 240690a_100000126638_100102619762 [0,2,0,0,0,0|1,0,1]=4 20117 B14R0.203 CCCCCCC(C)NC(C)CCCC 2230a_100000126638_100011215978 [0,2,0,0,0,0|2,0,0]=4 20118 B14R0.203 CCCCCCC(C)NC(C)CCCC 2230a_100000210919_200011215066 [0,2,0,0,0,0|2,0,0]=4 20119 B14R0.203 CCCCCCC(C)NC(C)CCCC 270004a_100000126638_100000210826 [0,2,0,0,0,0|2,0,0]=4 20120 B14R0.203 CCCCCCC(C)NC(C)CCCC 270004a_100000210919_100000210087 [0,2,0,0,0,0|2,0,0]=4 20121 B14R0.203 CCCCCCC(C)NC(C)CCCC 34a_100000210919_200011215066 [0,2,0,0,0,0|2,0,0]=4 20122 B14R0.203 CCCCCCC(C)OC(C)CCCC 34a_100000210265_200011215066 [0,2,0,0,0,0|2,0,0]=4 20123 B14R0.203 CCCCCCC(C)OC(C)CCCC 34a_100000687866_100011215978 [0,2,0,0,0,0|2,0,0]=4 20124 B14R0.203 CCCCCCC(C)OC(C)CCCC 7a_100000210265_200011215066 [0,2,0,0,0,0|2,0,0]=4 20125 B14R0.203 CCCCCCC(C)OC(C)CCCC 7a_100000687866_100011215978 [0,2,0,0,0,0|2,0,0]=4 20126 B14R0.203 CCCCCCC(C)OC(C)CCCCl 34a_200000718107_100011215978 [0,2,0,0,0,0|2,0,0]=4 20127 B14R0.203 CCCCCCC(C)OC(C)CCCCl 7a_200000718107_100011215978 [0,2,0,0,0,0|2,0,0]=4 20128 B14R0.203 CCCCCCC(C)SC(C)CCCC 62a_100011215978_200011215066 [0,2,0,0,0,0|2,0,0]=4 20129 B14R0.203 CCCCCCC(C)SC(C)CCCC 62a_200011215066_100011215978 [0,2,0,0,0,0|2,0,0]=4 20130 B14R0.529 CCCCC(C)CCC(=O)CCCCF 1458a_100000033779_100000729493 [0,2,0,0,0,0|1,0,1]=4 20131 B14R0.529 CCCCC(C)CCC(=O)CCCCO 1458a_100000033779_100000210776 [0,2,0,0,0,0|0,0,1]=3 20132 B14R0.529 CCCCC(C)CCC(=O)NCCCO 240690a_100000182051_100000033779 [0,2,0,0,0,0|1,0,1]=4 20133 B14R0.529 CCCCC(C)CCC(=O)NCCCO 527a_100000182051_100000033779 [0,2,0,0,0,0|1,0,1]=4 20134 B14R0.529 CCCCC(C)OC[C@@H](N)CCCCN 34a_100016993712_200011215066 [0,2,0,0,0,0|2,0,0]=4 20135 B14R0.529 CCCCCC(=O)CCC(C)CCCC 1458a_100000033779_100000210326 [0,2,0,0,0,0|1,0,1]=4 20136 B14R0.529 CCCCCC(=O)NC[C@H](C)CCCO 240690a_100160569302_100000212188 [0,2,0,0,0,0|1,0,1]=4 20137 B14R0.529 CCCCCC(=O)NC[C@H](C)CCCO 527a_100160569302_100000212188 [0,2,0,0,0,0|1,0,1]=4 20138 B14R0.529 CCCCCC(C)CCC(=O)CCCC 1458a_100000034243_100000210211 [0,2,0,0,0,0|1,0,1]=4 20139 B14R0.529 CCCCCC(C)CCC(=O)CCCF 1458a_100000034243_100011934791 [0,2,0,0,0,0|1,0,1]=4 20140 B14R0.529 CCCCCC(C)CCC(=O)CCCO 1458a_100000034243_100011215043 [0,2,0,0,0,0|0,0,1]=3 20141 B14R0.529 CCCCCC(C)CCC(=O)NCCO 240690a_100000210304_100000034243 [0,2,0,0,0,0|1,0,1]=4 20142 B14R0.529 CCCCCC(C)CCC(=O)NCCO 527a_100000210304_100000034243 [0,2,0,0,0,0|1,0,1]=4 20143 B14R0.529 CCCCCC(C)NC[C@H](C)CCCO 2230a_100160569302_200011218191 [0,2,0,0,0,0|1,0,0]=3 20144 B14R0.529 CCCCCC(C)NC[C@H](C)CCCO 270004a_100160569302_100000211708 [0,2,0,0,0,0|1,0,0]=3 20145 B14R0.529 CCCCCC(C)NC[C@H](C)CCCO 34a_100160569302_200011218191 [0,2,0,0,0,0|1,0,0]=3 20146 B14R0.529 CCCCCC(C)OCC(C)CCCC 34a_100011995851_200011218191 [0,2,0,0,0,0|2,0,0]=4 20147 B14R0.529 CCCCCC(C)OCC(C)CCCC 7a_100011995851_200011218191 [0,2,0,0,0,0|2,0,0]=4 20148 B14R0.529 CCCCCC(C)OC[C@@H](N)CCCC 34a_100011934283_200011218191 [0,2,0,0,0,0|2,0,0]=4 20149 B14R0.529 CCCCCN(C)CCC(=O)CCCO 1458a_100016987678_100011215043 [0,2,0,0,0,0|1,0,1]=4 20150 B14R0.529 CCCSCC(C)NC[C@H](C)CCCO 270004a_100160569302_100011343953 [0,2,0,0,0,0|2,0,0]=4 20151 B14R0.529 CCOCCC(C)NC[C@H](C)CCCO 270004a_100160569302_200011216536 [0,2,0,0,0,0|2,0,0]=4 20152 B14R0.529 CSCCCC(C)NC[C@H](C)CCCO 270004a_100160569302_100011399439 [0,2,0,0,0,0|2,0,0]=4 20153 B14R0.1095 CCCCC(C)C(=O)CCCCCCF 1458a_100000725509_100015922095 [0,2,0,0,0,0|1,0,1]=4 20154 B14R0.1095 CCCCC(C)C(=O)CCCCCCO 1458a_100000725509_100000766143 [0,2,0,0,0,0|0,0,1]=3 20155 B14R0.1095 CCCCC(C)C(=O)CCCCCCO 1458a_100011996774_200011215066 [0,2,0,0,0,0|0,0,1]=3 20156 B14R0.1095 CCCCC(C)C(=O)NCCCCCO 240690a_100000762737_100000725509 [0,2,0,0,0,0|1,0,1]=4 20157 B14R0.1095 CCCCC(O)C(=O)CCCCCCF 1458a_100000720857_100015922095 [0,2,0,0,0,0|1,0,1]=4 20158 B14R0.1095 CCCCC(O)C(=O)CCCCCCO 1458a_100000720857_100000766143 [0,2,0,0,0,0|0,0,1]=3 20159 B14R0.1095 CCCCC(O)C(=O)NCCCCCO 240690a_100000762737_100000720857 [0,2,0,0,0,0|1,0,1]=4 20160 B14R0.1095 CCCCCCCC(=O)C(C)CCCC 1458a_100000211969_200011215066 [0,2,0,0,0,0|1,0,1]=4 20161 B14R0.1095 CCCCCCCC(=O)C(C)CCCC 1458a_100000725509_100000210614 [0,2,0,0,0,0|1,0,1]=4 20162 B14R0.1095 CCCCCCCC(=O)C(O)CCCC 1458a_100000720857_100000210614 [0,2,0,0,0,0|1,0,1]=4 20163 B14R0.1095 CCCCCCCC(=O)N(C)CCCO 240690a_100000213112_100000211969 [0,2,0,0,0,0|1,0,1]=4 20164 B14R0.1095 CCCCCCCC(=O)N(C)CCCO 527a_100000213112_100000211969 [0,2,0,0,0,0|1,0,1]=4 20165 B14R0.1095 CCCCCCCC(C)C(=O)CCCC 1458a_100000210183_200011218727 [0,2,0,0,0,0|1,0,1]=4 20166 B14R0.1095 CCCCCCCC(C)N(C)CCCC 2230a_100000207549_200011218727 [0,2,0,0,0,0|2,0,0]=4 20167 B14R0.1095 CCCCCCCC(C)N(C)CCCC 269982a_100000207549_200011218727 [0,2,0,0,0,0|2,0,0]=4 20168 B14R0.1095 CCCCCCCC(C)N(C)CCCC 270004a_100000207549_100000210596 [0,2,0,0,0,0|2,0,0]=4 20169 B14R0.1095 CCCCCCCC(C)N(C)CCCO 2230a_100000213112_200011218727 [0,2,0,0,0,0|1,0,0]=3 20170 B14R0.1095 CCCCCCCC(C)N(C)CCCO 269982a_100000213112_200011218727 [0,2,0,0,0,0|1,0,0]=3 20171 B14R0.1095 CCCCCCCC(C)N(C)CCCO 270004a_100000213112_100000210596 [0,2,0,0,0,0|1,0,0]=3 20172 B14R0.1095 CCCCCCCN(C)C(C)CCCC 2230a_100000228206_200011215066 [0,2,0,0,0,0|2,0,0]=4 20173 B14R0.1095 CCCCCCCN(C)C(C)CCCC 269982a_100000228206_200011215066 [0,2,0,0,0,0|2,0,0]=4 20174 B14R0.1095 CCCCCCCN(C)C(C)CCCC 270004a_100000228206_100000210087 [0,2,0,0,0,0|2,0,0]=4 20175 B14R0.1095 CCCCN(C)C(=O)CCCCCCO 240690a_100000207549_100011996774 [0,2,0,0,0,0|1,0,1]=4 20176 B14R0.1095 CSCCC(O)C(=O)CCCCCCO 1458a_100000685904_100000766143 [0,2,0,0,0,0|1,0,1]=4 20177 B14R0.2489 CC(C)(CCCBr)OCCCCCCO 7a_100009888830_100000766143 [0,2,0,0,0,0|2,0,0]=4 20178 B14R0.2489 CCCCC(C)(C)COCCCCCF 7a_200011995781_100000729378 [0,2,0,0,0,0|2,0,0]=4 20179 B14R0.2489 CCCCC(C)(C)COCCCCCO 7a_200011995781_100000746330 [0,2,0,0,0,0|1,0,0]=3 20180 B14R0.2489 CCCCC(C)(C)COCCOCCO 7a_200011995781_100011215305 [0,2,0,0,0,0|2,0,0]=4 20181 B14R0.2489 CCCCC(C)(C)OCCCCCCF 7a_100011219641_100015922095 [0,2,0,0,0,0|2,0,0]=4 20182 B14R0.2489 CCCCC(C)(C)OCCCCCCO 7a_100011219641_100000766143 [0,2,0,0,0,0|1,0,0]=3 20183 B14R0.2489 CCCCCCCCS(=O)(=O)NCCO 270084a_100000210304_100011218563 [0,2,0,0,0,0|2,0,0]=4 20184 B14R0.2489 CCCCCCCCS(=O)(=O)NCCO 274078a_100000210304_100011218563 [0,2,0,0,0,0|2,0,0]=4 20185 B14R0.2489 CCCCCCCOC(C)(C)CCCBr 7a_100009888830_100000210614 [0,2,0,0,0,0|2,0,0]=4 20186 B14R0.2489 CCCCCCCOC(C)(C)CCCC 7a_100011219641_100000210614 [0,2,0,0,0,0|2,0,0]=4 20187 B14R0.2489 CCCCCCOCC(C)(C)CCCC 7a_200011995781_100000210314 [0,2,0,0,0,0|2,0,0]=4 20188 B14R0.2489 CCCCS(=O)(=O)NCCCCCCO 270084a_100000686447_100000212082 [0,2,0,0,0,0|2,0,0]=4 20189 B14R0.2489 CCCCS(=O)(=O)NCCCCCCO 274078a_100000686447_100000212082 [0,2,0,0,0,0|2,0,0]=4 20190 B14R0.2489 CCCCS(=O)(=O)NCCCCCCO 40a_100000686447_100000054263 [0,2,0,0,0,0|2,0,0]=4 20191 B14R0.2489 CCCC[Si](C)(C)CSCCCCCO 62a_100000746330_200000073895 [0,2,0,0,0,0|1,1,0]=4 20192 B14R0.2489 CCCC[Si](C)(C)CSCCCCCO 62a_200000073895_100000746330 [0,2,0,0,0,0|1,1,0]=4 20193 B14R0.12 CCC(C)CCNC(=O)CCCCCO 240690a_100020591266_100102619762 [0,2,0,0,0,0|1,0,1]=4 20194 B14R0.12 CCCCCCC(=O)NCCC(C)CO 240690a_106354213184_100102632555 [0,2,0,0,0,0|1,0,1]=4 20195 B14R0.12 CCCCCCC(=O)NCCC(C)CO 527a_106354213184_100102632555 [0,2,0,0,0,0|1,0,1]=4 20196 B14R0.12 CCCCCCC(C)CCOC(C)CC 34a_200011024964_100011215416 [0,2,0,0,0,0|2,0,0]=4 20197 B14R0.12 CCCCCCC(C)CCOC(C)CC 7a_200011024964_100000758301 [0,2,0,0,0,0|2,0,0]=4 20198 B14R0.12 CCCCCCC(C)CCOC(C)CO 34a_200011024964_100012180447 [0,2,0,0,0,0|1,0,0]=3 20199 B14R0.12 CCCCCCC(C)CCOC(C)CO 7a_200011024964_100012180447 [0,2,0,0,0,0|1,0,0]=3 20200 B14R0.12 CCCCCCC(C)NCCC(C)CC 2230a_100020591266_100011215978 [0,2,0,0,0,0|2,0,0]=4 20201 B14R0.12 CCCCCCC(C)NCCC(C)CC 270004a_100020591266_100000210826 [0,2,0,0,0,0|2,0,0]=4 20202 B14R0.12 CCCCCCC(C)NCCC(C)CO 2230a_106354213184_100011215978 [0,2,0,0,0,0|1,0,0]=3 20203 B14R0.12 CCCCCCC(C)NCCC(C)CO 270004a_106354213184_100000210826 [0,2,0,0,0,0|1,0,0]=3 20204 B14R0.12 CCCCCCC(C)NCCC(C)CO 34a_106354213184_100011215978 [0,2,0,0,0,0|1,0,0]=3 20205 B14R0.12 CCCCCCC(C)OCCC(C)CC 7a_100011215188_100011215978 [0,2,0,0,0,0|2,0,0]=4 20206 B14R0.12 CCN(C)CCCC(=O)CCCCCO 1458a_100102619762_100015186262 [0,2,0,0,0,0|1,0,1]=4 20207 B14R0.12 CCN(C)CCCN(C)CCCCCO 2230a_100000722520_100015186262 [0,2,0,0,0,0|2,0,0]=4 20208 B14R0.12 CCN(C)CCCN(C)CCCCCO 269982a_100000722520_100015186262 [0,2,0,0,0,0|2,0,0]=4 20209 B14R0.140 CCC(C)CCC(=O)CCCCCCF 1458a_100000701222_100015922095 [0,2,0,0,0,0|1,0,1]=4 20210 B14R0.140 CCC(C)CCC(=O)CCCCCCO 1458a_100000701222_100000766143 [0,2,0,0,0,0|0,0,1]=3 20211 B14R0.140 CCC(C)CCC(=O)NCCCCCO 240690a_100000762737_100000701222 [0,2,0,0,0,0|1,0,1]=4 20212 B14R0.140 CCC(C)CCC(C)OCCCCCF 7a_200011216552_100000729378 [0,2,0,0,0,0|2,0,0]=4 20213 B14R0.140 CCC(C)CCC(C)OCCCCCO 7a_200011216552_100000746330 [0,2,0,0,0,0|1,0,0]=3 20214 B14R0.140 CCC(C)CCC(C)OCCOCCO 7a_200011216552_100011215305 [0,2,0,0,0,0|2,0,0]=4 20215 B14R0.140 CCC(C)CNC(=O)CCCCCCO 240690a_100020588543_100011996774 [0,2,0,0,0,0|1,0,1]=4 20216 B14R0.140 CCC(O)CCC(=O)NCCCCCO 240690a_100000762737_203496584001 [0,2,0,0,0,0|1,0,1]=4 20217 B14R0.140 CCC(O)CNC(=O)CCCCCCO 240690a_100011218483_100011996774 [0,2,0,0,0,0|1,0,1]=4 20218 B14R0.140 CCCCCCCC(=O)CCC(C)CC 1458a_100000701222_100000210614 [0,2,0,0,0,0|1,0,1]=4 20219 B14R0.140 CCCCCCCC(=O)NCC(C)CO 240690a_100000744482_100000211969 [0,2,0,0,0,0|1,0,1]=4 20220 B14R0.140 CCCCCCCC(=O)NCC(C)CO 527a_100000744482_100000211969 [0,2,0,0,0,0|1,0,1]=4 20221 B14R0.140 CCCCCCCC(=O)NC[C@@H](F)CO 240690a_100015665980_100000211969 [0,2,0,0,0,0|1,0,1]=4 20222 B14R0.140 CCCCCCCC(=O)NC[C@@H](F)CO 527a_100015665980_100000211969 [0,2,0,0,0,0|1,0,1]=4 20223 B14R0.140 CCCCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000211969 [0,2,0,0,0,0|1,0,1]=4 20224 B14R0.140 CCCCCCCC(=O)NC[C@H](O)CO 527a_100020644852_100000211969 [0,2,0,0,0,0|1,0,1]=4 20225 B14R0.140 CCCCCCCC(C)NCC(C)CC 2230a_100020588543_200011218727 [0,2,0,0,0,0|2,0,0]=4 20226 B14R0.140 CCCCCCCC(C)NCC(C)CC 270004a_100020588543_100000210596 [0,2,0,0,0,0|2,0,0]=4 20227 B14R0.140 CCCCCCCC(C)NCC(C)CO 34a_100000744482_200011218727 [0,2,0,0,0,0|1,0,0]=3 20228 B14R0.140 CCCCCCCC(C)NCC(O)CC 2230a_100011218483_200011218727 [0,2,0,0,0,0|2,0,0]=4 20229 B14R0.140 CCCCCCCC(C)NCC(O)CC 270004a_100011218483_100000210596 [0,2,0,0,0,0|2,0,0]=4 20230 B14R0.140 CCCCCCCC(C)NC[C@@H](F)CO 270004a_100015665980_100000210596 [0,2,0,0,0,0|1,0,0]=3 20231 B14R0.140 CCCCCCCC(C)NC[C@@H](F)CO 34a_100015665980_200011218727 [0,2,0,0,0,0|1,0,0]=3 20232 B14R0.140 CCCCCCCC(C)NC[C@H](O)CO 2230a_100020644852_200011218727 [0,2,0,0,0,0|1,0,0]=3 20233 B14R0.140 CCCCCCCC(C)OCC(C)CC 34a_200011215852_100000748023 [0,2,0,0,0,0|2,0,0]=4 20234 B14R0.140 CCCCCCCC(C)OCC(C)CC 7a_200011215852_100000748023 [0,2,0,0,0,0|2,0,0]=4 20235 B14R0.140 CCCCCCCC(C)OCC(C)CN 34a_100000744482_200011218727 [0,2,0,0,0,0|2,0,0]=4 20236 B14R0.140 CCCCCCCC(C)OCC(Cl)CCl 34a_100000033668_200011218727 [0,2,0,0,0,0|2,0,0]=4 20237 B14R0.140 CCCCCCCC(C)OCC(O)CC 34a_200011215852_100011218378 [0,2,0,0,0,0|2,0,0]=4 20238 B14R0.140 CCCCCCCC(C)OCC(O)CC 7a_200011215852_100011218378 [0,2,0,0,0,0|2,0,0]=4 20239 B14R0.140 CCCCCCCC(C)OCC(O)CO 34a_200011215852_100011219619 [0,2,0,0,0,0|1,0,0]=3 20240 B14R0.140 CCCCCCCC(C)OCC(O)CO 7a_200011215852_100011219619 [0,2,0,0,0,0|1,0,0]=3 20241 B14R0.140 CCCCCCCC(C)OC[C@@H](C)CC 34a_200011215852_100009816398 [0,2,0,0,0,0|2,0,0]=4 20242 B14R0.140 CCCCCCCC(C)OC[C@@H](C)CC 7a_100009816381_200011218727 [0,2,0,0,0,0|2,0,0]=4 20243 B14R0.140 CCCCCCCC(C)OC[C@@H](C)CC 7a_200011215852_100009816398 [0,2,0,0,0,0|2,0,0]=4 20244 B14R0.140 CCCCCCCC(C)OC[C@@H](C)CO 34a_200011215852_100000059175 [0,2,0,0,0,0|1,0,0]=3 20245 B14R0.140 CCCCCCCC(C)OC[C@@H](C)CO 7a_200011215852_100000059175 [0,2,0,0,0,0|1,0,0]=3 20246 B14R0.140 CCCCCCCC(C)OC[C@@H](O)CF 34a_200011215852_100015614560 [0,2,0,0,0,0|2,0,0]=4 20247 B14R0.140 CCCCCCCC(C)OC[C@@H](O)CF 7a_200011215852_100015614560 [0,2,0,0,0,0|2,0,0]=4 20248 B14R0.140 CCCCCCCC(C)OC[C@@H](O)CO 34a_200011215852_100009815848 [0,2,0,0,0,0|1,0,0]=3 20249 B14R0.140 CCCCCCCC(C)OC[C@@H](O)CO 7a_200011215852_100009815848 [0,2,0,0,0,0|1,0,0]=3 20250 B14R0.140 CCCCCCCC(C)OC[C@H](F)CN 34a_100015665980_200011218727 [0,2,0,0,0,0|2,0,0]=4 20251 B14R0.140 CCCCCCCC(C)SCC(C)CC 62a_100000748023_200011218727 [0,2,0,0,0,0|2,0,0]=4 20252 B14R0.140 CCCCCCCC(C)SCC(C)CC 62a_200011218727_100000748023 [0,2,0,0,0,0|2,0,0]=4 20253 B14R0.140 CCCCCCCC(C)SCC(O)CC 62a_100011218378_200011218727 [0,2,0,0,0,0|2,0,0]=4 20254 B14R0.140 CCCCCCCC(C)SCC(O)CC 62a_200011218727_100011218378 [0,2,0,0,0,0|2,0,0]=4 20255 B14R0.140 CCCCCCCC(C)SCC(O)CO 62a_100011219619_200011218727 [0,2,0,0,0,0|1,0,0]=3 20256 B14R0.140 CCCCCCCC(C)SCC(O)CO 62a_200011218727_100011219619 [0,2,0,0,0,0|1,0,0]=3 20257 B14R0.140 CCCCCCCC(C)SC[C@@H](C)CC 62a_100009816398_200011218727 [0,2,0,0,0,0|2,0,0]=4 20258 B14R0.140 CCCCCCCC(C)SC[C@@H](C)CC 62a_200011218727_100009816398 [0,2,0,0,0,0|2,0,0]=4 20259 B14R0.140 CCCCCCCC(C)SC[C@@H](C)CO 62a_100000059175_200011218727 [0,2,0,0,0,0|1,0,0]=3 20260 B14R0.140 CCCCCCCC(C)SC[C@@H](C)CO 62a_200011218727_100000059175 [0,2,0,0,0,0|1,0,0]=3 20261 B14R0.140 CCCCCCCC(C)SC[C@@H](O)CF 62a_100015614560_200011218727 [0,2,0,0,0,0|2,0,0]=4 20262 B14R0.140 CCCCCCCC(C)SC[C@@H](O)CF 62a_200011218727_100015614560 [0,2,0,0,0,0|2,0,0]=4 20263 B14R0.140 CCCCCCCC(C)SC[C@@H](O)CO 62a_100009815848_200011218727 [0,2,0,0,0,0|1,0,0]=3 20264 B14R0.140 CCCCCCCC(C)SC[C@@H](O)CO 62a_200011218727_100009815848 [0,2,0,0,0,0|1,0,0]=3 20265 B14R0.140 CCCCCCOC(C)CCC(C)CC 7a_200011216552_100000210314 [0,2,0,0,0,0|2,0,0]=4 20266 B14R0.140 CCN(C)CCC(=O)CCCCCCO 1458a_100000755305_100000766143 [0,2,0,0,0,0|1,0,1]=4 20267 B14R0.140 CCS(=O)CCC(=O)CCCCCCO 1458a_100011387550_100000766143 [0,2,0,0,0,0|1,0,1]=4 20268 B14R0.197 CCC(C)CCCCCOCC(C)CC 7a_200000035636_100000748023 [0,2,0,0,0,0|2,0,0]=4 20269 B14R0.197 CCC(C)CCCCCOCC(O)CC 7a_200000035636_100011218378 [0,2,0,0,0,0|2,0,0]=4 20270 B14R0.197 CCC(C)CCCCCOCC(O)CO 7a_200000035636_100011219619 [0,2,0,0,0,0|1,0,0]=3 20271 B14R0.197 CCC(C)CCCCCOC[C@@H](C)CC 7a_200000035636_100009816398 [0,2,0,0,0,0|2,0,0]=4 20272 B14R0.197 CCC(C)CCCCCOC[C@@H](C)CO 7a_200000035636_100000059175 [0,2,0,0,0,0|1,0,0]=3 20273 B14R0.197 CCC(C)CCCCCOC[C@@H](O)CF 7a_200000035636_100015614560 [0,2,0,0,0,0|2,0,0]=4 20274 B14R0.197 CCC(C)CCCCCOC[C@@H](O)CO 7a_200000035636_100009815848 [0,2,0,0,0,0|1,0,0]=3 20275 B14R0.226 CCCCCC(=O)CNCCC(C)CO 2230a_106354213184_200012276598 [0,2,0,0,0,0|1,0,1]=4 20276 B14R0.226 CCCCCC(=O)CNCCC(C)CO 34a_106354213184_200012276598 [0,2,0,0,0,0|1,0,1]=4 20277 B14R0.226 CCCCCC(C)OCCCC(C)CC 7a_100011216074_200011218191 [0,2,0,0,0,0|2,0,0]=4 20278 B14R0.226 CCCCCC(C)OCCC[C@@H](C)CN 34a_100160569302_200011218191 [0,2,0,0,0,0|2,0,0]=4 20279 B14R0.2056 CC(C)(CCl)COCCCCCCCO 7a_100011217199_100000760002 [0,2,0,0,0,0|2,0,0]=4 20280 B14R0.2056 CC(C)(CCl)OCCCCCCCCO 7a_100000764493_100000033203 [0,2,0,0,0,0|2,0,0]=4 20281 B14R0.2056 CC(C)(CO)CCCNCCCCCF 2230a_100000039164_100000729378 [0,2,0,0,0,0|2,0,0]=4 20282 B14R0.2056 CC(C)(CO)CCCNCCCCCO 2230a_100000039164_100000746330 [0,2,0,0,0,0|2,0,0]=4 20283 B14R0.2056 CC(C)(CO)CNCCCCCCCO 2230a_100020635058_100000760002 [0,2,0,0,0,0|2,0,0]=4 20284 B14R0.2056 CC(C)(CO)CNCCCCCCCO 34a_100011996573_100009813988 [0,2,0,0,0,0|2,0,0]=4 20285 B14R0.2056 CC(C)(CO)COCCCCCCCBr 34a_100000760002_100009813988 [0,2,0,0,0,0|2,0,0]=4 20286 B14R0.2056 CC(C)(CO)COCCCCCCCBr 7a_100000760002_100009813988 [0,2,0,0,0,0|2,0,0]=4 20287 B14R0.2056 CC(C)(CO)COCCCCCCCN 34a_100011996573_100009813988 [0,2,0,0,0,0|2,0,0]=4 20288 B14R0.2056 CC(C)(CO)CSCCCCCCCO 62a_100000760002_100009813988 [0,2,0,0,0,0|2,0,0]=4 20289 B14R0.2056 CC(C)(CO)CSCCCCCCCO 62a_100009813988_100000760002 [0,2,0,0,0,0|2,0,0]=4 20290 B14R0.2056 CC(C)(CO)NCCCCCCCCO 2230a_100000210608_100000033203 [0,2,0,0,0,0|2,0,0]=4 20291 B14R0.2056 CCC(C)(C)COCCCCCCCO 7a_100000765029_100000760002 [0,2,0,0,0,0|1,0,0]=3 20292 B14R0.2056 CCC(C)(C)NCCCCCCCCO 2230a_100000211385_100000033203 [0,2,0,0,0,0|1,0,0]=3 20293 B14R0.2056 CCC(C)(C)OCCCCCCCCBr 7a_100009813846_100000210677 [0,2,0,0,0,0|2,0,0]=4 20294 B14R0.2056 CCC(C)(C)OCCCCCCCCCl 7a_100000033203_100000210677 [0,2,0,0,0,0|2,0,0]=4 20295 B14R0.2056 CCC(C)(C)OCCCCCCCCO 7a_100000210230_100000033203 [0,2,0,0,0,0|1,0,0]=3 20296 B14R0.2056 CCC(C)(C)SCCCCCCCCO 62a_100000032637_100000033203 [0,2,0,0,0,0|1,0,0]=3 20297 B14R0.2056 CCC(C)(C)SCCCCCCCCO 62a_100000033203_100000032637 [0,2,0,0,0,0|1,0,0]=3 20298 B14R0.2056 CCCCCCCCCNC(C)(C)CC 2230a_100000211385_100011214924 [0,2,0,0,0,0|2,0,0]=4 20299 B14R0.2056 CCCCCCCCCNC(C)(C)CO 2230a_100000210608_100011214924 [0,2,0,0,0,0|1,0,0]=3 20300 B14R0.2056 CCCCCCCCCOC(C)(C)CC 7a_100000210230_100000210328 [0,2,0,0,0,0|2,0,0]=4 20301 B14R0.2056 CCCCCCCCCOC(C)(C)CC 7a_100000210712_100000210677 [0,2,0,0,0,0|2,0,0]=4 20302 B14R0.2056 CCCCCCCCCOC(C)(C)CCl 7a_100000764493_100000210328 [0,2,0,0,0,0|2,0,0]=4 20303 B14R0.2056 CCCCCCCCCSC(C)(C)CC 62a_100000032637_100000210670 [0,2,0,0,0,0|2,0,0]=4 20304 B14R0.2056 CCCCCCCCCSC(F)(F)CO 62a_100011217949_100000210670 [0,2,0,0,0,0|1,0,0]=3 20305 B14R0.2056 CCCCCCCCNCC(C)(C)CO 2230a_100020635058_100000210759 [0,2,0,0,0,0|1,0,0]=3 20306 B14R0.2056 CCCCCCCCNCC(C)(C)CO 34a_100000229939_100009813988 [0,2,0,0,0,0|1,0,0]=3 20307 B14R0.2056 CCCCCCCCOCC(C)(C)CC 7a_100000765029_100000210759 [0,2,0,0,0,0|2,0,0]=4 20308 B14R0.2056 CCCCCCCCOCC(C)(C)CCl 7a_100011217199_100000210759 [0,2,0,0,0,0|2,0,0]=4 20309 B14R0.2056 CCCCCCCCOCC(C)(C)CO 34a_100000210232_100009813988 [0,2,0,0,0,0|1,0,0]=3 20310 B14R0.2056 CCCCCCCCOCC(C)(C)CO 7a_100000210232_100009813988 [0,2,0,0,0,0|1,0,0]=3 20311 B14R0.2056 CCCCCCCCOCC(F)(F)CN 34a_100000703232_100000210759 [0,2,0,0,0,0|2,0,0]=4 20312 B14R0.2056 CCCCCCCCSCC(C)(C)CO 62a_100000210759_100009813988 [0,2,0,0,0,0|1,0,0]=3 20313 B14R0.2056 CCCCCCCCSCC(C)(C)CO 62a_100009813988_100000210317 [0,2,0,0,0,0|1,0,0]=3 20314 B14R0.2056 CCCCCCNCCCC(C)(C)CO 2230a_100000039164_100000210314 [0,2,0,0,0,0|1,0,0]=3 20315 B14R0.2056 CCCCCNCCOCC(C)(C)CO 34a_100000224656_100009813988 [0,2,0,0,0,0|2,0,0]=4 20316 B14R0.2056 CCCCCOCCOCC(C)(C)CO 34a_100011215259_100009813988 [0,2,0,0,0,0|2,0,0]=4 20317 B14R0.2056 CCCCCOCCOCC(C)(C)CO 7a_100011215259_100009813988 [0,2,0,0,0,0|2,0,0]=4 20318 B14R0.2056 CCCCOCCCNCC(C)(C)CO 34a_200000211371_100009813988 [0,2,0,0,0,0|2,0,0]=4 20319 B14R0.2056 CCCCOCCCOCC(C)(C)CO 34a_200011215613_100009813988 [0,2,0,0,0,0|2,0,0]=4 20320 B14R0.2056 CCCCOCCCOCC(C)(C)CO 7a_200011215613_100009813988 [0,2,0,0,0,0|2,0,0]=4 20321 B14R0.2056 CCCCOCNCCCC(C)(C)CO 2230a_100000039164_100011995733 [0,2,0,0,0,0|2,0,0]=4 20322 B14R0.2056 CCCOCCNCCCC(C)(C)CO 2230a_100000039164_100011215938 [0,2,0,0,0,0|2,0,0]=4 20323 B14R0.2056 CCOCCCNCCCC(C)(C)CO 2230a_100000039164_100012232248 [0,2,0,0,0,0|2,0,0]=4 20324 B14R0.2056 CCS(=O)(=O)CCNCCCCCCO 2230a_100000686447_100000756660 [0,2,0,0,0,0|2,0,0]=4 20325 B14R0.2056 CCS(=O)(=O)CCNCCCCCCO 2230a_100000751051_100000766143 [0,2,0,0,0,0|2,0,0]=4 20326 B14R0.2056 CCS(=O)(=O)CCNCCCCCCO 34a_100000686447_100000756660 [0,2,0,0,0,0|2,0,0]=4 20327 B14R0.2056 CCS(=O)(=O)CCNCCCCCCO 34a_100000751051_100000766143 [0,2,0,0,0,0|2,0,0]=4 20328 B14R0.2056 CCS(=O)(=O)CCOCCCCCCO 34a_200011216379_100000766143 [0,2,0,0,0,0|2,0,0]=4 20329 B14R0.2056 CCS(=O)(=O)CCOCCCCCCO 7a_200011216379_100000766143 [0,2,0,0,0,0|2,0,0]=4 20330 B14R0.2056 CCS(=O)(=O)CCSCCCCCCO 62a_100000756660_100000766143 [0,2,0,0,0,0|2,0,0]=4 20331 B14R0.2056 CCS(=O)(=O)CCSCCCCCCO 62a_100000766143_100000756660 [0,2,0,0,0,0|2,0,0]=4 20332 B14R0.2056 CCS(=O)(=O)NCCCCCCCCO 270084a_102515433106_100000211323 [0,2,0,0,0,0|2,0,0]=4 20333 B14R0.2056 CCS(=O)(=O)NCCCCCCCCO 274078a_102515433106_100000211323 [0,2,0,0,0,0|2,0,0]=4 20334 B14R0.2056 CCS(=O)(=O)NCCCCCCCCO 40a_102515433106_100000053943 [0,2,0,0,0,0|2,0,0]=4 20335 B14R0.2056 COC(C)(C)CCOCCCCCCO 7a_100000699976_100000766143 [0,2,0,0,0,0|2,0,0]=4 20336 B14R0.2056 COC(C)(C)CNCCCCCCCO 2230a_100000763424_100000760002 [0,2,0,0,0,0|2,0,0]=4 20337 B14R0.2056 COC(C)(C)CNCCCCCCCO 34a_100011996573_100000701081 [0,2,0,0,0,0|2,0,0]=4 20338 B14R0.2056 COC(C)(C)CSCCCCCCCO 62a_100000701081_100000760002 [0,2,0,0,0,0|2,0,0]=4 20339 B14R0.2056 COC(C)(C)CSCCCCCCCO 62a_100000760002_100000701081 [0,2,0,0,0,0|2,0,0]=4 20340 B14R0.2056 COCCCCCCNCC(C)(C)CO 2230a_100020635058_100011998445 [0,2,0,0,0,0|2,0,0]=4 20341 B14R0.2056 COCCCCCCOCC(C)(C)CO 34a_200012092642_100009813988 [0,2,0,0,0,0|2,0,0]=4 20342 B14R0.2056 COCCCCCCOCC(C)(C)CO 7a_200012092642_100009813988 [0,2,0,0,0,0|2,0,0]=4 20343 B14R0.2056 COCCCCCCSCC(C)(C)CO 62a_100009813988_100011998445 [0,2,0,0,0,0|2,0,0]=4 20344 B14R0.2056 COCCCCCCSCC(C)(C)CO 62a_100011998445_100009813988 [0,2,0,0,0,0|2,0,0]=4 20345 B14R0.2056 COCCCCNCCCC(C)(C)CO 2230a_100000039164_100000730899 [0,2,0,0,0,0|2,0,0]=4 20346 B14R0.2056 CSC(C)(C)CNCCCCCCCO 270004a_100011996573_100009845794 [0,2,0,0,0,0|2,0,0]=4 20347 B14R0.2056 NCC(F)(F)COCCCCCCCO 34a_100000703232_100000760002 [0,2,0,0,0,0|2,0,0]=4 20348 B14R0.2056 OCCCCCCCCSC(F)(F)CO 62a_100000033203_100011217949 [0,2,0,0,0,0|2,0,0]=4 20349 B14R0.2056 OCCCCCCCCSC(F)(F)CO 62a_100011217949_100000033203 [0,2,0,0,0,0|2,0,0]=4 20350 B14R0.2297 C#CC(CC)OCCCCCCCCC 34a_100000758843_100011214924 [0,2,0,0,0,0|2,0,0]=4 20351 B14R0.2297 C#CC(CC)OCCCCCCCCC 7a_100000758843_100000210328 [0,2,0,0,0,0|2,0,0]=4 20352 B14R0.2297 C#CC(CC)OCCCCCCCCO 34a_100000758843_100000033203 [0,2,0,0,0,0|1,0,0]=3 20353 B14R0.2297 C#CC(CC)OCCCCCCCCO 7a_100000758843_100000033203 [0,2,0,0,0,0|1,0,0]=3 20354 B14R0.2297 C=CC(CC)OCCCCCCCCC 34a_100000766422_100011214924 [0,2,0,0,0,0|2,0,0]=4 20355 B14R0.2297 C=CC(CC)OCCCCCCCCC 7a_100000766422_100000210328 [0,2,0,0,0,0|2,0,0]=4 20356 B14R0.2297 C=CC(CC)OCCCCCCCCO 34a_100000766422_100000033203 [0,2,0,0,0,0|1,0,0]=3 20357 B14R0.2297 C=CC(CC)OCCCCCCCCO 7a_100000766422_100000033203 [0,2,0,0,0,0|1,0,0]=3 20358 B14R0.2297 C=C[C@@H](CO)NCCCCCCCCC 2230a_100016989147_100011214924 [0,2,0,0,0,0|1,0,0]=3 20359 B14R0.2297 C=C[C@@H](CO)NCCCCCCCCC 34a_100016989147_100011214924 [0,2,0,0,0,0|1,0,0]=3 20360 B14R0.2297 C=C[C@@H](CO)NCCCCCCCCO 2230a_100016989147_100000033203 [0,2,0,0,0,0|2,0,0]=4 20361 B14R0.2297 C=C[C@@H](CO)NCCCCCCCCO 34a_100016989147_100000033203 [0,2,0,0,0,0|2,0,0]=4 20362 B14R0.2297 CCC(CC)CNCCCCCCCO 2230a_100011996573_100011215472 [0,2,0,0,0,0|1,0,0]=3 20363 B14R0.2297 CCC(CC)CNCCCCCCCO 2230a_100102946423_100000760002 [0,2,0,0,0,0|1,0,0]=3 20364 B14R0.2297 CCC(CC)CNCCCCCCCO 269862a_100011996573_100000211137 [0,2,0,0,0,0|1,0,0]=3 20365 B14R0.2297 CCC(CC)CNCCCCCCCO 270004a_100011996573_100000211137 [0,2,0,0,0,0|1,0,0]=3 20366 B14R0.2297 CCC(CC)CNCCCCCCCO 34a_100011996573_100011215472 [0,2,0,0,0,0|1,0,0]=3 20367 B14R0.2297 CCC(CC)CNCCCOCCCO 2230a_100011310245_100011215472 [0,2,0,0,0,0|2,0,0]=4 20368 B14R0.2297 CCC(CC)CNCCCOCCCO 269862a_100011310245_100000211137 [0,2,0,0,0,0|2,0,0]=4 20369 B14R0.2297 CCC(CC)CNCCCOCCCO 270004a_100011310245_100000211137 [0,2,0,0,0,0|2,0,0]=4 20370 B14R0.2297 CCC(CC)CNCCCOCCCO 34a_100011310245_100011215472 [0,2,0,0,0,0|2,0,0]=4 20371 B14R0.2297 CCC(CC)COCCCCCCCBr 34a_100000760002_100011215472 [0,2,0,0,0,0|2,0,0]=4 20372 B14R0.2297 CCC(CC)COCCCCCCCBr 7a_100000760002_100011215472 [0,2,0,0,0,0|2,0,0]=4 20373 B14R0.2297 CCC(CC)COCCCCCCCN 34a_100011996573_100011215472 [0,2,0,0,0,0|2,0,0]=4 20374 B14R0.2297 CCC(CC)COCCCCCCCO 7a_100000703878_100000760002 [0,2,0,0,0,0|1,0,0]=3 20375 B14R0.2297 CCC(CC)CSCCCCCCCO 62a_100000760002_100011215472 [0,2,0,0,0,0|1,0,0]=3 20376 B14R0.2297 CCC(CC)CSCCCCCCCO 62a_100011215472_100000760002 [0,2,0,0,0,0|1,0,0]=3 20377 B14R0.2297 CCC(CC)NCCCCCCCCO 2230a_100000199018_100000033203 [0,2,0,0,0,0|1,0,0]=3 20378 B14R0.2297 CCC(CC)NCCCCCCCCO 270004a_102515433106_100000210860 [0,2,0,0,0,0|1,0,0]=3 20379 B14R0.2297 CCC(CC)OCCCCCCCCBr 7a_100009813846_100000210505 [0,2,0,0,0,0|2,0,0]=4 20380 B14R0.2297 CCC(CC)OCCCCCCCCCl 7a_100000033203_100000210505 [0,2,0,0,0,0|2,0,0]=4 20381 B14R0.2297 CCC(CC)OCCCCCCCCO 7a_100000688536_100000033203 [0,2,0,0,0,0|1,0,0]=3 20382 B14R0.2297 CCC(CC)SCCCCCCCCO 62a_100000033203_100000210505 [0,2,0,0,0,0|1,0,0]=3 20383 B14R0.2297 CCC(CC)SCCCCCCCCO 62a_100000210505_100000033203 [0,2,0,0,0,0|1,0,0]=3 20384 B14R0.2297 CCC(COCCCCCCCO)OC 34a_100011934954_100000760002 [0,2,0,0,0,0|1,0,0]=3 20385 B14R0.2297 CCC(COCCCCCCCO)OC 7a_100011934954_100000760002 [0,2,0,0,0,0|1,0,0]=3 20386 B14R0.2297 CCCCCCCCCCN(CC)CC 2230a_100000724800_100000210320 [0,2,0,0,0,0|2,0,0]=4 20387 B14R0.2297 CCCCCCCCCCN(CC)CC 269956a_100000042499_100000210320 [0,2,0,0,0,0|2,0,0]=4 20388 B14R0.2297 CCCCCCCCCCN(CC)CC 269982a_100000724800_100000210320 [0,2,0,0,0,0|2,0,0]=4 20389 B14R0.2297 CCCCCCCCCNC(CC)CC 2230a_100000199018_100011214924 [0,2,0,0,0,0|2,0,0]=4 20390 B14R0.2297 CCCCCCCCCNC(CC)CC 270004a_100000212291_100000210860 [0,2,0,0,0,0|2,0,0]=4 20391 B14R0.2297 CCCCCCCCCNC(CO)CO 2230a_100000759517_100011214924 [0,2,0,0,0,0|1,0,0]=3 20392 B14R0.2297 CCCCCCCCCN[C@@H](CC)CO 2230a_100000709445_100011214924 [0,2,0,0,0,0|1,0,0]=3 20393 B14R0.2297 CCCCCCCCCOC(CC)CC 7a_100000210712_100000210505 [0,2,0,0,0,0|2,0,0]=4 20394 B14R0.2297 CCCCCCCCCOC(CC)CC 7a_100000688536_100000210328 [0,2,0,0,0,0|2,0,0]=4 20395 B14R0.2297 CCCCCCCCCOC(CCl)CCl 7a_100000737055_100000210328 [0,2,0,0,0,0|2,0,0]=4 20396 B14R0.2297 CCCCCCCCCOC(CF)CF 34a_100000032261_100011214924 [0,2,0,0,0,0|2,0,0]=4 20397 B14R0.2297 CCCCCCCCCOC(CF)CF 7a_100000032261_100000210328 [0,2,0,0,0,0|2,0,0]=4 20398 B14R0.2297 CCCCCCCCCOC(CN)CN 34a_100000031598_100011214924 [0,2,0,0,0,0|2,0,0]=4 20399 B14R0.2297 CCCCCCCCCO[C@@H](CF)CCl 34a_100015614560_100011214924 [0,2,0,0,0,0|2,0,0]=4 20400 B14R0.2297 CCCCCCCCCO[C@@H](CF)CCl 7a_100015614560_100000210328 [0,2,0,0,0,0|2,0,0]=4 20401 B14R0.2297 CCCCCCCCCSC(CC)CC 62a_100000210505_100000210670 [0,2,0,0,0,0|2,0,0]=4 20402 B14R0.2297 CCCCCCCCNCC(CC)CC 2230a_100000229939_100011215472 [0,2,0,0,0,0|2,0,0]=4 20403 B14R0.2297 CCCCCCCCNCC(CC)CC 2230a_100102946423_100000210759 [0,2,0,0,0,0|2,0,0]=4 20404 B14R0.2297 CCCCCCCCNCC(CC)CC 269862a_100000229939_100000211137 [0,2,0,0,0,0|2,0,0]=4 20405 B14R0.2297 CCCCCCCCNCC(CC)CC 270004a_100000229939_100000211137 [0,2,0,0,0,0|2,0,0]=4 20406 B14R0.2297 CCCCCCCCNCC(CC)CC 34a_100000229939_100011215472 [0,2,0,0,0,0|2,0,0]=4 20407 B14R0.2297 CCCCCCCCOCC(CC)CC 34a_100000210232_100011215472 [0,2,0,0,0,0|2,0,0]=4 20408 B14R0.2297 CCCCCCCCOCC(CC)CC 7a_100000210232_100011215472 [0,2,0,0,0,0|2,0,0]=4 20409 B14R0.2297 CCCCCCCCOCC(CC)CC 7a_100000703878_100000210759 [0,2,0,0,0,0|2,0,0]=4 20410 B14R0.2297 CCCCCCCCOCC(CC)OC 34a_100011934954_100000210759 [0,2,0,0,0,0|2,0,0]=4 20411 B14R0.2297 CCCCCCCCOCC(CC)OC 7a_100011934954_100000210759 [0,2,0,0,0,0|2,0,0]=4 20412 B14R0.2297 CCCCCCCCSCC(CC)CC 62a_100000210759_100011215472 [0,2,0,0,0,0|2,0,0]=4 20413 B14R0.2297 CCCCCCCCSCC(CC)CC 62a_100011215472_100000210317 [0,2,0,0,0,0|2,0,0]=4 20414 B14R0.2297 CCN(CC)CCCCCCCCCO 2230a_100000724800_100009813782 [0,2,0,0,0,0|1,0,0]=3 20415 B14R0.2297 CCN(CC)CCCCCCCCCO 269956a_100000042499_100009813782 [0,2,0,0,0,0|1,0,0]=3 20416 B14R0.2297 CCN(CC)CCCCCCCCCO 269982a_100000724800_100009813782 [0,2,0,0,0,0|1,0,0]=3 20417 B14R0.2297 CCN(CC)CCCCCCOCCO 7a_100011632896_100000211926 [0,2,0,0,0,0|2,0,0]=4 20418 B14R0.2297 CCN(CC)CCCCCNCCCO 2230a_100011491781_100000230001 [0,2,0,0,0,0|2,0,0]=4 20419 B14R0.2297 CCN(CC)CCCCCOCCCO 7a_200011629222_100011215043 [0,2,0,0,0,0|2,0,0]=4 20420 B14R0.2297 CCN(CC)CCCCNCCCCO 2230a_100000743895_100000210776 [0,2,0,0,0,0|2,0,0]=4 20421 B14R0.2297 CCN(CC)CCCCOCCCCO 7a_100011305530_100000210776 [0,2,0,0,0,0|2,0,0]=4 20422 B14R0.2297 CCN(CC)CCCNCCCCCO 2230a_100000762737_100000709985 [0,2,0,0,0,0|2,0,0]=4 20423 B14R0.2297 CCN(CC)CCCOCCCCCO 7a_100000212844_100000746330 [0,2,0,0,0,0|2,0,0]=4 20424 B14R0.2297 CCN(CC)CCCSCCCCCO 62a_100000746330_100000709985 [0,2,0,0,0,0|2,0,0]=4 20425 B14R0.2297 CCN(CC)CCNCCCCCCO 2230a_100000686447_100000700428 [0,2,0,0,0,0|2,0,0]=4 20426 B14R0.2297 CCN(CC)CCNCCCCCCO 2230a_100015382049_100000766143 [0,2,0,0,0,0|2,0,0]=4 20427 B14R0.2297 CCN(CC)CCOCCCCCCO 7a_100016990331_100000766143 [0,2,0,0,0,0|2,0,0]=4 20428 B14R0.2297 CCN(CC)CCSCCCCCCO 62a_100000766143_100000700428 [0,2,0,0,0,0|2,0,0]=4 20429 B14R0.2297 CCN(CC)COCCCCCCCO 7a_200015374951_100000760002 [0,2,0,0,0,0|2,0,0]=4 20430 B14R0.2297 CCN(CCCCOCCCCO)N=O 34a_200000035056_100011216708 [0,2,0,0,0,0|2,0,0]=4 20431 B14R0.2297 CC[C@@H](CO)NCCCCCCCCO 2230a_100000709445_100000033203 [0,2,0,0,0,0|1,0,0]=3 20432 B14R0.2297 COC(CCCNCCCCCO)OC 2230a_100000762737_100000069011 [0,2,0,0,0,0|2,0,0]=4 20433 B14R0.2297 COC(CCCNCCCCCO)OC 34a_100000762737_100000069011 [0,2,0,0,0,0|2,0,0]=4 20434 B14R0.2297 COC(CCCSCCCCCO)OC 62a_100000069011_100000746330 [0,2,0,0,0,0|2,0,0]=4 20435 B14R0.2297 COC(CCCSCCCCCO)OC 62a_100000746330_100000069011 [0,2,0,0,0,0|2,0,0]=4 20436 B14R0.2297 COC(CCNCCCCCCO)OC 2230a_100000686447_100009813347 [0,2,0,0,0,0|2,0,0]=4 20437 B14R0.2297 COC(CCNCCCCCCO)OC 34a_100000686447_100000139399 [0,2,0,0,0,0|2,0,0]=4 20438 B14R0.2297 COC(CCSCCCCCCO)OC 62a_100000139399_100000766143 [0,2,0,0,0,0|2,0,0]=4 20439 B14R0.2297 COC(CCSCCCCCCO)OC 62a_100000766143_100000139399 [0,2,0,0,0,0|2,0,0]=4 20440 B14R0.2297 COC(CNCCCCCCCO)OC 2230a_100011996573_100000751394 [0,2,0,0,0,0|2,0,0]=4 20441 B14R0.2297 COC(CNCCCCCCCO)OC 270004a_100011996573_100000752162 [0,2,0,0,0,0|2,0,0]=4 20442 B14R0.2297 COC(CNCCCCCCCO)OC 34a_100011996573_100000211822 [0,2,0,0,0,0|2,0,0]=4 20443 B14R0.2297 COC(COCCCCCCCO)OC 34a_100011216393_100000760002 [0,2,0,0,0,0|2,0,0]=4 20444 B14R0.2297 COC(CSCCCCCCCO)OC 62a_100000751394_100000760002 [0,2,0,0,0,0|2,0,0]=4 20445 B14R0.2297 COC(CSCCCCCCCO)OC 62a_100000760002_100000751394 [0,2,0,0,0,0|2,0,0]=4 20446 B14R0.2297 NCC(CN)OCCCCCCCCO 34a_100000031598_100000033203 [0,2,0,0,0,0|2,0,0]=4 20447 B14R0.2297 OCCCCCCCCNC(CO)CO 2230a_100000759517_100000033203 [0,2,0,0,0,0|2,0,0]=4 20448 B14R0.2297 OCCCCCCCCOC(CCl)CCl 7a_100000737055_100000033203 [0,2,0,0,0,0|2,0,0]=4 20449 B14R0.2297 OCCCCCCCCOC(CF)CF 34a_100000032261_100000033203 [0,2,0,0,0,0|2,0,0]=4 20450 B14R0.2297 OCCCCCCCCOC(CF)CF 7a_100000032261_100000033203 [0,2,0,0,0,0|2,0,0]=4 20451 B14R0.2297 OCCCCCCCCO[C@@H](CF)CCl 34a_100015614560_100000033203 [0,2,0,0,0,0|2,0,0]=4 20452 B14R0.2297 OCCCCCCCCO[C@@H](CF)CCl 7a_100015614560_100000033203 [0,2,0,0,0,0|2,0,0]=4 20453 B14R0.145 C#CCCCCC(=O)CCCCCCC 1458a_100000211969_100010269958 [0,2,0,0,0,0|1,0,1]=4 20454 B14R0.145 C#CCCCCC(=O)CCCCCCC 1458a_100000696528_100000210614 [0,2,0,0,0,0|1,0,1]=4 20455 B14R0.145 C#CCCCCC(=O)CCCCCCO 1458a_100000696528_100000766143 [0,2,0,0,0,0|0,0,2]=4 20456 B14R0.145 C#CCCCCC(=O)CCCCCCO 1458a_100011996774_100010269958 [0,2,0,0,0,0|0,0,2]=4 20457 B14R0.145 C#CCCCCCC(=O)CCCCCC 1458a_100000694772_100000210757 [0,2,0,0,0,0|1,0,1]=4 20458 B14R0.145 C#CCCCCCC(=O)CCCCCC 1458a_100102632555_100012094781 [0,2,0,0,0,0|1,0,1]=4 20459 B14R0.145 C#CCCCCCC(=O)CCCCCO 1458a_100000694772_100000746330 [0,2,0,0,0,0|0,0,2]=4 20460 B14R0.145 C#CCCCCCC(=O)CCCCCO 1458a_100102619762_100012094781 [0,2,0,0,0,0|0,0,2]=4 20461 B14R0.145 C#CCCCCCN(C)CCCCCC 2230a_106256046315_100012094781 [0,2,0,0,0,0|1,0,1]=4 20462 B14R0.145 C#CCCCCCN(C)CCCCCC 269982a_106256046315_100012094781 [0,2,0,0,0,0|1,0,1]=4 20463 B14R0.145 C#CCCCCCN(C)CCCCCO 2230a_100000722520_100012094781 [0,2,0,0,0,0|0,0,2]=4 20464 B14R0.145 C#CCCCCCN(C)CCCCCO 269982a_100000722520_100012094781 [0,2,0,0,0,0|0,0,2]=4 20465 B14R0.145 C#CCCCCN(C)CCCCCCC 2230a_100000228206_100010269958 [0,2,0,0,0,0|1,0,1]=4 20466 B14R0.145 C#CCCCCN(C)CCCCCCC 269982a_100000228206_100010269958 [0,2,0,0,0,0|1,0,1]=4 20467 B14R0.145 C#CCCCCNC(C)CCCCCC 2230a_100000210919_100010269958 [0,2,0,0,0,0|1,0,1]=4 20468 B14R0.145 C#CCCCCNC(C)CCCCCC 2230a_100000706060_100011215978 [0,2,0,0,0,0|1,0,1]=4 20469 B14R0.145 C#CCCCCNC(C)CCCCCC 34a_100000210919_100010269958 [0,2,0,0,0,0|1,0,1]=4 20470 B14R0.145 C#CCCCCNC(C)CCCCCC 34a_100000706060_100011215978 [0,2,0,0,0,0|1,0,1]=4 20471 B14R0.145 C#CCCCCOC(C)CCCCCC 34a_100000210265_100010269958 [0,2,0,0,0,0|1,0,1]=4 20472 B14R0.145 C#CCCCCOC(C)CCCCCC 34a_100000766709_100011215978 [0,2,0,0,0,0|1,0,1]=4 20473 B14R0.145 C#CCCCCOC(C)CCCCCC 7a_100000210265_100010269958 [0,2,0,0,0,0|1,0,1]=4 20474 B14R0.145 C#CCCCCOC(C)CCCCCC 7a_100000766709_100011215978 [0,2,0,0,0,0|1,0,1]=4 20475 B14R0.145 C#CCCCCSC(C)CCCCCC 62a_100010269958_100011215978 [0,2,0,0,0,0|1,0,1]=4 20476 B14R0.145 C#CCCCCSC(C)CCCCCC 62a_100011215978_100010269958 [0,2,0,0,0,0|1,0,1]=4 20477 B14R0.145 C#CCCCNC(C)CCCCCCC 270004a_100000718082_100000210596 [0,2,0,0,0,0|1,0,1]=4 20478 B14R0.145 C#CCCCNC(C)CCCCCCC 34a_100000718082_200011218727 [0,2,0,0,0,0|1,0,1]=4 20479 B14R0.145 C#CCCCOC(C)CCCCCCC 34a_100000215630_200011218727 [0,2,0,0,0,0|1,0,1]=4 20480 B14R0.145 C#CCCCOC(C)CCCCCCC 34a_200011215852_100000695029 [0,2,0,0,0,0|1,0,1]=4 20481 B14R0.145 C#CCCCOC(C)CCCCCCC 7a_100000215630_200011218727 [0,2,0,0,0,0|1,0,1]=4 20482 B14R0.145 C#CCCCOC(C)CCCCCCC 7a_200011215852_100011215417 [0,2,0,0,0,0|1,0,1]=4 20483 B14R0.145 C#CCCCSC(C)CCCCCCC 62a_100011215417_200011218727 [0,2,0,0,0,0|1,0,1]=4 20484 B14R0.145 C#CCCCSC(C)CCCCCCC 62a_200011218727_100011215417 [0,2,0,0,0,0|1,0,1]=4 20485 B14R0.145 C#CCCOCCC(C)CCCCCC 34a_200011024964_100000688953 [0,2,0,0,0,0|1,0,1]=4 20486 B14R0.145 C#CCCOCCC(C)CCCCCC 7a_200011024964_100000688953 [0,2,0,0,0,0|1,0,1]=4 20487 B14R0.145 C=CCCCCC(=O)CCCCCCC 1458a_100000211969_100011215482 [0,2,0,0,0,0|1,0,1]=4 20488 B14R0.145 C=CCCCCC(=O)CCCCCCC 1458a_100011215552_100000210614 [0,2,0,0,0,0|1,0,1]=4 20489 B14R0.145 C=CCCCCC(=O)CCCCCCO 1458a_100011215552_100000766143 [0,2,0,0,0,0|0,0,2]=4 20490 B14R0.145 C=CCCCCC(=O)CCCCCCO 1458a_100011996774_100011215482 [0,2,0,0,0,0|0,0,2]=4 20491 B14R0.145 C=CCCCCCC(=O)CCCCCC 1458a_100011934241_100000210757 [0,2,0,0,0,0|1,0,1]=4 20492 B14R0.145 C=CCCCCCC(=O)CCCCCC 1458a_100102632555_100000700193 [0,2,0,0,0,0|1,0,1]=4 20493 B14R0.145 C=CCCCCCC(=O)CCCCCO 1458a_100011934241_100000746330 [0,2,0,0,0,0|0,0,2]=4 20494 B14R0.145 C=CCCCCCC(=O)CCCCCO 1458a_100102619762_100000700193 [0,2,0,0,0,0|0,0,2]=4 20495 B14R0.145 C=CCCCCCN(C)CCCCCC 2230a_106256046315_100000700193 [0,2,0,0,0,0|1,0,1]=4 20496 B14R0.145 C=CCCCCCN(C)CCCCCC 269982a_106256046315_100000700193 [0,2,0,0,0,0|1,0,1]=4 20497 B14R0.145 C=CCCCCCN(C)CCCCCO 2230a_100000722520_100000700193 [0,2,0,0,0,0|0,0,2]=4 20498 B14R0.145 C=CCCCCCN(C)CCCCCO 269982a_100000722520_100000700193 [0,2,0,0,0,0|0,0,2]=4 20499 B14R0.145 C=CCCCCN(C)CCCCCCC 2230a_100000228206_100011215482 [0,2,0,0,0,0|1,0,1]=4 20500 B14R0.145 C=CCCCCN(C)CCCCCCC 2230a_100012000471_100000210681 [0,2,0,0,0,0|1,0,1]=4 20501 B14R0.145 C=CCCCCN(C)CCCCCCC 269982a_100000228206_100011215482 [0,2,0,0,0,0|1,0,1]=4 20502 B14R0.145 C=CCCCCN(C)CCCCCCC 269982a_100012000471_100000210681 [0,2,0,0,0,0|1,0,1]=4 20503 B14R0.145 C=CCCCCN(C)CCCCCCO 2230a_100012000471_100000766143 [0,2,0,0,0,0|0,0,2]=4 20504 B14R0.145 C=CCCCCN(C)CCCCCCO 269982a_100012000471_100000766143 [0,2,0,0,0,0|0,0,2]=4 20505 B14R0.145 C=CCCCCNC(C)CCCCCC 2230a_100000210919_100011215482 [0,2,0,0,0,0|1,0,1]=4 20506 B14R0.145 C=CCCCCNC(C)CCCCCC 2230a_100000703577_100011215978 [0,2,0,0,0,0|1,0,1]=4 20507 B14R0.145 C=CCCCCNC(C)CCCCCC 270004a_100000703577_100000210826 [0,2,0,0,0,0|1,0,1]=4 20508 B14R0.145 C=CCCCCNC(C)CCCCCC 34a_100000210919_100011215482 [0,2,0,0,0,0|1,0,1]=4 20509 B14R0.145 C=CCCCCNC(C)CCCCCC 34a_100000703577_100011215978 [0,2,0,0,0,0|1,0,1]=4 20510 B14R0.145 C=CCCCCOC(C)CCCCCC 34a_100000210265_100011215482 [0,2,0,0,0,0|1,0,1]=4 20511 B14R0.145 C=CCCCCOC(C)CCCCCC 34a_100000766645_100011215978 [0,2,0,0,0,0|1,0,1]=4 20512 B14R0.145 C=CCCCCOC(C)CCCCCC 7a_100000210265_100011215482 [0,2,0,0,0,0|1,0,1]=4 20513 B14R0.145 C=CCCCCOC(C)CCCCCC 7a_100000766645_100011215978 [0,2,0,0,0,0|1,0,1]=4 20514 B14R0.145 C=CCCCCSC(C)CCCCCC 62a_100011215482_100011215978 [0,2,0,0,0,0|1,0,1]=4 20515 B14R0.145 C=CCCCCSC(C)CCCCCC 62a_100011215978_100011215482 [0,2,0,0,0,0|1,0,1]=4 20516 B14R0.145 C=CCCCNC(C)CCCCCCC 2230a_100000700776_200011218727 [0,2,0,0,0,0|1,0,1]=4 20517 B14R0.145 C=CCCCNC(C)CCCCCCC 270004a_100000700776_100000210596 [0,2,0,0,0,0|1,0,1]=4 20518 B14R0.145 C=CCCCNC(C)CCCCCCC 34a_100000700776_200011218727 [0,2,0,0,0,0|1,0,1]=4 20519 B14R0.145 C=CCCCOC(C)CCCCCCC 34a_100000758997_200011218727 [0,2,0,0,0,0|1,0,1]=4 20520 B14R0.145 C=CCCCOC(C)CCCCCCC 34a_200011215852_100000757094 [0,2,0,0,0,0|1,0,1]=4 20521 B14R0.145 C=CCCCOC(C)CCCCCCC 7a_100000758997_200011218727 [0,2,0,0,0,0|1,0,1]=4 20522 B14R0.145 C=CCCCOC(C)CCCCCCC 7a_200011215852_100000757094 [0,2,0,0,0,0|1,0,1]=4 20523 B14R0.145 C=CCCCSC(C)CCCCCCC 62a_100011713584_200011218727 [0,2,0,0,0,0|1,0,1]=4 20524 B14R0.145 C=CCCCSC(C)CCCCCCC 62a_200011218727_100000757094 [0,2,0,0,0,0|1,0,1]=4 20525 B14R0.145 C=CCCOCCC(C)CCCCCC 34a_200011024964_100000754431 [0,2,0,0,0,0|1,0,1]=4 20526 B14R0.145 C=CCCOCCC(C)CCCCCC 7a_200011024964_100000754431 [0,2,0,0,0,0|1,0,1]=4 20527 B14R0.145 CC/C=C\CCC(=O)CCCCCCO 1458a_100011996774_100015370543 [0,2,0,0,0,0|0,0,2]=4 20528 B14R0.145 CCC/C=C/CC(=O)CCCCCCO 1458a_200016266809_100000766143 [0,2,0,0,0,0|0,0,2]=4 20529 B14R0.145 CCCC/C=C/CC(=O)CCCCCO 1458a_200016282684_100000746330 [0,2,0,0,0,0|0,0,2]=4 20530 B14R0.145 CCCCC=CC(=O)CCCCCCO 1458a_100016266645_100000766143 [0,2,0,0,0,0|0,0,2]=4 20531 B14R0.145 CCCCCC#CC(=O)CCCCCO 1458a_100011215388_100000746330 [0,2,0,0,0,0|0,0,2]=4 20532 B14R0.145 CCCCCC=CC(=O)CCCCCO 1458a_100016263427_100000746330 [0,2,0,0,0,0|0,0,2]=4 20533 B14R0.145 CCCCCCC(=O)CCCCCC#N 1458a_100102632555_100009813376 [0,2,0,0,0,0|1,0,1]=4 20534 B14R0.145 CCCCCCC(=O)CCCCCCF 1458a_100102632555_100015922095 [0,2,0,0,0,0|1,0,0]=3 20535 B14R0.145 CCCCCCC(=O)CCCCCCO 1458a_100011996774_100000210757 [0,2,0,0,0,0|0,0,0]=2 20536 B14R0.145 CCCCCCC(=O)CCCCCCO 1458a_100102632555_100000766143 [0,2,0,0,0,0|0,0,0]=2 20537 B14R0.145 CCCCCCC(=O)CCCCCOC 1458a_100011935119_100000210757 [0,2,0,0,0,0|0,0,1]=3 20538 B14R0.145 CCCCCCC(=O)CCOCCCC 1458a_100102632555_100000743108 [0,2,0,0,0,0|1,0,1]=4 20539 B14R0.145 CCCCCCC(=O)CCOCCOC 1458a_100000745395_100000210757 [0,2,0,0,0,0|1,0,1]=4 20540 B14R0.145 CCCCCCC(=O)CCOCCOC 1458a_100102632555_100000695917 [0,2,0,0,0,0|1,0,1]=4 20541 B14R0.145 CCCCCCC(=O)NCCCCCO 240690a_100000762737_100102632555 [0,2,0,0,0,0|0,0,1]=3 20542 B14R0.145 CCCCCCC(=O)NCCOCCO 240690a_100000211614_100102632555 [0,2,0,0,0,0|1,0,1]=4 20543 B14R0.145 CCCCCCC(=O)NCCSCCO 240690a_100011219999_100102632555 [0,2,0,0,0,0|1,0,1]=4 20544 B14R0.145 CCCCCCC(=O)NCCSCCO 527a_100011219999_100102632555 [0,2,0,0,0,0|1,0,1]=4 20545 B14R0.145 CCCCCCC(C)CCOCCC#N 7a_200011024964_100000184422 [0,2,0,0,0,0|1,0,1]=4 20546 B14R0.145 CCCCCCC(C)CCOCCCC 34a_200011024964_100000210210 [0,2,0,0,0,0|1,0,0]=3 20547 B14R0.145 CCCCCCC(C)CCOCCCC 7a_200011024964_100000210211 [0,2,0,0,0,0|1,0,0]=3 20548 B14R0.145 CCCCCCC(C)CCOCCCF 34a_200011024964_100011934791 [0,2,0,0,0,0|1,0,0]=3 20549 B14R0.145 CCCCCCC(C)CCOCCCF 7a_200011024964_100011934791 [0,2,0,0,0,0|1,0,0]=3 20550 B14R0.145 CCCCCCC(C)CCOCCCO 34a_200011024964_100000230001 [0,2,0,0,0,0|0,0,0]=2 20551 B14R0.145 CCCCCCC(C)CCOCCCO 7a_200011024964_100011215043 [0,2,0,0,0,0|0,0,0]=2 20552 B14R0.145 CCCCCCC(C)CCOCCOC 34a_200011024964_100011201679 [0,2,0,0,0,0|1,0,0]=3 20553 B14R0.145 CCCCCCC(C)CCOCCOC 7a_200011024964_100000233755 [0,2,0,0,0,0|1,0,0]=3 20554 B14R0.145 CCCCCCC(C)CCOCCSC 34a_200011024964_100000212216 [0,2,0,0,0,0|1,1,0]=4 20555 B14R0.145 CCCCCCC(C)CCOCCSC 7a_200011024964_100000212216 [0,2,0,0,0,0|1,1,0]=4 20556 B14R0.145 CCCCCCC(C)NCCCCC#N 2230a_100000210919_100000211819 [0,2,0,0,0,0|1,0,1]=4 20557 B14R0.145 CCCCCCC(C)NCCCCC#N 270004a_100000751965_100000210826 [0,2,0,0,0,0|1,0,1]=4 20558 B14R0.145 CCCCCCC(C)NCCCCC=O 2230a_100000210919_100000139335 [0,2,0,0,0,0|0,0,2]=4 20559 B14R0.145 CCCCCCC(C)NCCCCCF 2230a_100000210919_100000729378 [0,2,0,0,0,0|1,0,0]=3 20560 B14R0.145 CCCCCCC(C)NCCCCCF 34a_100000210919_100000729378 [0,2,0,0,0,0|1,0,0]=3 20561 B14R0.145 CCCCCCC(C)NCCCCCO 2230a_100000210919_100000746330 [0,2,0,0,0,0|0,0,0]=2 20562 B14R0.145 CCCCCCC(C)NCCCCCO 2230a_100000762737_100011215978 [0,2,0,0,0,0|0,0,0]=2 20563 B14R0.145 CCCCCCC(C)NCCCCCO 270004a_100000762737_100000210826 [0,2,0,0,0,0|0,0,0]=2 20564 B14R0.145 CCCCCCC(C)NCCCCCO 34a_100000210919_100000746330 [0,2,0,0,0,0|0,0,0]=2 20565 B14R0.145 CCCCCCC(C)NCCCCCO 34a_100000762737_100011215978 [0,2,0,0,0,0|0,0,0]=2 20566 B14R0.145 CCCCCCC(C)NCCCCOC 2230a_100000210919_100000730899 [0,2,0,0,0,0|1,0,0]=3 20567 B14R0.145 CCCCCCC(C)NCCCCOC 34a_100000210919_100000755781 [0,2,0,0,0,0|1,0,0]=3 20568 B14R0.145 CCCCCCC(C)NCCCOCC 2230a_100000210919_100012232248 [0,2,0,0,0,0|2,0,0]=4 20569 B14R0.145 CCCCCCC(C)NCCCOCC 2230a_100000210961_100011215978 [0,2,0,0,0,0|2,0,0]=4 20570 B14R0.145 CCCCCCC(C)NCCCOCC 270004a_100000210961_100000210826 [0,2,0,0,0,0|2,0,0]=4 20571 B14R0.145 CCCCCCC(C)NCCCOCC 34a_100000210919_100012232248 [0,2,0,0,0,0|2,0,0]=4 20572 B14R0.145 CCCCCCC(C)NCCCOCC 34a_100000210961_100011215978 [0,2,0,0,0,0|2,0,0]=4 20573 B14R0.145 CCCCCCC(C)NCCOCCC 2230a_100000210919_100011215938 [0,2,0,0,0,0|2,0,0]=4 20574 B14R0.145 CCCCCCC(C)NCCOCCC 2230a_100161115042_100011215978 [0,2,0,0,0,0|2,0,0]=4 20575 B14R0.145 CCCCCCC(C)NCCOCCC 270004a_100161115042_100000210826 [0,2,0,0,0,0|2,0,0]=4 20576 B14R0.145 CCCCCCC(C)NCCOCCC 34a_100000210919_100011215938 [0,2,0,0,0,0|2,0,0]=4 20577 B14R0.145 CCCCCCC(C)NCCOCCC 34a_100161115042_100011215978 [0,2,0,0,0,0|2,0,0]=4 20578 B14R0.145 CCCCCCC(C)NCCOCCO 2230a_100000210919_100011215305 [0,2,0,0,0,0|1,0,0]=3 20579 B14R0.145 CCCCCCC(C)NCCOCCO 2230a_100000211614_100011215978 [0,2,0,0,0,0|1,0,0]=3 20580 B14R0.145 CCCCCCC(C)NCCOCCO 270004a_100000211614_100000210826 [0,2,0,0,0,0|1,0,0]=3 20581 B14R0.145 CCCCCCC(C)NCCOCCO 34a_100000210919_100000692535 [0,2,0,0,0,0|1,0,0]=3 20582 B14R0.145 CCCCCCC(C)NCCOCCO 34a_100000211614_100011215978 [0,2,0,0,0,0|1,0,0]=3 20583 B14R0.145 CCCCCCC(C)NCCSCCC 2230a_100020603323_100011215978 [0,2,0,0,0,0|2,0,0]=4 20584 B14R0.145 CCCCCCC(C)NCCSCCC 270004a_100020603323_100000210826 [0,2,0,0,0,0|2,0,0]=4 20585 B14R0.145 CCCCCCC(C)NCCSCCO 2230a_100011219999_100011215978 [0,2,0,0,0,0|1,0,0]=3 20586 B14R0.145 CCCCCCC(C)NCCSCCO 270004a_100011219999_100000210826 [0,2,0,0,0,0|1,0,0]=3 20587 B14R0.145 CCCCCCC(C)NCOCCCC 2230a_100000210919_100011995733 [0,2,0,0,0,0|2,0,0]=4 20588 B14R0.145 CCCCCCC(C)NCOCCCC 34a_100000210919_100011995733 [0,2,0,0,0,0|2,0,0]=4 20589 B14R0.145 CCCCCCC(C)NCOCCOC 2230a_100000210919_100000231047 [0,2,0,0,0,0|2,0,0]=4 20590 B14R0.145 CCCCCCC(C)OCCCCC#N 7a_100000210265_100000211819 [0,2,0,0,0,0|1,0,1]=4 20591 B14R0.145 CCCCCCC(C)OCCCCC=O 7a_100000210265_100000139335 [0,2,0,0,0,0|0,0,2]=4 20592 B14R0.145 CCCCCCC(C)OCCCCCBr 34a_100000746331_100011215978 [0,2,0,0,0,0|1,0,0]=3 20593 B14R0.145 CCCCCCC(C)OCCCCCBr 7a_100000746331_100011215978 [0,2,0,0,0,0|1,0,0]=3 20594 B14R0.145 CCCCCCC(C)OCCCCCCl 34a_100000746330_100011215978 [0,2,0,0,0,0|1,0,0]=3 20595 B14R0.145 CCCCCCC(C)OCCCCCCl 7a_100000746330_100011215978 [0,2,0,0,0,0|1,0,0]=3 20596 B14R0.145 CCCCCCC(C)OCCCCCF 34a_100000210265_100000729378 [0,2,0,0,0,0|1,0,0]=3 20597 B14R0.145 CCCCCCC(C)OCCCCCF 7a_100000210265_100000729378 [0,2,0,0,0,0|1,0,0]=3 20598 B14R0.145 CCCCCCC(C)OCCCCCI 34a_200012148887_100011215978 [0,2,0,0,0,0|1,0,0]=3 20599 B14R0.145 CCCCCCC(C)OCCCCCI 7a_200012148887_100011215978 [0,2,0,0,0,0|1,0,0]=3 20600 B14R0.145 CCCCCCC(C)OCCCCCN 34a_100000762737_100011215978 [0,2,0,0,0,0|1,0,0]=3 20601 B14R0.145 CCCCCCC(C)OCCCCCO 34a_100000210265_100000746330 [0,2,0,0,0,0|0,0,0]=2 20602 B14R0.145 CCCCCCC(C)OCCCCCO 7a_100000210265_100000746330 [0,2,0,0,0,0|0,0,0]=2 20603 B14R0.145 CCCCCCC(C)OCCCCOC 34a_100000210265_100000755781 [0,2,0,0,0,0|1,0,0]=3 20604 B14R0.145 CCCCCCC(C)OCCCCOC 34a_100000740925_100011215978 [0,2,0,0,0,0|1,0,0]=3 20605 B14R0.145 CCCCCCC(C)OCCCCOC 7a_100000210265_100000730899 [0,2,0,0,0,0|1,0,0]=3 20606 B14R0.145 CCCCCCC(C)OCCCCSC 34a_100011217163_100011215978 [0,2,0,0,0,0|1,1,0]=4 20607 B14R0.145 CCCCCCC(C)OCCCCSC 7a_100011217163_100011215978 [0,2,0,0,0,0|1,1,0]=4 20608 B14R0.145 CCCCCCC(C)OCCCOCC 34a_100000210265_100012232248 [0,2,0,0,0,0|2,0,0]=4 20609 B14R0.145 CCCCCCC(C)OCCCOCC 34a_100000757476_100011215978 [0,2,0,0,0,0|2,0,0]=4 20610 B14R0.145 CCCCCCC(C)OCCCOCC 7a_100000210265_100012232248 [0,2,0,0,0,0|2,0,0]=4 20611 B14R0.145 CCCCCCC(C)OCCCOCC 7a_100000757476_100011215978 [0,2,0,0,0,0|2,0,0]=4 20612 B14R0.145 CCCCCCC(C)OCCCSCC 34a_100011216438_100011215978 [0,2,0,0,0,0|2,0,0]=4 20613 B14R0.145 CCCCCCC(C)OCCCSCC 7a_100011216438_100011215978 [0,2,0,0,0,0|2,0,0]=4 20614 B14R0.145 CCCCCCC(C)OCCOCCBr 34a_100000692535_100011215978 [0,2,0,0,0,0|2,0,0]=4 20615 B14R0.145 CCCCCCC(C)OCCOCCBr 7a_100000692535_100011215978 [0,2,0,0,0,0|2,0,0]=4 20616 B14R0.145 CCCCCCC(C)OCCOCCC 34a_100000210265_100011215938 [0,2,0,0,0,0|2,0,0]=4 20617 B14R0.145 CCCCCCC(C)OCCOCCC 34a_100000752267_100011215978 [0,2,0,0,0,0|2,0,0]=4 20618 B14R0.145 CCCCCCC(C)OCCOCCC 7a_100000210265_100011215938 [0,2,0,0,0,0|2,0,0]=4 20619 B14R0.145 CCCCCCC(C)OCCOCCC 7a_100000752267_100011215978 [0,2,0,0,0,0|2,0,0]=4 20620 B14R0.145 CCCCCCC(C)OCCOCCCl 34a_100011215305_100011215978 [0,2,0,0,0,0|2,0,0]=4 20621 B14R0.145 CCCCCCC(C)OCCOCCCl 7a_100011215305_100011215978 [0,2,0,0,0,0|2,0,0]=4 20622 B14R0.145 CCCCCCC(C)OCCOCCF 34a_200015357709_100011215978 [0,2,0,0,0,0|2,0,0]=4 20623 B14R0.145 CCCCCCC(C)OCCOCCF 7a_200015357709_100011215978 [0,2,0,0,0,0|2,0,0]=4 20624 B14R0.145 CCCCCCC(C)OCCOCCI 34a_100012149058_100011215978 [0,2,0,0,0,0|2,0,0]=4 20625 B14R0.145 CCCCCCC(C)OCCOCCI 7a_100012149058_100011215978 [0,2,0,0,0,0|2,0,0]=4 20626 B14R0.145 CCCCCCC(C)OCCOCCN 34a_100000211614_100011215978 [0,2,0,0,0,0|2,0,0]=4 20627 B14R0.145 CCCCCCC(C)OCCOCCO 34a_100000210265_100000692535 [0,2,0,0,0,0|1,0,0]=3 20628 B14R0.145 CCCCCCC(C)OCCOCCO 7a_100000210265_100011215305 [0,2,0,0,0,0|1,0,0]=3 20629 B14R0.145 CCCCCCC(C)OCCSCCC 34a_200000230433_100011215978 [0,2,0,0,0,0|2,0,0]=4 20630 B14R0.145 CCCCCCC(C)OCCSCCC 7a_200000230433_100011215978 [0,2,0,0,0,0|2,0,0]=4 20631 B14R0.145 CCCCCCC(C)OCOCCCC 34a_100000210265_100011995733 [0,2,0,0,0,0|2,0,0]=4 20632 B14R0.145 CCCCCCC(C)SCCCCC#N 62a_100011215978_100000211819 [0,2,0,0,0,0|1,0,1]=4 20633 B14R0.145 CCCCCCC(C)SCCCCC#N 62a_100011219923_100011215978 [0,2,0,0,0,0|1,0,1]=4 20634 B14R0.145 CCCCCCC(C)SCCCCC=O 62a_100000139335_100011215978 [0,2,0,0,0,0|0,0,2]=4 20635 B14R0.145 CCCCCCC(C)SCCCCC=O 62a_100011215978_100000139335 [0,2,0,0,0,0|0,0,2]=4 20636 B14R0.145 CCCCCCC(C)SCCCCCF 62a_100000729378_100011215978 [0,2,0,0,0,0|1,0,0]=3 20637 B14R0.145 CCCCCCC(C)SCCCCCF 62a_100011215978_100000729378 [0,2,0,0,0,0|1,0,0]=3 20638 B14R0.145 CCCCCCC(C)SCCCCCO 62a_100000746330_100011215978 [0,2,0,0,0,0|0,0,0]=2 20639 B14R0.145 CCCCCCC(C)SCCCCCO 62a_100011215978_100000746330 [0,2,0,0,0,0|0,0,0]=2 20640 B14R0.145 CCCCCCC(C)SCCCCOC 62a_100000730899_100011215978 [0,2,0,0,0,0|1,0,0]=3 20641 B14R0.145 CCCCCCC(C)SCCCCOC 62a_100011215978_100000730899 [0,2,0,0,0,0|1,0,0]=3 20642 B14R0.145 CCCCCCC(C)SCCCOCC 62a_100011215978_100012232248 [0,2,0,0,0,0|2,0,0]=4 20643 B14R0.145 CCCCCCC(C)SCCCOCC 62a_100012232248_100011215978 [0,2,0,0,0,0|2,0,0]=4 20644 B14R0.145 CCCCCCC(C)SCCOCCC 62a_100011215938_100011215978 [0,2,0,0,0,0|2,0,0]=4 20645 B14R0.145 CCCCCCC(C)SCCOCCC 62a_100011215978_100011215938 [0,2,0,0,0,0|2,0,0]=4 20646 B14R0.145 CCCCCCC(C)SCCOCCO 62a_100011215305_100011215978 [0,2,0,0,0,0|1,0,0]=3 20647 B14R0.145 CCCCCCC(C)SCCOCCO 62a_100011215978_100011215305 [0,2,0,0,0,0|1,0,0]=3 20648 B14R0.145 CCCCCCC(C)SCOCCCC 62a_100011215978_100011995733 [0,2,0,0,0,0|2,0,0]=4 20649 B14R0.145 CCCCCCC(C)SCOCCCC 62a_100011995733_100011215978 [0,2,0,0,0,0|2,0,0]=4 20650 B14R0.145 CCCCCCC(C)SCOCCOC 62a_100000231047_100011215978 [0,2,0,0,0,0|2,0,0]=4 20651 B14R0.145 CCCCCCC(C)SCOCCOC 62a_100011215978_100000231047 [0,2,0,0,0,0|2,0,0]=4 20652 B14R0.145 CCCCCCCC(=O)CCCCC#N 1458a_100000211969_100000211819 [0,2,0,0,0,0|1,0,1]=4 20653 B14R0.145 CCCCCCCC(=O)CCCCCC 1458a_100000211969_100000210757 [0,2,0,0,0,0|1,0,0]=3 20654 B14R0.145 CCCCCCCC(=O)CCCCCC 1458a_100102632555_100000210614 [0,2,0,0,0,0|1,0,0]=3 20655 B14R0.145 CCCCCCCC(=O)CCCCCF 1458a_100000211969_100000729378 [0,2,0,0,0,0|1,0,0]=3 20656 B14R0.145 CCCCCCCC(=O)CCCCCO 1458a_100000211969_100000746330 [0,2,0,0,0,0|0,0,0]=2 20657 B14R0.145 CCCCCCCC(=O)CCCCCO 1458a_100102619762_100000210614 [0,2,0,0,0,0|0,0,0]=2 20658 B14R0.145 CCCCCCCC(=O)CCCCOC 1458a_100000211969_100000755781 [0,2,0,0,0,0|0,0,1]=3 20659 B14R0.145 CCCCCCCC(=O)CCCOCC 1458a_100000211969_100012232248 [0,2,0,0,0,0|1,0,1]=4 20660 B14R0.145 CCCCCCCC(=O)CCOCCC 1458a_100000211969_100011215938 [0,2,0,0,0,0|1,0,1]=4 20661 B14R0.145 CCCCCCCC(=O)CCOCCO 1458a_100000211969_100011215305 [0,2,0,0,0,0|0,0,1]=3 20662 B14R0.145 CCCCCCCC(=O)CCOCCO 1458a_100011229844_100000210614 [0,2,0,0,0,0|0,0,1]=3 20663 B14R0.145 CCCCCCCC(=O)COCCCC 1458a_100000211969_100011995733 [0,2,0,0,0,0|1,0,1]=4 20664 B14R0.145 CCCCCCCC(=O)COCCCC 1458a_100000757543_100000210614 [0,2,0,0,0,0|1,0,1]=4 20665 B14R0.145 CCCCCCCC(=O)COCCOC 1458a_100000211095_100000210614 [0,2,0,0,0,0|1,0,1]=4 20666 B14R0.145 CCCCCCCC(=O)CSCCCC 1458a_100000191162_100000210614 [0,2,0,0,0,0|1,0,1]=4 20667 B14R0.145 CCCCCCCC(=O)NCCCCC 11a_100000209983_100000211969 [0,2,0,0,0,0|1,0,1]=4 20668 B14R0.145 CCCCCCCC(=O)NCCCCC 1626a_100000209983_100000211969 [0,2,0,0,0,0|1,0,1]=4 20669 B14R0.145 CCCCCCCC(=O)NCCCCC 240690a_100000209983_100000211969 [0,2,0,0,0,0|1,0,1]=4 20670 B14R0.145 CCCCCCCC(=O)NCCCCC 527a_100000209983_100000211969 [0,2,0,0,0,0|1,0,1]=4 20671 B14R0.145 CCCCCCCC(=O)NCCCCO 240690a_100000750430_100000211969 [0,2,0,0,0,0|0,0,1]=3 20672 B14R0.145 CCCCCCCC(=O)NCCCCO 527a_100000750430_100000211969 [0,2,0,0,0,0|0,0,1]=3 20673 B14R0.145 CCCCCCCC(=O)NCCCOC 1626a_100150723488_100000211969 [0,2,0,0,0,0|1,0,1]=4 20674 B14R0.145 CCCCCCCC(=O)NCCCOC 240690a_100150723488_100000211969 [0,2,0,0,0,0|1,0,1]=4 20675 B14R0.145 CCCCCCCC(=O)NCCCOC 527a_100150723488_100000211969 [0,2,0,0,0,0|1,0,1]=4 20676 B14R0.145 CCCCCCCC(=O)OCNCCO 2230a_100016997473_100009852258 [0,2,0,0,0,0|1,0,1]=4 20677 B14R0.145 CCCCCCCC(=O)OCNCCO 34a_100016990907_100009852258 [0,2,0,0,0,0|1,0,1]=4 20678 B14R0.145 CCCCCCCC(=O)OCSCCO 62a_100000211926_100009852258 [0,2,0,0,0,0|1,0,1]=4 20679 B14R0.145 CCCCCCCC(C)NCCCCC 2230a_100000209983_200011218727 [0,2,0,0,0,0|1,0,0]=3 20680 B14R0.145 CCCCCCCC(C)NCCCCC 270004a_100000209983_100000210596 [0,2,0,0,0,0|1,0,0]=3 20681 B14R0.145 CCCCCCCC(C)NCCCCO 2230a_100000750430_200011218727 [0,2,0,0,0,0|0,0,0]=2 20682 B14R0.145 CCCCCCCC(C)NCCCCO 270004a_100000750430_100000210596 [0,2,0,0,0,0|0,0,0]=2 20683 B14R0.145 CCCCCCCC(C)NCCCCO 34a_100000750430_200011218727 [0,2,0,0,0,0|0,0,0]=2 20684 B14R0.145 CCCCCCCC(C)NCCCOC 270004a_100150723488_100000210596 [0,2,0,0,0,0|1,0,0]=3 20685 B14R0.145 CCCCCCCC(C)NCCCOC 34a_100150723488_200011218727 [0,2,0,0,0,0|1,0,0]=3 20686 B14R0.145 CCCCCCCC(C)NCCCSC 2230a_100000749238_200011218727 [0,2,0,0,0,0|1,1,0]=4 20687 B14R0.145 CCCCCCCC(C)NCCCSC 270004a_100000749238_100000210596 [0,2,0,0,0,0|1,1,0]=4 20688 B14R0.145 CCCCCCCC(C)NCCOCC 2230a_102516460346_200011218727 [0,2,0,0,0,0|2,0,0]=4 20689 B14R0.145 CCCCCCCC(C)NCCOCC 270004a_102516460346_100000210596 [0,2,0,0,0,0|2,0,0]=4 20690 B14R0.145 CCCCCCCC(C)NCCOCC 34a_102516460346_200011218727 [0,2,0,0,0,0|2,0,0]=4 20691 B14R0.145 CCCCCCCC(C)NCCSCC 2230a_100000106463_200011218727 [0,2,0,0,0,0|2,0,0]=4 20692 B14R0.145 CCCCCCCC(C)NCCSCC 270004a_100000106463_100000210596 [0,2,0,0,0,0|2,0,0]=4 20693 B14R0.145 CCCCCCCC(C)OCC#CCO 34a_200011215852_200000047223 [0,2,0,0,0,0|0,0,2]=4 20694 B14R0.145 CCCCCCCC(C)OCC#CCO 7a_200011215852_200000047223 [0,2,0,0,0,0|0,0,2]=4 20695 B14R0.145 CCCCCCCC(C)OCCCC#N 7a_200011215852_100000687738 [0,2,0,0,0,0|1,0,1]=4 20696 B14R0.145 CCCCCCCC(C)OCCCC=O 7a_200011215852_200011292268 [0,2,0,0,0,0|0,0,2]=4 20697 B14R0.145 CCCCCCCC(C)OCCCCBr 34a_100011216708_200011218727 [0,2,0,0,0,0|1,0,0]=3 20698 B14R0.145 CCCCCCCC(C)OCCCCC 34a_100000210253_200011218727 [0,2,0,0,0,0|1,0,0]=3 20699 B14R0.145 CCCCCCCC(C)OCCCCC 34a_200011215852_100000718602 [0,2,0,0,0,0|1,0,0]=3 20700 B14R0.145 CCCCCCCC(C)OCCCCC 7a_100000210253_200011218727 [0,2,0,0,0,0|1,0,0]=3 20701 B14R0.145 CCCCCCCC(C)OCCCCC 7a_200011215852_100000210326 [0,2,0,0,0,0|1,0,0]=3 20702 B14R0.145 CCCCCCCC(C)OCCCCCl 34a_100000210776_200011218727 [0,2,0,0,0,0|1,0,0]=3 20703 B14R0.145 CCCCCCCC(C)OCCCCCl 7a_100000210776_200011218727 [0,2,0,0,0,0|1,0,0]=3 20704 B14R0.145 CCCCCCCC(C)OCCCCF 34a_100011995726_200011218727 [0,2,0,0,0,0|1,0,0]=3 20705 B14R0.145 CCCCCCCC(C)OCCCCF 34a_200011215852_100000729493 [0,2,0,0,0,0|1,0,0]=3 20706 B14R0.145 CCCCCCCC(C)OCCCCF 7a_100011995726_200011218727 [0,2,0,0,0,0|1,0,0]=3 20707 B14R0.145 CCCCCCCC(C)OCCCCF 7a_200011215852_100000729493 [0,2,0,0,0,0|1,0,0]=3 20708 B14R0.145 CCCCCCCC(C)OCCCCI 34a_200012148704_200011218727 [0,2,0,0,0,0|1,0,0]=3 20709 B14R0.145 CCCCCCCC(C)OCCCCN 34a_100000750430_200011218727 [0,2,0,0,0,0|1,0,0]=3 20710 B14R0.145 CCCCCCCC(C)OCCCCO 34a_200011215852_100011216708 [0,2,0,0,0,0|0,0,0]=2 20711 B14R0.145 CCCCCCCC(C)OCCCCO 7a_200011215852_100000210776 [0,2,0,0,0,0|0,0,0]=2 20712 B14R0.145 CCCCCCCC(C)OCCCNC 34a_100000213112_200011218727 [0,2,0,0,0,0|2,0,0]=4 20713 B14R0.145 CCCCCCCC(C)OCCCOC 34a_100000740835_200011218727 [0,2,0,0,0,0|1,0,0]=3 20714 B14R0.145 CCCCCCCC(C)OCCCOC 34a_200011215852_100000740836 [0,2,0,0,0,0|1,0,0]=3 20715 B14R0.145 CCCCCCCC(C)OCCCOC 7a_200011215852_100000740836 [0,2,0,0,0,0|1,0,0]=3 20716 B14R0.145 CCCCCCCC(C)OCCCSC 34a_100000690336_200011218727 [0,2,0,0,0,0|1,1,0]=4 20717 B14R0.145 CCCCCCCC(C)OCCCSC 7a_100000690336_200011218727 [0,2,0,0,0,0|1,1,0]=4 20718 B14R0.145 CCCCCCCC(C)OCCOCC 34a_100000210136_200011218727 [0,2,0,0,0,0|2,0,0]=4 20719 B14R0.145 CCCCCCCC(C)OCCOCC 34a_200011215852_100000210147 [0,2,0,0,0,0|2,0,0]=4 20720 B14R0.145 CCCCCCCC(C)OCCOCC 7a_100000210136_200011218727 [0,2,0,0,0,0|2,0,0]=4 20721 B14R0.145 CCCCCCCC(C)OCCOCC 7a_200011215852_100011215890 [0,2,0,0,0,0|2,0,0]=4 20722 B14R0.145 CCCCCCCC(C)OCCSCC 34a_100000212035_200011218727 [0,2,0,0,0,0|2,0,0]=4 20723 B14R0.145 CCCCCCCC(C)OCCSCC 34a_200011215852_100000757381 [0,2,0,0,0,0|2,0,0]=4 20724 B14R0.145 CCCCCCCC(C)OCCSCC 7a_100000212035_200011218727 [0,2,0,0,0,0|2,0,0]=4 20725 B14R0.145 CCCCCCCC(C)OCCSCC 7a_200011215852_100000757381 [0,2,0,0,0,0|2,0,0]=4 20726 B14R0.145 CCCCCCCC(C)SCC#CCO 62a_200000047223_200011218727 [0,2,0,0,0,0|0,0,2]=4 20727 B14R0.145 CCCCCCCC(C)SCC#CCO 62a_200011218727_200000047223 [0,2,0,0,0,0|0,0,2]=4 20728 B14R0.145 CCCCCCCC(C)SCCCC#N 62a_100000687738_200011218727 [0,2,0,0,0,0|1,0,1]=4 20729 B14R0.145 CCCCCCCC(C)SCCCC#N 62a_200011218727_100000687738 [0,2,0,0,0,0|1,0,1]=4 20730 B14R0.145 CCCCCCCC(C)SCCCC=O 62a_200011218727_200011292268 [0,2,0,0,0,0|0,0,2]=4 20731 B14R0.145 CCCCCCCC(C)SCCCC=O 62a_200011292268_200011218727 [0,2,0,0,0,0|0,0,2]=4 20732 B14R0.145 CCCCCCCC(C)SCCCCC 62a_100000210326_200011218727 [0,2,0,0,0,0|1,0,0]=3 20733 B14R0.145 CCCCCCCC(C)SCCCCC 62a_200011218727_100000210326 [0,2,0,0,0,0|1,0,0]=3 20734 B14R0.145 CCCCCCCC(C)SCCCCF 62a_100000729493_200011218727 [0,2,0,0,0,0|1,0,0]=3 20735 B14R0.145 CCCCCCCC(C)SCCCCF 62a_200011218727_100000729493 [0,2,0,0,0,0|1,0,0]=3 20736 B14R0.145 CCCCCCCC(C)SCCCCO 62a_100000210776_200011218727 [0,2,0,0,0,0|0,0,0]=2 20737 B14R0.145 CCCCCCCC(C)SCCCCO 62a_200011218727_100000210776 [0,2,0,0,0,0|0,0,0]=2 20738 B14R0.145 CCCCCCCC(C)SCCCOC 62a_100000709357_200011218727 [0,2,0,0,0,0|1,0,0]=3 20739 B14R0.145 CCCCCCCC(C)SCCCOC 62a_200011218727_100000709357 [0,2,0,0,0,0|1,0,0]=3 20740 B14R0.145 CCCCCCCC(C)SCCOCC 62a_100000210147_200011218727 [0,2,0,0,0,0|2,0,0]=4 20741 B14R0.145 CCCCCCCC(C)SCCOCC 62a_200011218727_100011215890 [0,2,0,0,0,0|2,0,0]=4 20742 B14R0.145 CCCCCCCC(C)SCCSCC 62a_100000757381_200011218727 [0,2,0,0,0,0|2,0,0]=4 20743 B14R0.145 CCCCCCCC(C)SCCSCC 62a_200011218727_100000757381 [0,2,0,0,0,0|2,0,0]=4 20744 B14R0.145 CCCCCCCN(C)CCCCC#N 2230a_100000228206_100000211819 [0,2,0,0,0,0|1,0,1]=4 20745 B14R0.145 CCCCCCCN(C)CCCCC#N 269982a_100000228206_100011219923 [0,2,0,0,0,0|1,0,1]=4 20746 B14R0.145 CCCCCCCN(C)CCCCC=O 2230a_100000228206_100000139335 [0,2,0,0,0,0|0,0,2]=4 20747 B14R0.145 CCCCCCCN(C)CCCCC=O 269982a_100000228206_100000139335 [0,2,0,0,0,0|0,0,2]=4 20748 B14R0.145 CCCCCCCN(C)CCCCCC 2230a_100000228206_100000210314 [0,2,0,0,0,0|1,0,0]=3 20749 B14R0.145 CCCCCCCN(C)CCCCCC 2230a_106256046315_100000210681 [0,2,0,0,0,0|1,0,0]=3 20750 B14R0.145 CCCCCCCN(C)CCCCCC 269982a_100000228206_100000210757 [0,2,0,0,0,0|1,0,0]=3 20751 B14R0.145 CCCCCCCN(C)CCCCCC 269982a_106256046315_100000210681 [0,2,0,0,0,0|1,0,0]=3 20752 B14R0.145 CCCCCCCN(C)CCCCCF 2230a_100000228206_100000729378 [0,2,0,0,0,0|1,0,0]=3 20753 B14R0.145 CCCCCCCN(C)CCCCCF 269982a_100000228206_100000729378 [0,2,0,0,0,0|1,0,0]=3 20754 B14R0.145 CCCCCCCN(C)CCCCCO 2230a_100000228206_100000746330 [0,2,0,0,0,0|0,0,0]=2 20755 B14R0.145 CCCCCCCN(C)CCCCCO 2230a_100000722520_100000210681 [0,2,0,0,0,0|0,0,0]=2 20756 B14R0.145 CCCCCCCN(C)CCCCCO 269982a_100000228206_100000746330 [0,2,0,0,0,0|0,0,0]=2 20757 B14R0.145 CCCCCCCN(C)CCCCCO 269982a_100000722520_100000210681 [0,2,0,0,0,0|0,0,0]=2 20758 B14R0.145 CCCCCCCN(C)CCCCOC 2230a_100000228206_100000730899 [0,2,0,0,0,0|1,0,0]=3 20759 B14R0.145 CCCCCCCN(C)CCCCOC 269982a_100000228206_100000730899 [0,2,0,0,0,0|1,0,0]=3 20760 B14R0.145 CCCCCCCN(C)CCCOCC 2230a_100000228206_100012232248 [0,2,0,0,0,0|2,0,0]=4 20761 B14R0.145 CCCCCCCN(C)CCCOCC 269982a_100000228206_100012232248 [0,2,0,0,0,0|2,0,0]=4 20762 B14R0.145 CCCCCCCN(C)CCOCCC 2230a_100000228206_100011215938 [0,2,0,0,0,0|2,0,0]=4 20763 B14R0.145 CCCCCCCN(C)CCOCCC 269982a_100000228206_100011215938 [0,2,0,0,0,0|2,0,0]=4 20764 B14R0.145 CCCCCCCN(C)CCOCCO 2230a_100000228057_100000210681 [0,2,0,0,0,0|1,0,0]=3 20765 B14R0.145 CCCCCCCN(C)CCOCCO 2230a_100000228206_100011215305 [0,2,0,0,0,0|1,0,0]=3 20766 B14R0.145 CCCCCCCN(C)CCOCCO 269982a_100000228057_100000210681 [0,2,0,0,0,0|1,0,0]=3 20767 B14R0.145 CCCCCCCN(C)CCOCCO 269982a_100000228206_100011215305 [0,2,0,0,0,0|1,0,0]=3 20768 B14R0.145 CCCCCCCN(C)COCCCC 2230a_100000228206_100011995733 [0,2,0,0,0,0|2,0,0]=4 20769 B14R0.145 CCCCCCCN(C)COCCCC 269982a_100000228206_100011995733 [0,2,0,0,0,0|2,0,0]=4 20770 B14R0.145 CCCCCCCN(C)COCCOC 2230a_100000228206_100000231047 [0,2,0,0,0,0|2,0,0]=4 20771 B14R0.145 CCCCCCCN(C)COCCOC 269982a_100000228206_100000231047 [0,2,0,0,0,0|2,0,0]=4 20772 B14R0.145 CCCCCCN(C)CCCCCC#N 2230a_106256046315_100009813376 [0,2,0,0,0,0|1,0,1]=4 20773 B14R0.145 CCCCCCN(C)CCCCCC#N 269982a_106256046315_100009813376 [0,2,0,0,0,0|1,0,1]=4 20774 B14R0.145 CCCCCCN(C)CCCCCC=O 2230a_106256046315_100000139337 [0,2,0,0,0,0|0,0,2]=4 20775 B14R0.145 CCCCCCN(C)CCCCCC=O 269982a_106256046315_100000139337 [0,2,0,0,0,0|0,0,2]=4 20776 B14R0.145 CCCCCCN(C)CCCCCCF 2230a_106256046315_100015922095 [0,2,0,0,0,0|1,0,0]=3 20777 B14R0.145 CCCCCCN(C)CCCCCCF 269982a_106256046315_100015922095 [0,2,0,0,0,0|1,0,0]=3 20778 B14R0.145 CCCCCCN(C)CCCCCCO 2230a_106256046315_100000766143 [0,2,0,0,0,0|0,0,0]=2 20779 B14R0.145 CCCCCCN(C)CCCCCCO 269982a_106256046315_100000766143 [0,2,0,0,0,0|0,0,0]=2 20780 B14R0.145 CCCCCCN(C)CCOCCCC 2230a_106256046315_100000743108 [0,2,0,0,0,0|2,0,0]=4 20781 B14R0.145 CCCCCCN(C)CCOCCCC 269982a_106256046315_100000743108 [0,2,0,0,0,0|2,0,0]=4 20782 B14R0.145 CCCCCCN(C)CCOCCOC 2230a_106256046315_100000695917 [0,2,0,0,0,0|2,0,0]=4 20783 B14R0.145 CCCCCCN(C)CCOCCOC 269982a_106256046315_100000695917 [0,2,0,0,0,0|2,0,0]=4 20784 B14R0.145 CCCCCCNC(=O)CCCCCC 11a_100000210581_100102632555 [0,2,0,0,0,0|1,0,1]=4 20785 B14R0.145 CCCCCCNC(=O)CCCCCC 1626a_100000210581_100102632555 [0,2,0,0,0,0|1,0,1]=4 20786 B14R0.145 CCCCCCNC(=O)CCCCCC 240690a_100000210581_100102632555 [0,2,0,0,0,0|1,0,1]=4 20787 B14R0.145 CCCCCCNC(=O)CCCCCC 527a_100000210581_100102632555 [0,2,0,0,0,0|1,0,1]=4 20788 B14R0.145 CCCCCCNC(=O)CCCCCO 240690a_100000210581_100102619762 [0,2,0,0,0,0|0,0,1]=3 20789 B14R0.145 CCCCCCNC(=O)CCOCCO 1626a_100000210581_100011229844 [0,2,0,0,0,0|1,0,1]=4 20790 B14R0.145 CCCCCCNC(=O)CCOCCO 240690a_100000210581_100011229844 [0,2,0,0,0,0|1,0,1]=4 20791 B14R0.145 CCCCCCNC(=O)CSCCCO 62a_100000230325_100011215043 [0,2,0,0,0,0|1,0,1]=4 20792 B14R0.145 CCCCCCNC(=O)NCCCCO 2708a_100000210581_100000750430 [0,2,0,0,0,0|1,0,1]=4 20793 B14R0.145 CCCCCCNC(=O)NCCCCO 2708a_100000750430_100000210581 [0,2,0,0,0,0|1,0,1]=4 20794 B14R0.145 CCCCCCNC(=O)NCCCCO 273464a_100000210581_100000750430 [0,2,0,0,0,0|1,0,1]=4 20795 B14R0.145 CCCCCCNC(=O)NCCCCO 273464a_100000750430_100000210581 [0,2,0,0,0,0|1,0,1]=4 20796 B14R0.145 CCCCCCNC(=O)NCCCCO 512a_100000210581_100000750430 [0,2,0,0,0,0|1,0,1]=4 20797 B14R0.145 CCCCCCNC(=O)NCCCCO 512a_100000750430_100000210581 [0,2,0,0,0,0|1,0,1]=4 20798 B14R0.145 CCCCCCNC(C)CCCCCC 2230a_100000210581_100011215978 [0,2,0,0,0,0|1,0,0]=3 20799 B14R0.145 CCCCCCNC(C)CCCCCC 2230a_100000210919_100000210314 [0,2,0,0,0,0|1,0,0]=3 20800 B14R0.145 CCCCCCNC(C)CCCCCC 270004a_100000210581_100000210826 [0,2,0,0,0,0|1,0,0]=3 20801 B14R0.145 CCCCCCNC(C)CCCCCC 34a_100000210919_100000210314 [0,2,0,0,0,0|1,0,0]=3 20802 B14R0.145 CCCCCCOC(C)CCCCCC 34a_100000210259_100011215978 [0,2,0,0,0,0|1,0,0]=3 20803 B14R0.145 CCCCCCOC(C)CCCCCC 34a_100000210265_100000210314 [0,2,0,0,0,0|1,0,0]=3 20804 B14R0.145 CCCCCCOC(C)CCCCCC 7a_100000210259_100011215978 [0,2,0,0,0,0|1,0,0]=3 20805 B14R0.145 CCCCCCOC(C)CCCCCC 7a_100000210265_100000210314 [0,2,0,0,0,0|1,0,0]=3 20806 B14R0.145 CCCCCCOC(C)COCCCC 34a_100011217071_100000210314 [0,2,0,0,0,0|2,0,0]=4 20807 B14R0.145 CCCCCCOC(C)COCCCC 7a_100011217071_100000210314 [0,2,0,0,0,0|2,0,0]=4 20808 B14R0.145 CCCCCCSC(C)CCCCCC 62a_100000210314_100011215978 [0,2,0,0,0,0|1,0,0]=3 20809 B14R0.145 CCCCCCSC(C)CCCCCC 62a_100011215978_100000210757 [0,2,0,0,0,0|1,0,0]=3 20810 B14R0.145 CCCCCNC(=O)CCCCCCO 240690a_100000209983_100011996774 [0,2,0,0,0,0|0,0,1]=3 20811 B14R0.145 CCCCCNC(=O)CCCCCOC 11a_100000209983_100011935119 [0,2,0,0,0,0|1,0,1]=4 20812 B14R0.145 CCCCCNC(=O)CCCCCOC 1626a_100000209983_100011935119 [0,2,0,0,0,0|1,0,1]=4 20813 B14R0.145 CCCCCNC(=O)CCCCCOC 240690a_100000209983_100011935119 [0,2,0,0,0,0|1,0,1]=4 20814 B14R0.145 CCCCCNC(=O)CCCCCOC 527a_100000209983_100011935119 [0,2,0,0,0,0|1,0,1]=4 20815 B14R0.145 CCCCCNC(=O)CNCCCCO 2230a_100000750430_100000230301 [0,2,0,0,0,0|1,0,1]=4 20816 B14R0.145 CCCCCNC(=O)CNCCCCO 34a_100000750430_100000230301 [0,2,0,0,0,0|1,0,1]=4 20817 B14R0.145 CCCCCNC(=O)CSCCCCO 62a_100000210776_100000230301 [0,2,0,0,0,0|1,0,1]=4 20818 B14R0.145 CCCCCNC(=O)CSCCCCO 62a_100000230301_100000210776 [0,2,0,0,0,0|1,0,1]=4 20819 B14R0.145 CCCCCNC(=O)NCCCCCO 2708a_100000209983_100000762737 [0,2,0,0,0,0|1,0,1]=4 20820 B14R0.145 CCCCCNC(=O)NCCCCCO 273464a_100000209983_100000762737 [0,2,0,0,0,0|1,0,1]=4 20821 B14R0.145 CCCCCNC(=O)NCCCCCO 273464a_100000762737_100000209983 [0,2,0,0,0,0|1,0,1]=4 20822 B14R0.145 CCCCCNC(=O)NCCCCCO 512a_100000209983_100000762737 [0,2,0,0,0,0|1,0,1]=4 20823 B14R0.145 CCCCCNC(=O)NCCCCCO 512a_100000762737_100000209983 [0,2,0,0,0,0|1,0,1]=4 20824 B14R0.145 CCCCCNNC(=O)CCCCCO 22a_100000694160_100102619762 [0,2,0,0,0,0|1,0,1]=4 20825 B14R0.145 CCCCOCC(=O)CCCCCCF 1458a_100000757543_100015922095 [0,2,0,0,0,0|1,0,1]=4 20826 B14R0.145 CCCCOCC(=O)CCCCCCO 1458a_100000757543_100000766143 [0,2,0,0,0,0|0,0,1]=3 20827 B14R0.145 CCCCOCC(=O)CCCCCCO 1458a_100011996774_100011995733 [0,2,0,0,0,0|0,0,1]=3 20828 B14R0.145 CCCCOCC(=O)CCCCCOC 1458a_100011935119_100011995733 [0,2,0,0,0,0|1,0,1]=4 20829 B14R0.145 CCCCOCC(=O)NCCCCCO 240690a_100000762737_100000757543 [0,2,0,0,0,0|1,0,1]=4 20830 B14R0.145 CCCCOCC(C)OCCCCCF 34a_100011217071_100000729378 [0,2,0,0,0,0|2,0,0]=4 20831 B14R0.145 CCCCOCC(C)OCCCCCF 7a_100011217071_100000729378 [0,2,0,0,0,0|2,0,0]=4 20832 B14R0.145 CCCCOCC(C)OCCCCCO 34a_100011217071_100000746330 [0,2,0,0,0,0|1,0,0]=3 20833 B14R0.145 CCCCOCC(C)OCCCCCO 7a_100011217071_100000746330 [0,2,0,0,0,0|1,0,0]=3 20834 B14R0.145 CCCCOCC(C)OCCCCOC 34a_100011217071_100000755781 [0,2,0,0,0,0|2,0,0]=4 20835 B14R0.145 CCCCOCC(C)OCCCCOC 7a_100011217071_100000730899 [0,2,0,0,0,0|2,0,0]=4 20836 B14R0.145 CCCCOCC(C)OCCOCCO 34a_100011217071_100000692535 [0,2,0,0,0,0|2,0,0]=4 20837 B14R0.145 CCCCOCC(C)OCCOCCO 7a_100011217071_100011215305 [0,2,0,0,0,0|2,0,0]=4 20838 B14R0.145 CCCCOCCC(=O)CCCCCO 1458a_100102619762_100000743108 [0,2,0,0,0,0|0,0,1]=3 20839 B14R0.145 CCCCOCCC(=O)CCOCCO 1458a_100011229844_100000743108 [0,2,0,0,0,0|1,0,1]=4 20840 B14R0.145 CCCCOCCN(C)CCCCCO 2230a_100000722520_100000743108 [0,2,0,0,0,0|1,0,0]=3 20841 B14R0.145 CCCCOCCN(C)CCCCCO 269982a_100000722520_100000743108 [0,2,0,0,0,0|1,0,0]=3 20842 B14R0.145 CCCCOCCN(C)CCOCCO 2230a_100000228057_100000743108 [0,2,0,0,0,0|2,0,0]=4 20843 B14R0.145 CCCCOCCN(C)CCOCCO 269982a_100000228057_100000743108 [0,2,0,0,0,0|2,0,0]=4 20844 B14R0.145 CCCCSCC(=O)CCCCCCF 1458a_100000191162_100015922095 [0,2,0,0,0,0|1,0,1]=4 20845 B14R0.145 CCCCSCC(=O)CCCCCCO 1458a_100000191162_100000766143 [0,2,0,0,0,0|0,0,1]=3 20846 B14R0.145 CCCCSCC(=O)NCCCCCO 240690a_100000762737_100000191162 [0,2,0,0,0,0|1,0,1]=4 20847 B14R0.145 CCCOCCC(=O)CCCCCCO 1458a_100011996774_100011215938 [0,2,0,0,0,0|0,0,1]=3 20848 B14R0.145 CCCOCCC(=O)CCCCCOC 1458a_100011935119_100011215938 [0,2,0,0,0,0|1,0,1]=4 20849 B14R0.145 CCCOCCNC(=O)CCCCCO 240690a_100161115042_100102619762 [0,2,0,0,0,0|1,0,1]=4 20850 B14R0.145 CCCSCCNC(=O)CCCCCO 240690a_100020603323_100102619762 [0,2,0,0,0,0|1,0,1]=4 20851 B14R0.145 CCOCCCC(=O)CCCCCCO 1458a_100011996774_100012232248 [0,2,0,0,0,0|0,0,1]=3 20852 B14R0.145 CCOCCCC(=O)CCCCCOC 1458a_100011935119_100012232248 [0,2,0,0,0,0|1,0,1]=4 20853 B14R0.145 CCOCCCNC(=O)CCCCCO 240690a_100000210961_100102619762 [0,2,0,0,0,0|1,0,1]=4 20854 B14R0.145 CCOCCNC(=O)CCCCCCO 240690a_100011200944_100011996774 [0,2,0,0,0,0|1,0,1]=4 20855 B14R0.145 CCSCCNC(=O)CCCCCCO 240690a_100000106463_100011996774 [0,2,0,0,0,0|1,0,1]=4 20856 B14R0.145 CN(CCCCCCF)CCOCCO 2230a_100000228057_100015922095 [0,2,0,0,0,0|2,0,0]=4 20857 B14R0.145 CN(CCCCCCF)CCOCCO 269982a_100000228057_100015922095 [0,2,0,0,0,0|2,0,0]=4 20858 B14R0.145 CN(CCCCCCO)CCOCCO 2230a_100000228057_100000766143 [0,2,0,0,0,0|2,0,0]=4 20859 B14R0.145 CN(CCCCCCO)CCOCCO 269982a_100000228057_100000766143 [0,2,0,0,0,0|2,0,0]=4 20860 B14R0.145 CN(CCCCCO)CCCCCC#N 2230a_100000722520_100009813376 [0,2,0,0,0,0|1,0,1]=4 20861 B14R0.145 CN(CCCCCO)CCCCCC#N 269982a_100000722520_100009813376 [0,2,0,0,0,0|1,0,1]=4 20862 B14R0.145 CN(CCCCCO)CCCCCC=O 2230a_100000722520_100000139337 [0,2,0,0,0,0|1,0,1]=4 20863 B14R0.145 CN(CCCCCO)CCCCCC=O 269982a_100000722520_100000139337 [0,2,0,0,0,0|1,0,1]=4 20864 B14R0.145 CN(CCCCCO)CCCCCCF 2230a_100000722520_100015922095 [0,2,0,0,0,0|1,0,0]=3 20865 B14R0.145 CN(CCCCCO)CCCCCCF 269982a_100000722520_100015922095 [0,2,0,0,0,0|1,0,0]=3 20866 B14R0.145 CN(CCCCCO)CCCCCCO 2230a_100000722520_100000766143 [0,2,0,0,0,0|1,0,0]=3 20867 B14R0.145 CN(CCCCCO)CCCCCCO 269982a_100000722520_100000766143 [0,2,0,0,0,0|1,0,0]=3 20868 B14R0.145 COCCCCC(=O)CCCCCCO 1458a_100011996774_100000755781 [0,2,0,0,0,0|0,0,1]=3 20869 B14R0.145 COCCCCCC(=O)CCCCCF 1458a_100011935119_100000729378 [0,2,0,0,0,0|1,0,1]=4 20870 B14R0.145 COCCCCCC(=O)CCCCCO 1458a_100011935119_100000746330 [0,2,0,0,0,0|0,0,1]=3 20871 B14R0.145 COCCCCCC(=O)CCCCOC 1458a_100011935119_100000755781 [0,2,0,0,0,0|1,0,1]=4 20872 B14R0.145 COCCCCCC(=O)CCOCCO 1458a_100011935119_100011215305 [0,2,0,0,0,0|1,0,1]=4 20873 B14R0.145 COCCCCCC(=O)NCCCCO 240690a_100000750430_100011935119 [0,2,0,0,0,0|1,0,1]=4 20874 B14R0.145 COCCCCCC(=O)NCCCCO 527a_100000750430_100011935119 [0,2,0,0,0,0|1,0,1]=4 20875 B14R0.145 COCCCNC(=O)CCCCCCO 240690a_100150723488_100011996774 [0,2,0,0,0,0|1,0,1]=4 20876 B14R0.145 COCCOCC(=O)CCCCCCO 1458a_100000211095_100000766143 [0,2,0,0,0,0|1,0,1]=4 20877 B14R0.145 COCCOCCC(=O)CCCCCO 1458a_100000745395_100000746330 [0,2,0,0,0,0|1,0,1]=4 20878 B14R0.145 COCCOCCC(=O)CCCCCO 1458a_100102619762_100000695917 [0,2,0,0,0,0|1,0,1]=4 20879 B14R0.145 COCCOCCN(C)CCCCCO 2230a_100000722520_100000695917 [0,2,0,0,0,0|2,0,0]=4 20880 B14R0.145 COCCOCCN(C)CCCCCO 269982a_100000722520_100000695917 [0,2,0,0,0,0|2,0,0]=4 20881 B14R0.145 CSCCCNC(=O)CCCCCCO 240690a_100000749238_100011996774 [0,2,0,0,0,0|1,0,1]=4 20882 B14R0.145 N#CCCCCC(=O)CCCCCCO 1458a_100011996774_100000211819 [0,2,0,0,0,0|0,0,2]=4 20883 B14R0.145 N#CCCCCCC(=O)CCCCCO 1458a_100102619762_100009813376 [0,2,0,0,0,0|0,0,2]=4 20884 B14R0.145 O=C(CCCCCCF)CCOCCO 1458a_100011229844_100015922095 [0,2,0,0,0,0|1,0,1]=4 20885 B14R0.145 O=C(CCCCCCO)CCOCCO 1458a_100011229844_100000766143 [0,2,0,0,0,0|1,0,1]=4 20886 B14R0.145 O=C(CCCCCCO)CCOCCO 1458a_100011996774_100011215305 [0,2,0,0,0,0|1,0,1]=4 20887 B14R0.145 O=C(CCCCCCO)NCCCCO 240690a_100000750430_100011996774 [0,2,0,0,0,0|1,0,1]=4 20888 B14R0.145 O=C(CCCCCF)CCCCCCO 1458a_100011996774_100000729378 [0,2,0,0,0,0|0,0,1]=3 20889 B14R0.145 O=C(CCCCCO)CCCCCCF 1458a_100102619762_100015922095 [0,2,0,0,0,0|0,0,1]=3 20890 B14R0.145 O=C(CCCCCO)CCCCCCO 1458a_100011996774_100000746330 [0,2,0,0,0,0|0,0,1]=3 20891 B14R0.145 O=C(CCCCCO)CCCCCCO 1458a_100102619762_100000766143 [0,2,0,0,0,0|0,0,1]=3 20892 B14R0.145 O=C(CCCCCO)NCCCCCO 240690a_100000762737_100102619762 [0,2,0,0,0,0|1,0,1]=4 20893 B14R0.953 C#CC(CCCCCBr)OCCCCC 34a_200010408556_100000718602 [0,2,0,0,0,0|2,0,0]=4 20894 B14R0.953 C#CC(CCCCCBr)OCCCCC 7a_200010408556_100000210326 [0,2,0,0,0,0|2,0,0]=4 20895 B14R0.953 C#CC(CCCCCBr)OCCCCO 34a_200010408556_100011216708 [0,2,0,0,0,0|2,0,0]=4 20896 B14R0.953 C#CC(CCCCCBr)OCCCCO 7a_200010408556_100000210776 [0,2,0,0,0,0|2,0,0]=4 20897 B14R0.953 C=CC(CCCCCC)OCCCCC 34a_200011215977_100000718602 [0,2,0,0,0,0|2,0,0]=4 20898 B14R0.953 C=CC(CCCCCC)OCCCCC 7a_200011215977_100000210326 [0,2,0,0,0,0|2,0,0]=4 20899 B14R0.953 C=CC(CCCCCC)OCCCCF 34a_200011215977_100000729493 [0,2,0,0,0,0|2,0,0]=4 20900 B14R0.953 C=CC(CCCCCC)OCCCCF 7a_200011215977_100000729493 [0,2,0,0,0,0|2,0,0]=4 20901 B14R0.953 C=CC(CCCCCC)OCCCCO 34a_200011215977_100011216708 [0,2,0,0,0,0|1,0,0]=3 20902 B14R0.953 C=CC(CCCCCC)OCCCCO 7a_200011215977_100000210776 [0,2,0,0,0,0|1,0,0]=3 20903 B14R0.953 CCCCCCC(CC)NCCCCC 270004a_100000209983_100011219640 [0,2,0,0,0,0|2,0,0]=4 20904 B14R0.953 CCCCCCC(CC)NCCCCO 270004a_100000750430_100011219640 [0,2,0,0,0,0|1,0,0]=3 20905 B14R0.953 CCCCCCC(CC)OCCCCC 34a_100011215785_100000718602 [0,2,0,0,0,0|2,0,0]=4 20906 B14R0.953 CCCCCCC(CC)OCCCCC 7a_100011215785_100000210326 [0,2,0,0,0,0|2,0,0]=4 20907 B14R0.953 CCCCCCC(CC)OCCCCF 34a_100011215785_100000729493 [0,2,0,0,0,0|2,0,0]=4 20908 B14R0.953 CCCCCCC(CC)OCCCCF 7a_100011215785_100000729493 [0,2,0,0,0,0|2,0,0]=4 20909 B14R0.953 CCCCCCC(CC)OCCCCO 34a_100011215785_100011216708 [0,2,0,0,0,0|1,0,0]=3 20910 B14R0.953 CCCCCCC(CC)OCCCCO 7a_100011215785_100000210776 [0,2,0,0,0,0|1,0,0]=3 20911 B14R0.953 CCCCCCC(CCCCCC)NC 2230a_100012281684_200000210301 [0,2,0,0,0,0|1,0,0]=3 20912 B14R0.953 CCCCCCC(CCCCCC)NC 270004a_106832991635_100000210595 [0,2,0,0,0,0|1,0,0]=3 20913 B14R0.953 CCCCCCC(CCCCCC)NC 34a_100012281684_200000210301 [0,2,0,0,0,0|1,0,0]=3 20914 B14R0.953 CCCCCCC(CCCCCC)N[13CH3] 2230a_100012281684_200025704644 [0,2,0,0,0,0|1,0,0]=3 20915 B14R0.953 CCCCCCC(CCCCCC)N[13CH3] 34a_100012281684_200025704644 [0,2,0,0,0,0|1,0,0]=3 20916 B14R0.953 CCCCCCC(CCCCCC)OC 34a_100012225636_200000210301 [0,2,0,0,0,0|1,0,0]=3 20917 B14R0.953 CCCCCCC(CCCCCC)OC 7a_100012225636_200000210301 [0,2,0,0,0,0|1,0,0]=3 20918 B14R0.953 CCCCCCC(CCCCCC)O[13CH3] 34a_100012225636_200025704644 [0,2,0,0,0,0|1,0,0]=3 20919 B14R0.953 CCCCCCC(CCCCCC)O[13CH3] 7a_100012225636_200025704644 [0,2,0,0,0,0|1,0,0]=3 20920 B14R0.953 CCCCCCN(CC)CCCCCC 2230a_100000210582_100000210202 [0,2,0,0,0,0|2,0,0]=4 20921 B14R0.953 CCCCCCN(CC)CCCCCC 269982a_100000210582_100000204670 [0,2,0,0,0,0|2,0,0]=4 20922 B14R0.953 CCCCCCN(CF)CCCCCC 269982a_100000210582_100015361967 [0,2,0,0,0,0|2,0,0]=4 20923 B14R0.2151 CC(C)(CCCCCBr)OCCCCO 7a_100010402123_100000210776 [0,2,0,0,0,0|2,0,0]=4 20924 B14R0.2151 CCCCCCC(C)(C)OCCCCC 7a_200011995690_100000210326 [0,2,0,0,0,0|2,0,0]=4 20925 B14R0.2151 CCCCCCC(C)(C)OCCCCF 7a_200011995690_100000729493 [0,2,0,0,0,0|2,0,0]=4 20926 B14R0.2151 CCCCCCC(C)(C)OCCCCO 7a_200011995690_100000210776 [0,2,0,0,0,0|1,0,0]=3 20927 B14R0.2151 CCCCCCS(=O)(=O)NCCCCO 270084a_100000750430_100011361803 [0,2,0,0,0,0|2,0,0]=4 20928 B14R0.2151 CCCCCCS(=O)(=O)NCCCCO 274078a_100000750430_100011361803 [0,2,0,0,0,0|2,0,0]=4 20929 B14R0.2151 CCCCCOC(C)(C)CCCCCBr 7a_100010402123_100000210326 [0,2,0,0,0,0|2,0,0]=4 20930 B14R0.2256 CCCCCC(=O)N(C)CCCCCO 240690a_100000722520_100000212188 [0,2,0,0,0,0|1,0,1]=4 20931 B14R0.2256 CCCCCC(C)C(=O)CCCCCF 1458a_100011215998_100000729378 [0,2,0,0,0,0|1,0,1]=4 20932 B14R0.2256 CCCCCC(C)C(=O)CCCCCO 1458a_100011215998_100000746330 [0,2,0,0,0,0|0,0,1]=3 20933 B14R0.2256 CCCCCC(C)C(=O)CCCCCO 1458a_100102619762_200011218191 [0,2,0,0,0,0|0,0,1]=3 20934 B14R0.2256 CCCCCC(C)C(=O)CCOCCO 1458a_100011215998_100011215305 [0,2,0,0,0,0|1,0,1]=4 20935 B14R0.2256 CCCCCC(C)C(=O)CCOCCO 1458a_100011229844_200011218191 [0,2,0,0,0,0|1,0,1]=4 20936 B14R0.2256 CCCCCC(C)C(=O)NCCCCO 240690a_100000750430_100011215998 [0,2,0,0,0,0|1,0,1]=4 20937 B14R0.2256 CCCCCC(C)C(=O)NCCCCO 527a_100000750430_100011215998 [0,2,0,0,0,0|1,0,1]=4 20938 B14R0.2256 CCCCCC(C)N(C)CCCCCO 2230a_100000722520_200011218191 [0,2,0,0,0,0|1,0,0]=3 20939 B14R0.2256 CCCCCC(C)N(C)CCCCCO 269982a_100000722520_200011218191 [0,2,0,0,0,0|1,0,0]=3 20940 B14R0.2256 CCCCCC(C)N(C)CCCCCO 270004a_100000722520_100000211708 [0,2,0,0,0,0|1,0,0]=3 20941 B14R0.2256 CCCCCC(C)N(C)CCOCCO 2230a_100000228057_200011218191 [0,2,0,0,0,0|2,0,0]=4 20942 B14R0.2256 CCCCCC(C)N(C)CCOCCO 269982a_100000228057_200011218191 [0,2,0,0,0,0|2,0,0]=4 20943 B14R0.2256 CCCCCC(C)N(C)CCOCCO 270004a_100000228057_100000211708 [0,2,0,0,0,0|2,0,0]=4 20944 B14R0.2256 CCCCCCC(=O)C(C)CCCCC 1458a_100011215998_100000210757 [0,2,0,0,0,0|1,0,1]=4 20945 B14R0.2256 CCCCCCC(=O)C(C)CCCCC 1458a_100102632555_200011218191 [0,2,0,0,0,0|1,0,1]=4 20946 B14R0.2256 CCCCCCC(=O)N(C)CCCCO 240690a_100000717598_100102632555 [0,2,0,0,0,0|1,0,1]=4 20947 B14R0.2256 CCCCCCC(C)C(=O)CCCCC 1458a_100000212188_100011215978 [0,2,0,0,0,0|1,0,1]=4 20948 B14R0.2256 CCCCCCC(C)C(=O)CCCCO 1458a_100000695505_100011215978 [0,2,0,0,0,0|0,0,1]=3 20949 B14R0.2256 CCCCCCC(C)C(=O)COCCO 1458a_100000708028_100011215978 [0,2,0,0,0,0|1,0,1]=4 20950 B14R0.2256 CCCCCCC(C)N(C)CCCCC 2230a_100000223495_100011215978 [0,2,0,0,0,0|2,0,0]=4 20951 B14R0.2256 CCCCCCC(C)N(C)CCCCC 269982a_100000223495_100011215978 [0,2,0,0,0,0|2,0,0]=4 20952 B14R0.2256 CCCCCCC(C)N(C)CCCCC 270004a_100000223495_100000210826 [0,2,0,0,0,0|2,0,0]=4 20953 B14R0.2256 CCCCCCC(C)N(C)CCCCO 2230a_100000717598_100011215978 [0,2,0,0,0,0|1,0,0]=3 20954 B14R0.2256 CCCCCCC(C)N(C)CCCCO 269982a_100000717598_100011215978 [0,2,0,0,0,0|1,0,0]=3 20955 B14R0.2256 CCCCCCC(C)N(C)CCCCO 270004a_100000717598_100000210826 [0,2,0,0,0,0|1,0,0]=3 20956 B14R0.2256 CCCCCCC(O)C(=O)CCCCC 1458a_100011215828_100000210326 [0,2,0,0,0,0|1,0,1]=4 20957 B14R0.2256 CCCCCCC(O)C(=O)CCCCF 1458a_100011215828_100000729493 [0,2,0,0,0,0|1,0,1]=4 20958 B14R0.2256 CCCCCCC(O)C(=O)CCCCO 1458a_100011215828_100000210776 [0,2,0,0,0,0|0,0,1]=3 20959 B14R0.2256 CCCCCCC(O)C(=O)NCCCO 240690a_100000182051_100011215828 [0,2,0,0,0,0|1,0,1]=4 20960 B14R0.2256 CCCCCCN(C)C(=O)CCCCO 1626a_106256046315_100000695505 [0,2,0,0,0,0|1,0,1]=4 20961 B14R0.2256 CCCCCCN(C)C(C)CCCCC 2230a_106256046315_200011218191 [0,2,0,0,0,0|2,0,0]=4 20962 B14R0.2256 CCCCCCN(C)C(C)CCCCC 269982a_106256046315_200011218191 [0,2,0,0,0,0|2,0,0]=4 20963 B14R0.2256 CCCCCCN(C)C(C)CCCCC 270004a_106256046315_100000211708 [0,2,0,0,0,0|2,0,0]=4 20964 B14R0.2256 CCCCCN(C)C(=O)CCCCCO 240690a_100000223495_100102619762 [0,2,0,0,0,0|1,0,1]=4 20965 B14R0.2256 CCCCSC(C)C(=O)CCCCCO 1458a_100000191163_100000746330 [0,2,0,0,0,0|1,0,1]=4 20966 B14R0.2256 CCCSCC(C)N(C)CCCCCO 270004a_100000722520_100011343953 [0,2,0,0,0,0|2,0,0]=4 20967 B14R0.2256 CCOCCC(C)N(C)CCCCCO 270004a_100000722520_200011216536 [0,2,0,0,0,0|2,0,0]=4 20968 B14R0.2256 CSCCCC(C)N(C)CCCCCO 270004a_100000722520_100011399439 [0,2,0,0,0,0|2,0,0]=4 20969 B14R0.392 C#CCCCCCCCCCCOCC 34a_100000054667_100000210202 [0,2,0,0,0,0|1,0,0]=3 20970 B14R0.392 C#CCCCCCCCCCCOCC 7a_100000054667_100000210202 [0,2,0,0,0,0|1,0,0]=3 20971 B14R0.392 C#CCCCCCCCCCCOCF 34a_100000054667_100015361967 [0,2,0,0,0,0|0,0,2]=4 20972 B14R0.392 C#CCCCCCCCCCCOCF 7a_100000054667_100015361967 [0,2,0,0,0,0|0,0,2]=4 20973 B14R0.392 C#CCCCCCCCCCOCCC 34a_100000034437_100000210303 [0,2,0,0,0,0|1,0,0]=3 20974 B14R0.392 C#CCCCCCCCCCOCCC 7a_100000034437_100000210303 [0,2,0,0,0,0|1,0,0]=3 20975 B14R0.392 C#CCCCCCCCCCOCCF 34a_100000034437_100011217306 [0,2,0,0,0,0|1,0,1]=4 20976 B14R0.392 C#CCCCCCCCCCOCCF 7a_100000034437_100011217306 [0,2,0,0,0,0|1,0,1]=4 20977 B14R0.392 C#CCCCCCCCCCOCCO 34a_100000034437_100000211926 [0,2,0,0,0,0|0,0,1]=3 20978 B14R0.392 C#CCCCCCCCCCOCCO 7a_100000034437_100000211926 [0,2,0,0,0,0|0,0,1]=3 20979 B14R0.392 C#CCCCCCCCCCOCSC 34a_100000034437_100011218213 [0,2,0,0,0,0|1,0,1]=4 20980 B14R0.392 C#CCCCCCCCCOCCCC 34a_100000065265_100000210210 [0,2,0,0,0,0|1,0,0]=3 20981 B14R0.392 C#CCCCCCCCCOCCCC 7a_100000065265_100000210211 [0,2,0,0,0,0|1,0,0]=3 20982 B14R0.392 C#CCCCCCCCCOCCCF 34a_100000065265_100011934791 [0,2,0,0,0,0|1,0,1]=4 20983 B14R0.392 C#CCCCCCCCCOCCCF 7a_100000065265_100011934791 [0,2,0,0,0,0|1,0,1]=4 20984 B14R0.392 C#CCCCCCCCCOCCCO 34a_100000065265_100000230001 [0,2,0,0,0,0|0,0,1]=3 20985 B14R0.392 C#CCCCCCCCCOCCCO 7a_100000065265_100011215043 [0,2,0,0,0,0|0,0,1]=3 20986 B14R0.392 C#CCCCCCCCCOCCOC 34a_100000065265_100011201679 [0,2,0,0,0,0|0,0,2]=4 20987 B14R0.392 C#CCCCCCCCCOCCOC 7a_100000065265_100000233755 [0,2,0,0,0,0|0,0,2]=4 20988 B14R0.392 C#CCCCCCCCCOCCSC 34a_100000065265_100000212216 [0,2,0,0,0,0|1,0,1]=4 20989 B14R0.392 C#CCCCCCCCCOCCSC 7a_100000065265_100000212216 [0,2,0,0,0,0|1,0,1]=4 20990 B14R0.392 C#CCCCCCCCNCCCCC 2230a_100000209983_100153394163 [0,2,0,0,0,0|1,0,0]=3 20991 B14R0.392 C#CCCCCCCCNCCCCO 2230a_100000750430_100153394163 [0,2,0,0,0,0|0,0,1]=3 20992 B14R0.392 C#CCCCCCCCNCCCCO 34a_100000750430_100153394163 [0,2,0,0,0,0|0,0,1]=3 20993 B14R0.392 C#CCCCCCCCNCCCOC 34a_100150723488_100153394163 [0,2,0,0,0,0|0,0,2]=4 20994 B14R0.392 C#CCCCCCCCNCCCSC 2230a_100000749238_100153394163 [0,2,0,0,0,0|1,0,1]=4 20995 B14R0.392 C#CCCCCCCCNCCOCC 2230a_102516460346_100153394163 [0,2,0,0,0,0|1,0,1]=4 20996 B14R0.392 C#CCCCCCCCNCCOCC 34a_102516460346_100153394163 [0,2,0,0,0,0|1,0,1]=4 20997 B14R0.392 C#CCCCCCCCNCCSCC 2230a_100000106463_100153394163 [0,2,0,0,0,0|1,0,1]=4 20998 B14R0.392 C#CCCCCCCCOCCCCBr 34a_100011216708_100153394163 [0,2,0,0,0,0|1,0,1]=4 20999 B14R0.392 C#CCCCCCCCOCCCCC 34a_100000054614_100000718602 [0,2,0,0,0,0|1,0,0]=3 21000 B14R0.392 C#CCCCCCCCOCCCCC 34a_100000210253_100153394163 [0,2,0,0,0,0|1,0,0]=3 21001 B14R0.392 C#CCCCCCCCOCCCCC 7a_100000054614_100000210326 [0,2,0,0,0,0|1,0,0]=3 21002 B14R0.392 C#CCCCCCCCOCCCCC 7a_100000210253_100153394163 [0,2,0,0,0,0|1,0,0]=3 21003 B14R0.392 C#CCCCCCCCOCCCCCl 34a_100000210776_100153394163 [0,2,0,0,0,0|1,0,1]=4 21004 B14R0.392 C#CCCCCCCCOCCCCCl 7a_100000210776_100153394163 [0,2,0,0,0,0|1,0,1]=4 21005 B14R0.392 C#CCCCCCCCOCCCCF 34a_100000054614_100000729493 [0,2,0,0,0,0|1,0,1]=4 21006 B14R0.392 C#CCCCCCCCOCCCCF 34a_100011995726_100153394163 [0,2,0,0,0,0|1,0,1]=4 21007 B14R0.392 C#CCCCCCCCOCCCCF 7a_100000054614_100000729493 [0,2,0,0,0,0|1,0,1]=4 21008 B14R0.392 C#CCCCCCCCOCCCCF 7a_100011995726_100153394163 [0,2,0,0,0,0|1,0,1]=4 21009 B14R0.392 C#CCCCCCCCOCCCCI 34a_200012148704_100153394163 [0,2,0,0,0,0|1,0,1]=4 21010 B14R0.392 C#CCCCCCCCOCCCCN 34a_100000750430_100153394163 [0,2,0,0,0,0|1,0,1]=4 21011 B14R0.392 C#CCCCCCCCOCCCCO 34a_100000054614_100011216708 [0,2,0,0,0,0|0,0,1]=3 21012 B14R0.392 C#CCCCCCCCOCCCCO 7a_100000054614_100000210776 [0,2,0,0,0,0|0,0,1]=3 21013 B14R0.392 C#CCCCCCCCOCCCNC 34a_100000213112_100153394163 [0,2,0,0,0,0|1,0,1]=4 21014 B14R0.392 C#CCCCCCCCOCCCOC 34a_100000054614_100000740836 [0,2,0,0,0,0|0,0,2]=4 21015 B14R0.392 C#CCCCCCCCOCCCOC 34a_100000740835_100153394163 [0,2,0,0,0,0|0,0,2]=4 21016 B14R0.392 C#CCCCCCCCOCCCOC 7a_100000054614_100000740836 [0,2,0,0,0,0|0,0,2]=4 21017 B14R0.392 C#CCCCCCCCOCCCSC 34a_100000690336_100153394163 [0,2,0,0,0,0|1,0,1]=4 21018 B14R0.392 C#CCCCCCCCOCCCSC 7a_100000690336_100153394163 [0,2,0,0,0,0|1,0,1]=4 21019 B14R0.392 C#CCCCCCCCOCCOCC 34a_100000054614_100000210147 [0,2,0,0,0,0|1,0,1]=4 21020 B14R0.392 C#CCCCCCCCOCCOCC 34a_100000210136_100153394163 [0,2,0,0,0,0|1,0,1]=4 21021 B14R0.392 C#CCCCCCCCOCCOCC 7a_100000054614_100011215890 [0,2,0,0,0,0|1,0,1]=4 21022 B14R0.392 C#CCCCCCCCOCCOCC 7a_100000210136_100153394163 [0,2,0,0,0,0|1,0,1]=4 21023 B14R0.392 C#CCCCCCCCOCCSCC 34a_100000054614_100000757381 [0,2,0,0,0,0|1,0,1]=4 21024 B14R0.392 C#CCCCCCCCOCCSCC 34a_100000212035_100153394163 [0,2,0,0,0,0|1,0,1]=4 21025 B14R0.392 C#CCCCCCCCOCCSCC 7a_100000054614_100000757381 [0,2,0,0,0,0|1,0,1]=4 21026 B14R0.392 C#CCCCCCCCOCCSCC 7a_100000212035_100153394163 [0,2,0,0,0,0|1,0,1]=4 21027 B14R0.392 C#CCCCCCCCSCCCCC 62a_100000210326_100153394163 [0,2,0,0,0,0|1,0,0]=3 21028 B14R0.392 C#CCCCCCCCSCCCCC 62a_100153394163_100000210326 [0,2,0,0,0,0|1,0,0]=3 21029 B14R0.392 C#CCCCCCCCSCCCCF 62a_100000729493_100153394163 [0,2,0,0,0,0|1,0,1]=4 21030 B14R0.392 C#CCCCCCCCSCCCCF 62a_100153394163_100000729493 [0,2,0,0,0,0|1,0,1]=4 21031 B14R0.392 C#CCCCCCCCSCCCCO 62a_100000210776_100153394163 [0,2,0,0,0,0|0,0,1]=3 21032 B14R0.392 C#CCCCCCCCSCCCCO 62a_100153394163_100000210776 [0,2,0,0,0,0|0,0,1]=3 21033 B14R0.392 C#CCCCCCCCSCCCOC 62a_100000709357_100153394163 [0,2,0,0,0,0|0,0,2]=4 21034 B14R0.392 C#CCCCCCCCSCCCOC 62a_100153394163_100000709357 [0,2,0,0,0,0|0,0,2]=4 21035 B14R0.392 C#CCCCCCCCSCCOCC 62a_100000210147_100153394163 [0,2,0,0,0,0|1,0,1]=4 21036 B14R0.392 C#CCCCCCCCSCCOCC 62a_100153394163_100011215890 [0,2,0,0,0,0|1,0,1]=4 21037 B14R0.392 C#CCCCCCCCSCCSCC 62a_100000757381_100153394163 [0,2,0,0,0,0|1,0,1]=4 21038 B14R0.392 C#CCCCCCCCSCCSCC 62a_100153394163_100000757381 [0,2,0,0,0,0|1,0,1]=4 21039 B14R0.392 C#CCCCCCCNCCCCCC 2230a_100000210581_100012276617 [0,2,0,0,0,0|1,0,0]=3 21040 B14R0.392 C#CCCCCCCNCCCCCO 2230a_100000762737_100012276617 [0,2,0,0,0,0|0,0,1]=3 21041 B14R0.392 C#CCCCCCCNCCCCCO 34a_100000762737_100012276617 [0,2,0,0,0,0|0,0,1]=3 21042 B14R0.392 C#CCCCCCCNCCCOCC 2230a_100000210961_100012276617 [0,2,0,0,0,0|1,0,1]=4 21043 B14R0.392 C#CCCCCCCNCCCOCC 34a_100000210961_100012276617 [0,2,0,0,0,0|1,0,1]=4 21044 B14R0.392 C#CCCCCCCNCCOCCC 2230a_100161115042_100012276617 [0,2,0,0,0,0|1,0,1]=4 21045 B14R0.392 C#CCCCCCCNCCOCCC 34a_100161115042_100012276617 [0,2,0,0,0,0|1,0,1]=4 21046 B14R0.392 C#CCCCCCCNCCOCCO 2230a_100000211614_100012276617 [0,2,0,0,0,0|0,0,2]=4 21047 B14R0.392 C#CCCCCCCNCCOCCO 34a_100000211614_100012276617 [0,2,0,0,0,0|0,0,2]=4 21048 B14R0.392 C#CCCCCCCNCCSCCC 2230a_100020603323_100012276617 [0,2,0,0,0,0|1,0,1]=4 21049 B14R0.392 C#CCCCCCCNCCSCCO 2230a_100011219999_100012276617 [0,2,0,0,0,0|0,0,2]=4 21050 B14R0.392 C#CCCCCCCOCCCCCBr 34a_100000746331_100012276617 [0,2,0,0,0,0|1,0,1]=4 21051 B14R0.392 C#CCCCCCCOCCCCCBr 7a_100000746331_100012276617 [0,2,0,0,0,0|1,0,1]=4 21052 B14R0.392 C#CCCCCCCOCCCCCC 34a_100000210259_100012276617 [0,2,0,0,0,0|1,0,0]=3 21053 B14R0.392 C#CCCCCCCOCCCCCC 34a_100011217361_100000210314 [0,2,0,0,0,0|1,0,0]=3 21054 B14R0.392 C#CCCCCCCOCCCCCC 7a_100000210259_100012276617 [0,2,0,0,0,0|1,0,0]=3 21055 B14R0.392 C#CCCCCCCOCCCCCC 7a_100011217361_100000210314 [0,2,0,0,0,0|1,0,0]=3 21056 B14R0.392 C#CCCCCCCOCCCCCCl 34a_100000746330_100012276617 [0,2,0,0,0,0|1,0,1]=4 21057 B14R0.392 C#CCCCCCCOCCCCCCl 7a_100000746330_100012276617 [0,2,0,0,0,0|1,0,1]=4 21058 B14R0.392 C#CCCCCCCOCCCCCF 34a_100011217361_100000729378 [0,2,0,0,0,0|1,0,1]=4 21059 B14R0.392 C#CCCCCCCOCCCCCF 7a_100011217361_100000729378 [0,2,0,0,0,0|1,0,1]=4 21060 B14R0.392 C#CCCCCCCOCCCCCI 34a_200012148887_100012276617 [0,2,0,0,0,0|1,0,1]=4 21061 B14R0.392 C#CCCCCCCOCCCCCI 7a_200012148887_100012276617 [0,2,0,0,0,0|1,0,1]=4 21062 B14R0.392 C#CCCCCCCOCCCCCN 34a_100000762737_100012276617 [0,2,0,0,0,0|1,0,1]=4 21063 B14R0.392 C#CCCCCCCOCCCCCO 34a_100011217361_100000746330 [0,2,0,0,0,0|0,0,1]=3 21064 B14R0.392 C#CCCCCCCOCCCCCO 7a_100011217361_100000746330 [0,2,0,0,0,0|0,0,1]=3 21065 B14R0.392 C#CCCCCCCOCCCCOC 34a_100000740925_100012276617 [0,2,0,0,0,0|0,0,2]=4 21066 B14R0.392 C#CCCCCCCOCCCCOC 34a_100011217361_100000755781 [0,2,0,0,0,0|0,0,2]=4 21067 B14R0.392 C#CCCCCCCOCCCCOC 7a_100011217361_100000730899 [0,2,0,0,0,0|0,0,2]=4 21068 B14R0.392 C#CCCCCCCOCCCCSC 34a_100011217163_100012276617 [0,2,0,0,0,0|1,0,1]=4 21069 B14R0.392 C#CCCCCCCOCCCCSC 7a_100011217163_100012276617 [0,2,0,0,0,0|1,0,1]=4 21070 B14R0.392 C#CCCCCCCOCCCOCC 34a_100000757476_100012276617 [0,2,0,0,0,0|1,0,1]=4 21071 B14R0.392 C#CCCCCCCOCCCOCC 34a_100011217361_100012232248 [0,2,0,0,0,0|1,0,1]=4 21072 B14R0.392 C#CCCCCCCOCCCOCC 7a_100000757476_100012276617 [0,2,0,0,0,0|1,0,1]=4 21073 B14R0.392 C#CCCCCCCOCCCOCC 7a_100011217361_100012232248 [0,2,0,0,0,0|1,0,1]=4 21074 B14R0.392 C#CCCCCCCOCCCSCC 34a_100011216438_100012276617 [0,2,0,0,0,0|1,0,1]=4 21075 B14R0.392 C#CCCCCCCOCCCSCC 7a_100011216438_100012276617 [0,2,0,0,0,0|1,0,1]=4 21076 B14R0.392 C#CCCCCCCOCCOCCC 34a_100000752267_100012276617 [0,2,0,0,0,0|1,0,1]=4 21077 B14R0.392 C#CCCCCCCOCCOCCC 34a_100011217361_100011215938 [0,2,0,0,0,0|1,0,1]=4 21078 B14R0.392 C#CCCCCCCOCCOCCC 7a_100000752267_100012276617 [0,2,0,0,0,0|1,0,1]=4 21079 B14R0.392 C#CCCCCCCOCCOCCC 7a_100011217361_100011215938 [0,2,0,0,0,0|1,0,1]=4 21080 B14R0.392 C#CCCCCCCOCCOCCO 34a_100011217361_100000692535 [0,2,0,0,0,0|0,0,2]=4 21081 B14R0.392 C#CCCCCCCOCCOCCO 7a_100011217361_100011215305 [0,2,0,0,0,0|0,0,2]=4 21082 B14R0.392 C#CCCCCCCOCCSCCC 34a_200000230433_100012276617 [0,2,0,0,0,0|1,0,1]=4 21083 B14R0.392 C#CCCCCCCOCCSCCC 7a_200000230433_100012276617 [0,2,0,0,0,0|1,0,1]=4 21084 B14R0.392 C#CCCCCCCOCOCCCC 34a_100011217361_100011995733 [0,2,0,0,0,0|1,0,1]=4 21085 B14R0.392 C#CCCCCCCSCCCCCC 62a_100000210314_100012276617 [0,2,0,0,0,0|1,0,0]=3 21086 B14R0.392 C#CCCCCCCSCCCCCC 62a_100012276617_100000210757 [0,2,0,0,0,0|1,0,0]=3 21087 B14R0.392 C#CCCCCCCSCCCCCF 62a_100000729378_100012276617 [0,2,0,0,0,0|1,0,1]=4 21088 B14R0.392 C#CCCCCCCSCCCCCF 62a_100012276617_100000729378 [0,2,0,0,0,0|1,0,1]=4 21089 B14R0.392 C#CCCCCCCSCCCCCO 62a_100000746330_100012276617 [0,2,0,0,0,0|0,0,1]=3 21090 B14R0.392 C#CCCCCCCSCCCCCO 62a_100012276617_100000746330 [0,2,0,0,0,0|0,0,1]=3 21091 B14R0.392 C#CCCCCCCSCCCCOC 62a_100000730899_100012276617 [0,2,0,0,0,0|0,0,2]=4 21092 B14R0.392 C#CCCCCCCSCCCCOC 62a_100012276617_100000730899 [0,2,0,0,0,0|0,0,2]=4 21093 B14R0.392 C#CCCCCCCSCCCOCC 62a_100012232248_100012276617 [0,2,0,0,0,0|1,0,1]=4 21094 B14R0.392 C#CCCCCCCSCCCOCC 62a_100012276617_100012232248 [0,2,0,0,0,0|1,0,1]=4 21095 B14R0.392 C#CCCCCCCSCCOCCC 62a_100011215938_100012276617 [0,2,0,0,0,0|1,0,1]=4 21096 B14R0.392 C#CCCCCCCSCCOCCC 62a_100012276617_100011215938 [0,2,0,0,0,0|1,0,1]=4 21097 B14R0.392 C#CCCCCCCSCCOCCO 62a_100011215305_100012276617 [0,2,0,0,0,0|0,0,2]=4 21098 B14R0.392 C#CCCCCCCSCCOCCO 62a_100012276617_100011215305 [0,2,0,0,0,0|0,0,2]=4 21099 B14R0.392 C#CCCCCCCSCOCCCC 62a_100011995733_100012276617 [0,2,0,0,0,0|1,0,1]=4 21100 B14R0.392 C#CCCCCCCSCOCCCC 62a_100012276617_100011995733 [0,2,0,0,0,0|1,0,1]=4 21101 B14R0.392 C#CCCCCCNCCCCCCC 2230a_100000229938_100012094781 [0,2,0,0,0,0|1,0,0]=3 21102 B14R0.392 C#CCCCCCNCCCCCCO 2230a_100000686447_100012094781 [0,2,0,0,0,0|0,0,1]=3 21103 B14R0.392 C#CCCCCCNCCCCCCO 34a_100000686447_100012094781 [0,2,0,0,0,0|0,0,1]=3 21104 B14R0.392 C#CCCCCCNCCCCCOC 2230a_100000747528_100012094781 [0,2,0,0,0,0|0,0,2]=4 21105 B14R0.392 C#CCCCCCNCCCCCOC 34a_100000747528_100012094781 [0,2,0,0,0,0|0,0,2]=4 21106 B14R0.392 C#CCCCCCNCCCOCCC 2230a_100011217757_100012094781 [0,2,0,0,0,0|1,0,1]=4 21107 B14R0.392 C#CCCCCCNCCCOCCC 34a_100011217757_100012094781 [0,2,0,0,0,0|1,0,1]=4 21108 B14R0.392 C#CCCCCCNCCSCCCC 2230a_100025743550_100012094781 [0,2,0,0,0,0|1,0,1]=4 21109 B14R0.392 C#CCCCCCOCCCCCCBr 34a_100011215345_100012094781 [0,2,0,0,0,0|1,0,1]=4 21110 B14R0.392 C#CCCCCCOCCCCCCBr 7a_100011215345_100012094781 [0,2,0,0,0,0|1,0,1]=4 21111 B14R0.392 C#CCCCCCOCCCCCCC 34a_100000210272_100012094781 [0,2,0,0,0,0|1,0,0]=3 21112 B14R0.392 C#CCCCCCOCCCCCCC 34a_100000766912_100000210614 [0,2,0,0,0,0|1,0,0]=3 21113 B14R0.392 C#CCCCCCOCCCCCCC 7a_100000210272_100012094781 [0,2,0,0,0,0|1,0,0]=3 21114 B14R0.392 C#CCCCCCOCCCCCCC 7a_100000766912_100000210614 [0,2,0,0,0,0|1,0,0]=3 21115 B14R0.392 C#CCCCCCOCCCCCCCl 34a_100000766143_100012094781 [0,2,0,0,0,0|1,0,1]=4 21116 B14R0.392 C#CCCCCCOCCCCCCCl 7a_100000766143_100012094781 [0,2,0,0,0,0|1,0,1]=4 21117 B14R0.392 C#CCCCCCOCCCCCCF 34a_100000732779_100012094781 [0,2,0,0,0,0|1,0,1]=4 21118 B14R0.392 C#CCCCCCOCCCCCCF 34a_100000766912_100015922095 [0,2,0,0,0,0|1,0,1]=4 21119 B14R0.392 C#CCCCCCOCCCCCCF 7a_100000732779_100012094781 [0,2,0,0,0,0|1,0,1]=4 21120 B14R0.392 C#CCCCCCOCCCCCCF 7a_100000766912_100015922095 [0,2,0,0,0,0|1,0,1]=4 21121 B14R0.392 C#CCCCCCOCCCCCCN 34a_100000686447_100012094781 [0,2,0,0,0,0|1,0,1]=4 21122 B14R0.392 C#CCCCCCOCCCCCCO 34a_100000766912_100000766143 [0,2,0,0,0,0|0,0,1]=3 21123 B14R0.392 C#CCCCCCOCCCCCCO 7a_100000766912_100000766143 [0,2,0,0,0,0|0,0,1]=3 21124 B14R0.392 C#CCCCCCOCCCCCNC 34a_100000722520_100012094781 [0,2,0,0,0,0|1,0,1]=4 21125 B14R0.392 C#CCCCCCOCCOCCCC 34a_100000210238_100012094781 [0,2,0,0,0,0|1,0,1]=4 21126 B14R0.392 C#CCCCCCOCCOCCCC 34a_100000766912_100000743108 [0,2,0,0,0,0|1,0,1]=4 21127 B14R0.392 C#CCCCCCOCCOCCCC 7a_100000210238_100012094781 [0,2,0,0,0,0|1,0,1]=4 21128 B14R0.392 C#CCCCCCOCCOCCCC 7a_100000766912_100000743108 [0,2,0,0,0,0|1,0,1]=4 21129 B14R0.392 C#CCCCCCOCCSCCCC 34a_200000230436_100012094781 [0,2,0,0,0,0|1,0,1]=4 21130 B14R0.392 C#CCCCCCOCCSCCCC 7a_200000230436_100012094781 [0,2,0,0,0,0|1,0,1]=4 21131 B14R0.392 C#CCCCCCSCCCCCCC 62a_100000210614_100012094781 [0,2,0,0,0,0|1,0,0]=3 21132 B14R0.392 C#CCCCCCSCCCCCCC 62a_100012094781_100000210316 [0,2,0,0,0,0|1,0,0]=3 21133 B14R0.392 C#CCCCCCSCCCCCCF 62a_100012094781_100015922095 [0,2,0,0,0,0|1,0,1]=4 21134 B14R0.392 C#CCCCCCSCCCCCCF 62a_100015922095_100012094781 [0,2,0,0,0,0|1,0,1]=4 21135 B14R0.392 C#CCCCCCSCCCCCCO 62a_100000766143_100012094781 [0,2,0,0,0,0|0,0,1]=3 21136 B14R0.392 C#CCCCCCSCCCCCCO 62a_100012094781_100000766143 [0,2,0,0,0,0|0,0,1]=3 21137 B14R0.392 C#CCCCCCSCCOCCCC 62a_100000743108_100012094781 [0,2,0,0,0,0|1,0,1]=4 21138 B14R0.392 C#CCCCCCSCCOCCCC 62a_100012094781_100000743108 [0,2,0,0,0,0|1,0,1]=4 21139 B14R0.392 C#CCCCCNCCCCCCCC 2230a_100000229939_100010269958 [0,2,0,0,0,0|1,0,0]=3 21140 B14R0.392 C#CCCCCNCCCCCCCC 2230a_100000706060_100000210759 [0,2,0,0,0,0|1,0,0]=3 21141 B14R0.392 C#CCCCCNCCCCCCCC 34a_100000229939_100010269958 [0,2,0,0,0,0|1,0,0]=3 21142 B14R0.392 C#CCCCCNCCCCCCCC 34a_100000706060_100000210759 [0,2,0,0,0,0|1,0,0]=3 21143 B14R0.392 C#CCCCCNCCCCCCCO 2230a_100000706060_100000760002 [0,2,0,0,0,0|0,0,1]=3 21144 B14R0.392 C#CCCCCNCCCCCCCO 2230a_100011996573_100010269958 [0,2,0,0,0,0|0,0,1]=3 21145 B14R0.392 C#CCCCCNCCCCCCCO 34a_100000706060_100000760002 [0,2,0,0,0,0|0,0,1]=3 21146 B14R0.392 C#CCCCCNCCCCCCCO 34a_100011996573_100010269958 [0,2,0,0,0,0|0,0,1]=3 21147 B14R0.392 C#CCCCCNCCCCCCOC 2230a_100000706060_100011998445 [0,2,0,0,0,0|0,0,2]=4 21148 B14R0.392 C#CCCCCNCCCCCCOC 34a_100000706060_100011998445 [0,2,0,0,0,0|0,0,2]=4 21149 B14R0.392 C#CCCCCNCCCOCCCC 2230a_200000211371_100010269958 [0,2,0,0,0,0|1,0,1]=4 21150 B14R0.392 C#CCCCCNCCCOCCCC 34a_200000211371_100010269958 [0,2,0,0,0,0|1,0,1]=4 21151 B14R0.392 C#CCCCCNCCCOCCCO 2230a_100011310245_100010269958 [0,2,0,0,0,0|0,0,2]=4 21152 B14R0.392 C#CCCCCNCCCOCCCO 34a_100011310245_100010269958 [0,2,0,0,0,0|0,0,2]=4 21153 B14R0.392 C#CCCCCOCCCCCCCBr 34a_100000760002_100010269958 [0,2,0,0,0,0|1,0,1]=4 21154 B14R0.392 C#CCCCCOCCCCCCCBr 7a_100000760002_100010269958 [0,2,0,0,0,0|1,0,1]=4 21155 B14R0.392 C#CCCCCOCCCCCCCC 34a_100000210232_100010269958 [0,2,0,0,0,0|1,0,0]=3 21156 B14R0.392 C#CCCCCOCCCCCCCC 34a_100000766709_100000210759 [0,2,0,0,0,0|1,0,0]=3 21157 B14R0.392 C#CCCCCOCCCCCCCC 7a_100000210232_100010269958 [0,2,0,0,0,0|1,0,0]=3 21158 B14R0.392 C#CCCCCOCCCCCCCC 7a_100000766709_100000210759 [0,2,0,0,0,0|1,0,0]=3 21159 B14R0.392 C#CCCCCOCCCCCCCN 34a_100011996573_100010269958 [0,2,0,0,0,0|1,0,1]=4 21160 B14R0.392 C#CCCCCOCCCCCCCO 34a_100000766709_100000760002 [0,2,0,0,0,0|0,0,1]=3 21161 B14R0.392 C#CCCCCOCCCCCCCO 7a_100000766709_100000760002 [0,2,0,0,0,0|0,0,1]=3 21162 B14R0.392 C#CCCCCOCCCCCCOC 34a_100000766709_100011998445 [0,2,0,0,0,0|0,0,2]=4 21163 B14R0.392 C#CCCCCOCCCCCCOC 34a_200012092642_100010269958 [0,2,0,0,0,0|0,0,2]=4 21164 B14R0.392 C#CCCCCOCCCCCCOC 7a_100000766709_100011998445 [0,2,0,0,0,0|0,0,2]=4 21165 B14R0.392 C#CCCCCOCCCCCCOC 7a_200012092642_100010269958 [0,2,0,0,0,0|0,0,2]=4 21166 B14R0.392 C#CCCCCOCCCOCCCC 34a_200011215613_100010269958 [0,2,0,0,0,0|1,0,1]=4 21167 B14R0.392 C#CCCCCOCCCOCCCC 7a_200011215613_100010269958 [0,2,0,0,0,0|1,0,1]=4 21168 B14R0.392 C#CCCCCOCCNCCCCC 34a_100000224656_100010269958 [0,2,0,0,0,0|1,0,1]=4 21169 B14R0.392 C#CCCCCOCCOCCCCC 34a_100011215259_100010269958 [0,2,0,0,0,0|1,0,1]=4 21170 B14R0.392 C#CCCCCOCCOCCCCC 7a_100011215259_100010269958 [0,2,0,0,0,0|1,0,1]=4 21171 B14R0.392 C#CCCCCSCCCCCCCC 62a_100000210759_100010269958 [0,2,0,0,0,0|1,0,0]=3 21172 B14R0.392 C#CCCCCSCCCCCCCC 62a_100010269958_100000210317 [0,2,0,0,0,0|1,0,0]=3 21173 B14R0.392 C#CCCCCSCCCCCCCO 62a_100000760002_100010269958 [0,2,0,0,0,0|0,0,1]=3 21174 B14R0.392 C#CCCCCSCCCCCCCO 62a_100010269958_100000760002 [0,2,0,0,0,0|0,0,1]=3 21175 B14R0.392 C#CCCCCSCCCCCCOC 62a_100010269958_100011998445 [0,2,0,0,0,0|0,0,2]=4 21176 B14R0.392 C#CCCCCSCCCCCCOC 62a_100011998445_100010269958 [0,2,0,0,0,0|0,0,2]=4 21177 B14R0.392 C#CCCCNCCCCCCCCC 2230a_100000212291_100000731252 [0,2,0,0,0,0|1,0,0]=3 21178 B14R0.392 C#CCCCNCCCCCCCCC 34a_100000212291_100000695029 [0,2,0,0,0,0|1,0,0]=3 21179 B14R0.392 C#CCCCNCCCCCCCCC 34a_100000718082_100011214924 [0,2,0,0,0,0|1,0,0]=3 21180 B14R0.392 C#CCCCNCCCCCCCCO 2230a_102515433106_100000731252 [0,2,0,0,0,0|0,0,1]=3 21181 B14R0.392 C#CCCCNCCCCCCCCO 34a_100000718082_100000033203 [0,2,0,0,0,0|0,0,1]=3 21182 B14R0.392 C#CCCCNCCCCCCCCO 34a_102515433106_100000695029 [0,2,0,0,0,0|0,0,1]=3 21183 B14R0.392 C#CCCCOCCCCCCCCBr 34a_100009813846_100000695029 [0,2,0,0,0,0|1,0,1]=4 21184 B14R0.392 C#CCCCOCCCCCCCCBr 7a_100009813846_100011215417 [0,2,0,0,0,0|1,0,1]=4 21185 B14R0.392 C#CCCCOCCCCCCCCC 34a_100000210712_100000695029 [0,2,0,0,0,0|1,0,0]=3 21186 B14R0.392 C#CCCCOCCCCCCCCC 34a_100000215630_100011214924 [0,2,0,0,0,0|1,0,0]=3 21187 B14R0.392 C#CCCCOCCCCCCCCC 7a_100000210712_100011215417 [0,2,0,0,0,0|1,0,0]=3 21188 B14R0.392 C#CCCCOCCCCCCCCC 7a_100000215630_100000210328 [0,2,0,0,0,0|1,0,0]=3 21189 B14R0.392 C#CCCCOCCCCCCCCCl 34a_100000033203_100000695029 [0,2,0,0,0,0|1,0,1]=4 21190 B14R0.392 C#CCCCOCCCCCCCCCl 7a_100000033203_100011215417 [0,2,0,0,0,0|1,0,1]=4 21191 B14R0.392 C#CCCCOCCCCCCCCN 34a_102515433106_100000695029 [0,2,0,0,0,0|1,0,1]=4 21192 B14R0.392 C#CCCCOCCCCCCCCO 34a_100000215630_100000033203 [0,2,0,0,0,0|0,0,1]=3 21193 B14R0.392 C#CCCCOCCCCCCCCO 7a_100000215630_100000033203 [0,2,0,0,0,0|0,0,1]=3 21194 B14R0.392 C#CCCCOCCCCNCCCC 34a_200011216965_100000695029 [0,2,0,0,0,0|1,0,1]=4 21195 B14R0.392 C#CCCCOCCCCOCCCC 34a_200000760531_100000695029 [0,2,0,0,0,0|1,0,1]=4 21196 B14R0.392 C#CCCCOCCCCOCCCC 7a_200000760531_100011215417 [0,2,0,0,0,0|1,0,1]=4 21197 B14R0.392 C#CCCCOCCOCCCCCC 34a_100000691444_100000695029 [0,2,0,0,0,0|1,0,1]=4 21198 B14R0.392 C#CCCCOCCOCCCCCC 7a_100000691444_100011215417 [0,2,0,0,0,0|1,0,1]=4 21199 B14R0.392 C#CCCCSCCCCCCCCC 62a_100011215417_100000210670 [0,2,0,0,0,0|1,0,0]=3 21200 B14R0.392 C#CCCCSCCCCCCCCO 62a_100000033203_100011215417 [0,2,0,0,0,0|0,0,1]=3 21201 B14R0.392 C#CCCCSCCCCCCCCO 62a_100011215417_100000033203 [0,2,0,0,0,0|0,0,1]=3 21202 B14R0.392 C#CCCNCCCCCCCCCC 2230a_100000684558_100000688953 [0,2,0,0,0,0|1,0,0]=3 21203 B14R0.392 C#CCCNCCCCCCCCCC 34a_100000684558_100000688953 [0,2,0,0,0,0|1,0,0]=3 21204 B14R0.392 C#CCCNCCCCCCCCCC 34a_100000755551_100000210320 [0,2,0,0,0,0|1,0,0]=3 21205 B14R0.392 C#CCCNCCCCCCCCCO 2230a_100000078944_100000688953 [0,2,0,0,0,0|0,0,1]=3 21206 B14R0.392 C#CCCNCCCCCCCCCO 34a_100000078944_100000688953 [0,2,0,0,0,0|0,0,1]=3 21207 B14R0.392 C#CCCNCCCCCCCCCO 34a_100000755551_100009813782 [0,2,0,0,0,0|0,0,1]=3 21208 B14R0.392 C#CCCOCCCCCCCCCBr 34a_100009813782_100000688953 [0,2,0,0,0,0|1,0,1]=4 21209 B14R0.392 C#CCCOCCCCCCCCCBr 7a_100009813782_100000688953 [0,2,0,0,0,0|1,0,1]=4 21210 B14R0.392 C#CCCOCCCCCCCCCC 34a_100000210711_100000688953 [0,2,0,0,0,0|1,0,0]=3 21211 B14R0.392 C#CCCOCCCCCCCCCC 34a_100011215631_100000210320 [0,2,0,0,0,0|1,0,0]=3 21212 B14R0.392 C#CCCOCCCCCCCCCC 7a_100000210711_100000688953 [0,2,0,0,0,0|1,0,0]=3 21213 B14R0.392 C#CCCOCCCCCCCCCCl 34a_100009868337_100000688953 [0,2,0,0,0,0|1,0,1]=4 21214 B14R0.392 C#CCCOCCCCCCCCCCl 7a_100009868337_100000688953 [0,2,0,0,0,0|1,0,1]=4 21215 B14R0.392 C#CCCOCCCCCCCCCN 34a_100000078944_100000688953 [0,2,0,0,0,0|1,0,1]=4 21216 B14R0.392 C#CCCOCCCCCCCCCO 34a_100011215631_100009813782 [0,2,0,0,0,0|0,0,1]=3 21217 B14R0.392 C#CCCSCCCCCCCCCC 62a_100000688953_100000210320 [0,2,0,0,0,0|1,0,0]=3 21218 B14R0.392 C#CCCSCCCCCCCCCO 62a_100000688953_100009813782 [0,2,0,0,0,0|0,0,1]=3 21219 B14R0.392 C#CCCSCCCCCCCCCO 62a_100009813782_100000688953 [0,2,0,0,0,0|0,0,1]=3 21220 B14R0.392 C#CCNCCCCCCCCCCC 2230a_200011215754_100000038162 [0,2,0,0,0,0|1,0,0]=3 21221 B14R0.392 C#CCNCCCCCCCCCCC 34a_100000212058_100011215454 [0,2,0,0,0,0|1,0,0]=3 21222 B14R0.392 C#CCNCCCCCCCCCCC 34a_200011215754_100000184674 [0,2,0,0,0,0|1,0,0]=3 21223 B14R0.392 C#CCNCCCCCCCCCCO 2230a_100000066964_100000038162 [0,2,0,0,0,0|0,0,1]=3 21224 B14R0.392 C#CCNCCCCCCCCCCO 34a_100000066964_100000184674 [0,2,0,0,0,0|0,0,1]=3 21225 B14R0.392 C#CCNCCCCCCCCCCO 34a_100000212058_100009813290 [0,2,0,0,0,0|0,0,1]=3 21226 B14R0.392 C#CCOCCCCCCCCCCBr 34a_100009813290_100000184674 [0,2,0,0,0,0|1,0,1]=4 21227 B14R0.392 C#CCOCCCCCCCCCCBr 7a_100009813290_100000038162 [0,2,0,0,0,0|1,0,1]=4 21228 B14R0.392 C#CCOCCCCCCCCCCC 34a_100000210247_100011215454 [0,2,0,0,0,0|1,0,0]=3 21229 B14R0.392 C#CCOCCCCCCCCCCC 34a_100000210809_100000184674 [0,2,0,0,0,0|1,0,0]=3 21230 B14R0.392 C#CCOCCCCCCCCCCC 7a_100000210809_100000038162 [0,2,0,0,0,0|1,0,0]=3 21231 B14R0.392 C#CCOCCCCCCCCCCCl 34a_200000033068_100000184674 [0,2,0,0,0,0|1,0,1]=4 21232 B14R0.392 C#CCOCCCCCCCCCCCl 7a_200000033068_100000038162 [0,2,0,0,0,0|1,0,1]=4 21233 B14R0.392 C#CCOCCCCCCCCCCN 34a_100000066964_100000184674 [0,2,0,0,0,0|1,0,1]=4 21234 B14R0.392 C#CCOCCCCCCCCCCO 34a_100000210247_100009813290 [0,2,0,0,0,0|0,0,1]=3 21235 B14R0.392 C#CCOCCCCCCOCCCC 34a_200011021349_100000210210 [0,2,0,0,0,0|1,0,1]=4 21236 B14R0.392 C#CCOCCCCCCOCCCC 7a_200011021349_100000210211 [0,2,0,0,0,0|1,0,1]=4 21237 B14R0.392 C#CCOCCCCCCOCCCO 34a_200011021349_100000230001 [0,2,0,0,0,0|0,0,2]=4 21238 B14R0.392 C#CCOCCCCCCOCCCO 7a_200011021349_100011215043 [0,2,0,0,0,0|0,0,2]=4 21239 B14R0.392 C#CCOCCNCCCCCCCC 2230a_100000229939_100010402529 [0,2,0,0,0,0|1,0,1]=4 21240 B14R0.392 C#CCOCCNCCCCCCCC 2230a_100000700922_100000210759 [0,2,0,0,0,0|1,0,1]=4 21241 B14R0.392 C#CCOCCNCCCCCCCC 34a_100000229939_100010402529 [0,2,0,0,0,0|1,0,1]=4 21242 B14R0.392 C#CCOCCNCCCCCCCC 34a_100000700922_100000210759 [0,2,0,0,0,0|1,0,1]=4 21243 B14R0.392 C#CCOCCNCCCCCCCO 2230a_100000700922_100000760002 [0,2,0,0,0,0|0,0,2]=4 21244 B14R0.392 C#CCOCCNCCCCCCCO 2230a_100011996573_100010402529 [0,2,0,0,0,0|0,0,2]=4 21245 B14R0.392 C#CCOCCNCCCCCCCO 34a_100000700922_100000760002 [0,2,0,0,0,0|0,0,2]=4 21246 B14R0.392 C#CCOCCNCCCCCCCO 34a_100011996573_100010402529 [0,2,0,0,0,0|0,0,2]=4 21247 B14R0.392 C#CCOCCOCCCCCCCC 34a_100000054580_100000210759 [0,2,0,0,0,0|1,0,1]=4 21248 B14R0.392 C#CCOCCOCCCCCCCC 34a_100000210232_100010402529 [0,2,0,0,0,0|1,0,1]=4 21249 B14R0.392 C#CCOCCOCCCCCCCC 7a_100000054580_100000210759 [0,2,0,0,0,0|1,0,1]=4 21250 B14R0.392 C#CCOCCOCCCCCCCC 7a_100000210232_100010402529 [0,2,0,0,0,0|1,0,1]=4 21251 B14R0.392 C#CCOCCOCCCCCCCO 34a_100000054580_100000760002 [0,2,0,0,0,0|0,0,2]=4 21252 B14R0.392 C#CCOCCOCCCCCCCO 7a_100000054580_100000760002 [0,2,0,0,0,0|0,0,2]=4 21253 B14R0.392 C#CCOCCSCCCCCCCC 62a_100000210759_100010402529 [0,2,0,0,0,0|1,0,1]=4 21254 B14R0.392 C#CCOCCSCCCCCCCC 62a_100010402529_100000210317 [0,2,0,0,0,0|1,0,1]=4 21255 B14R0.392 C#CCOCCSCCCCCCCO 62a_100000760002_100010402529 [0,2,0,0,0,0|0,0,2]=4 21256 B14R0.392 C#CCOCCSCCCCCCCO 62a_100010402529_100000760002 [0,2,0,0,0,0|0,0,2]=4 21257 B14R0.392 C#CCSCCCCCCCCCCC 62a_100000038162_100011215454 [0,2,0,0,0,0|1,0,0]=3 21258 B14R0.392 C#CCSCCCCCCCCCCO 62a_100000038162_200000033068 [0,2,0,0,0,0|0,0,1]=3 21259 B14R0.392 C/C=C/CCOCCCCCCCCC 34a_100016278192_100011214924 [0,2,0,0,0,0|1,0,1]=4 21260 B14R0.392 C/C=C/CCOCCCCCCCCO 34a_100016278192_100000033203 [0,2,0,0,0,0|0,0,1]=3 21261 B14R0.392 C/C=C/CNCCCCCCCCCC 34a_100000684558_100102629194 [0,2,0,0,0,0|1,0,1]=4 21262 B14R0.392 C/C=C/CNCCCCCCCCCO 34a_100000078944_100102629194 [0,2,0,0,0,0|0,0,1]=3 21263 B14R0.392 C/C=C/COCCCCCCCCCBr 34a_100009813782_100102629194 [0,2,0,0,0,0|1,0,1]=4 21264 B14R0.392 C/C=C/COCCCCCCCCCBr 7a_100009813782_100102629194 [0,2,0,0,0,0|1,0,1]=4 21265 B14R0.392 C/C=C/COCCCCCCCCCC 34a_100000210711_100102629194 [0,2,0,0,0,0|1,0,1]=4 21266 B14R0.392 C/C=C/COCCCCCCCCCC 34a_100016270725_100000210320 [0,2,0,0,0,0|1,0,1]=4 21267 B14R0.392 C/C=C/COCCCCCCCCCC 7a_100000210711_100102629194 [0,2,0,0,0,0|1,0,1]=4 21268 B14R0.392 C/C=C/COCCCCCCCCCCl 34a_100009868337_100102629194 [0,2,0,0,0,0|1,0,1]=4 21269 B14R0.392 C/C=C/COCCCCCCCCCCl 7a_100009868337_100102629194 [0,2,0,0,0,0|1,0,1]=4 21270 B14R0.392 C/C=C/COCCCCCCCCCN 34a_100000078944_100102629194 [0,2,0,0,0,0|1,0,1]=4 21271 B14R0.392 C/C=C/COCCCCCCCCCO 34a_100016270725_100009813782 [0,2,0,0,0,0|0,0,1]=3 21272 B14R0.392 C/C=C/CSCCCCCCCCCC 62a_100102629194_100000210320 [0,2,0,0,0,0|1,0,1]=4 21273 B14R0.392 C/C=C/CSCCCCCCCCCO 62a_100009813782_100102629194 [0,2,0,0,0,0|0,0,1]=3 21274 B14R0.392 C/C=C/CSCCCCCCCCCO 62a_100102629194_100009813782 [0,2,0,0,0,0|0,0,1]=3 21275 B14R0.392 C=CCCCCCCCCCCCNC 2230a_106832991635_102130925996 [0,2,0,0,0,0|1,0,0]=3 21276 B14R0.392 C=CCCCCCCCCCCCNC 34a_100102657272_102130925996 [0,2,0,0,0,0|1,0,0]=3 21277 B14R0.392 C=CCCCCCCCCCCCNC 7a_106832991635_102130925996 [0,2,0,0,0,0|1,0,0]=3 21278 B14R0.392 C=CCCCCCCCCCCCOC 34a_100138415774_102130925996 [0,2,0,0,0,0|0,0,1]=3 21279 B14R0.392 C=CCCCCCCCCCCCSC 62a_102130925996_200000210301 [0,2,0,0,0,0|1,0,0]=3 21280 B14R0.392 C=CCCCCCCCCCCCSC 62a_200000210301_102130925996 [0,2,0,0,0,0|1,0,0]=3 21281 B14R0.392 C=CCCCCCCCCCCCS[13CH3] 62a_102130925996_200025704644 [0,2,0,0,0,0|1,0,0]=3 21282 B14R0.392 C=CCCCCCCCCCCCS[13CH3] 62a_200025704644_102130925996 [0,2,0,0,0,0|1,0,0]=3 21283 B14R0.392 C=CCCCCCCCCCCNCC 2230a_100015525214_100011093070 [0,2,0,0,0,0|1,0,0]=3 21284 B14R0.392 C=CCCCCCCCCCCOCC 34a_100121572206_100011093070 [0,2,0,0,0,0|1,0,0]=3 21285 B14R0.392 C=CCCCCCCCCCCSCC 62a_100000210202_100011093070 [0,2,0,0,0,0|1,0,0]=3 21286 B14R0.392 C=CCCCCCCCCCCSCC 62a_100011093070_100000210202 [0,2,0,0,0,0|1,0,0]=3 21287 B14R0.392 C=CCCCCCCCCCCSCF 62a_100011093070_100015361967 [0,2,0,0,0,0|1,0,1]=4 21288 B14R0.392 C=CCCCCCCCCCCSCF 62a_100015361967_100011093070 [0,2,0,0,0,0|1,0,1]=4 21289 B14R0.392 C=CCCCCCCCCCNCCC 2230a_100000081888_100000210303 [0,2,0,0,0,0|1,0,0]=3 21290 B14R0.392 C=CCCCCCCCCCNCCC 34a_100000081888_100000210303 [0,2,0,0,0,0|1,0,0]=3 21291 B14R0.392 C=CCCCCCCCCCNCCF 2230a_100000081888_100011217306 [0,2,0,0,0,0|1,0,1]=4 21292 B14R0.392 C=CCCCCCCCCCNCCF 34a_100000081888_100011217306 [0,2,0,0,0,0|1,0,1]=4 21293 B14R0.392 C=CCCCCCCCCCNCCF 34a_100000724931_100009814027 [0,2,0,0,0,0|1,0,1]=4 21294 B14R0.392 C=CCCCCCCCCCNCCO 2230a_100000081888_100000211926 [0,2,0,0,0,0|0,0,1]=3 21295 B14R0.392 C=CCCCCCCCCCNCCO 2230a_100016997473_100009814027 [0,2,0,0,0,0|0,0,1]=3 21296 B14R0.392 C=CCCCCCCCCCNCCO 34a_100000081888_100000211926 [0,2,0,0,0,0|0,0,1]=3 21297 B14R0.392 C=CCCCCCCCCCNCCO 34a_100016990907_100009814027 [0,2,0,0,0,0|0,0,1]=3 21298 B14R0.392 C=CCCCCCCCCCNCOC 2230a_100000081888_100000766300 [0,2,0,0,0,0|0,0,2]=4 21299 B14R0.392 C=CCCCCCCCCCNCSC 2230a_100000081888_100011218213 [0,2,0,0,0,0|1,0,1]=4 21300 B14R0.392 C=CCCCCCCCCCNCSC 34a_100000081888_100011218213 [0,2,0,0,0,0|1,0,1]=4 21301 B14R0.392 C=CCCCCCCCCCOCCBr 34a_100000211926_100009814027 [0,2,0,0,0,0|1,0,1]=4 21302 B14R0.392 C=CCCCCCCCCCOCCC 34a_100000038209_100000210303 [0,2,0,0,0,0|1,0,0]=3 21303 B14R0.392 C=CCCCCCCCCCOCCC 34a_100000210258_100009814027 [0,2,0,0,0,0|1,0,0]=3 21304 B14R0.392 C=CCCCCCCCCCOCCC 7a_100000038209_100000210303 [0,2,0,0,0,0|1,0,0]=3 21305 B14R0.392 C=CCCCCCCCCCOCCF 34a_100000038209_100011217306 [0,2,0,0,0,0|1,0,1]=4 21306 B14R0.392 C=CCCCCCCCCCOCCF 7a_100000038209_100011217306 [0,2,0,0,0,0|1,0,1]=4 21307 B14R0.392 C=CCCCCCCCCCOCCN 34a_100000210304_100009814027 [0,2,0,0,0,0|1,0,1]=4 21308 B14R0.392 C=CCCCCCCCCCOCCO 34a_100000038209_100000211926 [0,2,0,0,0,0|0,0,1]=3 21309 B14R0.392 C=CCCCCCCCCCOCCO 7a_100000038209_100000211926 [0,2,0,0,0,0|0,0,1]=3 21310 B14R0.392 C=CCCCCCCCCCOCSC 34a_100000038209_100011218213 [0,2,0,0,0,0|1,0,1]=4 21311 B14R0.392 C=CCCCCCCCCCSCCC 62a_100000210303_100009814027 [0,2,0,0,0,0|1,0,0]=3 21312 B14R0.392 C=CCCCCCCCCCSCCC 62a_100009814027_100000210303 [0,2,0,0,0,0|1,0,0]=3 21313 B14R0.392 C=CCCCCCCCCCSCCF 62a_100009814027_100011217306 [0,2,0,0,0,0|1,0,1]=4 21314 B14R0.392 C=CCCCCCCCCCSCCF 62a_100011217306_100009814027 [0,2,0,0,0,0|1,0,1]=4 21315 B14R0.392 C=CCCCCCCCCCSCCO 62a_100000211926_100009814027 [0,2,0,0,0,0|0,0,1]=3 21316 B14R0.392 C=CCCCCCCCCCSCCO 62a_100009814027_100000211926 [0,2,0,0,0,0|0,0,1]=3 21317 B14R0.392 C=CCCCCCCCCCSCOC 62a_100000766300_100009814027 [0,2,0,0,0,0|0,0,2]=4 21318 B14R0.392 C=CCCCCCCCCCSCOC 62a_100009814027_100000766300 [0,2,0,0,0,0|0,0,2]=4 21319 B14R0.392 C=CCCCCCCCCCSCSC 62a_100009814027_100011218213 [0,2,0,0,0,0|1,0,1]=4 21320 B14R0.392 C=CCCCCCCCCCSCSC 62a_100011218213_100009814027 [0,2,0,0,0,0|1,0,1]=4 21321 B14R0.392 C=CCCCCCCCCNCCCC 2230a_100000102301_100011933949 [0,2,0,0,0,0|1,0,0]=3 21322 B14R0.392 C=CCCCCCCCCNCCCC 7a_106832991798_100011933949 [0,2,0,0,0,0|1,0,0]=3 21323 B14R0.392 C=CCCCCCCCCNCCCF 2230a_100015189416_100011933949 [0,2,0,0,0,0|1,0,1]=4 21324 B14R0.392 C=CCCCCCCCCNCCCF 34a_100015189416_100011933949 [0,2,0,0,0,0|1,0,1]=4 21325 B14R0.392 C=CCCCCCCCCNCCOC 2230a_100000209980_100011933949 [0,2,0,0,0,0|0,0,2]=4 21326 B14R0.392 C=CCCCCCCCCNCCSC 2230a_100020590264_100011933949 [0,2,0,0,0,0|1,0,1]=4 21327 B14R0.392 C=CCCCCCCCCOCCCBr 34a_100011217188_100011933949 [0,2,0,0,0,0|1,0,1]=4 21328 B14R0.392 C=CCCCCCCCCOCCCC 34a_100000210227_100011933949 [0,2,0,0,0,0|1,0,0]=3 21329 B14R0.392 C=CCCCCCCCCOCCCC 34a_100011215194_100000210210 [0,2,0,0,0,0|1,0,0]=3 21330 B14R0.392 C=CCCCCCCCCOCCCC 7a_100000210227_100011933949 [0,2,0,0,0,0|1,0,0]=3 21331 B14R0.392 C=CCCCCCCCCOCCCC 7a_100011215194_100000210211 [0,2,0,0,0,0|1,0,0]=3 21332 B14R0.392 C=CCCCCCCCCOCCCCl 34a_100000230001_100011933949 [0,2,0,0,0,0|1,0,1]=4 21333 B14R0.392 C=CCCCCCCCCOCCCF 34a_100000759539_100011933949 [0,2,0,0,0,0|1,0,1]=4 21334 B14R0.392 C=CCCCCCCCCOCCCF 34a_100011215194_100011934791 [0,2,0,0,0,0|1,0,1]=4 21335 B14R0.392 C=CCCCCCCCCOCCCF 7a_100011215194_100011934791 [0,2,0,0,0,0|1,0,1]=4 21336 B14R0.392 C=CCCCCCCCCOCCCN 34a_100000182051_100011933949 [0,2,0,0,0,0|1,0,1]=4 21337 B14R0.392 C=CCCCCCCCCOCCCO 34a_100011215194_100000230001 [0,2,0,0,0,0|0,0,1]=3 21338 B14R0.392 C=CCCCCCCCCOCCCO 7a_100011215194_100011215043 [0,2,0,0,0,0|0,0,1]=3 21339 B14R0.392 C=CCCCCCCCCOCCOC 34a_100000210237_100011933949 [0,2,0,0,0,0|0,0,2]=4 21340 B14R0.392 C=CCCCCCCCCOCCOC 34a_100011215194_100011201679 [0,2,0,0,0,0|0,0,2]=4 21341 B14R0.392 C=CCCCCCCCCOCCOC 7a_100011215194_100000233755 [0,2,0,0,0,0|0,0,2]=4 21342 B14R0.392 C=CCCCCCCCCOCCON 34a_100000700252_100011933949 [0,2,0,0,0,0|0,0,2]=4 21343 B14R0.392 C=CCCCCCCCCOCCSC 34a_100000230434_100011933949 [0,2,0,0,0,0|1,0,1]=4 21344 B14R0.392 C=CCCCCCCCCOCCSC 34a_100011215194_100000212216 [0,2,0,0,0,0|1,0,1]=4 21345 B14R0.392 C=CCCCCCCCCOCCSC 7a_100000230434_100011933949 [0,2,0,0,0,0|1,0,1]=4 21346 B14R0.392 C=CCCCCCCCCOCCSC 7a_100011215194_100000212216 [0,2,0,0,0,0|1,0,1]=4 21347 B14R0.392 C=CCCCCCCCCSCCCC 62a_100000210211_100011933949 [0,2,0,0,0,0|1,0,0]=3 21348 B14R0.392 C=CCCCCCCCCSCCCC 62a_100011933949_100000210210 [0,2,0,0,0,0|1,0,0]=3 21349 B14R0.392 C=CCCCCCCCCSCCCF 62a_100011933949_100011934791 [0,2,0,0,0,0|1,0,1]=4 21350 B14R0.392 C=CCCCCCCCCSCCCF 62a_100011934791_100011933949 [0,2,0,0,0,0|1,0,1]=4 21351 B14R0.392 C=CCCCCCCCCSCCCO 62a_100011215043_100011933949 [0,2,0,0,0,0|0,0,1]=3 21352 B14R0.392 C=CCCCCCCCCSCCCO 62a_100011933949_100011215043 [0,2,0,0,0,0|0,0,1]=3 21353 B14R0.392 C=CCCCCCCCCSCCOC 62a_100000233755_100011933949 [0,2,0,0,0,0|0,0,2]=4 21354 B14R0.392 C=CCCCCCCCCSCCOC 62a_100011933949_100000233755 [0,2,0,0,0,0|0,0,2]=4 21355 B14R0.392 C=CCCCCCCCCSCCSC 62a_100000212216_100011933949 [0,2,0,0,0,0|1,0,1]=4 21356 B14R0.392 C=CCCCCCCCCSCCSC 62a_100011933949_100000751147 [0,2,0,0,0,0|1,0,1]=4 21357 B14R0.392 C=CCCCCCCCCSCOCC 62a_100000739092_100011933949 [0,2,0,0,0,0|1,0,1]=4 21358 B14R0.392 C=CCCCCCCCCSCOCC 62a_100011933949_100000739092 [0,2,0,0,0,0|1,0,1]=4 21359 B14R0.392 C=CCCCCCCCNCCCCC 2230a_100000209983_100012355270 [0,2,0,0,0,0|1,0,0]=3 21360 B14R0.392 C=CCCCCCCCNCCCCO 2230a_100000750430_100012355270 [0,2,0,0,0,0|0,0,1]=3 21361 B14R0.392 C=CCCCCCCCNCCCCO 34a_100000750430_100012355270 [0,2,0,0,0,0|0,0,1]=3 21362 B14R0.392 C=CCCCCCCCNCCCOC 34a_100150723488_100012355270 [0,2,0,0,0,0|0,0,2]=4 21363 B14R0.392 C=CCCCCCCCNCCCSC 2230a_100000749238_100012355270 [0,2,0,0,0,0|1,0,1]=4 21364 B14R0.392 C=CCCCCCCCNCCOCC 2230a_102516460346_100012355270 [0,2,0,0,0,0|1,0,1]=4 21365 B14R0.392 C=CCCCCCCCNCCOCC 34a_102516460346_100012355270 [0,2,0,0,0,0|1,0,1]=4 21366 B14R0.392 C=CCCCCCCCNCCSCC 2230a_100000106463_100012355270 [0,2,0,0,0,0|1,0,1]=4 21367 B14R0.392 C=CCCCCCCCOCCCCBr 34a_100011216708_100012355270 [0,2,0,0,0,0|1,0,1]=4 21368 B14R0.392 C=CCCCCCCCOCCCCC 34a_100000210253_100012355270 [0,2,0,0,0,0|1,0,0]=3 21369 B14R0.392 C=CCCCCCCCOCCCCC 34a_100000730831_100000718602 [0,2,0,0,0,0|1,0,0]=3 21370 B14R0.392 C=CCCCCCCCOCCCCC 7a_100000210253_100012355270 [0,2,0,0,0,0|1,0,0]=3 21371 B14R0.392 C=CCCCCCCCOCCCCC 7a_100000730831_100000210326 [0,2,0,0,0,0|1,0,0]=3 21372 B14R0.392 C=CCCCCCCCOCCCCCl 34a_100000210776_100012355270 [0,2,0,0,0,0|1,0,1]=4 21373 B14R0.392 C=CCCCCCCCOCCCCCl 7a_100000210776_100012355270 [0,2,0,0,0,0|1,0,1]=4 21374 B14R0.392 C=CCCCCCCCOCCCCF 34a_100000730831_100000729493 [0,2,0,0,0,0|1,0,1]=4 21375 B14R0.392 C=CCCCCCCCOCCCCF 34a_100011995726_100012355270 [0,2,0,0,0,0|1,0,1]=4 21376 B14R0.392 C=CCCCCCCCOCCCCF 7a_100000730831_100000729493 [0,2,0,0,0,0|1,0,1]=4 21377 B14R0.392 C=CCCCCCCCOCCCCF 7a_100011995726_100012355270 [0,2,0,0,0,0|1,0,1]=4 21378 B14R0.392 C=CCCCCCCCOCCCCI 34a_200012148704_100012355270 [0,2,0,0,0,0|1,0,1]=4 21379 B14R0.392 C=CCCCCCCCOCCCCN 34a_100000750430_100012355270 [0,2,0,0,0,0|1,0,1]=4 21380 B14R0.392 C=CCCCCCCCOCCCCO 34a_100000730831_100011216708 [0,2,0,0,0,0|0,0,1]=3 21381 B14R0.392 C=CCCCCCCCOCCCCO 7a_100000730831_100000210776 [0,2,0,0,0,0|0,0,1]=3 21382 B14R0.392 C=CCCCCCCCOCCCNC 34a_100000213112_100012355270 [0,2,0,0,0,0|1,0,1]=4 21383 B14R0.392 C=CCCCCCCCOCCCOC 34a_100000730831_100000740836 [0,2,0,0,0,0|0,0,2]=4 21384 B14R0.392 C=CCCCCCCCOCCCOC 34a_100000740835_100012355270 [0,2,0,0,0,0|0,0,2]=4 21385 B14R0.392 C=CCCCCCCCOCCCOC 7a_100000730831_100000740836 [0,2,0,0,0,0|0,0,2]=4 21386 B14R0.392 C=CCCCCCCCOCCCSC 34a_100000690336_100012355270 [0,2,0,0,0,0|1,0,1]=4 21387 B14R0.392 C=CCCCCCCCOCCCSC 7a_100000690336_100012355270 [0,2,0,0,0,0|1,0,1]=4 21388 B14R0.392 C=CCCCCCCCOCCOCC 34a_100000210136_100012355270 [0,2,0,0,0,0|1,0,1]=4 21389 B14R0.392 C=CCCCCCCCOCCOCC 34a_100000730831_100000210147 [0,2,0,0,0,0|1,0,1]=4 21390 B14R0.392 C=CCCCCCCCOCCOCC 7a_100000210136_100012355270 [0,2,0,0,0,0|1,0,1]=4 21391 B14R0.392 C=CCCCCCCCOCCOCC 7a_100000730831_100011215890 [0,2,0,0,0,0|1,0,1]=4 21392 B14R0.392 C=CCCCCCCCOCCSCC 34a_100000212035_100012355270 [0,2,0,0,0,0|1,0,1]=4 21393 B14R0.392 C=CCCCCCCCOCCSCC 34a_100000730831_100000757381 [0,2,0,0,0,0|1,0,1]=4 21394 B14R0.392 C=CCCCCCCCOCCSCC 7a_100000212035_100012355270 [0,2,0,0,0,0|1,0,1]=4 21395 B14R0.392 C=CCCCCCCCOCCSCC 7a_100000730831_100000757381 [0,2,0,0,0,0|1,0,1]=4 21396 B14R0.392 C=CCCCCCCCSCCCCC 62a_100000210326_100012355270 [0,2,0,0,0,0|1,0,0]=3 21397 B14R0.392 C=CCCCCCCCSCCCCC 62a_100012355270_100000210326 [0,2,0,0,0,0|1,0,0]=3 21398 B14R0.392 C=CCCCCCCCSCCCCF 62a_100000729493_100012355270 [0,2,0,0,0,0|1,0,1]=4 21399 B14R0.392 C=CCCCCCCCSCCCCF 62a_100012355270_100000729493 [0,2,0,0,0,0|1,0,1]=4 21400 B14R0.392 C=CCCCCCCCSCCCCO 62a_100000210776_100012355270 [0,2,0,0,0,0|0,0,1]=3 21401 B14R0.392 C=CCCCCCCCSCCCCO 62a_100012355270_100000210776 [0,2,0,0,0,0|0,0,1]=3 21402 B14R0.392 C=CCCCCCCCSCCCOC 62a_100000709357_100012355270 [0,2,0,0,0,0|0,0,2]=4 21403 B14R0.392 C=CCCCCCCCSCCCOC 62a_100012355270_100000709357 [0,2,0,0,0,0|0,0,2]=4 21404 B14R0.392 C=CCCCCCCCSCCOCC 62a_100000210147_100012355270 [0,2,0,0,0,0|1,0,1]=4 21405 B14R0.392 C=CCCCCCCCSCCOCC 62a_100012355270_100011215890 [0,2,0,0,0,0|1,0,1]=4 21406 B14R0.392 C=CCCCCCCCSCCSCC 62a_100000757381_100012355270 [0,2,0,0,0,0|1,0,1]=4 21407 B14R0.392 C=CCCCCCCCSCCSCC 62a_100012355270_100000757381 [0,2,0,0,0,0|1,0,1]=4 21408 B14R0.392 C=CCCCCCCNCCCCCC 2230a_100000210581_100011215473 [0,2,0,0,0,0|1,0,0]=3 21409 B14R0.392 C=CCCCCCCNCCCCCO 2230a_100000762737_100011215473 [0,2,0,0,0,0|0,0,1]=3 21410 B14R0.392 C=CCCCCCCNCCCCCO 34a_100000762737_100011215473 [0,2,0,0,0,0|0,0,1]=3 21411 B14R0.392 C=CCCCCCCNCCCOCC 2230a_100000210961_100011215473 [0,2,0,0,0,0|1,0,1]=4 21412 B14R0.392 C=CCCCCCCNCCCOCC 34a_100000210961_100011215473 [0,2,0,0,0,0|1,0,1]=4 21413 B14R0.392 C=CCCCCCCNCCOCCC 2230a_100161115042_100011215473 [0,2,0,0,0,0|1,0,1]=4 21414 B14R0.392 C=CCCCCCCNCCOCCC 34a_100161115042_100011215473 [0,2,0,0,0,0|1,0,1]=4 21415 B14R0.392 C=CCCCCCCNCCOCCO 2230a_100000211614_100011215473 [0,2,0,0,0,0|0,0,2]=4 21416 B14R0.392 C=CCCCCCCNCCOCCO 34a_100000211614_100011215473 [0,2,0,0,0,0|0,0,2]=4 21417 B14R0.392 C=CCCCCCCNCCSCCC 2230a_100020603323_100011215473 [0,2,0,0,0,0|1,0,1]=4 21418 B14R0.392 C=CCCCCCCNCCSCCO 2230a_100011219999_100011215473 [0,2,0,0,0,0|0,0,2]=4 21419 B14R0.392 C=CCCCCCCOCCCCCBr 34a_100000746331_100011215473 [0,2,0,0,0,0|1,0,1]=4 21420 B14R0.392 C=CCCCCCCOCCCCCBr 7a_100000746331_100011215473 [0,2,0,0,0,0|1,0,1]=4 21421 B14R0.392 C=CCCCCCCOCCCCCC 34a_100000210259_100011215473 [0,2,0,0,0,0|1,0,0]=3 21422 B14R0.392 C=CCCCCCCOCCCCCC 34a_200011216477_100000210314 [0,2,0,0,0,0|1,0,0]=3 21423 B14R0.392 C=CCCCCCCOCCCCCC 7a_100000210259_100011215473 [0,2,0,0,0,0|1,0,0]=3 21424 B14R0.392 C=CCCCCCCOCCCCCC 7a_200011216477_100000210314 [0,2,0,0,0,0|1,0,0]=3 21425 B14R0.392 C=CCCCCCCOCCCCCCl 34a_100000746330_100011215473 [0,2,0,0,0,0|1,0,1]=4 21426 B14R0.392 C=CCCCCCCOCCCCCCl 7a_100000746330_100011215473 [0,2,0,0,0,0|1,0,1]=4 21427 B14R0.392 C=CCCCCCCOCCCCCF 34a_200011216477_100000729378 [0,2,0,0,0,0|1,0,1]=4 21428 B14R0.392 C=CCCCCCCOCCCCCF 7a_200011216477_100000729378 [0,2,0,0,0,0|1,0,1]=4 21429 B14R0.392 C=CCCCCCCOCCCCCI 34a_200012148887_100011215473 [0,2,0,0,0,0|1,0,1]=4 21430 B14R0.392 C=CCCCCCCOCCCCCI 7a_200012148887_100011215473 [0,2,0,0,0,0|1,0,1]=4 21431 B14R0.392 C=CCCCCCCOCCCCCN 34a_100000762737_100011215473 [0,2,0,0,0,0|1,0,1]=4 21432 B14R0.392 C=CCCCCCCOCCCCCO 34a_200011216477_100000746330 [0,2,0,0,0,0|0,0,1]=3 21433 B14R0.392 C=CCCCCCCOCCCCCO 7a_200011216477_100000746330 [0,2,0,0,0,0|0,0,1]=3 21434 B14R0.392 C=CCCCCCCOCCCCOC 34a_100000740925_100011215473 [0,2,0,0,0,0|0,0,2]=4 21435 B14R0.392 C=CCCCCCCOCCCCOC 34a_200011216477_100000755781 [0,2,0,0,0,0|0,0,2]=4 21436 B14R0.392 C=CCCCCCCOCCCCOC 7a_200011216477_100000730899 [0,2,0,0,0,0|0,0,2]=4 21437 B14R0.392 C=CCCCCCCOCCCCSC 34a_100011217163_100011215473 [0,2,0,0,0,0|1,0,1]=4 21438 B14R0.392 C=CCCCCCCOCCCCSC 7a_100011217163_100011215473 [0,2,0,0,0,0|1,0,1]=4 21439 B14R0.392 C=CCCCCCCOCCCOCC 34a_100000757476_100011215473 [0,2,0,0,0,0|1,0,1]=4 21440 B14R0.392 C=CCCCCCCOCCCOCC 34a_200011216477_100012232248 [0,2,0,0,0,0|1,0,1]=4 21441 B14R0.392 C=CCCCCCCOCCCOCC 7a_100000757476_100011215473 [0,2,0,0,0,0|1,0,1]=4 21442 B14R0.392 C=CCCCCCCOCCCOCC 7a_200011216477_100012232248 [0,2,0,0,0,0|1,0,1]=4 21443 B14R0.392 C=CCCCCCCOCCCSCC 34a_100011216438_100011215473 [0,2,0,0,0,0|1,0,1]=4 21444 B14R0.392 C=CCCCCCCOCCCSCC 7a_100011216438_100011215473 [0,2,0,0,0,0|1,0,1]=4 21445 B14R0.392 C=CCCCCCCOCCOCCC 34a_100000752267_100011215473 [0,2,0,0,0,0|1,0,1]=4 21446 B14R0.392 C=CCCCCCCOCCOCCC 34a_200011216477_100011215938 [0,2,0,0,0,0|1,0,1]=4 21447 B14R0.392 C=CCCCCCCOCCOCCC 7a_100000752267_100011215473 [0,2,0,0,0,0|1,0,1]=4 21448 B14R0.392 C=CCCCCCCOCCOCCC 7a_200011216477_100011215938 [0,2,0,0,0,0|1,0,1]=4 21449 B14R0.392 C=CCCCCCCOCCOCCO 34a_200011216477_100000692535 [0,2,0,0,0,0|0,0,2]=4 21450 B14R0.392 C=CCCCCCCOCCOCCO 7a_200011216477_100011215305 [0,2,0,0,0,0|0,0,2]=4 21451 B14R0.392 C=CCCCCCCOCCSCCC 34a_200000230433_100011215473 [0,2,0,0,0,0|1,0,1]=4 21452 B14R0.392 C=CCCCCCCOCCSCCC 7a_200000230433_100011215473 [0,2,0,0,0,0|1,0,1]=4 21453 B14R0.392 C=CCCCCCCOCOCCCC 34a_200011216477_100011995733 [0,2,0,0,0,0|1,0,1]=4 21454 B14R0.392 C=CCCCCCCSCCCCCC 62a_100000210314_100011215473 [0,2,0,0,0,0|1,0,0]=3 21455 B14R0.392 C=CCCCCCCSCCCCCC 62a_100011215473_100000210757 [0,2,0,0,0,0|1,0,0]=3 21456 B14R0.392 C=CCCCCCCSCCCCCF 62a_100000729378_100011215473 [0,2,0,0,0,0|1,0,1]=4 21457 B14R0.392 C=CCCCCCCSCCCCCF 62a_100011215473_100000729378 [0,2,0,0,0,0|1,0,1]=4 21458 B14R0.392 C=CCCCCCCSCCCCCO 62a_100000746330_100011215473 [0,2,0,0,0,0|0,0,1]=3 21459 B14R0.392 C=CCCCCCCSCCCCCO 62a_100011215473_100000746330 [0,2,0,0,0,0|0,0,1]=3 21460 B14R0.392 C=CCCCCCCSCCCCOC 62a_100000730899_100011215473 [0,2,0,0,0,0|0,0,2]=4 21461 B14R0.392 C=CCCCCCCSCCCCOC 62a_100011215473_100000730899 [0,2,0,0,0,0|0,0,2]=4 21462 B14R0.392 C=CCCCCCCSCCCOCC 62a_100011215473_100012232248 [0,2,0,0,0,0|1,0,1]=4 21463 B14R0.392 C=CCCCCCCSCCCOCC 62a_100012232248_100011215473 [0,2,0,0,0,0|1,0,1]=4 21464 B14R0.392 C=CCCCCCCSCCOCCC 62a_100011215473_100011215938 [0,2,0,0,0,0|1,0,1]=4 21465 B14R0.392 C=CCCCCCCSCCOCCC 62a_100011215938_100011215473 [0,2,0,0,0,0|1,0,1]=4 21466 B14R0.392 C=CCCCCCCSCCOCCO 62a_100011215305_100011215473 [0,2,0,0,0,0|0,0,2]=4 21467 B14R0.392 C=CCCCCCCSCCOCCO 62a_100011215473_100011215305 [0,2,0,0,0,0|0,0,2]=4 21468 B14R0.392 C=CCCCCCCSCOCCCC 62a_100011215473_100011995733 [0,2,0,0,0,0|1,0,1]=4 21469 B14R0.392 C=CCCCCCCSCOCCCC 62a_100011995733_100011215473 [0,2,0,0,0,0|1,0,1]=4 21470 B14R0.392 C=CCCCCCNCCCCCCC 2230a_100000229938_100000700193 [0,2,0,0,0,0|1,0,0]=3 21471 B14R0.392 C=CCCCCCNCCCCCCO 2230a_100000686447_100000700193 [0,2,0,0,0,0|0,0,1]=3 21472 B14R0.392 C=CCCCCCNCCCCCCO 34a_100000686447_100000700193 [0,2,0,0,0,0|0,0,1]=3 21473 B14R0.392 C=CCCCCCNCCCCCOC 2230a_100000747528_100000700193 [0,2,0,0,0,0|0,0,2]=4 21474 B14R0.392 C=CCCCCCNCCCCCOC 34a_100000747528_100000700193 [0,2,0,0,0,0|0,0,2]=4 21475 B14R0.392 C=CCCCCCNCCCOCCC 2230a_100011217757_100000700193 [0,2,0,0,0,0|1,0,1]=4 21476 B14R0.392 C=CCCCCCNCCCOCCC 34a_100011217757_100000700193 [0,2,0,0,0,0|1,0,1]=4 21477 B14R0.392 C=CCCCCCNCCSCCCC 2230a_100025743550_100000700193 [0,2,0,0,0,0|1,0,1]=4 21478 B14R0.392 C=CCCCCCOCCCCCCBr 34a_100011215345_100000700193 [0,2,0,0,0,0|1,0,1]=4 21479 B14R0.392 C=CCCCCCOCCCCCCBr 7a_100011215345_100000700193 [0,2,0,0,0,0|1,0,1]=4 21480 B14R0.392 C=CCCCCCOCCCCCCC 34a_100000210272_100000700193 [0,2,0,0,0,0|1,0,0]=3 21481 B14R0.392 C=CCCCCCOCCCCCCC 34a_100011216702_100000210614 [0,2,0,0,0,0|1,0,0]=3 21482 B14R0.392 C=CCCCCCOCCCCCCC 7a_100000210272_100000700193 [0,2,0,0,0,0|1,0,0]=3 21483 B14R0.392 C=CCCCCCOCCCCCCC 7a_100011216702_100000210614 [0,2,0,0,0,0|1,0,0]=3 21484 B14R0.392 C=CCCCCCOCCCCCCCl 34a_100000766143_100000700193 [0,2,0,0,0,0|1,0,1]=4 21485 B14R0.392 C=CCCCCCOCCCCCCCl 7a_100000766143_100000700193 [0,2,0,0,0,0|1,0,1]=4 21486 B14R0.392 C=CCCCCCOCCCCCCF 34a_100000732779_100000700193 [0,2,0,0,0,0|1,0,1]=4 21487 B14R0.392 C=CCCCCCOCCCCCCF 34a_100011216702_100015922095 [0,2,0,0,0,0|1,0,1]=4 21488 B14R0.392 C=CCCCCCOCCCCCCF 7a_100000732779_100000700193 [0,2,0,0,0,0|1,0,1]=4 21489 B14R0.392 C=CCCCCCOCCCCCCF 7a_100011216702_100015922095 [0,2,0,0,0,0|1,0,1]=4 21490 B14R0.392 C=CCCCCCOCCCCCCN 34a_100000686447_100000700193 [0,2,0,0,0,0|1,0,1]=4 21491 B14R0.392 C=CCCCCCOCCCCCCO 34a_100011216702_100000766143 [0,2,0,0,0,0|0,0,1]=3 21492 B14R0.392 C=CCCCCCOCCCCCCO 7a_100011216702_100000766143 [0,2,0,0,0,0|0,0,1]=3 21493 B14R0.392 C=CCCCCCOCCCCCNC 34a_100000722520_100000700193 [0,2,0,0,0,0|1,0,1]=4 21494 B14R0.392 C=CCCCCCOCCOCCCC 34a_100000210238_100000700193 [0,2,0,0,0,0|1,0,1]=4 21495 B14R0.392 C=CCCCCCOCCOCCCC 34a_100011216702_100000743108 [0,2,0,0,0,0|1,0,1]=4 21496 B14R0.392 C=CCCCCCOCCOCCCC 7a_100000210238_100000700193 [0,2,0,0,0,0|1,0,1]=4 21497 B14R0.392 C=CCCCCCOCCOCCCC 7a_100011216702_100000743108 [0,2,0,0,0,0|1,0,1]=4 21498 B14R0.392 C=CCCCCCOCCSCCCC 34a_200000230436_100000700193 [0,2,0,0,0,0|1,0,1]=4 21499 B14R0.392 C=CCCCCCOCCSCCCC 7a_200000230436_100000700193 [0,2,0,0,0,0|1,0,1]=4 21500 B14R0.392 C=CCCCCCSCCCCCCC 62a_100000210614_100000700193 [0,2,0,0,0,0|1,0,0]=3 21501 B14R0.392 C=CCCCCCSCCCCCCC 62a_100000700193_100000210316 [0,2,0,0,0,0|1,0,0]=3 21502 B14R0.392 C=CCCCCCSCCCCCCF 62a_100000700193_100015922095 [0,2,0,0,0,0|1,0,1]=4 21503 B14R0.392 C=CCCCCCSCCCCCCF 62a_100015922095_100000700193 [0,2,0,0,0,0|1,0,1]=4 21504 B14R0.392 C=CCCCCCSCCCCCCO 62a_100000700193_100000766143 [0,2,0,0,0,0|0,0,1]=3 21505 B14R0.392 C=CCCCCCSCCCCCCO 62a_100000766143_100000700193 [0,2,0,0,0,0|0,0,1]=3 21506 B14R0.392 C=CCCCCCSCCOCCCC 62a_100000700193_100000743108 [0,2,0,0,0,0|1,0,1]=4 21507 B14R0.392 C=CCCCCCSCCOCCCC 62a_100000743108_100000700193 [0,2,0,0,0,0|1,0,1]=4 21508 B14R0.392 C=CCCCCNCCCCCCCC 2230a_100000229939_100011215482 [0,2,0,0,0,0|1,0,0]=3 21509 B14R0.392 C=CCCCCNCCCCCCCC 2230a_100000703577_100000210759 [0,2,0,0,0,0|1,0,0]=3 21510 B14R0.392 C=CCCCCNCCCCCCCC 34a_100000229939_100011215482 [0,2,0,0,0,0|1,0,0]=3 21511 B14R0.392 C=CCCCCNCCCCCCCC 34a_100000703577_100000210759 [0,2,0,0,0,0|1,0,0]=3 21512 B14R0.392 C=CCCCCNCCCCCCCO 2230a_100000703577_100000760002 [0,2,0,0,0,0|0,0,1]=3 21513 B14R0.392 C=CCCCCNCCCCCCCO 2230a_100011996573_100011215482 [0,2,0,0,0,0|0,0,1]=3 21514 B14R0.392 C=CCCCCNCCCCCCCO 34a_100000703577_100000760002 [0,2,0,0,0,0|0,0,1]=3 21515 B14R0.392 C=CCCCCNCCCCCCCO 34a_100011996573_100011215482 [0,2,0,0,0,0|0,0,1]=3 21516 B14R0.392 C=CCCCCNCCCCCCOC 2230a_100000703577_100011998445 [0,2,0,0,0,0|0,0,2]=4 21517 B14R0.392 C=CCCCCNCCCCCCOC 34a_100000703577_100011998445 [0,2,0,0,0,0|0,0,2]=4 21518 B14R0.392 C=CCCCCNCCCOCCCC 2230a_200000211371_100011215482 [0,2,0,0,0,0|1,0,1]=4 21519 B14R0.392 C=CCCCCNCCCOCCCC 34a_200000211371_100011215482 [0,2,0,0,0,0|1,0,1]=4 21520 B14R0.392 C=CCCCCNCCCOCCCO 2230a_100011310245_100011215482 [0,2,0,0,0,0|0,0,2]=4 21521 B14R0.392 C=CCCCCNCCCOCCCO 34a_100011310245_100011215482 [0,2,0,0,0,0|0,0,2]=4 21522 B14R0.392 C=CCCCCOCCCCCCCBr 34a_100000760002_100011215482 [0,2,0,0,0,0|1,0,1]=4 21523 B14R0.392 C=CCCCCOCCCCCCCBr 7a_100000760002_100011215482 [0,2,0,0,0,0|1,0,1]=4 21524 B14R0.392 C=CCCCCOCCCCCCCC 34a_100000210232_100011215482 [0,2,0,0,0,0|1,0,0]=3 21525 B14R0.392 C=CCCCCOCCCCCCCC 34a_100000766645_100000210759 [0,2,0,0,0,0|1,0,0]=3 21526 B14R0.392 C=CCCCCOCCCCCCCC 7a_100000210232_100011215482 [0,2,0,0,0,0|1,0,0]=3 21527 B14R0.392 C=CCCCCOCCCCCCCC 7a_100000766645_100000210759 [0,2,0,0,0,0|1,0,0]=3 21528 B14R0.392 C=CCCCCOCCCCCCCN 34a_100011996573_100011215482 [0,2,0,0,0,0|1,0,1]=4 21529 B14R0.392 C=CCCCCOCCCCCCCO 34a_100000766645_100000760002 [0,2,0,0,0,0|0,0,1]=3 21530 B14R0.392 C=CCCCCOCCCCCCCO 7a_100000766645_100000760002 [0,2,0,0,0,0|0,0,1]=3 21531 B14R0.392 C=CCCCCOCCCCCCOC 34a_100000766645_100011998445 [0,2,0,0,0,0|0,0,2]=4 21532 B14R0.392 C=CCCCCOCCCCCCOC 34a_200012092642_100011215482 [0,2,0,0,0,0|0,0,2]=4 21533 B14R0.392 C=CCCCCOCCCCCCOC 7a_100000766645_100011998445 [0,2,0,0,0,0|0,0,2]=4 21534 B14R0.392 C=CCCCCOCCCCCCOC 7a_200012092642_100011215482 [0,2,0,0,0,0|0,0,2]=4 21535 B14R0.392 C=CCCCCOCCCOCCCC 34a_200011215613_100011215482 [0,2,0,0,0,0|1,0,1]=4 21536 B14R0.392 C=CCCCCOCCCOCCCC 7a_200011215613_100011215482 [0,2,0,0,0,0|1,0,1]=4 21537 B14R0.392 C=CCCCCOCCNCCCCC 34a_100000224656_100011215482 [0,2,0,0,0,0|1,0,1]=4 21538 B14R0.392 C=CCCCCOCCOCCCCC 34a_100011215259_100011215482 [0,2,0,0,0,0|1,0,1]=4 21539 B14R0.392 C=CCCCCOCCOCCCCC 7a_100011215259_100011215482 [0,2,0,0,0,0|1,0,1]=4 21540 B14R0.392 C=CCCCCSCCCCCCCC 62a_100000210759_100011215482 [0,2,0,0,0,0|1,0,0]=3 21541 B14R0.392 C=CCCCCSCCCCCCCC 62a_100011215482_100000210317 [0,2,0,0,0,0|1,0,0]=3 21542 B14R0.392 C=CCCCCSCCCCCCCO 62a_100000760002_100011215482 [0,2,0,0,0,0|0,0,1]=3 21543 B14R0.392 C=CCCCCSCCCCCCCO 62a_100011215482_100000760002 [0,2,0,0,0,0|0,0,1]=3 21544 B14R0.392 C=CCCCCSCCCCCCOC 62a_100011215482_100011998445 [0,2,0,0,0,0|0,0,2]=4 21545 B14R0.392 C=CCCCCSCCCCCCOC 62a_100011998445_100011215482 [0,2,0,0,0,0|0,0,2]=4 21546 B14R0.392 C=CCCCNCCCCCCCCC 2230a_100000212291_100011713584 [0,2,0,0,0,0|1,0,0]=3 21547 B14R0.392 C=CCCCNCCCCCCCCC 2230a_100000700776_100011214924 [0,2,0,0,0,0|1,0,0]=3 21548 B14R0.392 C=CCCCNCCCCCCCCC 34a_100000212291_100000757094 [0,2,0,0,0,0|1,0,0]=3 21549 B14R0.392 C=CCCCNCCCCCCCCC 34a_100000700776_100011214924 [0,2,0,0,0,0|1,0,0]=3 21550 B14R0.392 C=CCCCNCCCCCCCCO 2230a_100000700776_100000033203 [0,2,0,0,0,0|0,0,1]=3 21551 B14R0.392 C=CCCCNCCCCCCCCO 2230a_102515433106_100011713584 [0,2,0,0,0,0|0,0,1]=3 21552 B14R0.392 C=CCCCNCCCCCCCCO 34a_100000700776_100000033203 [0,2,0,0,0,0|0,0,1]=3 21553 B14R0.392 C=CCCCNCCCCCCCCO 34a_102515433106_100000757094 [0,2,0,0,0,0|0,0,1]=3 21554 B14R0.392 C=CCCCOCCCCCCCCBr 34a_100009813846_100000757094 [0,2,0,0,0,0|1,0,1]=4 21555 B14R0.392 C=CCCCOCCCCCCCCBr 7a_100009813846_100000757094 [0,2,0,0,0,0|1,0,1]=4 21556 B14R0.392 C=CCCCOCCCCCCCCC 34a_100000210712_100000757094 [0,2,0,0,0,0|1,0,0]=3 21557 B14R0.392 C=CCCCOCCCCCCCCC 34a_100000758997_100011214924 [0,2,0,0,0,0|1,0,0]=3 21558 B14R0.392 C=CCCCOCCCCCCCCC 7a_100000210712_100000757094 [0,2,0,0,0,0|1,0,0]=3 21559 B14R0.392 C=CCCCOCCCCCCCCC 7a_100000758997_100000210328 [0,2,0,0,0,0|1,0,0]=3 21560 B14R0.392 C=CCCCOCCCCCCCCCl 34a_100000033203_100000757094 [0,2,0,0,0,0|1,0,1]=4 21561 B14R0.392 C=CCCCOCCCCCCCCCl 7a_100000033203_100000757094 [0,2,0,0,0,0|1,0,1]=4 21562 B14R0.392 C=CCCCOCCCCCCCCN 34a_102515433106_100000757094 [0,2,0,0,0,0|1,0,1]=4 21563 B14R0.392 C=CCCCOCCCCCCCCO 34a_100000758997_100000033203 [0,2,0,0,0,0|0,0,1]=3 21564 B14R0.392 C=CCCCOCCCCCCCCO 7a_100000758997_100000033203 [0,2,0,0,0,0|0,0,1]=3 21565 B14R0.392 C=CCCCOCCCCNCCCC 34a_200011216965_100000757094 [0,2,0,0,0,0|1,0,1]=4 21566 B14R0.392 C=CCCCOCCCCOCCCC 34a_200000760531_100000757094 [0,2,0,0,0,0|1,0,1]=4 21567 B14R0.392 C=CCCCOCCCCOCCCC 7a_200000760531_100000757094 [0,2,0,0,0,0|1,0,1]=4 21568 B14R0.392 C=CCCCOCCOCCCCCC 34a_100000691444_100000757094 [0,2,0,0,0,0|1,0,1]=4 21569 B14R0.392 C=CCCCOCCOCCCCCC 7a_100000691444_100000757094 [0,2,0,0,0,0|1,0,1]=4 21570 B14R0.392 C=CCCCSCCCCCCCCC 62a_100011713584_100000210670 [0,2,0,0,0,0|1,0,0]=3 21571 B14R0.392 C=CCCCSCCCCCCCCO 62a_100000033203_100000757094 [0,2,0,0,0,0|0,0,1]=3 21572 B14R0.392 C=CCCCSCCCCCCCCO 62a_100011713584_100000033203 [0,2,0,0,0,0|0,0,1]=3 21573 B14R0.392 C=CCCNCCCCCCCCCC 2230a_100000684558_100000754431 [0,2,0,0,0,0|1,0,0]=3 21574 B14R0.392 C=CCCNCCCCCCCCCC 2230a_100015191253_100000210320 [0,2,0,0,0,0|1,0,0]=3 21575 B14R0.392 C=CCCNCCCCCCCCCC 34a_100000684558_100000754431 [0,2,0,0,0,0|1,0,0]=3 21576 B14R0.392 C=CCCNCCCCCCCCCO 2230a_100000078944_100000754431 [0,2,0,0,0,0|0,0,1]=3 21577 B14R0.392 C=CCCNCCCCCCCCCO 2230a_100015191253_100009813782 [0,2,0,0,0,0|0,0,1]=3 21578 B14R0.392 C=CCCNCCCCCCCCCO 34a_100000078944_100000754431 [0,2,0,0,0,0|0,0,1]=3 21579 B14R0.392 C=CCCOCCCCCCCCCBr 34a_100009813782_100000754431 [0,2,0,0,0,0|1,0,1]=4 21580 B14R0.392 C=CCCOCCCCCCCCCBr 7a_100009813782_100000754431 [0,2,0,0,0,0|1,0,1]=4 21581 B14R0.392 C=CCCOCCCCCCCCCC 34a_100000210711_100000754431 [0,2,0,0,0,0|1,0,0]=3 21582 B14R0.392 C=CCCOCCCCCCCCCC 34a_100011205117_100000210320 [0,2,0,0,0,0|1,0,0]=3 21583 B14R0.392 C=CCCOCCCCCCCCCC 7a_100000210711_100000754431 [0,2,0,0,0,0|1,0,0]=3 21584 B14R0.392 C=CCCOCCCCCCCCCCl 34a_100009868337_100000754431 [0,2,0,0,0,0|1,0,1]=4 21585 B14R0.392 C=CCCOCCCCCCCCCCl 7a_100009868337_100000754431 [0,2,0,0,0,0|1,0,1]=4 21586 B14R0.392 C=CCCOCCCCCCCCCN 34a_100000078944_100000754431 [0,2,0,0,0,0|1,0,1]=4 21587 B14R0.392 C=CCCOCCCCCCCCCO 34a_100011205117_100009813782 [0,2,0,0,0,0|0,0,1]=3 21588 B14R0.392 C=CCCSCCCCCCCCCC 62a_100000754431_100000210320 [0,2,0,0,0,0|1,0,0]=3 21589 B14R0.392 C=CCCSCCCCCCCCCO 62a_100000754431_100009813782 [0,2,0,0,0,0|0,0,1]=3 21590 B14R0.392 C=CCCSCCCCCCCCCO 62a_100009813782_100000754431 [0,2,0,0,0,0|0,0,1]=3 21591 B14R0.392 C=CCNCCCCCCCCCCC 2230a_100020586998_100011215454 [0,2,0,0,0,0|1,0,0]=3 21592 B14R0.392 C=CCNCCCCCCCCCCC 2230a_200011215754_100000210623 [0,2,0,0,0,0|1,0,0]=3 21593 B14R0.392 C=CCNCCCCCCCCCCC 34a_200011215754_100015514636 [0,2,0,0,0,0|1,0,0]=3 21594 B14R0.392 C=CCNCCCCCCCCCCO 2230a_100000066964_100000210623 [0,2,0,0,0,0|0,0,1]=3 21595 B14R0.392 C=CCNCCCCCCCCCCO 2230a_100020586998_100009813290 [0,2,0,0,0,0|0,0,1]=3 21596 B14R0.392 C=CCNCCCCCCCCCCO 34a_100000066964_100015514636 [0,2,0,0,0,0|0,0,1]=3 21597 B14R0.392 C=CCOCCCCCCCCCCBr 34a_100009813290_100015514636 [0,2,0,0,0,0|1,0,1]=4 21598 B14R0.392 C=CCOCCCCCCCCCCBr 7a_100009813290_100015514636 [0,2,0,0,0,0|1,0,1]=4 21599 B14R0.392 C=CCOCCCCCCCCCCC 34a_100000210809_100015514636 [0,2,0,0,0,0|1,0,0]=3 21600 B14R0.392 C=CCOCCCCCCCCCCC 34a_200000210373_100011215454 [0,2,0,0,0,0|1,0,0]=3 21601 B14R0.392 C=CCOCCCCCCCCCCC 7a_100000210809_100015514636 [0,2,0,0,0,0|1,0,0]=3 21602 B14R0.392 C=CCOCCCCCCCCCCCl 34a_200000033068_100015514636 [0,2,0,0,0,0|1,0,1]=4 21603 B14R0.392 C=CCOCCCCCCCCCCCl 7a_200000033068_100015514636 [0,2,0,0,0,0|1,0,1]=4 21604 B14R0.392 C=CCOCCCCCCCCCCN 34a_100000066964_100015514636 [0,2,0,0,0,0|1,0,1]=4 21605 B14R0.392 C=CCOCCCCCCCCCCO 34a_200000210373_100009813290 [0,2,0,0,0,0|0,0,1]=3 21606 B14R0.392 C=CCOCCOCCCCCCCC 34a_100000037705_100000210759 [0,2,0,0,0,0|1,0,1]=4 21607 B14R0.392 C=CCOCCOCCCCCCCC 7a_100000037705_100000210759 [0,2,0,0,0,0|1,0,1]=4 21608 B14R0.392 C=CCOCCOCCCCCCCO 34a_100000037705_100000760002 [0,2,0,0,0,0|0,0,2]=4 21609 B14R0.392 C=CCOCCOCCCCCCCO 7a_100000037705_100000760002 [0,2,0,0,0,0|0,0,2]=4 21610 B14R0.392 C=CCSCCCCCCCCCCC 62a_100000210623_100011215454 [0,2,0,0,0,0|1,0,0]=3 21611 B14R0.392 C=CCSCCCCCCCCCCO 62a_100000210623_200000033068 [0,2,0,0,0,0|0,0,1]=3 21612 B14R0.392 C=CCSCCCCCCCCCCO 62a_100009813290_100000210623 [0,2,0,0,0,0|0,0,1]=3 21613 B14R0.392 C=COCCCCOCCCCCCC 34a_100000031558_100000210614 [0,2,0,0,0,0|1,0,0]=3 21614 B14R0.392 C=COCCCCOCCCCCCC 7a_100000031558_100000210614 [0,2,0,0,0,0|1,0,0]=3 21615 B14R0.392 C=COCCCCOCCCCCCF 34a_100000031558_100015922095 [0,2,0,0,0,0|2,0,0]=4 21616 B14R0.392 C=COCCCCOCCCCCCF 7a_100000031558_100015922095 [0,2,0,0,0,0|2,0,0]=4 21617 B14R0.392 C=COCCCCOCCCCCCO 34a_100000031558_100000766143 [0,2,0,0,0,0|0,0,2]=4 21618 B14R0.392 C=COCCCCOCCCCCCO 7a_100000031558_100000766143 [0,2,0,0,0,0|0,0,2]=4 21619 B14R0.392 C=COCCCCOCCOCCCC 34a_100000031558_100000743108 [0,2,0,0,0,0|2,0,0]=4 21620 B14R0.392 C=COCCCCOCCOCCCC 7a_100000031558_100000743108 [0,2,0,0,0,0|2,0,0]=4 21621 B14R0.392 C=COCCCNCCCCCCCC 2230a_100000210767_100000210759 [0,2,0,0,0,0|1,0,0]=3 21622 B14R0.392 C=COCCCNCCCCCCCC 34a_100000210767_100000210759 [0,2,0,0,0,0|1,0,0]=3 21623 B14R0.392 C=COCCCNCCCCCCCO 2230a_100000210767_100000760002 [0,2,0,0,0,0|0,0,2]=4 21624 B14R0.392 C=COCCCNCCCCCCCO 34a_100000210767_100000760002 [0,2,0,0,0,0|0,0,2]=4 21625 B14R0.392 C=COCCCNCCCCCCOC 2230a_100000210767_100011998445 [0,2,0,0,0,0|2,0,0]=4 21626 B14R0.392 C=COCCCNCCCCCCOC 34a_100000210767_100011998445 [0,2,0,0,0,0|2,0,0]=4 21627 B14R0.392 C=COCCNCCCCCCCCC 2230a_100000212291_100000039644 [0,2,0,0,0,0|1,0,0]=3 21628 B14R0.392 C=COCCNCCCCCCCCC 34a_100000212291_100000039644 [0,2,0,0,0,0|1,0,0]=3 21629 B14R0.392 C=COCCNCCCCCCCCO 2230a_102515433106_100000039644 [0,2,0,0,0,0|0,0,2]=4 21630 B14R0.392 C=COCCNCCCCCCCCO 34a_102515433106_100000039644 [0,2,0,0,0,0|0,0,2]=4 21631 B14R0.392 C=COCCOCCCCCCCCBr 34a_100009813846_100000039644 [0,2,0,0,0,0|2,0,0]=4 21632 B14R0.392 C=COCCOCCCCCCCCBr 7a_100009813846_100000039644 [0,2,0,0,0,0|2,0,0]=4 21633 B14R0.392 C=COCCOCCCCCCCCC 34a_100000033082_100011214924 [0,2,0,0,0,0|1,0,0]=3 21634 B14R0.392 C=COCCOCCCCCCCCC 34a_100000210712_100000039644 [0,2,0,0,0,0|1,0,0]=3 21635 B14R0.392 C=COCCOCCCCCCCCC 7a_100000210712_100000039644 [0,2,0,0,0,0|1,0,0]=3 21636 B14R0.392 C=COCCOCCCCCCCCCl 34a_100000033203_100000039644 [0,2,0,0,0,0|2,0,0]=4 21637 B14R0.392 C=COCCOCCCCCCCCCl 7a_100000033203_100000039644 [0,2,0,0,0,0|2,0,0]=4 21638 B14R0.392 C=COCCOCCCCCCCCN 34a_102515433106_100000039644 [0,2,0,0,0,0|2,0,0]=4 21639 B14R0.392 C=COCCOCCCCCCCCO 34a_100000033082_100000033203 [0,2,0,0,0,0|0,0,2]=4 21640 B14R0.392 C=COCCOCCCCNCCCC 34a_200011216965_100000039644 [0,2,0,0,0,0|2,0,0]=4 21641 B14R0.392 C=COCCOCCCCOCCCC 34a_200000760531_100000039644 [0,2,0,0,0,0|2,0,0]=4 21642 B14R0.392 C=COCCOCCCCOCCCC 7a_200000760531_100000039644 [0,2,0,0,0,0|2,0,0]=4 21643 B14R0.392 C=COCCOCCOCCCCCC 34a_100000039918_100000210314 [0,2,0,0,0,0|2,0,0]=4 21644 B14R0.392 C=COCCOCCOCCCCCC 34a_100000691444_100000039644 [0,2,0,0,0,0|2,0,0]=4 21645 B14R0.392 C=COCCOCCOCCCCCC 7a_100000039918_100000210314 [0,2,0,0,0,0|2,0,0]=4 21646 B14R0.392 C=COCCOCCOCCCCCC 7a_100000691444_100000039644 [0,2,0,0,0,0|2,0,0]=4 21647 B14R0.392 C=COCCSCCCCCCCCC 62a_100000039644_100000210670 [0,2,0,0,0,0|1,0,0]=3 21648 B14R0.392 C=COCCSCCCCCCCCO 62a_100000033203_100000039644 [0,2,0,0,0,0|0,0,2]=4 21649 B14R0.392 C=COCCSCCCCCCCCO 62a_100000039644_100000033203 [0,2,0,0,0,0|0,0,2]=4 21650 B14R0.392 CC#CCCOCCCCCCCCC 34a_100000750427_100011214924 [0,2,0,0,0,0|1,0,1]=4 21651 B14R0.392 CC#CCCOCCCCCCCCO 34a_100000750427_100000033203 [0,2,0,0,0,0|0,0,1]=3 21652 B14R0.392 CC#CCNCCCCCCCCCC 2230a_100000684558_100000748600 [0,2,0,0,0,0|1,0,1]=4 21653 B14R0.392 CC#CCNCCCCCCCCCC 2230a_100000685387_100000210320 [0,2,0,0,0,0|1,0,1]=4 21654 B14R0.392 CC#CCNCCCCCCCCCC 34a_100000684558_100000748600 [0,2,0,0,0,0|1,0,1]=4 21655 B14R0.392 CC#CCNCCCCCCCCCC 34a_100000685387_100000210320 [0,2,0,0,0,0|1,0,1]=4 21656 B14R0.392 CC#CCNCCCCCCCCCO 2230a_100000078944_100000748600 [0,2,0,0,0,0|0,0,1]=3 21657 B14R0.392 CC#CCNCCCCCCCCCO 2230a_100000685387_100009813782 [0,2,0,0,0,0|0,0,1]=3 21658 B14R0.392 CC#CCNCCCCCCCCCO 34a_100000078944_100000748600 [0,2,0,0,0,0|0,0,1]=3 21659 B14R0.392 CC#CCNCCCCCCCCCO 34a_100000685387_100009813782 [0,2,0,0,0,0|0,0,1]=3 21660 B14R0.392 CC#CCOCCCCCCCCCBr 34a_100009813782_100000748600 [0,2,0,0,0,0|1,0,1]=4 21661 B14R0.392 CC#CCOCCCCCCCCCBr 7a_100009813782_100000748600 [0,2,0,0,0,0|1,0,1]=4 21662 B14R0.392 CC#CCOCCCCCCCCCC 34a_100000210711_100000748600 [0,2,0,0,0,0|1,0,1]=4 21663 B14R0.392 CC#CCOCCCCCCCCCC 34a_100000761923_100000210320 [0,2,0,0,0,0|1,0,1]=4 21664 B14R0.392 CC#CCOCCCCCCCCCC 7a_100000210711_100000748600 [0,2,0,0,0,0|1,0,1]=4 21665 B14R0.392 CC#CCOCCCCCCCCCCl 34a_100009868337_100000748600 [0,2,0,0,0,0|1,0,1]=4 21666 B14R0.392 CC#CCOCCCCCCCCCCl 7a_100009868337_100000748600 [0,2,0,0,0,0|1,0,1]=4 21667 B14R0.392 CC#CCOCCCCCCCCCN 34a_100000078944_100000748600 [0,2,0,0,0,0|1,0,1]=4 21668 B14R0.392 CC#CCOCCCCCCCCCO 34a_100000761923_100009813782 [0,2,0,0,0,0|0,0,1]=3 21669 B14R0.392 CC#CCSCCCCCCCCCC 62a_100000748600_100000210320 [0,2,0,0,0,0|1,0,1]=4 21670 B14R0.392 CC#CCSCCCCCCCCCO 62a_100000748600_100009813782 [0,2,0,0,0,0|0,0,1]=3 21671 B14R0.392 CC#CCSCCCCCCCCCO 62a_100009813782_100000748600 [0,2,0,0,0,0|0,0,1]=3 21672 B14R0.392 CC/C=C/CCCOCCCCCCC 34a_100016287902_100000210614 [0,2,0,0,0,0|1,0,1]=4 21673 B14R0.392 CC/C=C/CCCOCCCCCCC 7a_100016287902_100000210614 [0,2,0,0,0,0|1,0,1]=4 21674 B14R0.392 CC/C=C/CCCOCCCCCCF 34a_100016287902_100015922095 [0,2,0,0,0,0|1,0,1]=4 21675 B14R0.392 CC/C=C/CCCOCCCCCCF 7a_100016287902_100015922095 [0,2,0,0,0,0|1,0,1]=4 21676 B14R0.392 CC/C=C/CCCOCCCCCCO 34a_100016287902_100000766143 [0,2,0,0,0,0|0,0,1]=3 21677 B14R0.392 CC/C=C/CCCOCCCCCCO 7a_100016287902_100000766143 [0,2,0,0,0,0|0,0,1]=3 21678 B14R0.392 CC/C=C\CCCCCCCNCCC 269862a_100020643023_200025770492 [0,2,0,0,0,0|1,0,1]=4 21679 B14R0.392 CC/C=C\CCCCCCCNCCF 269862a_100000724931_200025770492 [0,2,0,0,0,0|1,0,1]=4 21680 B14R0.392 CC/C=C\CCCCCCCNCCO 269862a_100000210304_200025770492 [0,2,0,0,0,0|0,0,1]=3 21681 B14R0.392 CC/C=C\CCCCCNCCCCC 269862a_100000209983_100016288537 [0,2,0,0,0,0|1,0,1]=4 21682 B14R0.392 CC/C=C\CCCCCNCCCCO 269862a_100000750430_100016288537 [0,2,0,0,0,0|0,0,1]=3 21683 B14R0.392 CC/C=C\CCCCCNCCCOC 269862a_100150723488_100016288537 [0,2,0,0,0,0|0,0,2]=4 21684 B14R0.392 CC/C=C\CCCCCOCCCCC 34a_100016268722_100000718602 [0,2,0,0,0,0|1,0,1]=4 21685 B14R0.392 CC/C=C\CCCCCOCCCCC 7a_100016268722_100000210326 [0,2,0,0,0,0|1,0,1]=4 21686 B14R0.392 CC/C=C\CCCCCOCCCCF 34a_100016268722_100000729493 [0,2,0,0,0,0|1,0,1]=4 21687 B14R0.392 CC/C=C\CCCCCOCCCCF 7a_100016268722_100000729493 [0,2,0,0,0,0|1,0,1]=4 21688 B14R0.392 CC/C=C\CCCCCOCCCCO 34a_100016268722_100011216708 [0,2,0,0,0,0|0,0,1]=3 21689 B14R0.392 CC/C=C\CCCCCOCCCCO 7a_100016268722_100000210776 [0,2,0,0,0,0|0,0,1]=3 21690 B14R0.392 CC/C=C\CCCCCOCCCOC 34a_100016268722_100000740836 [0,2,0,0,0,0|0,0,2]=4 21691 B14R0.392 CC/C=C\CCCCCOCCCOC 7a_100016268722_100000740836 [0,2,0,0,0,0|0,0,2]=4 21692 B14R0.392 CC/C=C\CCCCOCCCCCC 34a_100016287862_100000210314 [0,2,0,0,0,0|1,0,1]=4 21693 B14R0.392 CC/C=C\CCCCOCCCCCC 7a_100016287862_100000210314 [0,2,0,0,0,0|1,0,1]=4 21694 B14R0.392 CC/C=C\CCCCOCCCCCF 34a_100016287862_100000729378 [0,2,0,0,0,0|1,0,1]=4 21695 B14R0.392 CC/C=C\CCCCOCCCCCF 7a_100016287862_100000729378 [0,2,0,0,0,0|1,0,1]=4 21696 B14R0.392 CC/C=C\CCCCOCCCCCO 34a_100016287862_100000746330 [0,2,0,0,0,0|0,0,1]=3 21697 B14R0.392 CC/C=C\CCCCOCCCCCO 7a_100016287862_100000746330 [0,2,0,0,0,0|0,0,1]=3 21698 B14R0.392 CC/C=C\CCCCOCCCCOC 34a_100016287862_100000755781 [0,2,0,0,0,0|0,0,2]=4 21699 B14R0.392 CC/C=C\CCCCOCCCCOC 7a_100016287862_100000730899 [0,2,0,0,0,0|0,0,2]=4 21700 B14R0.392 CC/C=C\CCCCOCCOCCO 34a_100016287862_100000692535 [0,2,0,0,0,0|0,0,2]=4 21701 B14R0.392 CC/C=C\CCCCOCCOCCO 7a_100016287862_100011215305 [0,2,0,0,0,0|0,0,2]=4 21702 B14R0.392 CC/C=C\CCNCCCCCCCC 2230a_100000229939_100015370543 [0,2,0,0,0,0|1,0,1]=4 21703 B14R0.392 CC/C=C\CCNCCCCCCCC 34a_100000229939_100015370543 [0,2,0,0,0,0|1,0,1]=4 21704 B14R0.392 CC/C=C\CCNCCCCCCCO 2230a_100011996573_100015370543 [0,2,0,0,0,0|0,0,1]=3 21705 B14R0.392 CC/C=C\CCNCCCCCCCO 34a_100011996573_100015370543 [0,2,0,0,0,0|0,0,1]=3 21706 B14R0.392 CC/C=C\CCNCCCOCCCO 2230a_100011310245_100015370543 [0,2,0,0,0,0|0,0,2]=4 21707 B14R0.392 CC/C=C\CCNCCCOCCCO 34a_100011310245_100015370543 [0,2,0,0,0,0|0,0,2]=4 21708 B14R0.392 CC/C=C\CCOCCCCCCCBr 34a_100000760002_100015370543 [0,2,0,0,0,0|1,0,1]=4 21709 B14R0.392 CC/C=C\CCOCCCCCCCBr 7a_100000760002_100015370543 [0,2,0,0,0,0|1,0,1]=4 21710 B14R0.392 CC/C=C\CCOCCCCCCCC 34a_100000210232_100015370543 [0,2,0,0,0,0|1,0,1]=4 21711 B14R0.392 CC/C=C\CCOCCCCCCCC 34a_100016288707_100000210759 [0,2,0,0,0,0|1,0,1]=4 21712 B14R0.392 CC/C=C\CCOCCCCCCCC 7a_100000210232_100015370543 [0,2,0,0,0,0|1,0,1]=4 21713 B14R0.392 CC/C=C\CCOCCCCCCCC 7a_100016288707_100000210759 [0,2,0,0,0,0|1,0,1]=4 21714 B14R0.392 CC/C=C\CCOCCCCCCCN 34a_100011996573_100015370543 [0,2,0,0,0,0|1,0,1]=4 21715 B14R0.392 CC/C=C\CCOCCCCCCCO 34a_100016288707_100000760002 [0,2,0,0,0,0|0,0,1]=3 21716 B14R0.392 CC/C=C\CCOCCCCCCCO 7a_100016288707_100000760002 [0,2,0,0,0,0|0,0,1]=3 21717 B14R0.392 CC/C=C\CCOCCCCCCOC 34a_100016288707_100011998445 [0,2,0,0,0,0|0,0,2]=4 21718 B14R0.392 CC/C=C\CCOCCCCCCOC 34a_200012092642_100015370543 [0,2,0,0,0,0|0,0,2]=4 21719 B14R0.392 CC/C=C\CCOCCCCCCOC 7a_100016288707_100011998445 [0,2,0,0,0,0|0,0,2]=4 21720 B14R0.392 CC/C=C\CCOCCCCCCOC 7a_200012092642_100015370543 [0,2,0,0,0,0|0,0,2]=4 21721 B14R0.392 CC/C=C\CCSCCCCCCCC 62a_100000210759_100015370543 [0,2,0,0,0,0|1,0,1]=4 21722 B14R0.392 CC/C=C\CCSCCCCCCCC 62a_100015370543_100000210317 [0,2,0,0,0,0|1,0,1]=4 21723 B14R0.392 CC/C=C\CCSCCCCCCCO 62a_100000760002_100015370543 [0,2,0,0,0,0|0,0,1]=3 21724 B14R0.392 CC/C=C\CCSCCCCCCCO 62a_100015370543_100000760002 [0,2,0,0,0,0|0,0,1]=3 21725 B14R0.392 CC/C=C\CCSCCCCCCOC 62a_100011998445_100015370543 [0,2,0,0,0,0|0,0,2]=4 21726 B14R0.392 CC/C=C\CCSCCCCCCOC 62a_100015370543_100011998445 [0,2,0,0,0,0|0,0,2]=4 21727 B14R0.392 CC/C=C\CNCCCCCCCCC 2230a_100000212291_100103147603 [0,2,0,0,0,0|1,0,1]=4 21728 B14R0.392 CC/C=C\CNCCCCCCCCC 34a_100000212291_100103147603 [0,2,0,0,0,0|1,0,1]=4 21729 B14R0.392 CC/C=C\CNCCCCCCCCO 2230a_102515433106_100103147603 [0,2,0,0,0,0|0,0,1]=3 21730 B14R0.392 CC/C=C\CNCCCCCCCCO 34a_102515433106_100103147603 [0,2,0,0,0,0|0,0,1]=3 21731 B14R0.392 CC/C=C\COCCCCCCCCBr 34a_100009813846_100103147603 [0,2,0,0,0,0|1,0,1]=4 21732 B14R0.392 CC/C=C\COCCCCCCCCBr 7a_100009813846_100103147603 [0,2,0,0,0,0|1,0,1]=4 21733 B14R0.392 CC/C=C\COCCCCCCCCC 34a_100000210712_100103147603 [0,2,0,0,0,0|1,0,1]=4 21734 B14R0.392 CC/C=C\COCCCCCCCCC 34a_100016268518_100011214924 [0,2,0,0,0,0|1,0,1]=4 21735 B14R0.392 CC/C=C\COCCCCCCCCC 7a_100000210712_100103147603 [0,2,0,0,0,0|1,0,1]=4 21736 B14R0.392 CC/C=C\COCCCCCCCCCl 34a_100000033203_100103147603 [0,2,0,0,0,0|1,0,1]=4 21737 B14R0.392 CC/C=C\COCCCCCCCCCl 7a_100000033203_100103147603 [0,2,0,0,0,0|1,0,1]=4 21738 B14R0.392 CC/C=C\COCCCCCCCCN 34a_102515433106_100103147603 [0,2,0,0,0,0|1,0,1]=4 21739 B14R0.392 CC/C=C\COCCCCCCCCO 34a_100016268518_100000033203 [0,2,0,0,0,0|0,0,1]=3 21740 B14R0.392 CC/C=C\CSCCCCCCCCC 62a_100103147603_100000210670 [0,2,0,0,0,0|1,0,1]=4 21741 B14R0.392 CC/C=C\CSCCCCCCCCO 62a_100000033203_100103147603 [0,2,0,0,0,0|0,0,1]=3 21742 B14R0.392 CC/C=C\CSCCCCCCCCO 62a_100103147603_100000033203 [0,2,0,0,0,0|0,0,1]=3 21743 B14R0.392 CC=C=CCCOCCCCCCCO 34a_100011020354_100000760002 [0,2,0,0,0,0|0,0,2]=4 21744 B14R0.392 CC=CCCCOCCCCCCCC 34a_100020645299_100000210759 [0,2,0,0,0,0|1,0,1]=4 21745 B14R0.392 CC=CCCCOCCCCCCCO 34a_100020645299_100000760002 [0,2,0,0,0,0|0,0,1]=3 21746 B14R0.392 CC=CCCCOCCCCCCOC 34a_100020645299_100011998445 [0,2,0,0,0,0|0,0,2]=4 21747 B14R0.392 CC=CCNCCCCCCCCCC 2230a_100000684558_100000070051 [0,2,0,0,0,0|1,0,1]=4 21748 B14R0.392 CC=CCNCCCCCCCCCC 34a_100000684558_100000070051 [0,2,0,0,0,0|1,0,1]=4 21749 B14R0.392 CC=CCNCCCCCCCCCO 2230a_100000078944_100000070051 [0,2,0,0,0,0|0,0,1]=3 21750 B14R0.392 CC=CCNCCCCCCCCCO 34a_100000078944_100000070051 [0,2,0,0,0,0|0,0,1]=3 21751 B14R0.392 CC=CCOCCCCCCCCCBr 34a_100009813782_100000070051 [0,2,0,0,0,0|1,0,1]=4 21752 B14R0.392 CC=CCOCCCCCCCCCBr 7a_100009813782_100000070051 [0,2,0,0,0,0|1,0,1]=4 21753 B14R0.392 CC=CCOCCCCCCCCCC 34a_100000210711_100000070051 [0,2,0,0,0,0|1,0,1]=4 21754 B14R0.392 CC=CCOCCCCCCCCCC 7a_100000210711_100000070051 [0,2,0,0,0,0|1,0,1]=4 21755 B14R0.392 CC=CCOCCCCCCCCCCl 34a_100009868337_100000070051 [0,2,0,0,0,0|1,0,1]=4 21756 B14R0.392 CC=CCOCCCCCCCCCCl 7a_100009868337_100000070051 [0,2,0,0,0,0|1,0,1]=4 21757 B14R0.392 CC=CCOCCCCCCCCCN 34a_100000078944_100000070051 [0,2,0,0,0,0|1,0,1]=4 21758 B14R0.392 CC=CCSCCCCCCCCCC 62a_100000070051_100000210320 [0,2,0,0,0,0|1,0,1]=4 21759 B14R0.392 CC=CCSCCCCCCCCCO 62a_100000070051_100009813782 [0,2,0,0,0,0|0,0,1]=3 21760 B14R0.392 CC=CCSCCCCCCCCCO 62a_100009813782_100000070051 [0,2,0,0,0,0|0,0,1]=3 21761 B14R0.392 CCC#CCCCCCCCCOCC 34a_200000031908_100000210202 [0,2,0,0,0,0|0,0,2]=4 21762 B14R0.392 CCC#CCCCCCCCCOCC 7a_200000031908_100000210202 [0,2,0,0,0,0|0,0,2]=4 21763 B14R0.392 CCC#CCCCCCCCCOCF 34a_200000031908_100015361967 [0,2,0,0,0,0|0,0,2]=4 21764 B14R0.392 CCC#CCCCCCCCCOCF 7a_200000031908_100015361967 [0,2,0,0,0,0|0,0,2]=4 21765 B14R0.392 CCC#CCCCCCCNCCCC 2230a_100000102301_200000036426 [0,2,0,0,0,0|1,0,1]=4 21766 B14R0.392 CCC#CCCCCCCNCCCC 7a_106832991798_200000036426 [0,2,0,0,0,0|1,0,1]=4 21767 B14R0.392 CCC#CCCCCCCNCCCF 2230a_100015189416_200000036426 [0,2,0,0,0,0|1,0,1]=4 21768 B14R0.392 CCC#CCCCCCCNCCCF 34a_100015189416_200000036426 [0,2,0,0,0,0|1,0,1]=4 21769 B14R0.392 CCC#CCCCCCCNCCOC 2230a_100000209980_200000036426 [0,2,0,0,0,0|0,0,2]=4 21770 B14R0.392 CCC#CCCCCCCOCCCBr 34a_100011217188_200000036426 [0,2,0,0,0,0|1,0,1]=4 21771 B14R0.392 CCC#CCCCCCCOCCCC 34a_100000210227_200000036426 [0,2,0,0,0,0|1,0,1]=4 21772 B14R0.392 CCC#CCCCCCCOCCCC 7a_100000210227_200000036426 [0,2,0,0,0,0|1,0,1]=4 21773 B14R0.392 CCC#CCCCCCCOCCCCl 34a_100000230001_200000036426 [0,2,0,0,0,0|1,0,1]=4 21774 B14R0.392 CCC#CCCCCCCOCCCF 34a_100000759539_200000036426 [0,2,0,0,0,0|1,0,1]=4 21775 B14R0.392 CCC#CCCCCCCOCCCN 34a_100000182051_200000036426 [0,2,0,0,0,0|1,0,1]=4 21776 B14R0.392 CCC#CCCCCCCOCCOC 34a_100000210237_200000036426 [0,2,0,0,0,0|0,0,2]=4 21777 B14R0.392 CCC#CCCCCCCOCCON 34a_100000700252_200000036426 [0,2,0,0,0,0|0,0,2]=4 21778 B14R0.392 CCC#CCCCCCCSCCCC 62a_100000210211_200000036426 [0,2,0,0,0,0|1,0,1]=4 21779 B14R0.392 CCC#CCCCCCCSCCCC 62a_200000036426_100000210210 [0,2,0,0,0,0|1,0,1]=4 21780 B14R0.392 CCC#CCCCCCCSCCCF 62a_100011934791_200000036426 [0,2,0,0,0,0|1,0,1]=4 21781 B14R0.392 CCC#CCCCCCCSCCCF 62a_200000036426_100011934791 [0,2,0,0,0,0|1,0,1]=4 21782 B14R0.392 CCC#CCCCCCCSCCCO 62a_100011215043_200000036426 [0,2,0,0,0,0|0,0,1]=3 21783 B14R0.392 CCC#CCCCCCCSCCCO 62a_200000036426_100011215043 [0,2,0,0,0,0|0,0,1]=3 21784 B14R0.392 CCC#CCCCCCCSCCOC 62a_100000233755_200000036426 [0,2,0,0,0,0|0,0,2]=4 21785 B14R0.392 CCC#CCCCCCCSCCOC 62a_200000036426_100000233755 [0,2,0,0,0,0|0,0,2]=4 21786 B14R0.392 CCC#CCCOCCCCCCCC 34a_100000036655_100000210759 [0,2,0,0,0,0|1,0,1]=4 21787 B14R0.392 CCC#CCCOCCCCCCCC 7a_100000036655_100000210759 [0,2,0,0,0,0|1,0,1]=4 21788 B14R0.392 CCC#CCCOCCCCCCCO 34a_100000036655_100000760002 [0,2,0,0,0,0|0,0,1]=3 21789 B14R0.392 CCC#CCCOCCCCCCCO 7a_100000036655_100000760002 [0,2,0,0,0,0|0,0,1]=3 21790 B14R0.392 CCC#CCCOCCCCCCOC 34a_100000036655_100011998445 [0,2,0,0,0,0|0,0,2]=4 21791 B14R0.392 CCC#CCCOCCCCCCOC 7a_100000036655_100011998445 [0,2,0,0,0,0|0,0,2]=4 21792 B14R0.392 CCC#CCNCCCCCCCCC 2230a_100000212291_100009813939 [0,2,0,0,0,0|1,0,1]=4 21793 B14R0.392 CCC#CCNCCCCCCCCC 34a_100000212291_100009813939 [0,2,0,0,0,0|1,0,1]=4 21794 B14R0.392 CCC#CCNCCCCCCCCO 2230a_102515433106_100009813939 [0,2,0,0,0,0|0,0,1]=3 21795 B14R0.392 CCC#CCNCCCCCCCCO 34a_102515433106_100009813939 [0,2,0,0,0,0|0,0,1]=3 21796 B14R0.392 CCC#CCOCCCCCCCCBr 34a_100009813846_100009813939 [0,2,0,0,0,0|1,0,1]=4 21797 B14R0.392 CCC#CCOCCCCCCCCBr 7a_100009813846_100009813939 [0,2,0,0,0,0|1,0,1]=4 21798 B14R0.392 CCC#CCOCCCCCCCCC 34a_100000032950_100011214924 [0,2,0,0,0,0|1,0,1]=4 21799 B14R0.392 CCC#CCOCCCCCCCCC 34a_100000210712_100009813939 [0,2,0,0,0,0|1,0,1]=4 21800 B14R0.392 CCC#CCOCCCCCCCCC 7a_100000210712_100009813939 [0,2,0,0,0,0|1,0,1]=4 21801 B14R0.392 CCC#CCOCCCCCCCCCl 34a_100000033203_100009813939 [0,2,0,0,0,0|1,0,1]=4 21802 B14R0.392 CCC#CCOCCCCCCCCCl 7a_100000033203_100009813939 [0,2,0,0,0,0|1,0,1]=4 21803 B14R0.392 CCC#CCOCCCCCCCCN 34a_102515433106_100009813939 [0,2,0,0,0,0|1,0,1]=4 21804 B14R0.392 CCC#CCOCCCCCCCCO 34a_100000032950_100000033203 [0,2,0,0,0,0|0,0,1]=3 21805 B14R0.392 CCC#CCSCCCCCCCCC 62a_100009813939_100000210670 [0,2,0,0,0,0|1,0,1]=4 21806 B14R0.392 CCC#CCSCCCCCCCCO 62a_100000033203_100009813939 [0,2,0,0,0,0|0,0,1]=3 21807 B14R0.392 CCC#CCSCCCCCCCCO 62a_100009813939_100000033203 [0,2,0,0,0,0|0,0,1]=3 21808 B14R0.392 CCC/C=C/COCCCCCCCC 34a_100016278788_100000210759 [0,2,0,0,0,0|1,0,1]=4 21809 B14R0.392 CCC/C=C/COCCCCCCCC 7a_100016278788_100000210759 [0,2,0,0,0,0|1,0,1]=4 21810 B14R0.392 CCC/C=C/COCCCCCCCO 34a_100016278788_100000760002 [0,2,0,0,0,0|0,0,1]=3 21811 B14R0.392 CCC/C=C/COCCCCCCCO 7a_100016278788_100000760002 [0,2,0,0,0,0|0,0,1]=3 21812 B14R0.392 CCC/C=C/COCCCCCCOC 34a_100016278788_100011998445 [0,2,0,0,0,0|0,0,2]=4 21813 B14R0.392 CCC/C=C/COCCCCCCOC 7a_100016278788_100011998445 [0,2,0,0,0,0|0,0,2]=4 21814 B14R0.392 CCCC#CCCOCCCCCCC 34a_100000042726_100000210614 [0,2,0,0,0,0|1,0,1]=4 21815 B14R0.392 CCCC#CCCOCCCCCCC 7a_100000042726_100000210614 [0,2,0,0,0,0|1,0,1]=4 21816 B14R0.392 CCCC#CCCOCCCCCCF 34a_100000042726_100015922095 [0,2,0,0,0,0|1,0,1]=4 21817 B14R0.392 CCCC#CCCOCCCCCCF 7a_100000042726_100015922095 [0,2,0,0,0,0|1,0,1]=4 21818 B14R0.392 CCCC#CCCOCCCCCCO 34a_100000042726_100000766143 [0,2,0,0,0,0|0,0,1]=3 21819 B14R0.392 CCCC#CCCOCCCCCCO 7a_100000042726_100000766143 [0,2,0,0,0,0|0,0,1]=3 21820 B14R0.392 CCCC#CCOCCCCCCCC 34a_100000034806_100000210759 [0,2,0,0,0,0|1,0,1]=4 21821 B14R0.392 CCCC#CCOCCCCCCCC 7a_100000034806_100000210759 [0,2,0,0,0,0|1,0,1]=4 21822 B14R0.392 CCCC#CCOCCCCCCCO 34a_100000034806_100000760002 [0,2,0,0,0,0|0,0,1]=3 21823 B14R0.392 CCCC#CCOCCCCCCCO 7a_100000034806_100000760002 [0,2,0,0,0,0|0,0,1]=3 21824 B14R0.392 CCCC#CCOCCCCCCOC 34a_100000034806_100011998445 [0,2,0,0,0,0|0,0,2]=4 21825 B14R0.392 CCCC#CCOCCCCCCOC 7a_100000034806_100011998445 [0,2,0,0,0,0|0,0,2]=4 21826 B14R0.392 CCCC/C=C/CCCCOCCCC 34a_200020645093_100000210210 [0,2,0,0,0,0|1,0,1]=4 21827 B14R0.392 CCCC/C=C/CCCCOCCCC 7a_200020645093_100000210211 [0,2,0,0,0,0|1,0,1]=4 21828 B14R0.392 CCCC/C=C/CCCCOCCCF 34a_200020645093_100011934791 [0,2,0,0,0,0|1,0,1]=4 21829 B14R0.392 CCCC/C=C/CCCCOCCCF 7a_200020645093_100011934791 [0,2,0,0,0,0|1,0,1]=4 21830 B14R0.392 CCCC/C=C/CCCCOCCCO 34a_200020645093_100000230001 [0,2,0,0,0,0|0,0,1]=3 21831 B14R0.392 CCCC/C=C/CCCCOCCCO 7a_200020645093_100011215043 [0,2,0,0,0,0|0,0,1]=3 21832 B14R0.392 CCCC/C=C/CCCCOCCOC 34a_200020645093_100011201679 [0,2,0,0,0,0|0,0,2]=4 21833 B14R0.392 CCCC/C=C/CCCCOCCOC 7a_200020645093_100000233755 [0,2,0,0,0,0|0,0,2]=4 21834 B14R0.392 CCCC/C=C/COCCCCCCC 34a_200016272032_100000210614 [0,2,0,0,0,0|1,0,1]=4 21835 B14R0.392 CCCC/C=C/COCCCCCCC 7a_200016272032_100000210614 [0,2,0,0,0,0|1,0,1]=4 21836 B14R0.392 CCCC/C=C/COCCCCCCF 34a_200016272032_100015922095 [0,2,0,0,0,0|1,0,1]=4 21837 B14R0.392 CCCC/C=C/COCCCCCCF 7a_200016272032_100015922095 [0,2,0,0,0,0|1,0,1]=4 21838 B14R0.392 CCCC/C=C/COCCCCCCO 34a_200016272032_100000766143 [0,2,0,0,0,0|0,0,1]=3 21839 B14R0.392 CCCC/C=C/COCCCCCCO 7a_200016272032_100000766143 [0,2,0,0,0,0|0,0,1]=3 21840 B14R0.392 CCCC/C=C\CCOCCCCCC 34a_200016286491_100000210314 [0,2,0,0,0,0|1,0,1]=4 21841 B14R0.392 CCCC/C=C\CCOCCCCCC 7a_200016286491_100000210314 [0,2,0,0,0,0|1,0,1]=4 21842 B14R0.392 CCCC/C=C\CCOCCCCCF 34a_200016286491_100000729378 [0,2,0,0,0,0|1,0,1]=4 21843 B14R0.392 CCCC/C=C\CCOCCCCCF 7a_200016286491_100000729378 [0,2,0,0,0,0|1,0,1]=4 21844 B14R0.392 CCCC/C=C\CCOCCCCCO 34a_200016286491_100000746330 [0,2,0,0,0,0|0,0,1]=3 21845 B14R0.392 CCCC/C=C\CCOCCCCCO 7a_200016286491_100000746330 [0,2,0,0,0,0|0,0,1]=3 21846 B14R0.392 CCCC/C=C\CCOCCCCOC 34a_200016286491_100000755781 [0,2,0,0,0,0|0,0,2]=4 21847 B14R0.392 CCCC/C=C\CCOCCCCOC 7a_200016286491_100000730899 [0,2,0,0,0,0|0,0,2]=4 21848 B14R0.392 CCCC/C=C\CCOCCOCCO 34a_200016286491_100000692535 [0,2,0,0,0,0|0,0,2]=4 21849 B14R0.392 CCCC/C=C\CCOCCOCCO 7a_200016286491_100011215305 [0,2,0,0,0,0|0,0,2]=4 21850 B14R0.392 CCCCC#CCCCCCCNCC 2230a_100015525214_200000043322 [0,2,0,0,0,0|1,0,1]=4 21851 B14R0.392 CCCCC#CCCCCCCOCC 34a_100121572206_200000043322 [0,2,0,0,0,0|0,0,2]=4 21852 B14R0.392 CCCCC#CCCCCCCSCC 62a_100000210202_200000043322 [0,2,0,0,0,0|1,0,1]=4 21853 B14R0.392 CCCCC#CCCCCCCSCC 62a_200000043322_100000210202 [0,2,0,0,0,0|1,0,1]=4 21854 B14R0.392 CCCCC#CCCCCCCSCF 62a_100015361967_200000043322 [0,2,0,0,0,0|1,0,1]=4 21855 B14R0.392 CCCCC#CCCCCCCSCF 62a_200000043322_100015361967 [0,2,0,0,0,0|1,0,1]=4 21856 B14R0.392 CCCCC#CCCCCOCCCC 34a_200000066234_100000210210 [0,2,0,0,0,0|1,0,1]=4 21857 B14R0.392 CCCCC#CCCCCOCCCC 7a_200000066234_100000210211 [0,2,0,0,0,0|1,0,1]=4 21858 B14R0.392 CCCCC#CCCCCOCCCF 34a_200000066234_100011934791 [0,2,0,0,0,0|1,0,1]=4 21859 B14R0.392 CCCCC#CCCCCOCCCF 7a_200000066234_100011934791 [0,2,0,0,0,0|1,0,1]=4 21860 B14R0.392 CCCCC#CCCCCOCCCO 34a_200000066234_100000230001 [0,2,0,0,0,0|0,0,1]=3 21861 B14R0.392 CCCCC#CCCCCOCCCO 7a_200000066234_100011215043 [0,2,0,0,0,0|0,0,1]=3 21862 B14R0.392 CCCCC#CCCCCOCCOC 34a_200000066234_100011201679 [0,2,0,0,0,0|0,0,2]=4 21863 B14R0.392 CCCCC#CCCCCOCCOC 7a_200000066234_100000233755 [0,2,0,0,0,0|0,0,2]=4 21864 B14R0.392 CCCCC#CCCCNCCCCC 2230a_100000209983_200000047210 [0,2,0,0,0,0|1,0,1]=4 21865 B14R0.392 CCCCC#CCCCNCCCCO 2230a_100000750430_200000047210 [0,2,0,0,0,0|0,0,1]=3 21866 B14R0.392 CCCCC#CCCCNCCCCO 34a_100000750430_200000047210 [0,2,0,0,0,0|0,0,1]=3 21867 B14R0.392 CCCCC#CCCCNCCCOC 34a_100150723488_200000047210 [0,2,0,0,0,0|0,0,2]=4 21868 B14R0.392 CCCCC#CCCCOCCCCBr 34a_100011216708_200000047210 [0,2,0,0,0,0|1,0,1]=4 21869 B14R0.392 CCCCC#CCCCOCCCCC 34a_100000210253_200000047210 [0,2,0,0,0,0|1,0,1]=4 21870 B14R0.392 CCCCC#CCCCOCCCCC 7a_100000210253_200000047210 [0,2,0,0,0,0|1,0,1]=4 21871 B14R0.392 CCCCC#CCCCOCCCCCl 34a_100000210776_200000047210 [0,2,0,0,0,0|1,0,1]=4 21872 B14R0.392 CCCCC#CCCCOCCCCCl 7a_100000210776_200000047210 [0,2,0,0,0,0|1,0,1]=4 21873 B14R0.392 CCCCC#CCCCOCCCCF 34a_100011995726_200000047210 [0,2,0,0,0,0|1,0,1]=4 21874 B14R0.392 CCCCC#CCCCOCCCCF 7a_100011995726_200000047210 [0,2,0,0,0,0|1,0,1]=4 21875 B14R0.392 CCCCC#CCCCOCCCCI 34a_200012148704_200000047210 [0,2,0,0,0,0|1,0,1]=4 21876 B14R0.392 CCCCC#CCCCOCCCCN 34a_100000750430_200000047210 [0,2,0,0,0,0|1,0,1]=4 21877 B14R0.392 CCCCC#CCCCOCCCOC 34a_100000740835_200000047210 [0,2,0,0,0,0|0,0,2]=4 21878 B14R0.392 CCCCC#CCCCSCCCCC 62a_100000210326_200000047210 [0,2,0,0,0,0|1,0,1]=4 21879 B14R0.392 CCCCC#CCCCSCCCCC 62a_200000047210_100000210326 [0,2,0,0,0,0|1,0,1]=4 21880 B14R0.392 CCCCC#CCCCSCCCCF 62a_100000729493_200000047210 [0,2,0,0,0,0|1,0,1]=4 21881 B14R0.392 CCCCC#CCCCSCCCCF 62a_200000047210_100000729493 [0,2,0,0,0,0|1,0,1]=4 21882 B14R0.392 CCCCC#CCCCSCCCCO 62a_100000210776_200000047210 [0,2,0,0,0,0|0,0,1]=3 21883 B14R0.392 CCCCC#CCCCSCCCCO 62a_200000047210_100000210776 [0,2,0,0,0,0|0,0,1]=3 21884 B14R0.392 CCCCC#CCCCSCCCOC 62a_100000709357_200000047210 [0,2,0,0,0,0|0,0,2]=4 21885 B14R0.392 CCCCC#CCCCSCCCOC 62a_200000047210_100000709357 [0,2,0,0,0,0|0,0,2]=4 21886 B14R0.392 CCCCC#CCCOCCCCCC 34a_100000037610_100000210314 [0,2,0,0,0,0|1,0,1]=4 21887 B14R0.392 CCCCC#CCCOCCCCCC 7a_100000037610_100000210314 [0,2,0,0,0,0|1,0,1]=4 21888 B14R0.392 CCCCC#CCCOCCCCCF 34a_100000037610_100000729378 [0,2,0,0,0,0|1,0,1]=4 21889 B14R0.392 CCCCC#CCCOCCCCCF 7a_100000037610_100000729378 [0,2,0,0,0,0|1,0,1]=4 21890 B14R0.392 CCCCC#CCCOCCCCCO 34a_100000037610_100000746330 [0,2,0,0,0,0|0,0,1]=3 21891 B14R0.392 CCCCC#CCCOCCCCCO 7a_100000037610_100000746330 [0,2,0,0,0,0|0,0,1]=3 21892 B14R0.392 CCCCC#CCCOCCCCOC 34a_100000037610_100000755781 [0,2,0,0,0,0|0,0,2]=4 21893 B14R0.392 CCCCC#CCCOCCCCOC 7a_100000037610_100000730899 [0,2,0,0,0,0|0,0,2]=4 21894 B14R0.392 CCCCC#CCCOCCOCCO 34a_100000037610_100000692535 [0,2,0,0,0,0|0,0,2]=4 21895 B14R0.392 CCCCC#CCCOCCOCCO 7a_100000037610_100011215305 [0,2,0,0,0,0|0,0,2]=4 21896 B14R0.392 CCCCC#CCOCCCCCCC 34a_200000034558_100000210614 [0,2,0,0,0,0|1,0,1]=4 21897 B14R0.392 CCCCC#CCOCCCCCCC 7a_200000034558_100000210614 [0,2,0,0,0,0|1,0,1]=4 21898 B14R0.392 CCCCC#CCOCCCCCCF 34a_200000034558_100015922095 [0,2,0,0,0,0|1,0,1]=4 21899 B14R0.392 CCCCC#CCOCCCCCCF 7a_200000034558_100015922095 [0,2,0,0,0,0|1,0,1]=4 21900 B14R0.392 CCCCC#CCOCCCCCCO 34a_200000034558_100000766143 [0,2,0,0,0,0|0,0,1]=3 21901 B14R0.392 CCCCC#CCOCCCCCCO 7a_200000034558_100000766143 [0,2,0,0,0,0|0,0,1]=3 21902 B14R0.392 CCCCC/C=C/COCCCCCC 34a_100016258190_100000210314 [0,2,0,0,0,0|1,0,1]=4 21903 B14R0.392 CCCCC/C=C/COCCCCCC 7a_100016258190_100000210314 [0,2,0,0,0,0|1,0,1]=4 21904 B14R0.392 CCCCC/C=C/COCCCCCF 34a_100016258190_100000729378 [0,2,0,0,0,0|1,0,1]=4 21905 B14R0.392 CCCCC/C=C/COCCCCCF 7a_100016258190_100000729378 [0,2,0,0,0,0|1,0,1]=4 21906 B14R0.392 CCCCC/C=C/COCCCCCO 34a_100016258190_100000746330 [0,2,0,0,0,0|0,0,1]=3 21907 B14R0.392 CCCCC/C=C/COCCCCCO 7a_100016258190_100000746330 [0,2,0,0,0,0|0,0,1]=3 21908 B14R0.392 CCCCC/C=C/COCCCCOC 34a_100016258190_100000755781 [0,2,0,0,0,0|0,0,2]=4 21909 B14R0.392 CCCCC/C=C/COCCCCOC 7a_100016258190_100000730899 [0,2,0,0,0,0|0,0,2]=4 21910 B14R0.392 CCCCC/C=C/COCCOCCO 34a_100016258190_100000692535 [0,2,0,0,0,0|0,0,2]=4 21911 B14R0.392 CCCCC/C=C/COCCOCCO 7a_100016258190_100011215305 [0,2,0,0,0,0|0,0,2]=4 21912 B14R0.392 CCCCC/C=C\CCCOCCCC 34a_100020655193_100000210210 [0,2,0,0,0,0|1,0,1]=4 21913 B14R0.392 CCCCC/C=C\CCCOCCCC 7a_100020655193_100000210211 [0,2,0,0,0,0|1,0,1]=4 21914 B14R0.392 CCCCC/C=C\CCCOCCCF 34a_100020655193_100011934791 [0,2,0,0,0,0|1,0,1]=4 21915 B14R0.392 CCCCC/C=C\CCCOCCCF 7a_100020655193_100011934791 [0,2,0,0,0,0|1,0,1]=4 21916 B14R0.392 CCCCC/C=C\CCCOCCCO 34a_100020655193_100000230001 [0,2,0,0,0,0|0,0,1]=3 21917 B14R0.392 CCCCC/C=C\CCCOCCCO 7a_100020655193_100011215043 [0,2,0,0,0,0|0,0,1]=3 21918 B14R0.392 CCCCC/C=C\CCCOCCOC 34a_100020655193_100011201679 [0,2,0,0,0,0|0,0,2]=4 21919 B14R0.392 CCCCC/C=C\CCCOCCOC 7a_100020655193_100000233755 [0,2,0,0,0,0|0,0,2]=4 21920 B14R0.392 CCCCC/C=C\CCOCCCCC 34a_100016277358_100000718602 [0,2,0,0,0,0|1,0,1]=4 21921 B14R0.392 CCCCC/C=C\CCOCCCCC 7a_100016277358_100000210326 [0,2,0,0,0,0|1,0,1]=4 21922 B14R0.392 CCCCC/C=C\CCOCCCCF 34a_100016277358_100000729493 [0,2,0,0,0,0|1,0,1]=4 21923 B14R0.392 CCCCC/C=C\CCOCCCCF 7a_100016277358_100000729493 [0,2,0,0,0,0|1,0,1]=4 21924 B14R0.392 CCCCC/C=C\CCOCCCCO 34a_100016277358_100011216708 [0,2,0,0,0,0|0,0,1]=3 21925 B14R0.392 CCCCC/C=C\CCOCCCCO 7a_100016277358_100000210776 [0,2,0,0,0,0|0,0,1]=3 21926 B14R0.392 CCCCC/C=C\CCOCCCOC 34a_100016277358_100000740836 [0,2,0,0,0,0|0,0,2]=4 21927 B14R0.392 CCCCC/C=C\CCOCCCOC 7a_100016277358_100000740836 [0,2,0,0,0,0|0,0,2]=4 21928 B14R0.392 CCCCCC#CCCOCCCCC 34a_200000042877_100000718602 [0,2,0,0,0,0|1,0,1]=4 21929 B14R0.392 CCCCCC#CCCOCCCCC 7a_200000042877_100000210326 [0,2,0,0,0,0|1,0,1]=4 21930 B14R0.392 CCCCCC#CCCOCCCCF 34a_200000042877_100000729493 [0,2,0,0,0,0|1,0,1]=4 21931 B14R0.392 CCCCCC#CCCOCCCCF 7a_200000042877_100000729493 [0,2,0,0,0,0|1,0,1]=4 21932 B14R0.392 CCCCCC#CCCOCCCCO 34a_200000042877_100011216708 [0,2,0,0,0,0|0,0,1]=3 21933 B14R0.392 CCCCCC#CCCOCCCCO 7a_200000042877_100000210776 [0,2,0,0,0,0|0,0,1]=3 21934 B14R0.392 CCCCCC#CCCOCCCOC 34a_200000042877_100000740836 [0,2,0,0,0,0|0,0,2]=4 21935 B14R0.392 CCCCCC#CCCOCCCOC 7a_200000042877_100000740836 [0,2,0,0,0,0|0,0,2]=4 21936 B14R0.392 CCCCCC#CCNCCCCCC 2230a_100000210581_100009816472 [0,2,0,0,0,0|1,0,1]=4 21937 B14R0.392 CCCCCC#CCNCCCCCO 2230a_100000762737_100009816472 [0,2,0,0,0,0|0,0,1]=3 21938 B14R0.392 CCCCCC#CCNCCCCCO 34a_100000762737_100009816472 [0,2,0,0,0,0|0,0,1]=3 21939 B14R0.392 CCCCCC#CCNCCOCCO 2230a_100000211614_100009816472 [0,2,0,0,0,0|0,0,2]=4 21940 B14R0.392 CCCCCC#CCNCCOCCO 34a_100000211614_100009816472 [0,2,0,0,0,0|0,0,2]=4 21941 B14R0.392 CCCCCC#CCNCCSCCO 2230a_100011219999_100009816472 [0,2,0,0,0,0|0,0,2]=4 21942 B14R0.392 CCCCCC#CCOCCCCCBr 34a_100000746331_100009816472 [0,2,0,0,0,0|1,0,1]=4 21943 B14R0.392 CCCCCC#CCOCCCCCBr 7a_100000746331_100009816472 [0,2,0,0,0,0|1,0,1]=4 21944 B14R0.392 CCCCCC#CCOCCCCCC 34a_100000210259_100009816472 [0,2,0,0,0,0|1,0,1]=4 21945 B14R0.392 CCCCCC#CCOCCCCCC 34a_200000033628_100000210314 [0,2,0,0,0,0|1,0,1]=4 21946 B14R0.392 CCCCCC#CCOCCCCCC 7a_100000210259_100009816472 [0,2,0,0,0,0|1,0,1]=4 21947 B14R0.392 CCCCCC#CCOCCCCCC 7a_200000033628_100000210314 [0,2,0,0,0,0|1,0,1]=4 21948 B14R0.392 CCCCCC#CCOCCCCCCl 34a_100000746330_100009816472 [0,2,0,0,0,0|1,0,1]=4 21949 B14R0.392 CCCCCC#CCOCCCCCCl 7a_100000746330_100009816472 [0,2,0,0,0,0|1,0,1]=4 21950 B14R0.392 CCCCCC#CCOCCCCCF 34a_200000033628_100000729378 [0,2,0,0,0,0|1,0,1]=4 21951 B14R0.392 CCCCCC#CCOCCCCCF 7a_200000033628_100000729378 [0,2,0,0,0,0|1,0,1]=4 21952 B14R0.392 CCCCCC#CCOCCCCCI 34a_200012148887_100009816472 [0,2,0,0,0,0|1,0,1]=4 21953 B14R0.392 CCCCCC#CCOCCCCCI 7a_200012148887_100009816472 [0,2,0,0,0,0|1,0,1]=4 21954 B14R0.392 CCCCCC#CCOCCCCCN 34a_100000762737_100009816472 [0,2,0,0,0,0|1,0,1]=4 21955 B14R0.392 CCCCCC#CCOCCCCCO 34a_200000033628_100000746330 [0,2,0,0,0,0|0,0,1]=3 21956 B14R0.392 CCCCCC#CCOCCCCCO 7a_200000033628_100000746330 [0,2,0,0,0,0|0,0,1]=3 21957 B14R0.392 CCCCCC#CCOCCCCOC 34a_100000740925_100009816472 [0,2,0,0,0,0|0,0,2]=4 21958 B14R0.392 CCCCCC#CCOCCCCOC 34a_200000033628_100000755781 [0,2,0,0,0,0|0,0,2]=4 21959 B14R0.392 CCCCCC#CCOCCCCOC 7a_200000033628_100000730899 [0,2,0,0,0,0|0,0,2]=4 21960 B14R0.392 CCCCCC#CCOCCOCCO 34a_200000033628_100000692535 [0,2,0,0,0,0|0,0,2]=4 21961 B14R0.392 CCCCCC#CCOCCOCCO 7a_200000033628_100011215305 [0,2,0,0,0,0|0,0,2]=4 21962 B14R0.392 CCCCCC#CCSCCCCCC 62a_100000210314_100009816472 [0,2,0,0,0,0|1,0,1]=4 21963 B14R0.392 CCCCCC#CCSCCCCCC 62a_100009816472_100000210757 [0,2,0,0,0,0|1,0,1]=4 21964 B14R0.392 CCCCCC#CCSCCCCCF 62a_100000729378_100009816472 [0,2,0,0,0,0|1,0,1]=4 21965 B14R0.392 CCCCCC#CCSCCCCCF 62a_100009816472_100000729378 [0,2,0,0,0,0|1,0,1]=4 21966 B14R0.392 CCCCCC#CCSCCCCCO 62a_100000746330_100009816472 [0,2,0,0,0,0|0,0,1]=3 21967 B14R0.392 CCCCCC#CCSCCCCCO 62a_100009816472_100000746330 [0,2,0,0,0,0|0,0,1]=3 21968 B14R0.392 CCCCCC#CCSCCCCOC 62a_100000730899_100009816472 [0,2,0,0,0,0|0,0,2]=4 21969 B14R0.392 CCCCCC#CCSCCCCOC 62a_100009816472_100000730899 [0,2,0,0,0,0|0,0,2]=4 21970 B14R0.392 CCCCCC#CCSCCOCCO 62a_100009816472_100011215305 [0,2,0,0,0,0|0,0,2]=4 21971 B14R0.392 CCCCCC#CCSCCOCCO 62a_100011215305_100009816472 [0,2,0,0,0,0|0,0,2]=4 21972 B14R0.392 CCCCCC/C=C/COCCCCC 34a_200016276170_100000718602 [0,2,0,0,0,0|1,0,1]=4 21973 B14R0.392 CCCCCC/C=C/COCCCCC 7a_200016276170_100000210326 [0,2,0,0,0,0|1,0,1]=4 21974 B14R0.392 CCCCCC/C=C/COCCCCF 34a_200016276170_100000729493 [0,2,0,0,0,0|1,0,1]=4 21975 B14R0.392 CCCCCC/C=C/COCCCCF 7a_200016276170_100000729493 [0,2,0,0,0,0|1,0,1]=4 21976 B14R0.392 CCCCCC/C=C/COCCCCO 34a_200016276170_100011216708 [0,2,0,0,0,0|0,0,1]=3 21977 B14R0.392 CCCCCC/C=C/COCCCCO 7a_200016276170_100000210776 [0,2,0,0,0,0|0,0,1]=3 21978 B14R0.392 CCCCCC/C=C/COCCCOC 34a_200016276170_100000740836 [0,2,0,0,0,0|0,0,2]=4 21979 B14R0.392 CCCCCC/C=C/COCCCOC 7a_200016276170_100000740836 [0,2,0,0,0,0|0,0,2]=4 21980 B14R0.392 CCCCCCC#CCCOCCCC 34a_200000033163_100000210210 [0,2,0,0,0,0|1,0,1]=4 21981 B14R0.392 CCCCCCC#CCCOCCCC 7a_200000033163_100000210211 [0,2,0,0,0,0|1,0,1]=4 21982 B14R0.392 CCCCCCC#CCCOCCCF 34a_200000033163_100011934791 [0,2,0,0,0,0|1,0,1]=4 21983 B14R0.392 CCCCCCC#CCCOCCCF 7a_200000033163_100011934791 [0,2,0,0,0,0|1,0,1]=4 21984 B14R0.392 CCCCCCC#CCCOCCCO 34a_200000033163_100000230001 [0,2,0,0,0,0|0,0,1]=3 21985 B14R0.392 CCCCCCC#CCCOCCCO 7a_200000033163_100011215043 [0,2,0,0,0,0|0,0,1]=3 21986 B14R0.392 CCCCCCC#CCCOCCOC 34a_200000033163_100011201679 [0,2,0,0,0,0|0,0,2]=4 21987 B14R0.392 CCCCCCC#CCCOCCOC 7a_200000033163_100000233755 [0,2,0,0,0,0|0,0,2]=4 21988 B14R0.392 CCCCCCC#CCOCCCCC 34a_200000037284_100000718602 [0,2,0,0,0,0|1,0,1]=4 21989 B14R0.392 CCCCCCC#CCOCCCCC 7a_200000037284_100000210326 [0,2,0,0,0,0|1,0,1]=4 21990 B14R0.392 CCCCCCC#CCOCCCCF 34a_200000037284_100000729493 [0,2,0,0,0,0|1,0,1]=4 21991 B14R0.392 CCCCCCC#CCOCCCCF 7a_200000037284_100000729493 [0,2,0,0,0,0|1,0,1]=4 21992 B14R0.392 CCCCCCC#CCOCCCCO 34a_200000037284_100011216708 [0,2,0,0,0,0|0,0,1]=3 21993 B14R0.392 CCCCCCC#CCOCCCCO 7a_200000037284_100000210776 [0,2,0,0,0,0|0,0,1]=3 21994 B14R0.392 CCCCCCC#CCOCCCOC 34a_200000037284_100000740836 [0,2,0,0,0,0|0,0,2]=4 21995 B14R0.392 CCCCCCC#CCOCCCOC 7a_200000037284_100000740836 [0,2,0,0,0,0|0,0,2]=4 21996 B14R0.392 CCCCCCCC#CCOCCCC 34a_200000061759_100000210210 [0,2,0,0,0,0|1,0,1]=4 21997 B14R0.392 CCCCCCCC#CCOCCCC 7a_200000061759_100000210211 [0,2,0,0,0,0|1,0,1]=4 21998 B14R0.392 CCCCCCCC#CCOCCCF 34a_200000061759_100011934791 [0,2,0,0,0,0|1,0,1]=4 21999 B14R0.392 CCCCCCCC#CCOCCCF 7a_200000061759_100011934791 [0,2,0,0,0,0|1,0,1]=4 22000 B14R0.392 CCCCCCCC#CCOCCCO 34a_200000061759_100000230001 [0,2,0,0,0,0|0,0,1]=3 22001 B14R0.392 CCCCCCCC#CCOCCCO 7a_200000061759_100011215043 [0,2,0,0,0,0|0,0,1]=3 22002 B14R0.392 CCCCCCCC#CCOCCOC 34a_200000061759_100011201679 [0,2,0,0,0,0|0,0,2]=4 22003 B14R0.392 CCCCCCCC#CCOCCOC 7a_200000061759_100000233755 [0,2,0,0,0,0|0,0,2]=4 22004 B14R0.392 CCCCCCCC/C=C/COCCC 34a_200020667288_100000210303 [0,2,0,0,0,0|1,0,1]=4 22005 B14R0.392 CCCCCCCC/C=C/COCCC 7a_200020667288_100000210303 [0,2,0,0,0,0|1,0,1]=4 22006 B14R0.392 CCCCCCCC/C=C/COCCF 34a_200020667288_100011217306 [0,2,0,0,0,0|1,0,1]=4 22007 B14R0.392 CCCCCCCC/C=C/COCCF 7a_200020667288_100011217306 [0,2,0,0,0,0|1,0,1]=4 22008 B14R0.392 CCCCCCCC/C=C/COCCO 34a_200020667288_100000211926 [0,2,0,0,0,0|0,0,1]=3 22009 B14R0.392 CCCCCCCC/C=C/COCCO 7a_200020667288_100000211926 [0,2,0,0,0,0|0,0,1]=3 22010 B14R0.392 CCCCCCCC=NNCCCCC 4a_100000694160_100000210592 [0,2,0,0,0,0|1,0,1]=4 22011 B14R0.392 CCCCCCCCC/C=C/COCC 34a_100015232335_100000210202 [0,2,0,0,0,0|0,0,2]=4 22012 B14R0.392 CCCCCCCCC/C=C/COCC 7a_100015232335_100000210202 [0,2,0,0,0,0|0,0,2]=4 22013 B14R0.392 CCCCCCCCC/C=C/COCF 34a_100015232335_100015361967 [0,2,0,0,0,0|0,0,2]=4 22014 B14R0.392 CCCCCCCCC/C=C/COCF 7a_100015232335_100015361967 [0,2,0,0,0,0|0,0,2]=4 22015 B14R0.392 CCCCCCCCC=NNCCCC 4a_100025702795_100011218696 [0,2,0,0,0,0|1,0,1]=4 22016 B14R0.392 CCCCCCCCCC/C=C/COC 34a_200025761149_200000210301 [0,2,0,0,0,0|0,0,1]=3 22017 B14R0.392 CCCCCCCCCC/C=C/COC 7a_200025761149_200000210301 [0,2,0,0,0,0|0,0,1]=3 22018 B14R0.392 CCCCCCCCCC/C=C/CO[13CH3] 34a_200025761149_200025704644 [0,2,0,0,0,0|0,0,1]=3 22019 B14R0.392 CCCCCCCCCC/C=C/CO[13CH3] 7a_200025761149_200025704644 [0,2,0,0,0,0|0,0,1]=3 22020 B14R0.392 CCCCCCCCCC=NNCCC 4a_100000740057_100000210895 [0,2,0,0,0,0|1,0,1]=4 22021 B14R0.392 CCCCCCCCCC=NNCCO 4a_100000210001_100000210895 [0,2,0,0,0,0|0,0,1]=3 22022 B14R0.392 CCCCCCCCCCC=NNCC 4a_100000756455_100011218819 [0,2,0,0,0,0|1,0,1]=4 22023 B14R0.392 CCCCCCCCCCCCCNC 2230a_100011215765_200000210301 [0,2,0,0,0,0|1,0,0]=3 22024 B14R0.392 CCCCCCCCCCCCCNC 2230a_106832991635_100000210684 [0,2,0,0,0,0|1,0,0]=3 22025 B14R0.392 CCCCCCCCCCCCCNC 270004a_106832991635_200011215488 [0,2,0,0,0,0|1,0,0]=3 22026 B14R0.392 CCCCCCCCCCCCCNC 34a_100011215765_200000210301 [0,2,0,0,0,0|1,0,0]=3 22027 B14R0.392 CCCCCCCCCCCCCNC 34a_100102657272_100000210684 [0,2,0,0,0,0|1,0,0]=3 22028 B14R0.392 CCCCCCCCCCCCCNC 7a_106832991635_100000210684 [0,2,0,0,0,0|1,0,0]=3 22029 B14R0.392 CCCCCCCCCCCCCN[13CH3] 2230a_100011215765_200025704644 [0,2,0,0,0,0|1,0,0]=3 22030 B14R0.392 CCCCCCCCCCCCCN[13CH3] 34a_100011215765_200025704644 [0,2,0,0,0,0|1,0,0]=3 22031 B14R0.392 CCCCCCCCCCCCCOC 34a_100000185773_200000210301 [0,2,0,0,0,0|0,0,0]=2 22032 B14R0.392 CCCCCCCCCCCCCOC 34a_100138415774_100000210684 [0,2,0,0,0,0|0,0,0]=2 22033 B14R0.392 CCCCCCCCCCCCCOC 7a_100000185773_200000210301 [0,2,0,0,0,0|0,0,0]=2 22034 B14R0.392 CCCCCCCCCCCCCO[13CH3] 34a_100000185773_200025704644 [0,2,0,0,0,0|0,0,0]=2 22035 B14R0.392 CCCCCCCCCCCCCO[13CH3] 7a_100000185773_200025704644 [0,2,0,0,0,0|0,0,0]=2 22036 B14R0.392 CCCCCCCCCCCCCSC 62a_200000210301_100011934334 [0,2,0,0,0,0|0,1,0]=3 22037 B14R0.392 CCCCCCCCCCCCCS[13CH3] 62a_200025704644_100011934334 [0,2,0,0,0,0|0,1,0]=3 22038 B14R0.392 CCCCCCCCCCCCNCC 2230a_100000210451_100000210202 [0,2,0,0,0,0|1,0,0]=3 22039 B14R0.392 CCCCCCCCCCCCNCC 2230a_100015525214_100011215052 [0,2,0,0,0,0|1,0,0]=3 22040 B14R0.392 CCCCCCCCCCCCNCC 270004a_100015525214_100011218549 [0,2,0,0,0,0|1,0,0]=3 22041 B14R0.392 CCCCCCCCCCCCNCC 34a_100000210451_100000210202 [0,2,0,0,0,0|1,0,0]=3 22042 B14R0.392 CCCCCCCCCCCCNCF 34a_100000210451_100015361967 [0,2,0,0,0,0|1,0,0]=3 22043 B14R0.392 CCCCCCCCCCCCOCC 34a_100000210810_100000210202 [0,2,0,0,0,0|0,0,0]=2 22044 B14R0.392 CCCCCCCCCCCCOCC 34a_100121572206_100000759014 [0,2,0,0,0,0|0,0,0]=2 22045 B14R0.392 CCCCCCCCCCCCOCC 7a_100000210810_100000210202 [0,2,0,0,0,0|0,0,0]=2 22046 B14R0.392 CCCCCCCCCCCCOCF 34a_100000210810_100015361967 [0,2,0,0,0,0|0,0,0]=2 22047 B14R0.392 CCCCCCCCCCCCOCF 7a_100000210810_100015361967 [0,2,0,0,0,0|0,0,0]=2 22048 B14R0.392 CCCCCCCCCCCCSCC 62a_100000210202_100000759014 [0,2,0,0,0,0|0,1,0]=3 22049 B14R0.392 CCCCCCCCCCCCSCF 62a_100015361967_100000759014 [0,2,0,0,0,0|0,1,0]=3 22050 B14R0.392 CCCCCCCCCCCNCC#N 2230a_200011215754_100011215382 [0,2,0,0,0,0|1,0,0]=3 22051 B14R0.392 CCCCCCCCCCCNCC=O 2230a_200011215754_200015260668 [0,2,0,0,0,0|0,0,1]=3 22052 B14R0.392 CCCCCCCCCCCNCC=O 34a_200011215754_200009817547 [0,2,0,0,0,0|0,0,1]=3 22053 B14R0.392 CCCCCCCCCCCNCCC 2230a_200011215754_100000210303 [0,2,0,0,0,0|1,0,0]=3 22054 B14R0.392 CCCCCCCCCCCNCCC 34a_200011215754_100000210303 [0,2,0,0,0,0|1,0,0]=3 22055 B14R0.392 CCCCCCCCCCCNCCF 2230a_200011215754_100011217306 [0,2,0,0,0,0|1,0,0]=3 22056 B14R0.392 CCCCCCCCCCCNCCF 34a_100000724931_100011215454 [0,2,0,0,0,0|1,0,0]=3 22057 B14R0.392 CCCCCCCCCCCNCCF 34a_200011215754_100011217306 [0,2,0,0,0,0|1,0,0]=3 22058 B14R0.392 CCCCCCCCCCCNCCO 2230a_100016997473_100011215454 [0,2,0,0,0,0|0,0,0]=2 22059 B14R0.392 CCCCCCCCCCCNCCO 2230a_200011215754_100000211926 [0,2,0,0,0,0|0,0,0]=2 22060 B14R0.392 CCCCCCCCCCCNCCO 34a_100016990907_100011215454 [0,2,0,0,0,0|0,0,0]=2 22061 B14R0.392 CCCCCCCCCCCNCCO 34a_200011215754_100000211926 [0,2,0,0,0,0|0,0,0]=2 22062 B14R0.392 CCCCCCCCCCCNCOC 2230a_200011215754_100000766300 [0,2,0,0,0,0|0,0,0]=2 22063 B14R0.392 CCCCCCCCCCCNCSC 2230a_200011215754_100011218213 [0,2,0,0,0,0|0,1,0]=3 22064 B14R0.392 CCCCCCCCCCCNCSC 34a_200011215754_100011218213 [0,2,0,0,0,0|0,1,0]=3 22065 B14R0.392 CCCCCCCCCCCOCC#N 7a_100000210809_100011215382 [0,2,0,0,0,0|1,0,0]=3 22066 B14R0.392 CCCCCCCCCCCOCC=O 34a_100000210809_200009817547 [0,2,0,0,0,0|0,0,1]=3 22067 B14R0.392 CCCCCCCCCCCOCC=O 7a_100000210809_200015260668 [0,2,0,0,0,0|0,0,1]=3 22068 B14R0.392 CCCCCCCCCCCOCCBr 34a_100000211926_100011215454 [0,2,0,0,0,0|1,0,0]=3 22069 B14R0.392 CCCCCCCCCCCOCCC 34a_100000210258_100011215454 [0,2,0,0,0,0|1,0,0]=3 22070 B14R0.392 CCCCCCCCCCCOCCC 34a_100000210809_100000210303 [0,2,0,0,0,0|1,0,0]=3 22071 B14R0.392 CCCCCCCCCCCOCCC 7a_100000210809_100000210303 [0,2,0,0,0,0|1,0,0]=3 22072 B14R0.392 CCCCCCCCCCCOCCF 34a_100000210809_100011217306 [0,2,0,0,0,0|1,0,0]=3 22073 B14R0.392 CCCCCCCCCCCOCCF 7a_100000210809_100011217306 [0,2,0,0,0,0|1,0,0]=3 22074 B14R0.392 CCCCCCCCCCCOCCN 34a_100000210304_100011215454 [0,2,0,0,0,0|1,0,0]=3 22075 B14R0.392 CCCCCCCCCCCOCCO 34a_100000210809_100000211926 [0,2,0,0,0,0|0,0,0]=2 22076 B14R0.392 CCCCCCCCCCCOCCO 7a_100000210809_100000211926 [0,2,0,0,0,0|0,0,0]=2 22077 B14R0.392 CCCCCCCCCCCOCSC 34a_100000210809_100011218213 [0,2,0,0,0,0|0,1,0]=3 22078 B14R0.392 CCCCCCCCCCCSCC#N 62a_100011215382_100011215454 [0,2,0,0,0,0|1,0,0]=3 22079 B14R0.392 CCCCCCCCCCCSCC=O 62a_200015260668_100011215454 [0,2,0,0,0,0|0,0,1]=3 22080 B14R0.392 CCCCCCCCCCCSCCC 62a_100000210303_100011215454 [0,2,0,0,0,0|1,0,0]=3 22081 B14R0.392 CCCCCCCCCCCSCCF 62a_100011217306_100011215454 [0,2,0,0,0,0|1,0,0]=3 22082 B14R0.392 CCCCCCCCCCCSCCO 62a_100000211926_100011215454 [0,2,0,0,0,0|0,0,0]=2 22083 B14R0.392 CCCCCCCCCCCSCOC 62a_100000766300_100011215454 [0,2,0,0,0,0|0,0,0]=2 22084 B14R0.392 CCCCCCCCCCCSCSC 62a_100011218213_100011215454 [0,2,0,0,0,0|0,1,0]=3 22085 B14R0.392 CCCCCCCCCCNCCC#N 2230a_100000684558_100011215226 [0,2,0,0,0,0|1,0,0]=3 22086 B14R0.392 CCCCCCCCCCNCCCC 2230a_100000102301_100000210320 [0,2,0,0,0,0|1,0,0]=3 22087 B14R0.392 CCCCCCCCCCNCCCC 2230a_100000684558_100000210211 [0,2,0,0,0,0|1,0,0]=3 22088 B14R0.392 CCCCCCCCCCNCCCC 34a_100000684558_100000210210 [0,2,0,0,0,0|1,0,0]=3 22089 B14R0.392 CCCCCCCCCCNCCCC 7a_106832991798_100000210320 [0,2,0,0,0,0|1,0,0]=3 22090 B14R0.392 CCCCCCCCCCNCCCF 2230a_100000684558_100011934791 [0,2,0,0,0,0|1,0,0]=3 22091 B14R0.392 CCCCCCCCCCNCCCF 2230a_100015189416_100000210320 [0,2,0,0,0,0|1,0,0]=3 22092 B14R0.392 CCCCCCCCCCNCCCF 34a_100000684558_100011934791 [0,2,0,0,0,0|1,0,0]=3 22093 B14R0.392 CCCCCCCCCCNCCCF 34a_100015189416_100000210320 [0,2,0,0,0,0|1,0,0]=3 22094 B14R0.392 CCCCCCCCCCNCCCO 2230a_100000684558_100000230001 [0,2,0,0,0,0|0,0,0]=2 22095 B14R0.392 CCCCCCCCCCNCCCO 34a_100000684558_100000230001 [0,2,0,0,0,0|0,0,0]=2 22096 B14R0.392 CCCCCCCCCCNCCOC 2230a_100000209980_100000210320 [0,2,0,0,0,0|0,0,0]=2 22097 B14R0.392 CCCCCCCCCCNCCOC 2230a_100000684558_100011201679 [0,2,0,0,0,0|0,0,0]=2 22098 B14R0.392 CCCCCCCCCCNCCOC 34a_100000684558_100011201679 [0,2,0,0,0,0|0,0,0]=2 22099 B14R0.392 CCCCCCCCCCNCCSC 2230a_100000684558_100000751147 [0,2,0,0,0,0|0,1,0]=3 22100 B14R0.392 CCCCCCCCCCNCCSC 2230a_100020590264_100000210320 [0,2,0,0,0,0|0,1,0]=3 22101 B14R0.392 CCCCCCCCCCNCCSC 34a_100000684558_100000212216 [0,2,0,0,0,0|0,1,0]=3 22102 B14R0.392 CCCCCCCCCCOCCC#N 7a_100000210711_100000184422 [0,2,0,0,0,0|1,0,0]=3 22103 B14R0.392 CCCCCCCCCCOCCCBr 34a_100011217188_100000210320 [0,2,0,0,0,0|1,0,0]=3 22104 B14R0.392 CCCCCCCCCCOCCCC 34a_100000210227_100000210320 [0,2,0,0,0,0|1,0,0]=3 22105 B14R0.392 CCCCCCCCCCOCCCC 34a_100000210711_100000210210 [0,2,0,0,0,0|1,0,0]=3 22106 B14R0.392 CCCCCCCCCCOCCCC 7a_100000210227_100000210320 [0,2,0,0,0,0|1,0,0]=3 22107 B14R0.392 CCCCCCCCCCOCCCC 7a_100000210711_100000210211 [0,2,0,0,0,0|1,0,0]=3 22108 B14R0.392 CCCCCCCCCCOCCCCl 34a_100000230001_100000210320 [0,2,0,0,0,0|1,0,0]=3 22109 B14R0.392 CCCCCCCCCCOCCCF 34a_100000210711_100011934791 [0,2,0,0,0,0|1,0,0]=3 22110 B14R0.392 CCCCCCCCCCOCCCF 34a_100000759539_100000210320 [0,2,0,0,0,0|1,0,0]=3 22111 B14R0.392 CCCCCCCCCCOCCCF 7a_100000210711_100011934791 [0,2,0,0,0,0|1,0,0]=3 22112 B14R0.392 CCCCCCCCCCOCCCN 34a_100000182051_100000210320 [0,2,0,0,0,0|1,0,0]=3 22113 B14R0.392 CCCCCCCCCCOCCCO 34a_100000210711_100000230001 [0,2,0,0,0,0|0,0,0]=2 22114 B14R0.392 CCCCCCCCCCOCCCO 7a_100000210711_100011215043 [0,2,0,0,0,0|0,0,0]=2 22115 B14R0.392 CCCCCCCCCCOCCOC 34a_100000210237_100000210320 [0,2,0,0,0,0|0,0,0]=2 22116 B14R0.392 CCCCCCCCCCOCCOC 34a_100000210711_100011201679 [0,2,0,0,0,0|0,0,0]=2 22117 B14R0.392 CCCCCCCCCCOCCOC 7a_100000210711_100000233755 [0,2,0,0,0,0|0,0,0]=2 22118 B14R0.392 CCCCCCCCCCOCCON 34a_100000700252_100000210320 [0,2,0,0,0,0|0,0,0]=2 22119 B14R0.392 CCCCCCCCCCOCCSC 34a_100000210711_100000212216 [0,2,0,0,0,0|0,1,0]=3 22120 B14R0.392 CCCCCCCCCCOCCSC 34a_100000230434_100000210320 [0,2,0,0,0,0|0,1,0]=3 22121 B14R0.392 CCCCCCCCCCOCCSC 7a_100000210711_100000212216 [0,2,0,0,0,0|0,1,0]=3 22122 B14R0.392 CCCCCCCCCCOCCSC 7a_100000230434_100000210320 [0,2,0,0,0,0|0,1,0]=3 22123 B14R0.392 CCCCCCCCCCSCCC#N 62a_100011215226_100000210320 [0,2,0,0,0,0|1,0,0]=3 22124 B14R0.392 CCCCCCCCCCSCCCC 62a_100000210211_100000210320 [0,2,0,0,0,0|1,0,0]=3 22125 B14R0.392 CCCCCCCCCCSCCCF 62a_100011934791_100000210320 [0,2,0,0,0,0|1,0,0]=3 22126 B14R0.392 CCCCCCCCCCSCCCO 62a_100011215043_100000210320 [0,2,0,0,0,0|0,0,0]=2 22127 B14R0.392 CCCCCCCCCCSCCOC 34a_100011628728_200000210301 [0,2,0,0,0,0|0,0,0]=2 22128 B14R0.392 CCCCCCCCCCSCCOC 62a_100000233755_100000210320 [0,2,0,0,0,0|0,0,0]=2 22129 B14R0.392 CCCCCCCCCCSCCOC 7a_100011628728_200000210301 [0,2,0,0,0,0|0,0,0]=2 22130 B14R0.392 CCCCCCCCCCSCCO[13CH3] 34a_100011628728_200025704644 [0,2,0,0,0,0|0,0,0]=2 22131 B14R0.392 CCCCCCCCCCSCCO[13CH3] 7a_100011628728_200025704644 [0,2,0,0,0,0|0,0,0]=2 22132 B14R0.392 CCCCCCCCCCSCCSC 62a_100000212216_100000210320 [0,2,0,0,0,0|0,1,0]=3 22133 B14R0.392 CCCCCCCCCCSCOCC 62a_100000739092_100000210320 [0,2,0,0,0,0|1,0,0]=3 22134 B14R0.392 CCCCCCCCCCSCSC#N 62a_100000211825_100000210320 [0,2,0,0,0,0|1,0,1]=4 22135 B14R0.392 CCCCCCCCCNCC#CCO 2230a_100000212291_200000047223 [0,2,0,0,0,0|0,0,1]=3 22136 B14R0.392 CCCCCCCCCNCC#CCO 34a_100000212291_200000047223 [0,2,0,0,0,0|0,0,1]=3 22137 B14R0.392 CCCCCCCCCNCCCC#N 2230a_100000212291_100000687738 [0,2,0,0,0,0|1,0,0]=3 22138 B14R0.392 CCCCCCCCCNCCCC=O 2230a_100000212291_200011292268 [0,2,0,0,0,0|0,0,1]=3 22139 B14R0.392 CCCCCCCCCNCCCCC 2230a_100000209983_100011214924 [0,2,0,0,0,0|1,0,0]=3 22140 B14R0.392 CCCCCCCCCNCCCCC 2230a_100000212291_100000210326 [0,2,0,0,0,0|1,0,0]=3 22141 B14R0.392 CCCCCCCCCNCCCCC 34a_100000212291_100000718602 [0,2,0,0,0,0|1,0,0]=3 22142 B14R0.392 CCCCCCCCCNCCCCF 2230a_100000212291_100000729493 [0,2,0,0,0,0|1,0,0]=3 22143 B14R0.392 CCCCCCCCCNCCCCF 34a_100000212291_100000729493 [0,2,0,0,0,0|1,0,0]=3 22144 B14R0.392 CCCCCCCCCNCCCCO 2230a_100000212291_100000210776 [0,2,0,0,0,0|0,0,0]=2 22145 B14R0.392 CCCCCCCCCNCCCCO 2230a_100000750430_100011214924 [0,2,0,0,0,0|0,0,0]=2 22146 B14R0.392 CCCCCCCCCNCCCCO 34a_100000212291_100011216708 [0,2,0,0,0,0|0,0,0]=2 22147 B14R0.392 CCCCCCCCCNCCCCO 34a_100000750430_100011214924 [0,2,0,0,0,0|0,0,0]=2 22148 B14R0.392 CCCCCCCCCNCCCOC 2230a_100000212291_100000740836 [0,2,0,0,0,0|0,0,0]=2 22149 B14R0.392 CCCCCCCCCNCCCOC 34a_100000212291_100000740836 [0,2,0,0,0,0|0,0,0]=2 22150 B14R0.392 CCCCCCCCCNCCCOC 34a_100150723488_100011214924 [0,2,0,0,0,0|0,0,0]=2 22151 B14R0.392 CCCCCCCCCNCCCSC 2230a_100000749238_100011214924 [0,2,0,0,0,0|0,1,0]=3 22152 B14R0.392 CCCCCCCCCNCCOCC 2230a_100000212291_100011215890 [0,2,0,0,0,0|1,0,0]=3 22153 B14R0.392 CCCCCCCCCNCCOCC 2230a_102516460346_100011214924 [0,2,0,0,0,0|1,0,0]=3 22154 B14R0.392 CCCCCCCCCNCCOCC 34a_100000212291_100000210147 [0,2,0,0,0,0|1,0,0]=3 22155 B14R0.392 CCCCCCCCCNCCOCC 34a_102516460346_100011214924 [0,2,0,0,0,0|1,0,0]=3 22156 B14R0.392 CCCCCCCCCNCCSCC 2230a_100000106463_100011214924 [0,2,0,0,0,0|1,0,0]=3 22157 B14R0.392 CCCCCCCCCNCCSCC 2230a_100000212291_100000757381 [0,2,0,0,0,0|1,0,0]=3 22158 B14R0.392 CCCCCCCCCNCCSCC 34a_100000212291_100000757381 [0,2,0,0,0,0|1,0,0]=3 22159 B14R0.392 CCCCCCCCCOCC#CCCl 34a_200000047223_100011214924 [0,2,0,0,0,0|1,0,1]=4 22160 B14R0.392 CCCCCCCCCOCC#CCO 34a_100000210712_200000047223 [0,2,0,0,0,0|0,0,1]=3 22161 B14R0.392 CCCCCCCCCOCC#CCO 7a_100000210712_200000047223 [0,2,0,0,0,0|0,0,1]=3 22162 B14R0.392 CCCCCCCCCOCCCC#N 7a_100000210712_100000687738 [0,2,0,0,0,0|1,0,0]=3 22163 B14R0.392 CCCCCCCCCOCCCC=O 7a_100000210712_200011292268 [0,2,0,0,0,0|0,0,1]=3 22164 B14R0.392 CCCCCCCCCOCCCCBr 34a_100011216708_100011214924 [0,2,0,0,0,0|1,0,0]=3 22165 B14R0.392 CCCCCCCCCOCCCCC 34a_100000210253_100011214924 [0,2,0,0,0,0|1,0,0]=3 22166 B14R0.392 CCCCCCCCCOCCCCC 34a_100000210712_100000718602 [0,2,0,0,0,0|1,0,0]=3 22167 B14R0.392 CCCCCCCCCOCCCCC 7a_100000210253_100000210328 [0,2,0,0,0,0|1,0,0]=3 22168 B14R0.392 CCCCCCCCCOCCCCC 7a_100000210712_100000210326 [0,2,0,0,0,0|1,0,0]=3 22169 B14R0.392 CCCCCCCCCOCCCCCl 34a_100000210776_100011214924 [0,2,0,0,0,0|1,0,0]=3 22170 B14R0.392 CCCCCCCCCOCCCCCl 7a_100000210776_100000210328 [0,2,0,0,0,0|1,0,0]=3 22171 B14R0.392 CCCCCCCCCOCCCCF 34a_100000210712_100000729493 [0,2,0,0,0,0|1,0,0]=3 22172 B14R0.392 CCCCCCCCCOCCCCF 34a_100011995726_100011214924 [0,2,0,0,0,0|1,0,0]=3 22173 B14R0.392 CCCCCCCCCOCCCCF 7a_100000210712_100000729493 [0,2,0,0,0,0|1,0,0]=3 22174 B14R0.392 CCCCCCCCCOCCCCF 7a_100011995726_100000210328 [0,2,0,0,0,0|1,0,0]=3 22175 B14R0.392 CCCCCCCCCOCCCCI 34a_200012148704_100011214924 [0,2,0,0,0,0|1,0,0]=3 22176 B14R0.392 CCCCCCCCCOCCCCN 34a_100000750430_100011214924 [0,2,0,0,0,0|1,0,0]=3 22177 B14R0.392 CCCCCCCCCOCCCCO 34a_100000210712_100011216708 [0,2,0,0,0,0|0,0,0]=2 22178 B14R0.392 CCCCCCCCCOCCCCO 7a_100000210712_100000210776 [0,2,0,0,0,0|0,0,0]=2 22179 B14R0.392 CCCCCCCCCOCCCNC 34a_100000213112_100011214924 [0,2,0,0,0,0|1,0,0]=3 22180 B14R0.392 CCCCCCCCCOCCCOC 34a_100000210712_100000740836 [0,2,0,0,0,0|0,0,0]=2 22181 B14R0.392 CCCCCCCCCOCCCOC 34a_100000740835_100011214924 [0,2,0,0,0,0|0,0,0]=2 22182 B14R0.392 CCCCCCCCCOCCCOC 7a_100000210712_100000740836 [0,2,0,0,0,0|0,0,0]=2 22183 B14R0.392 CCCCCCCCCOCCCSC 34a_100000690336_100011214924 [0,2,0,0,0,0|0,1,0]=3 22184 B14R0.392 CCCCCCCCCOCCCSC 7a_100000690336_100000210328 [0,2,0,0,0,0|0,1,0]=3 22185 B14R0.392 CCCCCCCCCOCCOCC 34a_100000210136_100011214924 [0,2,0,0,0,0|1,0,0]=3 22186 B14R0.392 CCCCCCCCCOCCOCC 34a_100000210712_100000210147 [0,2,0,0,0,0|1,0,0]=3 22187 B14R0.392 CCCCCCCCCOCCOCC 7a_100000210136_100000210328 [0,2,0,0,0,0|1,0,0]=3 22188 B14R0.392 CCCCCCCCCOCCOCC 7a_100000210712_100011215890 [0,2,0,0,0,0|1,0,0]=3 22189 B14R0.392 CCCCCCCCCOCCSCC 34a_100000210712_100000757381 [0,2,0,0,0,0|1,0,0]=3 22190 B14R0.392 CCCCCCCCCOCCSCC 34a_100000212035_100011214924 [0,2,0,0,0,0|1,0,0]=3 22191 B14R0.392 CCCCCCCCCOCCSCC 7a_100000210712_100000757381 [0,2,0,0,0,0|1,0,0]=3 22192 B14R0.392 CCCCCCCCCOCCSCC 7a_100000212035_100000210328 [0,2,0,0,0,0|1,0,0]=3 22193 B14R0.392 CCCCCCCCCSCC#CCO 62a_200000047223_100000210670 [0,2,0,0,0,0|0,0,1]=3 22194 B14R0.392 CCCCCCCCCSCCCC#N 62a_100000687738_100000210670 [0,2,0,0,0,0|1,0,0]=3 22195 B14R0.392 CCCCCCCCCSCCCC=O 62a_200011292268_100000210670 [0,2,0,0,0,0|0,0,1]=3 22196 B14R0.392 CCCCCCCCCSCCCCC 62a_100000210326_100000210670 [0,2,0,0,0,0|1,0,0]=3 22197 B14R0.392 CCCCCCCCCSCCCCF 62a_100000729493_100000210670 [0,2,0,0,0,0|1,0,0]=3 22198 B14R0.392 CCCCCCCCCSCCCCO 62a_100000210776_100000210670 [0,2,0,0,0,0|0,0,0]=2 22199 B14R0.392 CCCCCCCCCSCCCOC 62a_100000709357_100000210670 [0,2,0,0,0,0|0,0,0]=2 22200 B14R0.392 CCCCCCCCCSCCOCC 62a_100000210147_100000210670 [0,2,0,0,0,0|1,0,0]=3 22201 B14R0.392 CCCCCCCCCSCCSC#N 62a_100000034367_100000210670 [0,2,0,0,0,0|1,0,1]=4 22202 B14R0.392 CCCCCCCCCSCCSCC 62a_100000757381_100000210670 [0,2,0,0,0,0|1,0,0]=3 22203 B14R0.392 CCCCCCCCNCCCCC#N 2230a_100000229939_100000211819 [0,2,0,0,0,0|1,0,0]=3 22204 B14R0.392 CCCCCCCCNCCCCC=O 2230a_100000229939_100000139335 [0,2,0,0,0,0|0,0,1]=3 22205 B14R0.392 CCCCCCCCNCCCCCC 2230a_100000210581_100000210759 [0,2,0,0,0,0|1,0,0]=3 22206 B14R0.392 CCCCCCCCNCCCCCC 2230a_100000229939_100000210314 [0,2,0,0,0,0|1,0,0]=3 22207 B14R0.392 CCCCCCCCNCCCCCC 34a_100000229939_100000210314 [0,2,0,0,0,0|1,0,0]=3 22208 B14R0.392 CCCCCCCCNCCCCCF 2230a_100000229939_100000729378 [0,2,0,0,0,0|1,0,0]=3 22209 B14R0.392 CCCCCCCCNCCCCCF 34a_100000229939_100000729378 [0,2,0,0,0,0|1,0,0]=3 22210 B14R0.392 CCCCCCCCNCCCCCO 2230a_100000229939_100000746330 [0,2,0,0,0,0|0,0,0]=2 22211 B14R0.392 CCCCCCCCNCCCCCO 2230a_100000762737_100000210759 [0,2,0,0,0,0|0,0,0]=2 22212 B14R0.392 CCCCCCCCNCCCCCO 34a_100000229939_100000746330 [0,2,0,0,0,0|0,0,0]=2 22213 B14R0.392 CCCCCCCCNCCCCCO 34a_100000762737_100000210759 [0,2,0,0,0,0|0,0,0]=2 22214 B14R0.392 CCCCCCCCNCCCCOC 2230a_100000229939_100000730899 [0,2,0,0,0,0|0,0,0]=2 22215 B14R0.392 CCCCCCCCNCCCCOC 34a_100000229939_100000755781 [0,2,0,0,0,0|0,0,0]=2 22216 B14R0.392 CCCCCCCCNCCCN=[N+]=[N-] 2230a_100000744732_100000210759 [0,2,0,0,0,0|2,0,0]=4 22217 B14R0.392 CCCCCCCCNCCCOCC 2230a_100000210961_100000210759 [0,2,0,0,0,0|1,0,0]=3 22218 B14R0.392 CCCCCCCCNCCCOCC 2230a_100000229939_100012232248 [0,2,0,0,0,0|1,0,0]=3 22219 B14R0.392 CCCCCCCCNCCCOCC 34a_100000210961_100000210759 [0,2,0,0,0,0|1,0,0]=3 22220 B14R0.392 CCCCCCCCNCCCOCC 34a_100000229939_100012232248 [0,2,0,0,0,0|1,0,0]=3 22221 B14R0.392 CCCCCCCCNCCOCC#N 2230a_100000229939_200000047693 [0,2,0,0,0,0|1,0,1]=4 22222 B14R0.392 CCCCCCCCNCCOCCC 2230a_100000229939_100011215938 [0,2,0,0,0,0|1,0,0]=3 22223 B14R0.392 CCCCCCCCNCCOCCC 2230a_100161115042_100000210759 [0,2,0,0,0,0|1,0,0]=3 22224 B14R0.392 CCCCCCCCNCCOCCC 34a_100000229939_100011215938 [0,2,0,0,0,0|1,0,0]=3 22225 B14R0.392 CCCCCCCCNCCOCCC 34a_100161115042_100000210759 [0,2,0,0,0,0|1,0,0]=3 22226 B14R0.392 CCCCCCCCNCCOCCO 2230a_100000211614_100000210759 [0,2,0,0,0,0|0,0,0]=2 22227 B14R0.392 CCCCCCCCNCCOCCO 2230a_100000229939_100011215305 [0,2,0,0,0,0|0,0,0]=2 22228 B14R0.392 CCCCCCCCNCCOCCO 34a_100000211614_100000210759 [0,2,0,0,0,0|0,0,0]=2 22229 B14R0.392 CCCCCCCCNCCOCCO 34a_100000229939_100000692535 [0,2,0,0,0,0|0,0,0]=2 22230 B14R0.392 CCCCCCCCNCCSCCC 2230a_100020603323_100000210759 [0,2,0,0,0,0|1,0,0]=3 22231 B14R0.392 CCCCCCCCNCCSCCO 2230a_100011219999_100000210759 [0,2,0,0,0,0|0,0,0]=2 22232 B14R0.392 CCCCCCCCNCOCCCC 2230a_100000229939_100011995733 [0,2,0,0,0,0|1,0,0]=3 22233 B14R0.392 CCCCCCCCNCOCCCC 34a_100000229939_100011995733 [0,2,0,0,0,0|1,0,0]=3 22234 B14R0.392 CCCCCCCCNCOCCOC 2230a_100000229939_100000231047 [0,2,0,0,0,0|1,0,0]=3 22235 B14R0.392 CCCCCCCCOCCCCC#N 7a_100000210232_100000211819 [0,2,0,0,0,0|1,0,0]=3 22236 B14R0.392 CCCCCCCCOCCCCC=O 7a_100000210232_100000139335 [0,2,0,0,0,0|0,0,1]=3 22237 B14R0.392 CCCCCCCCOCCCCCBr 34a_100000746331_100000210759 [0,2,0,0,0,0|1,0,0]=3 22238 B14R0.392 CCCCCCCCOCCCCCBr 7a_100000746331_100000210759 [0,2,0,0,0,0|1,0,0]=3 22239 B14R0.392 CCCCCCCCOCCCCCC 34a_100000210232_100000210314 [0,2,0,0,0,0|1,0,0]=3 22240 B14R0.392 CCCCCCCCOCCCCCC 34a_100000210259_100000210759 [0,2,0,0,0,0|1,0,0]=3 22241 B14R0.392 CCCCCCCCOCCCCCC 7a_100000210232_100000210314 [0,2,0,0,0,0|1,0,0]=3 22242 B14R0.392 CCCCCCCCOCCCCCC 7a_100000210259_100000210759 [0,2,0,0,0,0|1,0,0]=3 22243 B14R0.392 CCCCCCCCOCCCCCCl 34a_100000746330_100000210759 [0,2,0,0,0,0|1,0,0]=3 22244 B14R0.392 CCCCCCCCOCCCCCCl 7a_100000746330_100000210759 [0,2,0,0,0,0|1,0,0]=3 22245 B14R0.392 CCCCCCCCOCCCCCF 34a_100000210232_100000729378 [0,2,0,0,0,0|1,0,0]=3 22246 B14R0.392 CCCCCCCCOCCCCCF 7a_100000210232_100000729378 [0,2,0,0,0,0|1,0,0]=3 22247 B14R0.392 CCCCCCCCOCCCCCI 34a_200012148887_100000210759 [0,2,0,0,0,0|1,0,0]=3 22248 B14R0.392 CCCCCCCCOCCCCCI 7a_200012148887_100000210759 [0,2,0,0,0,0|1,0,0]=3 22249 B14R0.392 CCCCCCCCOCCCCCN 34a_100000762737_100000210759 [0,2,0,0,0,0|1,0,0]=3 22250 B14R0.392 CCCCCCCCOCCCCCO 34a_100000210232_100000746330 [0,2,0,0,0,0|0,0,0]=2 22251 B14R0.392 CCCCCCCCOCCCCCO 7a_100000210232_100000746330 [0,2,0,0,0,0|0,0,0]=2 22252 B14R0.392 CCCCCCCCOCCCCOC 34a_100000210232_100000755781 [0,2,0,0,0,0|0,0,0]=2 22253 B14R0.392 CCCCCCCCOCCCCOC 34a_100000740925_100000210759 [0,2,0,0,0,0|0,0,0]=2 22254 B14R0.392 CCCCCCCCOCCCCOC 7a_100000210232_100000730899 [0,2,0,0,0,0|0,0,0]=2 22255 B14R0.392 CCCCCCCCOCCCCSC 34a_100011217163_100000210759 [0,2,0,0,0,0|0,1,0]=3 22256 B14R0.392 CCCCCCCCOCCCCSC 7a_100011217163_100000210759 [0,2,0,0,0,0|0,1,0]=3 22257 B14R0.392 CCCCCCCCOCCCOCC 34a_100000210232_100012232248 [0,2,0,0,0,0|1,0,0]=3 22258 B14R0.392 CCCCCCCCOCCCOCC 34a_100000757476_100000210759 [0,2,0,0,0,0|1,0,0]=3 22259 B14R0.392 CCCCCCCCOCCCOCC 7a_100000210232_100012232248 [0,2,0,0,0,0|1,0,0]=3 22260 B14R0.392 CCCCCCCCOCCCOCC 7a_100000757476_100000210759 [0,2,0,0,0,0|1,0,0]=3 22261 B14R0.392 CCCCCCCCOCCCSCC 34a_100011216438_100000210759 [0,2,0,0,0,0|1,0,0]=3 22262 B14R0.392 CCCCCCCCOCCCSCC 7a_100011216438_100000210759 [0,2,0,0,0,0|1,0,0]=3 22263 B14R0.392 CCCCCCCCOCCOCC#N 7a_100000210232_200000047693 [0,2,0,0,0,0|1,0,1]=4 22264 B14R0.392 CCCCCCCCOCCOCCBr 34a_100000692535_100000210759 [0,2,0,0,0,0|1,0,0]=3 22265 B14R0.392 CCCCCCCCOCCOCCBr 7a_100000692535_100000210759 [0,2,0,0,0,0|1,0,0]=3 22266 B14R0.392 CCCCCCCCOCCOCCC 34a_100000210232_100011215938 [0,2,0,0,0,0|1,0,0]=3 22267 B14R0.392 CCCCCCCCOCCOCCC 34a_100000752267_100000210759 [0,2,0,0,0,0|1,0,0]=3 22268 B14R0.392 CCCCCCCCOCCOCCC 7a_100000210232_100011215938 [0,2,0,0,0,0|1,0,0]=3 22269 B14R0.392 CCCCCCCCOCCOCCC 7a_100000752267_100000210759 [0,2,0,0,0,0|1,0,0]=3 22270 B14R0.392 CCCCCCCCOCCOCCCl 34a_100011215305_100000210759 [0,2,0,0,0,0|1,0,0]=3 22271 B14R0.392 CCCCCCCCOCCOCCCl 7a_100011215305_100000210759 [0,2,0,0,0,0|1,0,0]=3 22272 B14R0.392 CCCCCCCCOCCOCCF 34a_200015357709_100000210759 [0,2,0,0,0,0|1,0,0]=3 22273 B14R0.392 CCCCCCCCOCCOCCF 7a_200015357709_100000210759 [0,2,0,0,0,0|1,0,0]=3 22274 B14R0.392 CCCCCCCCOCCOCCI 34a_100012149058_100000210759 [0,2,0,0,0,0|1,0,0]=3 22275 B14R0.392 CCCCCCCCOCCOCCI 7a_100012149058_100000210759 [0,2,0,0,0,0|1,0,0]=3 22276 B14R0.392 CCCCCCCCOCCOCCN 34a_100000211614_100000210759 [0,2,0,0,0,0|1,0,0]=3 22277 B14R0.392 CCCCCCCCOCCOCCO 34a_100000210232_100000692535 [0,2,0,0,0,0|0,0,0]=2 22278 B14R0.392 CCCCCCCCOCCOCCO 7a_100000210232_100011215305 [0,2,0,0,0,0|0,0,0]=2 22279 B14R0.392 CCCCCCCCOCCSCCC 34a_200000230433_100000210759 [0,2,0,0,0,0|1,0,0]=3 22280 B14R0.392 CCCCCCCCOCCSCCC 7a_200000230433_100000210759 [0,2,0,0,0,0|1,0,0]=3 22281 B14R0.392 CCCCCCCCOCOCCCC 34a_100000210232_100011995733 [0,2,0,0,0,0|1,0,0]=3 22282 B14R0.392 CCCCCCCCSCCCCC#N 62a_100000210759_100000211819 [0,2,0,0,0,0|1,0,0]=3 22283 B14R0.392 CCCCCCCCSCCCCC#N 62a_100011219923_100000210317 [0,2,0,0,0,0|1,0,0]=3 22284 B14R0.392 CCCCCCCCSCCCCC=O 62a_100000139335_100000210317 [0,2,0,0,0,0|0,0,1]=3 22285 B14R0.392 CCCCCCCCSCCCCC=O 62a_100000210759_100000139335 [0,2,0,0,0,0|0,0,1]=3 22286 B14R0.392 CCCCCCCCSCCCCCC 62a_100000210314_100000210317 [0,2,0,0,0,0|1,0,0]=3 22287 B14R0.392 CCCCCCCCSCCCCCC 62a_100000210759_100000210757 [0,2,0,0,0,0|1,0,0]=3 22288 B14R0.392 CCCCCCCCSCCCCCF 62a_100000210759_100000729378 [0,2,0,0,0,0|1,0,0]=3 22289 B14R0.392 CCCCCCCCSCCCCCF 62a_100000729378_100000210317 [0,2,0,0,0,0|1,0,0]=3 22290 B14R0.392 CCCCCCCCSCCCCCO 62a_100000210759_100000746330 [0,2,0,0,0,0|0,0,0]=2 22291 B14R0.392 CCCCCCCCSCCCCCO 62a_100000746330_100000210317 [0,2,0,0,0,0|0,0,0]=2 22292 B14R0.392 CCCCCCCCSCCCCOC 62a_100000210759_100000730899 [0,2,0,0,0,0|0,0,0]=2 22293 B14R0.392 CCCCCCCCSCCCCOC 62a_100000730899_100000210317 [0,2,0,0,0,0|0,0,0]=2 22294 B14R0.392 CCCCCCCCSCCCOCC 62a_100000210759_100012232248 [0,2,0,0,0,0|1,0,0]=3 22295 B14R0.392 CCCCCCCCSCCCOCC 62a_100012232248_100000210317 [0,2,0,0,0,0|1,0,0]=3 22296 B14R0.392 CCCCCCCCSCCOCC#N 62a_100000210759_200000047693 [0,2,0,0,0,0|1,0,1]=4 22297 B14R0.392 CCCCCCCCSCCOCC#N 62a_200000047693_100000210317 [0,2,0,0,0,0|1,0,1]=4 22298 B14R0.392 CCCCCCCCSCCOCCC 62a_100000210759_100011215938 [0,2,0,0,0,0|1,0,0]=3 22299 B14R0.392 CCCCCCCCSCCOCCC 62a_100011215938_100000210317 [0,2,0,0,0,0|1,0,0]=3 22300 B14R0.392 CCCCCCCCSCCOCCO 62a_100000210759_100011215305 [0,2,0,0,0,0|0,0,0]=2 22301 B14R0.392 CCCCCCCCSCCOCCO 62a_100011215305_100000210317 [0,2,0,0,0,0|0,0,0]=2 22302 B14R0.392 CCCCCCCCSCOCCCC 62a_100000210759_100011995733 [0,2,0,0,0,0|1,0,0]=3 22303 B14R0.392 CCCCCCCCSCOCCCC 62a_100011995733_100000210317 [0,2,0,0,0,0|1,0,0]=3 22304 B14R0.392 CCCCCCCCSCOCCOC 62a_100000210759_100000231047 [0,2,0,0,0,0|1,0,0]=3 22305 B14R0.392 CCCCCCCCSCOCCOC 62a_100000231047_100000210317 [0,2,0,0,0,0|1,0,0]=3 22306 B14R0.392 CCCCCCCNCCCCCC#N 2230a_100000229938_100009813376 [0,2,0,0,0,0|1,0,0]=3 22307 B14R0.392 CCCCCCCNCCCCCC=O 2230a_100000229938_100000139337 [0,2,0,0,0,0|0,0,1]=3 22308 B14R0.392 CCCCCCCNCCCCCCC 2230a_100000229938_100000210681 [0,2,0,0,0,0|1,0,0]=3 22309 B14R0.392 CCCCCCCNCCCCCCF 2230a_100000229938_100015922095 [0,2,0,0,0,0|1,0,0]=3 22310 B14R0.392 CCCCCCCNCCCCCCO 2230a_100000229938_100000766143 [0,2,0,0,0,0|0,0,0]=2 22311 B14R0.392 CCCCCCCNCCCCCCO 2230a_100000686447_100000210681 [0,2,0,0,0,0|0,0,0]=2 22312 B14R0.392 CCCCCCCNCCCCCCO 34a_100000686447_100000210614 [0,2,0,0,0,0|0,0,0]=2 22313 B14R0.392 CCCCCCCNCCCCCOC 2230a_100000747528_100000210681 [0,2,0,0,0,0|0,0,0]=2 22314 B14R0.392 CCCCCCCNCCCCCOC 34a_100000747528_100000210614 [0,2,0,0,0,0|0,0,0]=2 22315 B14R0.392 CCCCCCCNCCCCN=[N+]=[N-] 2230a_100000101370_100000210681 [0,2,0,0,0,0|2,0,0]=4 22316 B14R0.392 CCCCCCCNCCCOCCC 2230a_100011217757_100000210681 [0,2,0,0,0,0|1,0,0]=3 22317 B14R0.392 CCCCCCCNCCCOCCC 34a_100011217757_100000210614 [0,2,0,0,0,0|1,0,0]=3 22318 B14R0.392 CCCCCCCNCCOCCCC 2230a_100000229938_100000743108 [0,2,0,0,0,0|1,0,0]=3 22319 B14R0.392 CCCCCCCNCCOCCOC 2230a_100000229938_100000695917 [0,2,0,0,0,0|1,0,0]=3 22320 B14R0.392 CCCCCCCNCCOCCOC 2230a_100000745349_100000210681 [0,2,0,0,0,0|1,0,0]=3 22321 B14R0.392 CCCCCCCNCCOCCOC 34a_100000745349_100000210614 [0,2,0,0,0,0|1,0,0]=3 22322 B14R0.392 CCCCCCCNCCSCCCC 2230a_100025743550_100000210681 [0,2,0,0,0,0|1,0,0]=3 22323 B14R0.392 CCCCCCCOCCCCCC#N 7a_100000210272_100009813376 [0,2,0,0,0,0|1,0,0]=3 22324 B14R0.392 CCCCCCCOCCCCCC=O 7a_100000210272_100000139337 [0,2,0,0,0,0|0,0,1]=3 22325 B14R0.392 CCCCCCCOCCCCCCBr 34a_100011215345_100000210614 [0,2,0,0,0,0|1,0,0]=3 22326 B14R0.392 CCCCCCCOCCCCCCBr 7a_100011215345_100000210614 [0,2,0,0,0,0|1,0,0]=3 22327 B14R0.392 CCCCCCCOCCCCCCC 34a_100000210272_100000210614 [0,2,0,0,0,0|1,0,0]=3 22328 B14R0.392 CCCCCCCOCCCCCCC 7a_100000210272_100000210614 [0,2,0,0,0,0|1,0,0]=3 22329 B14R0.392 CCCCCCCOCCCCCCCl 34a_100000766143_100000210614 [0,2,0,0,0,0|1,0,0]=3 22330 B14R0.392 CCCCCCCOCCCCCCCl 7a_100000766143_100000210614 [0,2,0,0,0,0|1,0,0]=3 22331 B14R0.392 CCCCCCCOCCCCCCF 34a_100000210272_100015922095 [0,2,0,0,0,0|1,0,0]=3 22332 B14R0.392 CCCCCCCOCCCCCCF 34a_100000732779_100000210614 [0,2,0,0,0,0|1,0,0]=3 22333 B14R0.392 CCCCCCCOCCCCCCF 7a_100000210272_100015922095 [0,2,0,0,0,0|1,0,0]=3 22334 B14R0.392 CCCCCCCOCCCCCCF 7a_100000732779_100000210614 [0,2,0,0,0,0|1,0,0]=3 22335 B14R0.392 CCCCCCCOCCCCCCN 34a_100000686447_100000210614 [0,2,0,0,0,0|1,0,0]=3 22336 B14R0.392 CCCCCCCOCCCCCCO 34a_100000210272_100000766143 [0,2,0,0,0,0|0,0,0]=2 22337 B14R0.392 CCCCCCCOCCCCCCO 7a_100000210272_100000766143 [0,2,0,0,0,0|0,0,0]=2 22338 B14R0.392 CCCCCCCOCCCCCNC 34a_100000722520_100000210614 [0,2,0,0,0,0|1,0,0]=3 22339 B14R0.392 CCCCCCCOCCOCCCC 34a_100000210238_100000210614 [0,2,0,0,0,0|1,0,0]=3 22340 B14R0.392 CCCCCCCOCCOCCCC 34a_100000210272_100000743108 [0,2,0,0,0,0|1,0,0]=3 22341 B14R0.392 CCCCCCCOCCOCCCC 7a_100000210238_100000210614 [0,2,0,0,0,0|1,0,0]=3 22342 B14R0.392 CCCCCCCOCCOCCCC 7a_100000210272_100000743108 [0,2,0,0,0,0|1,0,0]=3 22343 B14R0.392 CCCCCCCOCCOCCNC 34a_100000228057_100000210614 [0,2,0,0,0,0|2,0,0]=4 22344 B14R0.392 CCCCCCCOCCOCCOC 34a_100000210272_100000695917 [0,2,0,0,0,0|1,0,0]=3 22345 B14R0.392 CCCCCCCOCCOCCOC 34a_100011215163_100000210614 [0,2,0,0,0,0|1,0,0]=3 22346 B14R0.392 CCCCCCCOCCOCCOC 7a_100000210272_100000695917 [0,2,0,0,0,0|1,0,0]=3 22347 B14R0.392 CCCCCCCOCCOCCOC 7a_100011215163_100000210614 [0,2,0,0,0,0|1,0,0]=3 22348 B14R0.392 CCCCCCCOCCSCCCC 34a_200000230436_100000210614 [0,2,0,0,0,0|1,0,0]=3 22349 B14R0.392 CCCCCCCOCCSCCCC 7a_200000230436_100000210614 [0,2,0,0,0,0|1,0,0]=3 22350 B14R0.392 CCCCCCCSCCCCCC#N 62a_100000210614_100009813376 [0,2,0,0,0,0|1,0,0]=3 22351 B14R0.392 CCCCCCCSCCCCCC#N 62a_100009813376_100000210316 [0,2,0,0,0,0|1,0,0]=3 22352 B14R0.392 CCCCCCCSCCCCCC=O 62a_100000139337_100000210316 [0,2,0,0,0,0|0,0,1]=3 22353 B14R0.392 CCCCCCCSCCCCCC=O 62a_100000210614_100000139337 [0,2,0,0,0,0|0,0,1]=3 22354 B14R0.392 CCCCCCCSCCCCCCC 62a_100000210614_100000210316 [0,2,0,0,0,0|1,0,0]=3 22355 B14R0.392 CCCCCCCSCCCCCCF 62a_100000210614_100015922095 [0,2,0,0,0,0|1,0,0]=3 22356 B14R0.392 CCCCCCCSCCCCCCF 62a_100015922095_100000210316 [0,2,0,0,0,0|1,0,0]=3 22357 B14R0.392 CCCCCCCSCCCCCCO 62a_100000210614_100000766143 [0,2,0,0,0,0|0,0,0]=2 22358 B14R0.392 CCCCCCCSCCCCCCO 62a_100000766143_100000210316 [0,2,0,0,0,0|0,0,0]=2 22359 B14R0.392 CCCCCCCSCCOCCCC 62a_100000210614_100000743108 [0,2,0,0,0,0|1,0,0]=3 22360 B14R0.392 CCCCCCCSCCOCCCC 62a_100000743108_100000210316 [0,2,0,0,0,0|1,0,0]=3 22361 B14R0.392 CCCCCCCSCCOCCOC 62a_100000210614_100000695917 [0,2,0,0,0,0|1,0,0]=3 22362 B14R0.392 CCCCCCCSCCOCCOC 62a_100000695917_100000210316 [0,2,0,0,0,0|1,0,0]=3 22363 B14R0.392 CCCCCCNCCCCCCC#N 2230a_100000210581_100009813337 [0,2,0,0,0,0|1,0,0]=3 22364 B14R0.392 CCCCCCNCCCCCCCO 2230a_100000210581_100000760002 [0,2,0,0,0,0|0,0,0]=2 22365 B14R0.392 CCCCCCNCCCCCCCO 2230a_100011996573_100000210314 [0,2,0,0,0,0|0,0,0]=2 22366 B14R0.392 CCCCCCNCCCCCCCO 34a_100011996573_100000210314 [0,2,0,0,0,0|0,0,0]=2 22367 B14R0.392 CCCCCCNCCCCCCOC 2230a_100000210581_100011998445 [0,2,0,0,0,0|0,0,0]=2 22368 B14R0.392 CCCCCCNCCCOCCCC 2230a_200000211371_100000210314 [0,2,0,0,0,0|1,0,0]=3 22369 B14R0.392 CCCCCCNCCCOCCCC 34a_200000211371_100000210314 [0,2,0,0,0,0|1,0,0]=3 22370 B14R0.392 CCCCCCNCCCOCCCO 2230a_100011310245_100000210314 [0,2,0,0,0,0|0,0,0]=2 22371 B14R0.392 CCCCCCNCCCOCCCO 34a_100011310245_100000210314 [0,2,0,0,0,0|0,0,0]=2 22372 B14R0.392 CCCCCCNCCCOCCOC 2230a_100000206027_100000210314 [0,2,0,0,0,0|1,0,0]=3 22373 B14R0.392 CCCCCCNCCCOCCOC 2230a_100000210581_100011216529 [0,2,0,0,0,0|1,0,0]=3 22374 B14R0.392 CCCCCCNCCCOCCOC 34a_100000206027_100000210314 [0,2,0,0,0,0|1,0,0]=3 22375 B14R0.392 CCCCCCNCCOCCOCC 2230a_100000210581_100011211534 [0,2,0,0,0,0|2,0,0]=4 22376 B14R0.392 CCCCCCNCCOCCOCC 2230a_100102712874_100000210314 [0,2,0,0,0,0|2,0,0]=4 22377 B14R0.392 CCCCCCNCCOCCOCC 34a_100102712874_100000210314 [0,2,0,0,0,0|2,0,0]=4 22378 B14R0.392 CCCCCCOCCCCCCC#N 7a_100000210259_100009813337 [0,2,0,0,0,0|1,0,0]=3 22379 B14R0.392 CCCCCCOCCCCCCCBr 34a_100000760002_100000210314 [0,2,0,0,0,0|1,0,0]=3 22380 B14R0.392 CCCCCCOCCCCCCCBr 7a_100000760002_100000210314 [0,2,0,0,0,0|1,0,0]=3 22381 B14R0.392 CCCCCCOCCCCCCCN 34a_100011996573_100000210314 [0,2,0,0,0,0|1,0,0]=3 22382 B14R0.392 CCCCCCOCCCCCCCO 34a_100000210259_100000760002 [0,2,0,0,0,0|0,0,0]=2 22383 B14R0.392 CCCCCCOCCCCCCCO 7a_100000210259_100000760002 [0,2,0,0,0,0|0,0,0]=2 22384 B14R0.392 CCCCCCOCCCCCCOC 34a_100000210259_100011998445 [0,2,0,0,0,0|0,0,0]=2 22385 B14R0.392 CCCCCCOCCCCCCOC 34a_200012092642_100000210314 [0,2,0,0,0,0|0,0,0]=2 22386 B14R0.392 CCCCCCOCCCCCCOC 7a_100000210259_100011998445 [0,2,0,0,0,0|0,0,0]=2 22387 B14R0.392 CCCCCCOCCCCCCOC 7a_200012092642_100000210314 [0,2,0,0,0,0|0,0,0]=2 22388 B14R0.392 CCCCCCOCCCOCCCC 34a_200011215613_100000210314 [0,2,0,0,0,0|1,0,0]=3 22389 B14R0.392 CCCCCCOCCCOCCCC 7a_200011215613_100000210314 [0,2,0,0,0,0|1,0,0]=3 22390 B14R0.392 CCCCCCOCCCOCCCN 34a_100011310245_100000210314 [0,2,0,0,0,0|1,0,0]=3 22391 B14R0.392 CCCCCCOCCCOCCOC 34a_100000210259_100011216529 [0,2,0,0,0,0|1,0,0]=3 22392 B14R0.392 CCCCCCOCCCOCCOC 7a_100000210259_100011216529 [0,2,0,0,0,0|1,0,0]=3 22393 B14R0.392 CCCCCCOCCNCCCCC 34a_100000224656_100000210314 [0,2,0,0,0,0|1,0,0]=3 22394 B14R0.392 CCCCCCOCCOCC#CCO 34a_100000691444_200000047223 [0,2,0,0,0,0|0,0,2]=4 22395 B14R0.392 CCCCCCOCCOCC#CCO 7a_100000691444_200000047223 [0,2,0,0,0,0|0,0,2]=4 22396 B14R0.392 CCCCCCOCCOCCCC#N 7a_100000691444_100000687738 [0,2,0,0,0,0|1,0,1]=4 22397 B14R0.392 CCCCCCOCCOCCCC=O 7a_100000691444_200011292268 [0,2,0,0,0,0|0,0,2]=4 22398 B14R0.392 CCCCCCOCCOCCCCC 34a_100000691444_100000718602 [0,2,0,0,0,0|1,0,0]=3 22399 B14R0.392 CCCCCCOCCOCCCCC 34a_100011215259_100000210314 [0,2,0,0,0,0|1,0,0]=3 22400 B14R0.392 CCCCCCOCCOCCCCC 7a_100000691444_100000210326 [0,2,0,0,0,0|1,0,0]=3 22401 B14R0.392 CCCCCCOCCOCCCCC 7a_100011215259_100000210314 [0,2,0,0,0,0|1,0,0]=3 22402 B14R0.392 CCCCCCOCCOCCCCF 34a_100000691444_100000729493 [0,2,0,0,0,0|1,0,0]=3 22403 B14R0.392 CCCCCCOCCOCCCCF 7a_100000691444_100000729493 [0,2,0,0,0,0|1,0,0]=3 22404 B14R0.392 CCCCCCOCCOCCCCO 34a_100000691444_100011216708 [0,2,0,0,0,0|0,0,0]=2 22405 B14R0.392 CCCCCCOCCOCCCCO 7a_100000691444_100000210776 [0,2,0,0,0,0|0,0,0]=2 22406 B14R0.392 CCCCCCOCCOCCCOC 34a_100000691444_100000740836 [0,2,0,0,0,0|1,0,0]=3 22407 B14R0.392 CCCCCCOCCOCCCOC 7a_100000691444_100000740836 [0,2,0,0,0,0|1,0,0]=3 22408 B14R0.392 CCCCCCOCCOCCOCC 34a_100000032842_100000210202 [0,2,0,0,0,0|2,0,0]=4 22409 B14R0.392 CCCCCCOCCOCCOCC 34a_100000210240_100000210314 [0,2,0,0,0,0|2,0,0]=4 22410 B14R0.392 CCCCCCOCCOCCOCC 34a_100000210259_100011211534 [0,2,0,0,0,0|2,0,0]=4 22411 B14R0.392 CCCCCCOCCOCCOCC 34a_100000691444_100000210147 [0,2,0,0,0,0|2,0,0]=4 22412 B14R0.392 CCCCCCOCCOCCOCC 7a_100000032842_100000210202 [0,2,0,0,0,0|2,0,0]=4 22413 B14R0.392 CCCCCCOCCOCCOCC 7a_100000210240_100000210314 [0,2,0,0,0,0|2,0,0]=4 22414 B14R0.392 CCCCCCOCCOCCOCC 7a_100000210259_100011211534 [0,2,0,0,0,0|2,0,0]=4 22415 B14R0.392 CCCCCCOCCOCCOCC 7a_100000691444_100011215890 [0,2,0,0,0,0|2,0,0]=4 22416 B14R0.392 CCCCCCOCCOCCOCF 34a_100000032842_100015361967 [0,2,0,0,0,0|2,0,0]=4 22417 B14R0.392 CCCCCCOCCOCCOCF 7a_100000032842_100015361967 [0,2,0,0,0,0|2,0,0]=4 22418 B14R0.392 CCCCCCOCCOCCSCC 34a_100000691444_100000757381 [0,2,0,0,0,0|2,0,0]=4 22419 B14R0.392 CCCCCCOCCOCCSCC 7a_100000691444_100000757381 [0,2,0,0,0,0|2,0,0]=4 22420 B14R0.392 CCCCCCSCCCCCCC#N 62a_100000210314_100009813337 [0,2,0,0,0,0|1,0,0]=3 22421 B14R0.392 CCCCCCSCCCCCCC#N 62a_100009813337_100000210757 [0,2,0,0,0,0|1,0,0]=3 22422 B14R0.392 CCCCCCSCCCCCCCO 62a_100000210314_100000760002 [0,2,0,0,0,0|0,0,0]=2 22423 B14R0.392 CCCCCCSCCCCCCCO 62a_100000760002_100000210757 [0,2,0,0,0,0|0,0,0]=2 22424 B14R0.392 CCCCCCSCCCCCCOC 62a_100000210314_100011998445 [0,2,0,0,0,0|0,0,0]=2 22425 B14R0.392 CCCCCCSCCCCCCOC 62a_100011998445_100000210757 [0,2,0,0,0,0|0,0,0]=2 22426 B14R0.392 CCCCCCSCCCOCCOC 62a_100000210314_100011216529 [0,2,0,0,0,0|1,0,0]=3 22427 B14R0.392 CCCCCCSCCCOCCOC 62a_100011216529_100000210757 [0,2,0,0,0,0|1,0,0]=3 22428 B14R0.392 CCCCCCSCCOCCOCC 62a_100000210314_100011211534 [0,2,0,0,0,0|2,0,0]=4 22429 B14R0.392 CCCCCCSCCOCCOCC 62a_100011211534_100000210757 [0,2,0,0,0,0|2,0,0]=4 22430 B14R0.392 CCCCCNCCCCCCCCO 2230a_100000209983_100000033203 [0,2,0,0,0,0|0,0,0]=2 22431 B14R0.392 CCCCCNCCCCCCCCO 2230a_102515433106_100000210326 [0,2,0,0,0,0|0,0,0]=2 22432 B14R0.392 CCCCCNCCCCCCCCO 34a_102515433106_100000718602 [0,2,0,0,0,0|0,0,0]=2 22433 B14R0.392 CCCCCNCCCCCCN=[N+]=[N-] 2230a_200000049180_100000210326 [0,2,0,0,0,0|2,0,0]=4 22434 B14R0.392 CCCCCNCCOCCCCCF 34a_100000224656_100000729378 [0,2,0,0,0,0|1,0,0]=3 22435 B14R0.392 CCCCCNCCOCCCCCO 34a_100000224656_100000746330 [0,2,0,0,0,0|0,0,0]=2 22436 B14R0.392 CCCCCNCCOCCCCOC 34a_100000224656_100000755781 [0,2,0,0,0,0|1,0,0]=3 22437 B14R0.392 CCCCCNCCOCCCOCC 34a_100000224656_100012232248 [0,2,0,0,0,0|2,0,0]=4 22438 B14R0.392 CCCCCNCCOCCOCCC 2230a_200011904461_100000210326 [0,2,0,0,0,0|2,0,0]=4 22439 B14R0.392 CCCCCNCCOCCOCCC 34a_100000224656_100011215938 [0,2,0,0,0,0|2,0,0]=4 22440 B14R0.392 CCCCCNCCOCCOCCC 34a_200011904461_100000718602 [0,2,0,0,0,0|2,0,0]=4 22441 B14R0.392 CCCCCNCCOCCOCCO 2230a_100000209983_100000032323 [0,2,0,0,0,0|1,0,0]=3 22442 B14R0.392 CCCCCNCCOCCOCCO 2230a_100011998139_100000210326 [0,2,0,0,0,0|1,0,0]=3 22443 B14R0.392 CCCCCNCCOCCOCCO 34a_100000224656_100000692535 [0,2,0,0,0,0|1,0,0]=3 22444 B14R0.392 CCCCCNCCOCCOCCO 34a_100011998139_100000718602 [0,2,0,0,0,0|1,0,0]=3 22445 B14R0.392 CCCCCNCCOCOCCCC 34a_100000224656_100011995733 [0,2,0,0,0,0|2,0,0]=4 22446 B14R0.392 CCCCCOCCCCCCCCBr 34a_100009813846_100000718602 [0,2,0,0,0,0|1,0,0]=3 22447 B14R0.392 CCCCCOCCCCCCCCBr 7a_100009813846_100000210326 [0,2,0,0,0,0|1,0,0]=3 22448 B14R0.392 CCCCCOCCCCCCCCCl 34a_100000033203_100000718602 [0,2,0,0,0,0|1,0,0]=3 22449 B14R0.392 CCCCCOCCCCCCCCCl 7a_100000033203_100000210326 [0,2,0,0,0,0|1,0,0]=3 22450 B14R0.392 CCCCCOCCCCCCCCN 34a_102515433106_100000718602 [0,2,0,0,0,0|1,0,0]=3 22451 B14R0.392 CCCCCOCCCCCCCCO 34a_100000210253_100000033203 [0,2,0,0,0,0|0,0,0]=2 22452 B14R0.392 CCCCCOCCCCCCCCO 7a_100000210253_100000033203 [0,2,0,0,0,0|0,0,0]=2 22453 B14R0.392 CCCCCOCCCCCNCCN 34a_103619048469_100000718602 [0,2,0,0,0,0|1,0,0]=3 22454 B14R0.392 CCCCCOCCCCNCCCC 34a_200011216965_100000718602 [0,2,0,0,0,0|1,0,0]=3 22455 B14R0.392 CCCCCOCCCCOCCCC 34a_200000760531_100000718602 [0,2,0,0,0,0|1,0,0]=3 22456 B14R0.392 CCCCCOCCCCOCCCC 7a_200000760531_100000210326 [0,2,0,0,0,0|1,0,0]=3 22457 B14R0.392 CCCCCOCCCOCCCOC 34a_200011215475_100000718602 [0,2,0,0,0,0|1,0,0]=3 22458 B14R0.392 CCCCCOCCCOCCCOC 7a_200011215475_100000210326 [0,2,0,0,0,0|1,0,0]=3 22459 B14R0.392 CCCCCOCCOCCCCC#N 7a_100011215259_100000211819 [0,2,0,0,0,0|1,0,1]=4 22460 B14R0.392 CCCCCOCCOCCCCC=O 7a_100011215259_100000139335 [0,2,0,0,0,0|0,0,2]=4 22461 B14R0.392 CCCCCOCCOCCCCCF 34a_100011215259_100000729378 [0,2,0,0,0,0|1,0,0]=3 22462 B14R0.392 CCCCCOCCOCCCCCF 7a_100011215259_100000729378 [0,2,0,0,0,0|1,0,0]=3 22463 B14R0.392 CCCCCOCCOCCCCCO 34a_100011215259_100000746330 [0,2,0,0,0,0|0,0,0]=2 22464 B14R0.392 CCCCCOCCOCCCCCO 7a_100011215259_100000746330 [0,2,0,0,0,0|0,0,0]=2 22465 B14R0.392 CCCCCOCCOCCCCOC 34a_100011215259_100000755781 [0,2,0,0,0,0|1,0,0]=3 22466 B14R0.392 CCCCCOCCOCCCCOC 7a_100011215259_100000730899 [0,2,0,0,0,0|1,0,0]=3 22467 B14R0.392 CCCCCOCCOCCCOCC 34a_100011215259_100012232248 [0,2,0,0,0,0|2,0,0]=4 22468 B14R0.392 CCCCCOCCOCCCOCC 7a_100011215259_100012232248 [0,2,0,0,0,0|2,0,0]=4 22469 B14R0.392 CCCCCOCCOCCOCCBr 34a_100010132937_100000718602 [0,2,0,0,0,0|2,0,0]=4 22470 B14R0.392 CCCCCOCCOCCOCCBr 7a_100010132937_100000210326 [0,2,0,0,0,0|2,0,0]=4 22471 B14R0.392 CCCCCOCCOCCOCCC 34a_100011215259_100011215938 [0,2,0,0,0,0|2,0,0]=4 22472 B14R0.392 CCCCCOCCOCCOCCC 7a_100011215259_100011215938 [0,2,0,0,0,0|2,0,0]=4 22473 B14R0.392 CCCCCOCCOCCOCCCl 34a_100000032323_100000718602 [0,2,0,0,0,0|2,0,0]=4 22474 B14R0.392 CCCCCOCCOCCOCCCl 7a_100000032323_100000210326 [0,2,0,0,0,0|2,0,0]=4 22475 B14R0.392 CCCCCOCCOCCOCCN 34a_100011998139_100000718602 [0,2,0,0,0,0|2,0,0]=4 22476 B14R0.392 CCCCCOCCOCCOCCO 34a_100000210253_100000032323 [0,2,0,0,0,0|1,0,0]=3 22477 B14R0.392 CCCCCOCCOCCOCCO 34a_100011215259_100000692535 [0,2,0,0,0,0|1,0,0]=3 22478 B14R0.392 CCCCCOCCOCCOCCO 7a_100000210253_100000032323 [0,2,0,0,0,0|1,0,0]=3 22479 B14R0.392 CCCCCOCCOCCOCCO 7a_100011215259_100011215305 [0,2,0,0,0,0|1,0,0]=3 22480 B14R0.392 CCCCCOCCOCOCCCC 34a_100011215259_100011995733 [0,2,0,0,0,0|2,0,0]=4 22481 B14R0.392 CCCCCSCCCCCCCCO 62a_100000033203_100000210326 [0,2,0,0,0,0|0,0,0]=2 22482 B14R0.392 CCCCCSCCCCCCCCO 62a_100000210326_100000033203 [0,2,0,0,0,0|0,0,0]=2 22483 B14R0.392 CCCCCSCCOCCOCCO 62a_100000032323_100000210326 [0,2,0,0,0,0|1,0,0]=3 22484 B14R0.392 CCCCCSCCOCCOCCO 62a_100000210326_100000032323 [0,2,0,0,0,0|1,0,0]=3 22485 B14R0.392 CCCCNCCCCCCCCCO 2230a_100000078944_100000210211 [0,2,0,0,0,0|0,0,0]=2 22486 B14R0.392 CCCCNCCCCCCCCCO 2230a_100000102301_100009813782 [0,2,0,0,0,0|0,0,0]=2 22487 B14R0.392 CCCCNCCCCCCCCCO 34a_100000078944_100000210210 [0,2,0,0,0,0|0,0,0]=2 22488 B14R0.392 CCCCNCCCCCCCCCO 7a_106832991798_100009813782 [0,2,0,0,0,0|0,0,0]=2 22489 B14R0.392 CCCCNCCCCOCC#CCO 34a_200011216965_200000047223 [0,2,0,0,0,0|0,0,2]=4 22490 B14R0.392 CCCCNCCCCOCCCCF 34a_200011216965_100000729493 [0,2,0,0,0,0|1,0,0]=3 22491 B14R0.392 CCCCNCCCCOCCCCO 34a_200011216965_100011216708 [0,2,0,0,0,0|0,0,0]=2 22492 B14R0.392 CCCCNCCCCOCCCOC 34a_200011216965_100000740836 [0,2,0,0,0,0|1,0,0]=3 22493 B14R0.392 CCCCNCCCCOCCOCC 34a_200011216965_100000210147 [0,2,0,0,0,0|2,0,0]=4 22494 B14R0.392 CCCCNCCCCOCCSCC 34a_200011216965_100000757381 [0,2,0,0,0,0|2,0,0]=4 22495 B14R0.392 CCCCNCCCOCCOCCO 2230a_100011996194_100000210211 [0,2,0,0,0,0|1,0,0]=3 22496 B14R0.392 CCCCNCCCOCCOCCO 34a_100011996194_100000210210 [0,2,0,0,0,0|1,0,0]=3 22497 B14R0.392 CCCCNCCOCCOCCOC 2230a_100000102301_100013367474 [0,2,0,0,0,0|2,0,0]=4 22498 B14R0.392 CCCCNCCOCCOCCOC 2230a_100012028300_100000210211 [0,2,0,0,0,0|2,0,0]=4 22499 B14R0.392 CCCCNCCOCCOCCOC 34a_100012028300_100000210210 [0,2,0,0,0,0|2,0,0]=4 22500 B14R0.392 CCCCNCCOCCOCCOC 7a_106832991798_100013367474 [0,2,0,0,0,0|2,0,0]=4 22501 B14R0.392 CCCCOCCCCCCCCCBr 34a_100009813782_100000210210 [0,2,0,0,0,0|1,0,0]=3 22502 B14R0.392 CCCCOCCCCCCCCCBr 7a_100009813782_100000210211 [0,2,0,0,0,0|1,0,0]=3 22503 B14R0.392 CCCCOCCCCCCCCCCl 34a_100009868337_100000210210 [0,2,0,0,0,0|1,0,0]=3 22504 B14R0.392 CCCCOCCCCCCCCCCl 7a_100009868337_100000210211 [0,2,0,0,0,0|1,0,0]=3 22505 B14R0.392 CCCCOCCCCCCCCCN 34a_100000078944_100000210210 [0,2,0,0,0,0|1,0,0]=3 22506 B14R0.392 CCCCOCCCCCCCCCO 34a_100000210227_100009813782 [0,2,0,0,0,0|0,0,0]=2 22507 B14R0.392 CCCCOCCCCCCCCCO 7a_100000210227_100009813782 [0,2,0,0,0,0|0,0,0]=2 22508 B14R0.392 CCCCOCCCCOCC#CCO 34a_200000760531_200000047223 [0,2,0,0,0,0|0,0,2]=4 22509 B14R0.392 CCCCOCCCCOCC#CCO 7a_200000760531_200000047223 [0,2,0,0,0,0|0,0,2]=4 22510 B14R0.392 CCCCOCCCCOCCCC#N 7a_200000760531_100000687738 [0,2,0,0,0,0|1,0,1]=4 22511 B14R0.392 CCCCOCCCCOCCCC=O 7a_200000760531_200011292268 [0,2,0,0,0,0|0,0,2]=4 22512 B14R0.392 CCCCOCCCCOCCCCF 34a_200000760531_100000729493 [0,2,0,0,0,0|1,0,0]=3 22513 B14R0.392 CCCCOCCCCOCCCCF 7a_200000760531_100000729493 [0,2,0,0,0,0|1,0,0]=3 22514 B14R0.392 CCCCOCCCCOCCCCO 34a_200000760531_100011216708 [0,2,0,0,0,0|0,0,0]=2 22515 B14R0.392 CCCCOCCCCOCCCCO 7a_200000760531_100000210776 [0,2,0,0,0,0|0,0,0]=2 22516 B14R0.392 CCCCOCCCCOCCCOC 34a_200000760531_100000740836 [0,2,0,0,0,0|1,0,0]=3 22517 B14R0.392 CCCCOCCCCOCCCOC 7a_200000760531_100000740836 [0,2,0,0,0,0|1,0,0]=3 22518 B14R0.392 CCCCOCCCCOCCOCC 34a_200000760531_100000210147 [0,2,0,0,0,0|2,0,0]=4 22519 B14R0.392 CCCCOCCCCOCCOCC 7a_200000760531_100011215890 [0,2,0,0,0,0|2,0,0]=4 22520 B14R0.392 CCCCOCCCCOCCSCC 34a_200000760531_100000757381 [0,2,0,0,0,0|2,0,0]=4 22521 B14R0.392 CCCCOCCCCOCCSCC 7a_200000760531_100000757381 [0,2,0,0,0,0|2,0,0]=4 22522 B14R0.392 CCCCOCCCNCCCCC#N 2230a_200000211371_100000211819 [0,2,0,0,0,0|1,0,1]=4 22523 B14R0.392 CCCCOCCCNCCCCC=O 2230a_200000211371_100000139335 [0,2,0,0,0,0|0,0,2]=4 22524 B14R0.392 CCCCOCCCNCCCCCF 2230a_200000211371_100000729378 [0,2,0,0,0,0|1,0,0]=3 22525 B14R0.392 CCCCOCCCNCCCCCF 34a_200000211371_100000729378 [0,2,0,0,0,0|1,0,0]=3 22526 B14R0.392 CCCCOCCCNCCCCCO 2230a_200000211371_100000746330 [0,2,0,0,0,0|0,0,0]=2 22527 B14R0.392 CCCCOCCCNCCCCCO 34a_200000211371_100000746330 [0,2,0,0,0,0|0,0,0]=2 22528 B14R0.392 CCCCOCCCNCCCCOC 2230a_200000211371_100000730899 [0,2,0,0,0,0|1,0,0]=3 22529 B14R0.392 CCCCOCCCNCCCCOC 34a_200000211371_100000755781 [0,2,0,0,0,0|1,0,0]=3 22530 B14R0.392 CCCCOCCCNCCCOCC 2230a_200000211371_100012232248 [0,2,0,0,0,0|2,0,0]=4 22531 B14R0.392 CCCCOCCCNCCCOCC 34a_200000211371_100012232248 [0,2,0,0,0,0|2,0,0]=4 22532 B14R0.392 CCCCOCCCNCCOCCC 2230a_200000211371_100011215938 [0,2,0,0,0,0|2,0,0]=4 22533 B14R0.392 CCCCOCCCNCCOCCC 34a_200000211371_100011215938 [0,2,0,0,0,0|2,0,0]=4 22534 B14R0.392 CCCCOCCCNCCOCCO 2230a_200000211371_100011215305 [0,2,0,0,0,0|1,0,0]=3 22535 B14R0.392 CCCCOCCCNCCOCCO 34a_200000211371_100000692535 [0,2,0,0,0,0|1,0,0]=3 22536 B14R0.392 CCCCOCCCNCOCCCC 2230a_200000211371_100011995733 [0,2,0,0,0,0|2,0,0]=4 22537 B14R0.392 CCCCOCCCNCOCCCC 34a_200000211371_100011995733 [0,2,0,0,0,0|2,0,0]=4 22538 B14R0.392 CCCCOCCCNCOCCOC 2230a_200000211371_100000231047 [0,2,0,0,0,0|2,0,0]=4 22539 B14R0.392 CCCCOCCCOCCCCC#N 7a_200011215613_100000211819 [0,2,0,0,0,0|1,0,1]=4 22540 B14R0.392 CCCCOCCCOCCCCC=O 7a_200011215613_100000139335 [0,2,0,0,0,0|0,0,2]=4 22541 B14R0.392 CCCCOCCCOCCCCCF 34a_200011215613_100000729378 [0,2,0,0,0,0|1,0,0]=3 22542 B14R0.392 CCCCOCCCOCCCCCF 7a_200011215613_100000729378 [0,2,0,0,0,0|1,0,0]=3 22543 B14R0.392 CCCCOCCCOCCCCCO 34a_200011215613_100000746330 [0,2,0,0,0,0|0,0,0]=2 22544 B14R0.392 CCCCOCCCOCCCCCO 7a_200011215613_100000746330 [0,2,0,0,0,0|0,0,0]=2 22545 B14R0.392 CCCCOCCCOCCCCOC 34a_200011215613_100000755781 [0,2,0,0,0,0|1,0,0]=3 22546 B14R0.392 CCCCOCCCOCCCCOC 7a_200011215613_100000730899 [0,2,0,0,0,0|1,0,0]=3 22547 B14R0.392 CCCCOCCCOCCCOCC 34a_200011215613_100012232248 [0,2,0,0,0,0|2,0,0]=4 22548 B14R0.392 CCCCOCCCOCCCOCC 7a_200011215613_100012232248 [0,2,0,0,0,0|2,0,0]=4 22549 B14R0.392 CCCCOCCCOCCOCCC 34a_200011215613_100011215938 [0,2,0,0,0,0|2,0,0]=4 22550 B14R0.392 CCCCOCCCOCCOCCC 7a_200011215613_100011215938 [0,2,0,0,0,0|2,0,0]=4 22551 B14R0.392 CCCCOCCCOCCOCCO 34a_200011215613_100000692535 [0,2,0,0,0,0|1,0,0]=3 22552 B14R0.392 CCCCOCCCOCCOCCO 7a_200011215613_100011215305 [0,2,0,0,0,0|1,0,0]=3 22553 B14R0.392 CCCCOCCCOCOCCCC 34a_200011215613_100011995733 [0,2,0,0,0,0|2,0,0]=4 22554 B14R0.392 CCCCOCCNCCCCCCO 2230a_100000686447_100000743108 [0,2,0,0,0,0|0,0,0]=2 22555 B14R0.392 CCCCOCCNCCCCCCO 34a_100000686447_100000743108 [0,2,0,0,0,0|0,0,0]=2 22556 B14R0.392 CCCCOCCNCCCCCOC 2230a_100000747528_100000743108 [0,2,0,0,0,0|1,0,0]=3 22557 B14R0.392 CCCCOCCNCCCCCOC 34a_100000747528_100000743108 [0,2,0,0,0,0|1,0,0]=3 22558 B14R0.392 CCCCOCCNCCCOCCC 2230a_100011217757_100000743108 [0,2,0,0,0,0|2,0,0]=4 22559 B14R0.392 CCCCOCCNCCCOCCC 34a_100011217757_100000743108 [0,2,0,0,0,0|2,0,0]=4 22560 B14R0.392 CCCCOCCNCCOCCOC 2230a_100000745349_100000743108 [0,2,0,0,0,0|2,0,0]=4 22561 B14R0.392 CCCCOCCNCCOCCOC 34a_100000745349_100000743108 [0,2,0,0,0,0|2,0,0]=4 22562 B14R0.392 CCCCOCCNCCSCCCC 2230a_100025743550_100000743108 [0,2,0,0,0,0|2,0,0]=4 22563 B14R0.392 CCCCOCCOCCCCCC#N 7a_100000210238_100009813376 [0,2,0,0,0,0|1,0,1]=4 22564 B14R0.392 CCCCOCCOCCCCCC=O 7a_100000210238_100000139337 [0,2,0,0,0,0|0,0,2]=4 22565 B14R0.392 CCCCOCCOCCCCCCBr 34a_100011215345_100000743108 [0,2,0,0,0,0|1,0,0]=3 22566 B14R0.392 CCCCOCCOCCCCCCBr 7a_100011215345_100000743108 [0,2,0,0,0,0|1,0,0]=3 22567 B14R0.392 CCCCOCCOCCCCCCCl 34a_100000766143_100000743108 [0,2,0,0,0,0|1,0,0]=3 22568 B14R0.392 CCCCOCCOCCCCCCCl 7a_100000766143_100000743108 [0,2,0,0,0,0|1,0,0]=3 22569 B14R0.392 CCCCOCCOCCCCCCF 34a_100000210238_100015922095 [0,2,0,0,0,0|1,0,0]=3 22570 B14R0.392 CCCCOCCOCCCCCCF 34a_100000732779_100000743108 [0,2,0,0,0,0|1,0,0]=3 22571 B14R0.392 CCCCOCCOCCCCCCF 7a_100000210238_100015922095 [0,2,0,0,0,0|1,0,0]=3 22572 B14R0.392 CCCCOCCOCCCCCCF 7a_100000732779_100000743108 [0,2,0,0,0,0|1,0,0]=3 22573 B14R0.392 CCCCOCCOCCCCCCN 34a_100000686447_100000743108 [0,2,0,0,0,0|1,0,0]=3 22574 B14R0.392 CCCCOCCOCCCCCCO 34a_100000210238_100000766143 [0,2,0,0,0,0|0,0,0]=2 22575 B14R0.392 CCCCOCCOCCCCCCO 7a_100000210238_100000766143 [0,2,0,0,0,0|0,0,0]=2 22576 B14R0.392 CCCCOCCOCCCCCNC 34a_100000722520_100000743108 [0,2,0,0,0,0|2,0,0]=4 22577 B14R0.392 CCCCOCCOCCOCCCC 34a_100000210238_100000743108 [0,2,0,0,0,0|2,0,0]=4 22578 B14R0.392 CCCCOCCOCCOCCCC 34a_100011215186_100000210210 [0,2,0,0,0,0|2,0,0]=4 22579 B14R0.392 CCCCOCCOCCOCCCC 7a_100000210238_100000743108 [0,2,0,0,0,0|2,0,0]=4 22580 B14R0.392 CCCCOCCOCCOCCCC 7a_100011215186_100000210211 [0,2,0,0,0,0|2,0,0]=4 22581 B14R0.392 CCCCOCCOCCOCCCF 34a_100011215186_100011934791 [0,2,0,0,0,0|2,0,0]=4 22582 B14R0.392 CCCCOCCOCCOCCCF 7a_100011215186_100011934791 [0,2,0,0,0,0|2,0,0]=4 22583 B14R0.392 CCCCOCCOCCOCCCN 34a_100011996194_100000210210 [0,2,0,0,0,0|2,0,0]=4 22584 B14R0.392 CCCCOCCOCCOCCCO 34a_100011215186_100000230001 [0,2,0,0,0,0|1,0,0]=3 22585 B14R0.392 CCCCOCCOCCOCCCO 7a_100011215186_100011215043 [0,2,0,0,0,0|1,0,0]=3 22586 B14R0.392 CCCCOCCOCCOCCOC 34a_100000210227_100013367474 [0,2,0,0,0,0|2,0,0]=4 22587 B14R0.392 CCCCOCCOCCOCCOC 34a_100000210238_100000695917 [0,2,0,0,0,0|2,0,0]=4 22588 B14R0.392 CCCCOCCOCCOCCOC 34a_100000688194_100000210210 [0,2,0,0,0,0|2,0,0]=4 22589 B14R0.392 CCCCOCCOCCOCCOC 34a_100000700218_200000210301 [0,2,0,0,0,0|2,0,0]=4 22590 B14R0.392 CCCCOCCOCCOCCOC 34a_100011215163_100000743108 [0,2,0,0,0,0|2,0,0]=4 22591 B14R0.392 CCCCOCCOCCOCCOC 34a_100011215186_100011201679 [0,2,0,0,0,0|2,0,0]=4 22592 B14R0.392 CCCCOCCOCCOCCOC 7a_100000210227_100013367474 [0,2,0,0,0,0|2,0,0]=4 22593 B14R0.392 CCCCOCCOCCOCCOC 7a_100000210238_100000695917 [0,2,0,0,0,0|2,0,0]=4 22594 B14R0.392 CCCCOCCOCCOCCOC 7a_100000688194_100000210211 [0,2,0,0,0,0|2,0,0]=4 22595 B14R0.392 CCCCOCCOCCOCCOC 7a_100000700218_200000210301 [0,2,0,0,0,0|2,0,0]=4 22596 B14R0.392 CCCCOCCOCCOCCOC 7a_100011215163_100000743108 [0,2,0,0,0,0|2,0,0]=4 22597 B14R0.392 CCCCOCCOCCOCCOC 7a_100011215186_100000233755 [0,2,0,0,0,0|2,0,0]=4 22598 B14R0.392 CCCCOCCOCCOCCO[13CH3] 34a_100000700218_200025704644 [0,2,0,0,0,0|2,0,0]=4 22599 B14R0.392 CCCCOCCOCCOCCO[13CH3] 7a_100000700218_200025704644 [0,2,0,0,0,0|2,0,0]=4 22600 B14R0.392 CCCCOCCOCCSCCCC 34a_200000230436_100000743108 [0,2,0,0,0,0|2,0,0]=4 22601 B14R0.392 CCCCOCCOCCSCCCC 7a_200000230436_100000743108 [0,2,0,0,0,0|2,0,0]=4 22602 B14R0.392 CCCCOCCSCCCCCC#N 62a_100000743108_100009813376 [0,2,0,0,0,0|1,0,1]=4 22603 B14R0.392 CCCCOCCSCCCCCC#N 62a_100009813376_100000743108 [0,2,0,0,0,0|1,0,1]=4 22604 B14R0.392 CCCCOCCSCCCCCC=O 62a_100000139337_100000743108 [0,2,0,0,0,0|0,0,2]=4 22605 B14R0.392 CCCCOCCSCCCCCC=O 62a_100000743108_100000139337 [0,2,0,0,0,0|0,0,2]=4 22606 B14R0.392 CCCCOCCSCCCCCCF 62a_100000743108_100015922095 [0,2,0,0,0,0|1,0,0]=3 22607 B14R0.392 CCCCOCCSCCCCCCF 62a_100015922095_100000743108 [0,2,0,0,0,0|1,0,0]=3 22608 B14R0.392 CCCCOCCSCCCCCCO 62a_100000743108_100000766143 [0,2,0,0,0,0|0,0,0]=2 22609 B14R0.392 CCCCOCCSCCCCCCO 62a_100000766143_100000743108 [0,2,0,0,0,0|0,0,0]=2 22610 B14R0.392 CCCCOCCSCCOCCCC 62a_100000743108_100000743108 [0,2,0,0,0,0|2,0,0]=4 22611 B14R0.392 CCCCOCCSCCOCCOC 62a_100000695917_100000743108 [0,2,0,0,0,0|2,0,0]=4 22612 B14R0.392 CCCCOCCSCCOCCOC 62a_100000743108_100000695917 [0,2,0,0,0,0|2,0,0]=4 22613 B14R0.392 CCCCOCNCCCCCCCO 2230a_100011996573_100011995733 [0,2,0,0,0,0|0,0,0]=2 22614 B14R0.392 CCCCOCNCCCCCCCO 34a_100011996573_100011995733 [0,2,0,0,0,0|0,0,0]=2 22615 B14R0.392 CCCCOCNCCCOCCCO 2230a_100011310245_100011995733 [0,2,0,0,0,0|1,0,0]=3 22616 B14R0.392 CCCCOCNCCCOCCCO 34a_100011310245_100011995733 [0,2,0,0,0,0|1,0,0]=3 22617 B14R0.392 CCCCOCNCCCOCCOC 2230a_100000206027_100011995733 [0,2,0,0,0,0|2,0,0]=4 22618 B14R0.392 CCCCOCNCCCOCCOC 34a_100000206027_100011995733 [0,2,0,0,0,0|2,0,0]=4 22619 B14R0.392 CCCCOCOCCCCCCCBr 34a_100000760002_100011995733 [0,2,0,0,0,0|1,0,0]=3 22620 B14R0.392 CCCCOCOCCCCCCCN 34a_100011996573_100011995733 [0,2,0,0,0,0|1,0,0]=3 22621 B14R0.392 CCCCOCOCCCCCCOC 34a_200012092642_100011995733 [0,2,0,0,0,0|1,0,0]=3 22622 B14R0.392 CCCCOCOCCCOCCCN 34a_100011310245_100011995733 [0,2,0,0,0,0|2,0,0]=4 22623 B14R0.392 CCCCOCSCCCCCCC#N 62a_100009813337_100011995733 [0,2,0,0,0,0|1,0,1]=4 22624 B14R0.392 CCCCOCSCCCCCCC#N 62a_100011995733_100009813337 [0,2,0,0,0,0|1,0,1]=4 22625 B14R0.392 CCCCOCSCCCCCCCO 62a_100000760002_100011995733 [0,2,0,0,0,0|0,0,0]=2 22626 B14R0.392 CCCCOCSCCCCCCCO 62a_100011995733_100000760002 [0,2,0,0,0,0|0,0,0]=2 22627 B14R0.392 CCCCOCSCCCCCCOC 62a_100011995733_100011998445 [0,2,0,0,0,0|1,0,0]=3 22628 B14R0.392 CCCCOCSCCCCCCOC 62a_100011998445_100011995733 [0,2,0,0,0,0|1,0,0]=3 22629 B14R0.392 CCCCOCSCCCOCCOC 62a_100011216529_100011995733 [0,2,0,0,0,0|2,0,0]=4 22630 B14R0.392 CCCCOCSCCCOCCOC 62a_100011995733_100011216529 [0,2,0,0,0,0|2,0,0]=4 22631 B14R0.392 CCCCSCCCCCCCCCO 62a_100000210211_100009813782 [0,2,0,0,0,0|0,0,0]=2 22632 B14R0.392 CCCCSCCCCCCCCCO 62a_100009813782_100000210210 [0,2,0,0,0,0|0,0,0]=2 22633 B14R0.392 CCCCSCCNCCCCCC#N 2230a_100025743550_100009813376 [0,2,0,0,0,0|1,0,1]=4 22634 B14R0.392 CCCCSCCNCCCCCC=O 2230a_100025743550_100000139337 [0,2,0,0,0,0|0,0,2]=4 22635 B14R0.392 CCCCSCCNCCCCCCF 2230a_100025743550_100015922095 [0,2,0,0,0,0|1,0,0]=3 22636 B14R0.392 CCCCSCCNCCCCCCO 2230a_100025743550_100000766143 [0,2,0,0,0,0|0,0,0]=2 22637 B14R0.392 CCCCSCCNCCOCCOC 2230a_100025743550_100000695917 [0,2,0,0,0,0|2,0,0]=4 22638 B14R0.392 CCCCSCCOCCCCCC#N 7a_200000230436_100009813376 [0,2,0,0,0,0|1,0,1]=4 22639 B14R0.392 CCCCSCCOCCCCCC=O 7a_200000230436_100000139337 [0,2,0,0,0,0|0,0,2]=4 22640 B14R0.392 CCCCSCCOCCCCCCF 34a_200000230436_100015922095 [0,2,0,0,0,0|1,0,0]=3 22641 B14R0.392 CCCCSCCOCCCCCCF 7a_200000230436_100015922095 [0,2,0,0,0,0|1,0,0]=3 22642 B14R0.392 CCCCSCCOCCCCCCO 34a_200000230436_100000766143 [0,2,0,0,0,0|0,0,0]=2 22643 B14R0.392 CCCCSCCOCCCCCCO 7a_200000230436_100000766143 [0,2,0,0,0,0|0,0,0]=2 22644 B14R0.392 CCCCSCCOCCOCCOC 34a_200000230436_100000695917 [0,2,0,0,0,0|2,0,0]=4 22645 B14R0.392 CCCCSCCOCCOCCOC 62a_100000210211_100013367474 [0,2,0,0,0,0|2,0,0]=4 22646 B14R0.392 CCCCSCCOCCOCCOC 62a_100013367474_100000210210 [0,2,0,0,0,0|2,0,0]=4 22647 B14R0.392 CCCCSCCOCCOCCOC 7a_200000230436_100000695917 [0,2,0,0,0,0|2,0,0]=4 22648 B14R0.392 CCCNCCCCCCCCCCO 2230a_100000066964_100000210303 [0,2,0,0,0,0|0,0,0]=2 22649 B14R0.392 CCCNCCCCCCCCCCO 34a_100000066964_100000210303 [0,2,0,0,0,0|0,0,0]=2 22650 B14R0.392 CCCOCCCCCCCCCCBr 34a_100009813290_100000210303 [0,2,0,0,0,0|1,0,0]=3 22651 B14R0.392 CCCOCCCCCCCCCCBr 7a_100009813290_100000210303 [0,2,0,0,0,0|1,0,0]=3 22652 B14R0.392 CCCOCCCCCCCCCCCl 34a_200000033068_100000210303 [0,2,0,0,0,0|1,0,0]=3 22653 B14R0.392 CCCOCCCCCCCCCCCl 7a_200000033068_100000210303 [0,2,0,0,0,0|1,0,0]=3 22654 B14R0.392 CCCOCCCCCCCCCCN 34a_100000066964_100000210303 [0,2,0,0,0,0|1,0,0]=3 22655 B14R0.392 CCCOCCCCCCCCCCO 34a_100000210258_100009813290 [0,2,0,0,0,0|0,0,0]=2 22656 B14R0.392 CCCOCCCNCCCCCC#N 2230a_100011217757_100009813376 [0,2,0,0,0,0|1,0,1]=4 22657 B14R0.392 CCCOCCCNCCCCCC=O 2230a_100011217757_100000139337 [0,2,0,0,0,0|0,0,2]=4 22658 B14R0.392 CCCOCCCNCCCCCCF 2230a_100011217757_100015922095 [0,2,0,0,0,0|1,0,0]=3 22659 B14R0.392 CCCOCCCNCCCCCCF 34a_100011217757_100015922095 [0,2,0,0,0,0|1,0,0]=3 22660 B14R0.392 CCCOCCCNCCCCCCO 2230a_100011217757_100000766143 [0,2,0,0,0,0|0,0,0]=2 22661 B14R0.392 CCCOCCCNCCCCCCO 34a_100011217757_100000766143 [0,2,0,0,0,0|0,0,0]=2 22662 B14R0.392 CCCOCCCNCCOCCOC 2230a_100011217757_100000695917 [0,2,0,0,0,0|2,0,0]=4 22663 B14R0.392 CCCOCCCNCCOCCOC 34a_100011217757_100000695917 [0,2,0,0,0,0|2,0,0]=4 22664 B14R0.392 CCCOCCNCCCCCCC#N 2230a_100161115042_100009813337 [0,2,0,0,0,0|1,0,1]=4 22665 B14R0.392 CCCOCCNCCCCCCCO 2230a_100011996573_100011215938 [0,2,0,0,0,0|0,0,0]=2 22666 B14R0.392 CCCOCCNCCCCCCCO 2230a_100161115042_100000760002 [0,2,0,0,0,0|0,0,0]=2 22667 B14R0.392 CCCOCCNCCCCCCCO 34a_100011996573_100011215938 [0,2,0,0,0,0|0,0,0]=2 22668 B14R0.392 CCCOCCNCCCCCCCO 34a_100161115042_100000760002 [0,2,0,0,0,0|0,0,0]=2 22669 B14R0.392 CCCOCCNCCCCCCOC 2230a_100161115042_100011998445 [0,2,0,0,0,0|1,0,0]=3 22670 B14R0.392 CCCOCCNCCCCCCOC 34a_100161115042_100011998445 [0,2,0,0,0,0|1,0,0]=3 22671 B14R0.392 CCCOCCNCCCOCCCO 2230a_100011310245_100011215938 [0,2,0,0,0,0|1,0,0]=3 22672 B14R0.392 CCCOCCNCCCOCCCO 34a_100011310245_100011215938 [0,2,0,0,0,0|1,0,0]=3 22673 B14R0.392 CCCOCCNCCCOCCOC 2230a_100000206027_100011215938 [0,2,0,0,0,0|2,0,0]=4 22674 B14R0.392 CCCOCCNCCCOCCOC 2230a_100161115042_100011216529 [0,2,0,0,0,0|2,0,0]=4 22675 B14R0.392 CCCOCCNCCCOCCOC 34a_100000206027_100011215938 [0,2,0,0,0,0|2,0,0]=4 22676 B14R0.392 CCCOCCNCCCOCCOC 34a_100161115042_100011216529 [0,2,0,0,0,0|2,0,0]=4 22677 B14R0.392 CCCOCCOCCCCCCC#N 7a_100000752267_100009813337 [0,2,0,0,0,0|1,0,1]=4 22678 B14R0.392 CCCOCCOCCCCCCCBr 34a_100000760002_100011215938 [0,2,0,0,0,0|1,0,0]=3 22679 B14R0.392 CCCOCCOCCCCCCCBr 7a_100000760002_100011215938 [0,2,0,0,0,0|1,0,0]=3 22680 B14R0.392 CCCOCCOCCCCCCCN 34a_100011996573_100011215938 [0,2,0,0,0,0|1,0,0]=3 22681 B14R0.392 CCCOCCOCCCCCCCO 34a_100000752267_100000760002 [0,2,0,0,0,0|0,0,0]=2 22682 B14R0.392 CCCOCCOCCCCCCCO 7a_100000752267_100000760002 [0,2,0,0,0,0|0,0,0]=2 22683 B14R0.392 CCCOCCOCCCCCCOC 34a_100000752267_100011998445 [0,2,0,0,0,0|1,0,0]=3 22684 B14R0.392 CCCOCCOCCCCCCOC 34a_200012092642_100011215938 [0,2,0,0,0,0|1,0,0]=3 22685 B14R0.392 CCCOCCOCCCCCCOC 7a_100000752267_100011998445 [0,2,0,0,0,0|1,0,0]=3 22686 B14R0.392 CCCOCCOCCCCCCOC 7a_200012092642_100011215938 [0,2,0,0,0,0|1,0,0]=3 22687 B14R0.392 CCCOCCOCCCOCCCN 34a_100011310245_100011215938 [0,2,0,0,0,0|2,0,0]=4 22688 B14R0.392 CCCOCCOCCCOCCOC 34a_100000752267_100011216529 [0,2,0,0,0,0|2,0,0]=4 22689 B14R0.392 CCCOCCOCCCOCCOC 7a_100000752267_100011216529 [0,2,0,0,0,0|2,0,0]=4 22690 B14R0.392 CCCOCCOCCNCCCCF 2230a_200011904461_100000729493 [0,2,0,0,0,0|2,0,0]=4 22691 B14R0.392 CCCOCCOCCNCCCCF 34a_200011904461_100000729493 [0,2,0,0,0,0|2,0,0]=4 22692 B14R0.392 CCCOCCOCCNCCCCO 2230a_200011904461_100000210776 [0,2,0,0,0,0|1,0,0]=3 22693 B14R0.392 CCCOCCOCCNCCCCO 34a_200011904461_100011216708 [0,2,0,0,0,0|1,0,0]=3 22694 B14R0.392 CCCOCCOCCNCCCOC 2230a_200011904461_100000740836 [0,2,0,0,0,0|2,0,0]=4 22695 B14R0.392 CCCOCCOCCNCCCOC 34a_200011904461_100000740836 [0,2,0,0,0,0|2,0,0]=4 22696 B14R0.392 CCCOCCSCCCCCCC#N 62a_100009813337_100011215938 [0,2,0,0,0,0|1,0,1]=4 22697 B14R0.392 CCCOCCSCCCCCCC#N 62a_100011215938_100009813337 [0,2,0,0,0,0|1,0,1]=4 22698 B14R0.392 CCCOCCSCCCCCCCO 62a_100000760002_100011215938 [0,2,0,0,0,0|0,0,0]=2 22699 B14R0.392 CCCOCCSCCCCCCCO 62a_100011215938_100000760002 [0,2,0,0,0,0|0,0,0]=2 22700 B14R0.392 CCCOCCSCCCCCCOC 62a_100011215938_100011998445 [0,2,0,0,0,0|1,0,0]=3 22701 B14R0.392 CCCOCCSCCCCCCOC 62a_100011998445_100011215938 [0,2,0,0,0,0|1,0,0]=3 22702 B14R0.392 CCCOCCSCCCOCCOC 62a_100011215938_100011216529 [0,2,0,0,0,0|2,0,0]=4 22703 B14R0.392 CCCOCCSCCCOCCOC 62a_100011216529_100011215938 [0,2,0,0,0,0|2,0,0]=4 22704 B14R0.392 CCCSCCCCCCCCCCO 62a_100000210303_200000033068 [0,2,0,0,0,0|0,0,0]=2 22705 B14R0.392 CCCSCCCCCCCCCCO 62a_100009813290_100000210303 [0,2,0,0,0,0|0,0,0]=2 22706 B14R0.392 CCCSCCNCCCCCCC#N 2230a_100020603323_100009813337 [0,2,0,0,0,0|1,0,1]=4 22707 B14R0.392 CCCSCCNCCCCCCCO 2230a_100020603323_100000760002 [0,2,0,0,0,0|0,0,0]=2 22708 B14R0.392 CCCSCCNCCCCCCOC 2230a_100020603323_100011998445 [0,2,0,0,0,0|1,0,0]=3 22709 B14R0.392 CCCSCCNCCCOCCOC 2230a_100020603323_100011216529 [0,2,0,0,0,0|2,0,0]=4 22710 B14R0.392 CCCSCCOCCCCCCC#N 7a_200000230433_100009813337 [0,2,0,0,0,0|1,0,1]=4 22711 B14R0.392 CCCSCCOCCCCCCCO 34a_200000230433_100000760002 [0,2,0,0,0,0|0,0,0]=2 22712 B14R0.392 CCCSCCOCCCCCCCO 7a_200000230433_100000760002 [0,2,0,0,0,0|0,0,0]=2 22713 B14R0.392 CCCSCCOCCCCCCOC 34a_200000230433_100011998445 [0,2,0,0,0,0|1,0,0]=3 22714 B14R0.392 CCCSCCOCCCCCCOC 7a_200000230433_100011998445 [0,2,0,0,0,0|1,0,0]=3 22715 B14R0.392 CCCSCCOCCCOCCOC 34a_200000230433_100011216529 [0,2,0,0,0,0|2,0,0]=4 22716 B14R0.392 CCCSCCOCCCOCCOC 7a_200000230433_100011216529 [0,2,0,0,0,0|2,0,0]=4 22717 B14R0.392 CCNCCCCCCCCCCCO 2230a_100015525214_100009812471 [0,2,0,0,0,0|0,0,0]=2 22718 B14R0.392 CCNCCOCCOCCOCCO 2230a_100015525214_100010166562 [0,2,0,0,0,0|2,0,0]=4 22719 B14R0.392 CCNCCOCCOCCOCCO 2230a_103437854208_100000210202 [0,2,0,0,0,0|2,0,0]=4 22720 B14R0.392 CCNCCOCCOCCOCCO 34a_103437854208_100000210202 [0,2,0,0,0,0|2,0,0]=4 22721 B14R0.392 CCOCCCCCCCCCCCBr 34a_100009812471_100000210202 [0,2,0,0,0,0|1,0,0]=3 22722 B14R0.392 CCOCCCCCCCCCCCBr 7a_100009812471_100000210202 [0,2,0,0,0,0|1,0,0]=3 22723 B14R0.392 CCOCCCCCCCCCCCO 34a_100121572206_100009812471 [0,2,0,0,0,0|0,0,0]=2 22724 B14R0.392 CCOCCCCCCCCCOCC 34a_100009875440_100000210202 [0,2,0,0,0,0|1,0,0]=3 22725 B14R0.392 CCOCCCCCCCCCOCC 7a_100009875440_100000210202 [0,2,0,0,0,0|1,0,0]=3 22726 B14R0.392 CCOCCCCCCCCCOCF 34a_100009875440_100015361967 [0,2,0,0,0,0|1,0,0]=3 22727 B14R0.392 CCOCCCCCCCCCOCF 7a_100009875440_100015361967 [0,2,0,0,0,0|1,0,0]=3 22728 B14R0.392 CCOCCCNCCCCCCC#N 2230a_100000210961_100009813337 [0,2,0,0,0,0|1,0,1]=4 22729 B14R0.392 CCOCCCNCCCCCCCO 2230a_100000210961_100000760002 [0,2,0,0,0,0|0,0,0]=2 22730 B14R0.392 CCOCCCNCCCCCCCO 2230a_100011996573_100012232248 [0,2,0,0,0,0|0,0,0]=2 22731 B14R0.392 CCOCCCNCCCCCCCO 34a_100000210961_100000760002 [0,2,0,0,0,0|0,0,0]=2 22732 B14R0.392 CCOCCCNCCCCCCCO 34a_100011996573_100012232248 [0,2,0,0,0,0|0,0,0]=2 22733 B14R0.392 CCOCCCNCCCCCCOC 2230a_100000210961_100011998445 [0,2,0,0,0,0|1,0,0]=3 22734 B14R0.392 CCOCCCNCCCCCCOC 34a_100000210961_100011998445 [0,2,0,0,0,0|1,0,0]=3 22735 B14R0.392 CCOCCCNCCCOCCCO 2230a_100011310245_100012232248 [0,2,0,0,0,0|1,0,0]=3 22736 B14R0.392 CCOCCCNCCCOCCCO 34a_100011310245_100012232248 [0,2,0,0,0,0|1,0,0]=3 22737 B14R0.392 CCOCCCNCCCOCCOC 2230a_100000206027_100012232248 [0,2,0,0,0,0|2,0,0]=4 22738 B14R0.392 CCOCCCNCCCOCCOC 2230a_100000210961_100011216529 [0,2,0,0,0,0|2,0,0]=4 22739 B14R0.392 CCOCCCNCCCOCCOC 34a_100000206027_100012232248 [0,2,0,0,0,0|2,0,0]=4 22740 B14R0.392 CCOCCCNCCCOCCOC 34a_100000210961_100011216529 [0,2,0,0,0,0|2,0,0]=4 22741 B14R0.392 CCOCCCOCCCCCCC#N 7a_100000757476_100009813337 [0,2,0,0,0,0|1,0,1]=4 22742 B14R0.392 CCOCCCOCCCCCCCBr 34a_100000760002_100012232248 [0,2,0,0,0,0|1,0,0]=3 22743 B14R0.392 CCOCCCOCCCCCCCBr 7a_100000760002_100012232248 [0,2,0,0,0,0|1,0,0]=3 22744 B14R0.392 CCOCCCOCCCCCCCN 34a_100011996573_100012232248 [0,2,0,0,0,0|1,0,0]=3 22745 B14R0.392 CCOCCCOCCCCCCCO 34a_100000757476_100000760002 [0,2,0,0,0,0|0,0,0]=2 22746 B14R0.392 CCOCCCOCCCCCCCO 7a_100000757476_100000760002 [0,2,0,0,0,0|0,0,0]=2 22747 B14R0.392 CCOCCCOCCCCCCOC 34a_100000757476_100011998445 [0,2,0,0,0,0|1,0,0]=3 22748 B14R0.392 CCOCCCOCCCCCCOC 34a_200012092642_100012232248 [0,2,0,0,0,0|1,0,0]=3 22749 B14R0.392 CCOCCCOCCCCCCOC 7a_100000757476_100011998445 [0,2,0,0,0,0|1,0,0]=3 22750 B14R0.392 CCOCCCOCCCCCCOC 7a_200012092642_100012232248 [0,2,0,0,0,0|1,0,0]=3 22751 B14R0.392 CCOCCCOCCCOCCCN 34a_100011310245_100012232248 [0,2,0,0,0,0|2,0,0]=4 22752 B14R0.392 CCOCCCOCCCOCCOC 34a_100000757476_100011216529 [0,2,0,0,0,0|2,0,0]=4 22753 B14R0.392 CCOCCCOCCCOCCOC 7a_100000757476_100011216529 [0,2,0,0,0,0|2,0,0]=4 22754 B14R0.392 CCOCCCSCCCCCCC#N 62a_100009813337_100012232248 [0,2,0,0,0,0|1,0,1]=4 22755 B14R0.392 CCOCCCSCCCCCCC#N 62a_100012232248_100009813337 [0,2,0,0,0,0|1,0,1]=4 22756 B14R0.392 CCOCCCSCCCCCCCO 62a_100000760002_100012232248 [0,2,0,0,0,0|0,0,0]=2 22757 B14R0.392 CCOCCCSCCCCCCCO 62a_100012232248_100000760002 [0,2,0,0,0,0|0,0,0]=2 22758 B14R0.392 CCOCCCSCCCCCCOC 62a_100011998445_100012232248 [0,2,0,0,0,0|1,0,0]=3 22759 B14R0.392 CCOCCCSCCCCCCOC 62a_100012232248_100011998445 [0,2,0,0,0,0|1,0,0]=3 22760 B14R0.392 CCOCCCSCCCOCCOC 62a_100011216529_100012232248 [0,2,0,0,0,0|2,0,0]=4 22761 B14R0.392 CCOCCCSCCCOCCOC 62a_100012232248_100011216529 [0,2,0,0,0,0|2,0,0]=4 22762 B14R0.392 CCOCCNCCCCCCCCO 2230a_102515433106_100011215890 [0,2,0,0,0,0|0,0,0]=2 22763 B14R0.392 CCOCCNCCCCCCCCO 2230a_102516460346_100000033203 [0,2,0,0,0,0|0,0,0]=2 22764 B14R0.392 CCOCCNCCCCCCCCO 34a_102515433106_100000210147 [0,2,0,0,0,0|0,0,0]=2 22765 B14R0.392 CCOCCNCCCCCCCCO 34a_102516460346_100000033203 [0,2,0,0,0,0|0,0,0]=2 22766 B14R0.392 CCOCCNCCOCCOCCO 2230a_100011998139_100011215890 [0,2,0,0,0,0|2,0,0]=4 22767 B14R0.392 CCOCCNCCOCCOCCO 2230a_102516460346_100000032323 [0,2,0,0,0,0|2,0,0]=4 22768 B14R0.392 CCOCCNCCOCCOCCO 34a_100011998139_100000210147 [0,2,0,0,0,0|2,0,0]=4 22769 B14R0.392 CCOCCNCCOCCOCCO 34a_102516460346_100000032323 [0,2,0,0,0,0|2,0,0]=4 22770 B14R0.392 CCOCCOCCCCCCCCBr 34a_100009813846_100000210147 [0,2,0,0,0,0|1,0,0]=3 22771 B14R0.392 CCOCCOCCCCCCCCBr 7a_100009813846_100011215890 [0,2,0,0,0,0|1,0,0]=3 22772 B14R0.392 CCOCCOCCCCCCCCCl 34a_100000033203_100000210147 [0,2,0,0,0,0|1,0,0]=3 22773 B14R0.392 CCOCCOCCCCCCCCCl 7a_100000033203_100011215890 [0,2,0,0,0,0|1,0,0]=3 22774 B14R0.392 CCOCCOCCCCCCCCN 34a_102515433106_100000210147 [0,2,0,0,0,0|1,0,0]=3 22775 B14R0.392 CCOCCOCCCCCCCCO 34a_100000210136_100000033203 [0,2,0,0,0,0|0,0,0]=2 22776 B14R0.392 CCOCCOCCCCCCCCO 7a_100000210136_100000033203 [0,2,0,0,0,0|0,0,0]=2 22777 B14R0.392 CCOCCOCCCCCNCCN 34a_103619048469_100000210147 [0,2,0,0,0,0|2,0,0]=4 22778 B14R0.392 CCOCCOCCCOCCCOC 34a_200011215475_100000210147 [0,2,0,0,0,0|2,0,0]=4 22779 B14R0.392 CCOCCOCCCOCCCOC 7a_200011215475_100011215890 [0,2,0,0,0,0|2,0,0]=4 22780 B14R0.392 CCOCCOCCNCCCCCF 2230a_100102712874_100000729378 [0,2,0,0,0,0|2,0,0]=4 22781 B14R0.392 CCOCCOCCNCCCCCF 34a_100102712874_100000729378 [0,2,0,0,0,0|2,0,0]=4 22782 B14R0.392 CCOCCOCCNCCCCCO 2230a_100000762737_100011211534 [0,2,0,0,0,0|1,0,0]=3 22783 B14R0.392 CCOCCOCCNCCCCCO 2230a_100102712874_100000746330 [0,2,0,0,0,0|1,0,0]=3 22784 B14R0.392 CCOCCOCCNCCCCCO 34a_100000762737_100011211534 [0,2,0,0,0,0|1,0,0]=3 22785 B14R0.392 CCOCCOCCNCCCCCO 34a_100102712874_100000746330 [0,2,0,0,0,0|1,0,0]=3 22786 B14R0.392 CCOCCOCCNCCCCOC 2230a_100102712874_100000730899 [0,2,0,0,0,0|2,0,0]=4 22787 B14R0.392 CCOCCOCCNCCCCOC 34a_100102712874_100000755781 [0,2,0,0,0,0|2,0,0]=4 22788 B14R0.392 CCOCCOCCNCCOCCO 2230a_100000211614_100011211534 [0,2,0,0,0,0|2,0,0]=4 22789 B14R0.392 CCOCCOCCNCCOCCO 2230a_100102712874_100011215305 [0,2,0,0,0,0|2,0,0]=4 22790 B14R0.392 CCOCCOCCNCCOCCO 34a_100000211614_100011211534 [0,2,0,0,0,0|2,0,0]=4 22791 B14R0.392 CCOCCOCCNCCOCCO 34a_100102712874_100000692535 [0,2,0,0,0,0|2,0,0]=4 22792 B14R0.392 CCOCCOCCNCCSCCO 2230a_100011219999_100011211534 [0,2,0,0,0,0|2,0,0]=4 22793 B14R0.392 CCOCCOCCOCCCCCBr 34a_100000746331_100011211534 [0,2,0,0,0,0|2,0,0]=4 22794 B14R0.392 CCOCCOCCOCCCCCBr 7a_100000746331_100011211534 [0,2,0,0,0,0|2,0,0]=4 22795 B14R0.392 CCOCCOCCOCCCCCCl 34a_100000746330_100011211534 [0,2,0,0,0,0|2,0,0]=4 22796 B14R0.392 CCOCCOCCOCCCCCCl 7a_100000746330_100011211534 [0,2,0,0,0,0|2,0,0]=4 22797 B14R0.392 CCOCCOCCOCCCCCF 34a_100000210240_100000729378 [0,2,0,0,0,0|2,0,0]=4 22798 B14R0.392 CCOCCOCCOCCCCCF 7a_100000210240_100000729378 [0,2,0,0,0,0|2,0,0]=4 22799 B14R0.392 CCOCCOCCOCCCCCI 34a_200012148887_100011211534 [0,2,0,0,0,0|2,0,0]=4 22800 B14R0.392 CCOCCOCCOCCCCCI 7a_200012148887_100011211534 [0,2,0,0,0,0|2,0,0]=4 22801 B14R0.392 CCOCCOCCOCCCCCN 34a_100000762737_100011211534 [0,2,0,0,0,0|2,0,0]=4 22802 B14R0.392 CCOCCOCCOCCCCCO 34a_100000210240_100000746330 [0,2,0,0,0,0|1,0,0]=3 22803 B14R0.392 CCOCCOCCOCCCCCO 7a_100000210240_100000746330 [0,2,0,0,0,0|1,0,0]=3 22804 B14R0.392 CCOCCOCCOCCCCOC 34a_100000210240_100000755781 [0,2,0,0,0,0|2,0,0]=4 22805 B14R0.392 CCOCCOCCOCCCCOC 34a_100000740925_100011211534 [0,2,0,0,0,0|2,0,0]=4 22806 B14R0.392 CCOCCOCCOCCCCOC 7a_100000210240_100000730899 [0,2,0,0,0,0|2,0,0]=4 22807 B14R0.392 CCOCCOCCOCCNCCO 2230a_100012282185_100000211926 [0,2,0,0,0,0|2,0,0]=4 22808 B14R0.392 CCOCCOCCOCCNCCO 34a_100012282185_100000211926 [0,2,0,0,0,0|2,0,0]=4 22809 B14R0.392 CCOCCOCCOCCOCCO 34a_100000033264_100000211926 [0,2,0,0,0,0|2,0,0]=4 22810 B14R0.392 CCOCCOCCOCCOCCO 34a_100000210136_100000032323 [0,2,0,0,0,0|2,0,0]=4 22811 B14R0.392 CCOCCOCCOCCOCCO 34a_100000210240_100000692535 [0,2,0,0,0,0|2,0,0]=4 22812 B14R0.392 CCOCCOCCOCCOCCO 34a_100121572206_100010166562 [0,2,0,0,0,0|2,0,0]=4 22813 B14R0.392 CCOCCOCCOCCOCCO 7a_100000033264_100000211926 [0,2,0,0,0,0|2,0,0]=4 22814 B14R0.392 CCOCCOCCOCCOCCO 7a_100000210136_100000032323 [0,2,0,0,0,0|2,0,0]=4 22815 B14R0.392 CCOCCOCCOCCOCCO 7a_100000210240_100011215305 [0,2,0,0,0,0|2,0,0]=4 22816 B14R0.392 CCOCCOCCSCCCCCF 62a_100000729378_100011211534 [0,2,0,0,0,0|2,0,0]=4 22817 B14R0.392 CCOCCOCCSCCCCCF 62a_100011211534_100000729378 [0,2,0,0,0,0|2,0,0]=4 22818 B14R0.392 CCOCCOCCSCCCCCO 62a_100000746330_100011211534 [0,2,0,0,0,0|1,0,0]=3 22819 B14R0.392 CCOCCOCCSCCCCCO 62a_100011211534_100000746330 [0,2,0,0,0,0|1,0,0]=3 22820 B14R0.392 CCOCCOCCSCCCCOC 62a_100000730899_100011211534 [0,2,0,0,0,0|2,0,0]=4 22821 B14R0.392 CCOCCOCCSCCCCOC 62a_100011211534_100000730899 [0,2,0,0,0,0|2,0,0]=4 22822 B14R0.392 CCOCCOCCSCCOCCO 62a_100011211534_100011215305 [0,2,0,0,0,0|2,0,0]=4 22823 B14R0.392 CCOCCOCCSCCOCCO 62a_100011215305_100011211534 [0,2,0,0,0,0|2,0,0]=4 22824 B14R0.392 CCOCCSCCCCCCCCO 62a_100000033203_100011215890 [0,2,0,0,0,0|0,0,0]=2 22825 B14R0.392 CCOCCSCCCCCCCCO 62a_100000210147_100000033203 [0,2,0,0,0,0|0,0,0]=2 22826 B14R0.392 CCOCCSCCOCCOCCO 62a_100000032323_100011215890 [0,2,0,0,0,0|2,0,0]=4 22827 B14R0.392 CCOCCSCCOCCOCCO 62a_100000210147_100000032323 [0,2,0,0,0,0|2,0,0]=4 22828 B14R0.392 CCOCSCCCCCCCCCO 62a_100000739092_100009813782 [0,2,0,0,0,0|0,0,0]=2 22829 B14R0.392 CCOCSCCCCCCCCCO 62a_100009813782_100000739092 [0,2,0,0,0,0|0,0,0]=2 22830 B14R0.392 CCSCCCCCCCCCCCO 62a_100009812471_100000210202 [0,2,0,0,0,0|0,0,0]=2 22831 B14R0.392 CCSCCCOCCCCCCC#N 7a_100011216438_100009813337 [0,2,0,0,0,0|1,0,1]=4 22832 B14R0.392 CCSCCCOCCCCCCCO 34a_100011216438_100000760002 [0,2,0,0,0,0|0,0,0]=2 22833 B14R0.392 CCSCCCOCCCCCCCO 7a_100011216438_100000760002 [0,2,0,0,0,0|0,0,0]=2 22834 B14R0.392 CCSCCCOCCCCCCOC 34a_100011216438_100011998445 [0,2,0,0,0,0|1,0,0]=3 22835 B14R0.392 CCSCCCOCCCCCCOC 7a_100011216438_100011998445 [0,2,0,0,0,0|1,0,0]=3 22836 B14R0.392 CCSCCCOCCCOCCOC 34a_100011216438_100011216529 [0,2,0,0,0,0|2,0,0]=4 22837 B14R0.392 CCSCCCOCCCOCCOC 7a_100011216438_100011216529 [0,2,0,0,0,0|2,0,0]=4 22838 B14R0.392 CCSCCNCCCCCCCCO 2230a_100000106463_100000033203 [0,2,0,0,0,0|0,0,0]=2 22839 B14R0.392 CCSCCNCCCCCCCCO 2230a_102515433106_100000757381 [0,2,0,0,0,0|0,0,0]=2 22840 B14R0.392 CCSCCNCCCCCCCCO 34a_102515433106_100000757381 [0,2,0,0,0,0|0,0,0]=2 22841 B14R0.392 CCSCCNCCOCCOCCO 2230a_100000106463_100000032323 [0,2,0,0,0,0|2,0,0]=4 22842 B14R0.392 CCSCCNCCOCCOCCO 2230a_100011998139_100000757381 [0,2,0,0,0,0|2,0,0]=4 22843 B14R0.392 CCSCCNCCOCCOCCO 34a_100011998139_100000757381 [0,2,0,0,0,0|2,0,0]=4 22844 B14R0.392 CCSCCOCCCCCCCCBr 34a_100009813846_100000757381 [0,2,0,0,0,0|1,0,0]=3 22845 B14R0.392 CCSCCOCCCCCCCCBr 7a_100009813846_100000757381 [0,2,0,0,0,0|1,0,0]=3 22846 B14R0.392 CCSCCOCCCCCCCCCl 34a_100000033203_100000757381 [0,2,0,0,0,0|1,0,0]=3 22847 B14R0.392 CCSCCOCCCCCCCCCl 7a_100000033203_100000757381 [0,2,0,0,0,0|1,0,0]=3 22848 B14R0.392 CCSCCOCCCCCCCCN 34a_102515433106_100000757381 [0,2,0,0,0,0|1,0,0]=3 22849 B14R0.392 CCSCCOCCCCCCCCO 34a_100000212035_100000033203 [0,2,0,0,0,0|0,0,0]=2 22850 B14R0.392 CCSCCOCCCCCCCCO 7a_100000212035_100000033203 [0,2,0,0,0,0|0,0,0]=2 22851 B14R0.392 CCSCCOCCCCCNCCN 34a_103619048469_100000757381 [0,2,0,0,0,0|2,0,0]=4 22852 B14R0.392 CCSCCOCCCOCCCOC 34a_200011215475_100000757381 [0,2,0,0,0,0|2,0,0]=4 22853 B14R0.392 CCSCCOCCCOCCCOC 7a_200011215475_100000757381 [0,2,0,0,0,0|2,0,0]=4 22854 B14R0.392 CCSCCOCCOCCOCCO 34a_100000212035_100000032323 [0,2,0,0,0,0|2,0,0]=4 22855 B14R0.392 CCSCCOCCOCCOCCO 62a_100000210202_100010166562 [0,2,0,0,0,0|2,0,0]=4 22856 B14R0.392 CCSCCOCCOCCOCCO 62a_100010166562_100000210202 [0,2,0,0,0,0|2,0,0]=4 22857 B14R0.392 CCSCCOCCOCCOCCO 7a_100000212035_100000032323 [0,2,0,0,0,0|2,0,0]=4 22858 B14R0.392 CCSCCSCCCCCCCCO 62a_100000033203_100000757381 [0,2,0,0,0,0|0,0,0]=2 22859 B14R0.392 CCSCCSCCCCCCCCO 62a_100000757381_100000033203 [0,2,0,0,0,0|0,0,0]=2 22860 B14R0.392 CCSCCSCCOCCOCCO 62a_100000032323_100000757381 [0,2,0,0,0,0|2,0,0]=4 22861 B14R0.392 CCSCCSCCOCCOCCO 62a_100000757381_100000032323 [0,2,0,0,0,0|2,0,0]=4 22862 B14R0.392 CNCCCCCCCCCCCCO 2230a_100000066677_200000210301 [0,2,0,0,0,0|0,0,0]=2 22863 B14R0.392 CNCCCCCCCCCCCCO 2230a_106832991635_100009813331 [0,2,0,0,0,0|0,0,0]=2 22864 B14R0.392 CNCCCCCCCCCCCCO 34a_100000066677_200000210301 [0,2,0,0,0,0|0,0,0]=2 22865 B14R0.392 CNCCCCCCCCCCCCO 34a_100102657272_100009813331 [0,2,0,0,0,0|0,0,0]=2 22866 B14R0.392 CNCCCCCCCCCCCCO 7a_106832991635_100009813331 [0,2,0,0,0,0|0,0,0]=2 22867 B14R0.392 CNCCCCCCOCCCCCO 2230a_106832991635_200132310570 [0,2,0,0,0,0|0,0,0]=2 22868 B14R0.392 CNCCCCCCOCCCCCO 34a_100102657272_200132310570 [0,2,0,0,0,0|0,0,0]=2 22869 B14R0.392 CNCCCCCCOCCCCCO 7a_106832991635_200132310570 [0,2,0,0,0,0|0,0,0]=2 22870 B14R0.392 CNCCCCCOCCCCCCF 34a_100000722520_100015922095 [0,2,0,0,0,0|1,0,0]=3 22871 B14R0.392 CNCCCCCOCCCCCCO 34a_100000722520_100000766143 [0,2,0,0,0,0|0,0,0]=2 22872 B14R0.392 CNCCCCCOCCOCCOC 34a_100000722520_100000695917 [0,2,0,0,0,0|2,0,0]=4 22873 B14R0.392 CNCCCOCCCCCCCCO 34a_100000213112_100000033203 [0,2,0,0,0,0|0,0,0]=2 22874 B14R0.392 CNCCCOCCOCCOCCO 34a_100000213112_100000032323 [0,2,0,0,0,0|2,0,0]=4 22875 B14R0.392 CNCCOCCOCCCCCCF 34a_100000228057_100015922095 [0,2,0,0,0,0|2,0,0]=4 22876 B14R0.392 CNCCOCCOCCCCCCO 34a_100000228057_100000766143 [0,2,0,0,0,0|1,0,0]=3 22877 B14R0.392 CNCCOCCOCCOCCCO 34a_200014138305_100000230001 [0,2,0,0,0,0|2,0,0]=4 22878 B14R0.392 COCCCCCCCCCCCCBr 34a_100009813331_200000210301 [0,2,0,0,0,0|0,0,0]=2 22879 B14R0.392 COCCCCCCCCCCCCBr 7a_100009813331_200000210301 [0,2,0,0,0,0|0,0,0]=2 22880 B14R0.392 COCCCCCCCCCCCCN 34a_100000066677_200000210301 [0,2,0,0,0,0|0,0,0]=2 22881 B14R0.392 COCCCCCCCCCCCCO 34a_100138415774_100009813331 [0,2,0,0,0,0|0,0,0]=2 22882 B14R0.392 COCCCCCCNCCCCCO 2230a_100000762737_100011998445 [0,2,0,0,0,0|0,0,0]=2 22883 B14R0.392 COCCCCCCNCCCCCO 34a_100000762737_100011998445 [0,2,0,0,0,0|0,0,0]=2 22884 B14R0.392 COCCCCCCNCCOCCO 2230a_100000211614_100011998445 [0,2,0,0,0,0|1,0,0]=3 22885 B14R0.392 COCCCCCCNCCOCCO 34a_100000211614_100011998445 [0,2,0,0,0,0|1,0,0]=3 22886 B14R0.392 COCCCCCCNCCSCCO 2230a_100011219999_100011998445 [0,2,0,0,0,0|1,0,0]=3 22887 B14R0.392 COCCCCCCOCCCCC#N 7a_200012092642_100000211819 [0,2,0,0,0,0|1,0,1]=4 22888 B14R0.392 COCCCCCCOCCCCC=O 7a_200012092642_100000139335 [0,2,0,0,0,0|0,0,2]=4 22889 B14R0.392 COCCCCCCOCCCCCBr 34a_100000746331_100011998445 [0,2,0,0,0,0|1,0,0]=3 22890 B14R0.392 COCCCCCCOCCCCCBr 7a_100000746331_100011998445 [0,2,0,0,0,0|1,0,0]=3 22891 B14R0.392 COCCCCCCOCCCCCCl 34a_100000746330_100011998445 [0,2,0,0,0,0|1,0,0]=3 22892 B14R0.392 COCCCCCCOCCCCCCl 7a_100000746330_100011998445 [0,2,0,0,0,0|1,0,0]=3 22893 B14R0.392 COCCCCCCOCCCCCF 34a_200012092642_100000729378 [0,2,0,0,0,0|1,0,0]=3 22894 B14R0.392 COCCCCCCOCCCCCF 7a_200012092642_100000729378 [0,2,0,0,0,0|1,0,0]=3 22895 B14R0.392 COCCCCCCOCCCCCI 34a_200012148887_100011998445 [0,2,0,0,0,0|1,0,0]=3 22896 B14R0.392 COCCCCCCOCCCCCI 7a_200012148887_100011998445 [0,2,0,0,0,0|1,0,0]=3 22897 B14R0.392 COCCCCCCOCCCCCN 34a_100000762737_100011998445 [0,2,0,0,0,0|1,0,0]=3 22898 B14R0.392 COCCCCCCOCCCCCO 34a_100138415774_200132310570 [0,2,0,0,0,0|0,0,0]=2 22899 B14R0.392 COCCCCCCOCCCCCO 34a_200012092642_100000746330 [0,2,0,0,0,0|0,0,0]=2 22900 B14R0.392 COCCCCCCOCCCCCO 7a_200012092642_100000746330 [0,2,0,0,0,0|0,0,0]=2 22901 B14R0.392 COCCCCCCOCCCCOC 34a_100000740925_100011998445 [0,2,0,0,0,0|1,0,0]=3 22902 B14R0.392 COCCCCCCOCCCCOC 34a_200012092642_100000755781 [0,2,0,0,0,0|1,0,0]=3 22903 B14R0.392 COCCCCCCOCCCCOC 7a_200012092642_100000730899 [0,2,0,0,0,0|1,0,0]=3 22904 B14R0.392 COCCCCCCOCCCCSC 34a_100011217163_100011998445 [0,2,0,0,0,0|1,0,0]=3 22905 B14R0.392 COCCCCCCOCCCCSC 7a_100011217163_100011998445 [0,2,0,0,0,0|1,0,0]=3 22906 B14R0.392 COCCCCCCOCCOCCBr 34a_100000692535_100011998445 [0,2,0,0,0,0|2,0,0]=4 22907 B14R0.392 COCCCCCCOCCOCCBr 7a_100000692535_100011998445 [0,2,0,0,0,0|2,0,0]=4 22908 B14R0.392 COCCCCCCOCCOCCCl 34a_100011215305_100011998445 [0,2,0,0,0,0|2,0,0]=4 22909 B14R0.392 COCCCCCCOCCOCCCl 7a_100011215305_100011998445 [0,2,0,0,0,0|2,0,0]=4 22910 B14R0.392 COCCCCCCOCCOCCF 34a_200015357709_100011998445 [0,2,0,0,0,0|2,0,0]=4 22911 B14R0.392 COCCCCCCOCCOCCF 7a_200015357709_100011998445 [0,2,0,0,0,0|2,0,0]=4 22912 B14R0.392 COCCCCCCOCCOCCI 34a_100012149058_100011998445 [0,2,0,0,0,0|2,0,0]=4 22913 B14R0.392 COCCCCCCOCCOCCI 7a_100012149058_100011998445 [0,2,0,0,0,0|2,0,0]=4 22914 B14R0.392 COCCCCCCOCCOCCN 34a_100000211614_100011998445 [0,2,0,0,0,0|2,0,0]=4 22915 B14R0.392 COCCCCCCOCCOCCO 34a_200012092642_100000692535 [0,2,0,0,0,0|1,0,0]=3 22916 B14R0.392 COCCCCCCOCCOCCO 7a_200012092642_100011215305 [0,2,0,0,0,0|1,0,0]=3 22917 B14R0.392 COCCCCCCSCCCCC#N 62a_100011219923_100011998445 [0,2,0,0,0,0|1,0,1]=4 22918 B14R0.392 COCCCCCCSCCCCC#N 62a_100011998445_100000211819 [0,2,0,0,0,0|1,0,1]=4 22919 B14R0.392 COCCCCCCSCCCCC=O 62a_100000139335_100011998445 [0,2,0,0,0,0|0,0,2]=4 22920 B14R0.392 COCCCCCCSCCCCC=O 62a_100011998445_100000139335 [0,2,0,0,0,0|0,0,2]=4 22921 B14R0.392 COCCCCCCSCCCCCF 62a_100000729378_100011998445 [0,2,0,0,0,0|1,0,0]=3 22922 B14R0.392 COCCCCCCSCCCCCF 62a_100011998445_100000729378 [0,2,0,0,0,0|1,0,0]=3 22923 B14R0.392 COCCCCCCSCCCCCO 62a_100000746330_100011998445 [0,2,0,0,0,0|0,0,0]=2 22924 B14R0.392 COCCCCCCSCCCCCO 62a_100011998445_100000746330 [0,2,0,0,0,0|0,0,0]=2 22925 B14R0.392 COCCCCCCSCCCCOC 62a_100000730899_100011998445 [0,2,0,0,0,0|1,0,0]=3 22926 B14R0.392 COCCCCCCSCCCCOC 62a_100011998445_100000730899 [0,2,0,0,0,0|1,0,0]=3 22927 B14R0.392 COCCCCCCSCCOCCO 62a_100011215305_100011998445 [0,2,0,0,0,0|1,0,0]=3 22928 B14R0.392 COCCCCCCSCCOCCO 62a_100011998445_100011215305 [0,2,0,0,0,0|1,0,0]=3 22929 B14R0.392 COCCCCCCSCOCCOC 62a_100000231047_100011998445 [0,2,0,0,0,0|2,0,0]=4 22930 B14R0.392 COCCCCCCSCOCCOC 62a_100011998445_100000231047 [0,2,0,0,0,0|2,0,0]=4 22931 B14R0.392 COCCCCCNCCCCCC#N 2230a_100000747528_100009813376 [0,2,0,0,0,0|1,0,1]=4 22932 B14R0.392 COCCCCCNCCCCCC=O 2230a_100000747528_100000139337 [0,2,0,0,0,0|0,0,2]=4 22933 B14R0.392 COCCCCCNCCCCCCF 2230a_100000747528_100015922095 [0,2,0,0,0,0|1,0,0]=3 22934 B14R0.392 COCCCCCNCCCCCCF 34a_100000747528_100015922095 [0,2,0,0,0,0|1,0,0]=3 22935 B14R0.392 COCCCCCNCCCCCCO 2230a_100000747528_100000766143 [0,2,0,0,0,0|0,0,0]=2 22936 B14R0.392 COCCCCCNCCCCCCO 34a_100000747528_100000766143 [0,2,0,0,0,0|0,0,0]=2 22937 B14R0.392 COCCCCCNCCOCCOC 2230a_100000747528_100000695917 [0,2,0,0,0,0|2,0,0]=4 22938 B14R0.392 COCCCCCNCCOCCOC 34a_100000747528_100000695917 [0,2,0,0,0,0|2,0,0]=4 22939 B14R0.392 COCCCCCOCCCCCCCl 34a_200132310570_200000210301 [0,2,0,0,0,0|1,0,0]=3 22940 B14R0.392 COCCCCCOCCCCCCCl 7a_200132310570_200000210301 [0,2,0,0,0,0|1,0,0]=3 22941 B14R0.392 COCCCCNCCCCCCCO 2230a_100011996573_100000730899 [0,2,0,0,0,0|0,0,0]=2 22942 B14R0.392 COCCCCNCCCCCCCO 34a_100011996573_100000755781 [0,2,0,0,0,0|0,0,0]=2 22943 B14R0.392 COCCCCNCCCOCCCO 2230a_100011310245_100000730899 [0,2,0,0,0,0|1,0,0]=3 22944 B14R0.392 COCCCCNCCCOCCCO 34a_100011310245_100000755781 [0,2,0,0,0,0|1,0,0]=3 22945 B14R0.392 COCCCCNCCCOCCOC 2230a_100000206027_100000730899 [0,2,0,0,0,0|2,0,0]=4 22946 B14R0.392 COCCCCNCCCOCCOC 34a_100000206027_100000755781 [0,2,0,0,0,0|2,0,0]=4 22947 B14R0.392 COCCCCOCCCCCCCBr 34a_100000760002_100000755781 [0,2,0,0,0,0|1,0,0]=3 22948 B14R0.392 COCCCCOCCCCCCCBr 7a_100000760002_100000730899 [0,2,0,0,0,0|1,0,0]=3 22949 B14R0.392 COCCCCOCCCCCCCN 34a_100011996573_100000755781 [0,2,0,0,0,0|1,0,0]=3 22950 B14R0.392 COCCCCOCCCCCCCO 34a_100000740925_100000760002 [0,2,0,0,0,0|0,0,0]=2 22951 B14R0.392 COCCCCOCCCOCCCN 34a_100011310245_100000755781 [0,2,0,0,0,0|2,0,0]=4 22952 B14R0.392 COCCCCOCCCOCCOC 34a_100000740925_100011216529 [0,2,0,0,0,0|2,0,0]=4 22953 B14R0.392 COCCCCSCCCCCCC#N 62a_100000730899_100009813337 [0,2,0,0,0,0|1,0,1]=4 22954 B14R0.392 COCCCCSCCCCCCC#N 62a_100009813337_100000730899 [0,2,0,0,0,0|1,0,1]=4 22955 B14R0.392 COCCCCSCCCCCCCO 62a_100000730899_100000760002 [0,2,0,0,0,0|0,0,0]=2 22956 B14R0.392 COCCCCSCCCCCCCO 62a_100000760002_100000730899 [0,2,0,0,0,0|0,0,0]=2 22957 B14R0.392 COCCCCSCCCOCCOC 62a_100000730899_100011216529 [0,2,0,0,0,0|2,0,0]=4 22958 B14R0.392 COCCCCSCCCOCCOC 62a_100011216529_100000730899 [0,2,0,0,0,0|2,0,0]=4 22959 B14R0.392 COCCCNCCCCCCCCO 2230a_102515433106_100000740836 [0,2,0,0,0,0|0,0,0]=2 22960 B14R0.392 COCCCNCCCCCCCCO 34a_100150723488_100000033203 [0,2,0,0,0,0|0,0,0]=2 22961 B14R0.392 COCCCNCCCCCCCCO 34a_102515433106_100000740836 [0,2,0,0,0,0|0,0,0]=2 22962 B14R0.392 COCCCNCCOCCOCCO 2230a_100011998139_100000740836 [0,2,0,0,0,0|2,0,0]=4 22963 B14R0.392 COCCCNCCOCCOCCO 34a_100011998139_100000740836 [0,2,0,0,0,0|2,0,0]=4 22964 B14R0.392 COCCCNCCOCCOCCO 34a_100150723488_100000032323 [0,2,0,0,0,0|2,0,0]=4 22965 B14R0.392 COCCCOCCCCCCCCBr 34a_100009813846_100000740836 [0,2,0,0,0,0|1,0,0]=3 22966 B14R0.392 COCCCOCCCCCCCCBr 7a_100009813846_100000740836 [0,2,0,0,0,0|1,0,0]=3 22967 B14R0.392 COCCCOCCCCCCCCCl 34a_100000033203_100000740836 [0,2,0,0,0,0|1,0,0]=3 22968 B14R0.392 COCCCOCCCCCCCCCl 7a_100000033203_100000740836 [0,2,0,0,0,0|1,0,0]=3 22969 B14R0.392 COCCCOCCCCCCCCN 34a_102515433106_100000740836 [0,2,0,0,0,0|1,0,0]=3 22970 B14R0.392 COCCCOCCCCCCCCO 34a_100000740835_100000033203 [0,2,0,0,0,0|0,0,0]=2 22971 B14R0.392 COCCCOCCCCCNCCN 34a_103619048469_100000740836 [0,2,0,0,0,0|2,0,0]=4 22972 B14R0.392 COCCCOCCCOCCCCF 34a_200011215475_100000729493 [0,2,0,0,0,0|2,0,0]=4 22973 B14R0.392 COCCCOCCCOCCCCF 7a_200011215475_100000729493 [0,2,0,0,0,0|2,0,0]=4 22974 B14R0.392 COCCCOCCCOCCCCO 34a_200011215475_100011216708 [0,2,0,0,0,0|1,0,0]=3 22975 B14R0.392 COCCCOCCCOCCCCO 7a_200011215475_100000210776 [0,2,0,0,0,0|1,0,0]=3 22976 B14R0.392 COCCCOCCCOCCCOC 34a_200011215475_100000740836 [0,2,0,0,0,0|2,0,0]=4 22977 B14R0.392 COCCCOCCCOCCCOC 7a_200011215475_100000740836 [0,2,0,0,0,0|2,0,0]=4 22978 B14R0.392 COCCCOCCOCCOCCO 34a_100000740835_100000032323 [0,2,0,0,0,0|2,0,0]=4 22979 B14R0.392 COCCCSCCCCCCCCO 62a_100000033203_100000709357 [0,2,0,0,0,0|0,0,0]=2 22980 B14R0.392 COCCCSCCCCCCCCO 62a_100000709357_100000033203 [0,2,0,0,0,0|0,0,0]=2 22981 B14R0.392 COCCCSCCOCCOCCO 62a_100000032323_100000709357 [0,2,0,0,0,0|2,0,0]=4 22982 B14R0.392 COCCCSCCOCCOCCO 62a_100000709357_100000032323 [0,2,0,0,0,0|2,0,0]=4 22983 B14R0.392 COCCNCCCCCCCCCO 2230a_100000078944_100011201679 [0,2,0,0,0,0|0,0,0]=2 22984 B14R0.392 COCCNCCCCCCCCCO 2230a_100000209980_100009813782 [0,2,0,0,0,0|0,0,0]=2 22985 B14R0.392 COCCNCCCCCCCCCO 34a_100000078944_100011201679 [0,2,0,0,0,0|0,0,0]=2 22986 B14R0.392 COCCNCCCOCCOCCO 2230a_100011996194_100011201679 [0,2,0,0,0,0|2,0,0]=4 22987 B14R0.392 COCCNCCCOCCOCCO 34a_100011996194_100011201679 [0,2,0,0,0,0|2,0,0]=4 22988 B14R0.392 COCCOCCCCCCCCCBr 34a_100009813782_100011201679 [0,2,0,0,0,0|1,0,0]=3 22989 B14R0.392 COCCOCCCCCCCCCBr 7a_100009813782_100000233755 [0,2,0,0,0,0|1,0,0]=3 22990 B14R0.392 COCCOCCCCCCCCCCl 34a_100009868337_100011201679 [0,2,0,0,0,0|1,0,0]=3 22991 B14R0.392 COCCOCCCCCCCCCCl 7a_100009868337_100000233755 [0,2,0,0,0,0|1,0,0]=3 22992 B14R0.392 COCCOCCCCCCCCCN 34a_100000078944_100011201679 [0,2,0,0,0,0|1,0,0]=3 22993 B14R0.392 COCCOCCCCCCCCCO 34a_100000210237_100009813782 [0,2,0,0,0,0|0,0,0]=2 22994 B14R0.392 COCCOCCCNCCCCCF 2230a_100000206027_100000729378 [0,2,0,0,0,0|2,0,0]=4 22995 B14R0.392 COCCOCCCNCCCCCF 34a_100000206027_100000729378 [0,2,0,0,0,0|2,0,0]=4 22996 B14R0.392 COCCOCCCNCCCCCO 2230a_100000206027_100000746330 [0,2,0,0,0,0|1,0,0]=3 22997 B14R0.392 COCCOCCCNCCCCCO 2230a_100000762737_100011216529 [0,2,0,0,0,0|1,0,0]=3 22998 B14R0.392 COCCOCCCNCCCCCO 34a_100000206027_100000746330 [0,2,0,0,0,0|1,0,0]=3 22999 B14R0.392 COCCOCCCNCCCCCO 34a_100000762737_100011216529 [0,2,0,0,0,0|1,0,0]=3 23000 B14R0.392 COCCOCCCNCCOCCO 2230a_100000206027_100011215305 [0,2,0,0,0,0|2,0,0]=4 23001 B14R0.392 COCCOCCCNCCOCCO 2230a_100000211614_100011216529 [0,2,0,0,0,0|2,0,0]=4 23002 B14R0.392 COCCOCCCNCCOCCO 34a_100000206027_100000692535 [0,2,0,0,0,0|2,0,0]=4 23003 B14R0.392 COCCOCCCNCCOCCO 34a_100000211614_100011216529 [0,2,0,0,0,0|2,0,0]=4 23004 B14R0.392 COCCOCCCNCCSCCO 2230a_100011219999_100011216529 [0,2,0,0,0,0|2,0,0]=4 23005 B14R0.392 COCCOCCCOCCCCCBr 34a_100000746331_100011216529 [0,2,0,0,0,0|2,0,0]=4 23006 B14R0.392 COCCOCCCOCCCCCBr 7a_100000746331_100011216529 [0,2,0,0,0,0|2,0,0]=4 23007 B14R0.392 COCCOCCCOCCCCCCl 34a_100000746330_100011216529 [0,2,0,0,0,0|2,0,0]=4 23008 B14R0.392 COCCOCCCOCCCCCCl 7a_100000746330_100011216529 [0,2,0,0,0,0|2,0,0]=4 23009 B14R0.392 COCCOCCCOCCCCCI 34a_200012148887_100011216529 [0,2,0,0,0,0|2,0,0]=4 23010 B14R0.392 COCCOCCCOCCCCCI 7a_200012148887_100011216529 [0,2,0,0,0,0|2,0,0]=4 23011 B14R0.392 COCCOCCCOCCCCCN 34a_100000762737_100011216529 [0,2,0,0,0,0|2,0,0]=4 23012 B14R0.392 COCCOCCCOCCCCSC 34a_100011217163_100011216529 [0,2,0,0,0,0|2,0,0]=4 23013 B14R0.392 COCCOCCCOCCCCSC 7a_100011217163_100011216529 [0,2,0,0,0,0|2,0,0]=4 23014 B14R0.392 COCCOCCCSCCCCCF 62a_100000729378_100011216529 [0,2,0,0,0,0|2,0,0]=4 23015 B14R0.392 COCCOCCCSCCCCCF 62a_100011216529_100000729378 [0,2,0,0,0,0|2,0,0]=4 23016 B14R0.392 COCCOCCCSCCCCCO 62a_100000746330_100011216529 [0,2,0,0,0,0|1,0,0]=3 23017 B14R0.392 COCCOCCCSCCCCCO 62a_100011216529_100000746330 [0,2,0,0,0,0|1,0,0]=3 23018 B14R0.392 COCCOCCCSCCOCCO 62a_100011215305_100011216529 [0,2,0,0,0,0|2,0,0]=4 23019 B14R0.392 COCCOCCCSCCOCCO 62a_100011216529_100011215305 [0,2,0,0,0,0|2,0,0]=4 23020 B14R0.392 COCCOCCNCCCCCCF 2230a_100000745349_100015922095 [0,2,0,0,0,0|2,0,0]=4 23021 B14R0.392 COCCOCCNCCCCCCF 34a_100000745349_100015922095 [0,2,0,0,0,0|2,0,0]=4 23022 B14R0.392 COCCOCCNCCCCCCO 2230a_100000686447_100000695917 [0,2,0,0,0,0|1,0,0]=3 23023 B14R0.392 COCCOCCNCCCCCCO 2230a_100000745349_100000766143 [0,2,0,0,0,0|1,0,0]=3 23024 B14R0.392 COCCOCCNCCCCCCO 34a_100000686447_100000695917 [0,2,0,0,0,0|1,0,0]=3 23025 B14R0.392 COCCOCCNCCCCCCO 34a_100000745349_100000766143 [0,2,0,0,0,0|1,0,0]=3 23026 B14R0.392 COCCOCCOCCCCCCBr 34a_100011215345_100000695917 [0,2,0,0,0,0|2,0,0]=4 23027 B14R0.392 COCCOCCOCCCCCCBr 7a_100011215345_100000695917 [0,2,0,0,0,0|2,0,0]=4 23028 B14R0.392 COCCOCCOCCCCCCCl 34a_100000766143_100000695917 [0,2,0,0,0,0|2,0,0]=4 23029 B14R0.392 COCCOCCOCCCCCCCl 7a_100000766143_100000695917 [0,2,0,0,0,0|2,0,0]=4 23030 B14R0.392 COCCOCCOCCCCCCF 34a_100000732779_100000695917 [0,2,0,0,0,0|2,0,0]=4 23031 B14R0.392 COCCOCCOCCCCCCF 34a_100011215163_100015922095 [0,2,0,0,0,0|2,0,0]=4 23032 B14R0.392 COCCOCCOCCCCCCF 7a_100000732779_100000695917 [0,2,0,0,0,0|2,0,0]=4 23033 B14R0.392 COCCOCCOCCCCCCF 7a_100011215163_100015922095 [0,2,0,0,0,0|2,0,0]=4 23034 B14R0.392 COCCOCCOCCCCCCN 34a_100000686447_100000695917 [0,2,0,0,0,0|2,0,0]=4 23035 B14R0.392 COCCOCCOCCCCCCO 34a_100011215163_100000766143 [0,2,0,0,0,0|1,0,0]=3 23036 B14R0.392 COCCOCCOCCCCCCO 7a_100011215163_100000766143 [0,2,0,0,0,0|1,0,0]=3 23037 B14R0.392 COCCOCCOCCNCCCO 2230a_100012028300_100000230001 [0,2,0,0,0,0|2,0,0]=4 23038 B14R0.392 COCCOCCOCCNCCCO 34a_100012028300_100000230001 [0,2,0,0,0,0|2,0,0]=4 23039 B14R0.392 COCCOCCOCCOCCCO 34a_100000688194_100000230001 [0,2,0,0,0,0|2,0,0]=4 23040 B14R0.392 COCCOCCOCCOCCCO 7a_100000688194_100011215043 [0,2,0,0,0,0|2,0,0]=4 23041 B14R0.392 COCCOCCOCCSCCCO 62a_100011215043_100013367474 [0,2,0,0,0,0|2,0,0]=4 23042 B14R0.392 COCCOCCOCCSCCCO 62a_100013367474_100011215043 [0,2,0,0,0,0|2,0,0]=4 23043 B14R0.392 COCCOCCSCCCCCCF 62a_100000695917_100015922095 [0,2,0,0,0,0|2,0,0]=4 23044 B14R0.392 COCCOCCSCCCCCCF 62a_100015922095_100000695917 [0,2,0,0,0,0|2,0,0]=4 23045 B14R0.392 COCCOCCSCCCCCCO 62a_100000695917_100000766143 [0,2,0,0,0,0|1,0,0]=3 23046 B14R0.392 COCCOCCSCCCCCCO 62a_100000766143_100000695917 [0,2,0,0,0,0|1,0,0]=3 23047 B14R0.392 COCCOCNCCCCCCCO 2230a_100011996573_100000231047 [0,2,0,0,0,0|1,0,0]=3 23048 B14R0.392 COCCOCNCCCOCCCO 2230a_100011310245_100000231047 [0,2,0,0,0,0|2,0,0]=4 23049 B14R0.392 COCCOCSCCCCCCCO 62a_100000231047_100000760002 [0,2,0,0,0,0|1,0,0]=3 23050 B14R0.392 COCCOCSCCCCCCCO 62a_100000760002_100000231047 [0,2,0,0,0,0|1,0,0]=3 23051 B14R0.392 COCCSCCCCCCCCCO 62a_100000233755_100009813782 [0,2,0,0,0,0|0,0,0]=2 23052 B14R0.392 COCCSCCCCCCCCCO 62a_100009813782_100000233755 [0,2,0,0,0,0|0,0,0]=2 23053 B14R0.392 COCNCCCCCCCCCCO 2230a_100000066964_100000766300 [0,2,0,0,0,0|0,0,0]=2 23054 B14R0.392 COCSCCCCCCCCCCO 62a_100000766300_200000033068 [0,2,0,0,0,0|0,0,0]=2 23055 B14R0.392 COCSCCCCCCCCCCO 62a_100009813290_100000766300 [0,2,0,0,0,0|0,0,0]=2 23056 B14R0.392 CSCCCCCCCCCCCCO 62a_100009813331_200000210301 [0,2,0,0,0,0|0,0,0]=2 23057 B14R0.392 CSCCCCCCOCCCCCO 62a_200000210301_200132310570 [0,2,0,0,0,0|0,0,0]=2 23058 B14R0.392 CSCCCCCCOCCCCCO 62a_200132310570_200000210301 [0,2,0,0,0,0|0,0,0]=2 23059 B14R0.392 CSCCCCOCCCCCCC#N 7a_100011217163_100009813337 [0,2,0,0,0,0|1,0,1]=4 23060 B14R0.392 CSCCCCOCCCCCCCO 34a_100011217163_100000760002 [0,2,0,0,0,0|0,0,0]=2 23061 B14R0.392 CSCCCCOCCCCCCCO 7a_100011217163_100000760002 [0,2,0,0,0,0|0,0,0]=2 23062 B14R0.392 CSCCCNCCCCCCCCO 2230a_100000749238_100000033203 [0,2,0,0,0,0|0,0,0]=2 23063 B14R0.392 CSCCCNCCOCCOCCO 2230a_100000749238_100000032323 [0,2,0,0,0,0|2,0,0]=4 23064 B14R0.392 CSCCCOCCCCCCCCO 34a_100000690336_100000033203 [0,2,0,0,0,0|0,0,0]=2 23065 B14R0.392 CSCCCOCCCCCCCCO 7a_100000690336_100000033203 [0,2,0,0,0,0|0,0,0]=2 23066 B14R0.392 CSCCCOCCOCCOCCO 34a_100000690336_100000032323 [0,2,0,0,0,0|2,0,0]=4 23067 B14R0.392 CSCCCOCCOCCOCCO 7a_100000690336_100000032323 [0,2,0,0,0,0|2,0,0]=4 23068 B14R0.392 CSCCNCCCCCCCCCO 2230a_100000078944_100000751147 [0,2,0,0,0,0|0,0,0]=2 23069 B14R0.392 CSCCNCCCCCCCCCO 2230a_100020590264_100009813782 [0,2,0,0,0,0|0,0,0]=2 23070 B14R0.392 CSCCNCCCCCCCCCO 34a_100000078944_100000212216 [0,2,0,0,0,0|0,0,0]=2 23071 B14R0.392 CSCCNCCCOCCOCCO 2230a_100011996194_100000751147 [0,2,0,0,0,0|2,0,0]=4 23072 B14R0.392 CSCCNCCCOCCOCCO 34a_100011996194_100000212216 [0,2,0,0,0,0|2,0,0]=4 23073 B14R0.392 CSCCOCCCCCCCCCBr 34a_100009813782_100000212216 [0,2,0,0,0,0|1,0,0]=3 23074 B14R0.392 CSCCOCCCCCCCCCBr 7a_100009813782_100000212216 [0,2,0,0,0,0|1,0,0]=3 23075 B14R0.392 CSCCOCCCCCCCCCCl 34a_100009868337_100000212216 [0,2,0,0,0,0|1,0,0]=3 23076 B14R0.392 CSCCOCCCCCCCCCCl 7a_100009868337_100000212216 [0,2,0,0,0,0|1,0,0]=3 23077 B14R0.392 CSCCOCCCCCCCCCN 34a_100000078944_100000212216 [0,2,0,0,0,0|1,0,0]=3 23078 B14R0.392 CSCCOCCCCCCCCCO 34a_100000230434_100009813782 [0,2,0,0,0,0|0,0,0]=2 23079 B14R0.392 CSCCOCCCCCCCCCO 7a_100000230434_100009813782 [0,2,0,0,0,0|0,0,0]=2 23080 B14R0.392 CSCCSCCCCCCCCCO 62a_100000212216_100009813782 [0,2,0,0,0,0|0,0,0]=2 23081 B14R0.392 CSCCSCCCCCCCCCO 62a_100009813782_100000751147 [0,2,0,0,0,0|0,0,0]=2 23082 B14R0.392 CSCNCCCCCCCCCCO 2230a_100000066964_100011218213 [0,2,0,0,0,0|0,0,0]=2 23083 B14R0.392 CSCNCCCCCCCCCCO 34a_100000066964_100011218213 [0,2,0,0,0,0|0,0,0]=2 23084 B14R0.392 CSCOCCCCCCCCCCBr 34a_100009813290_100011218213 [0,2,0,0,0,0|1,0,0]=3 23085 B14R0.392 CSCOCCCCCCCCCCCl 34a_200000033068_100011218213 [0,2,0,0,0,0|1,0,0]=3 23086 B14R0.392 CSCOCCCCCCCCCCN 34a_100000066964_100011218213 [0,2,0,0,0,0|1,0,0]=3 23087 B14R0.392 CSCSCCCCCCCCCCO 62a_100009813290_100011218213 [0,2,0,0,0,0|0,0,0]=2 23088 B14R0.392 CSCSCCCCCCCCCCO 62a_100011218213_200000033068 [0,2,0,0,0,0|0,0,0]=2 23089 B14R0.392 FCCCCCCOCCCCCCBr 34a_100011215345_100015922095 [0,2,0,0,0,0|1,0,0]=3 23090 B14R0.392 FCCCCCCOCCCCCCBr 7a_100011215345_100015922095 [0,2,0,0,0,0|1,0,0]=3 23091 B14R0.392 FCCCCCCOCCCCCCCl 34a_100000766143_100015922095 [0,2,0,0,0,0|1,0,0]=3 23092 B14R0.392 FCCCCCCOCCCCCCCl 7a_100000766143_100015922095 [0,2,0,0,0,0|1,0,0]=3 23093 B14R0.392 FCCCCCCOCCCCCCF 34a_100000732779_100015922095 [0,2,0,0,0,0|1,0,0]=3 23094 B14R0.392 FCCCCCCOCCCCCCF 7a_100000732779_100015922095 [0,2,0,0,0,0|1,0,0]=3 23095 B14R0.392 FCCCCCCSCCCCCCF 62a_100015922095_100015922095 [0,2,0,0,0,0|1,0,0]=3 23096 B14R0.392 FCCCCCOCCCCCCCBr 34a_100000760002_100000729378 [0,2,0,0,0,0|1,0,0]=3 23097 B14R0.392 FCCCCCOCCCCCCCBr 7a_100000760002_100000729378 [0,2,0,0,0,0|1,0,0]=3 23098 B14R0.392 FCCCCOCCCCCCCCBr 34a_100009813846_100000729493 [0,2,0,0,0,0|1,0,0]=3 23099 B14R0.392 FCCCCOCCCCCCCCBr 7a_100009813846_100000729493 [0,2,0,0,0,0|1,0,0]=3 23100 B14R0.392 FCCCCOCCCCCCCCCl 34a_100000033203_100000729493 [0,2,0,0,0,0|1,0,0]=3 23101 B14R0.392 FCCCCOCCCCCCCCCl 7a_100000033203_100000729493 [0,2,0,0,0,0|1,0,0]=3 23102 B14R0.392 FCCCOCCCCCCCCCBr 34a_100009813782_100011934791 [0,2,0,0,0,0|1,0,0]=3 23103 B14R0.392 FCCCOCCCCCCCCCBr 7a_100009813782_100011934791 [0,2,0,0,0,0|1,0,0]=3 23104 B14R0.392 FCCCOCCCCCCCCCCl 34a_100009868337_100011934791 [0,2,0,0,0,0|1,0,0]=3 23105 B14R0.392 FCCCOCCCCCCCCCCl 7a_100009868337_100011934791 [0,2,0,0,0,0|1,0,0]=3 23106 B14R0.392 FCCOCCCCCCCCCCBr 34a_100009813290_100011217306 [0,2,0,0,0,0|1,0,0]=3 23107 B14R0.392 FCCOCCCCCCCCCCBr 7a_100009813290_100011217306 [0,2,0,0,0,0|1,0,0]=3 23108 B14R0.392 FCCOCCCCCCCCCCCl 34a_200000033068_100011217306 [0,2,0,0,0,0|1,0,0]=3 23109 B14R0.392 FCCOCCCCCCCCCCCl 7a_200000033068_100011217306 [0,2,0,0,0,0|1,0,0]=3 23110 B14R0.392 FCOCCCCCCCCCCCBr 34a_100009812471_100015361967 [0,2,0,0,0,0|1,0,0]=3 23111 B14R0.392 FCOCCCCCCCCCCCBr 7a_100009812471_100015361967 [0,2,0,0,0,0|1,0,0]=3 23112 B14R0.392 N#CCCCCCCNCCCCCO 2230a_100000762737_100009813337 [0,2,0,0,0,0|0,0,1]=3 23113 B14R0.392 N#CCCCCCCNCCOCCO 2230a_100000211614_100009813337 [0,2,0,0,0,0|1,0,1]=4 23114 B14R0.392 N#CCCCCCCNCCSCCO 2230a_100011219999_100009813337 [0,2,0,0,0,0|1,0,1]=4 23115 B14R0.392 N#CCCCCCCOCCCCCBr 7a_100000746331_100009813337 [0,2,0,0,0,0|1,0,1]=4 23116 B14R0.392 N#CCCCCCCOCCCCCCl 7a_100000746330_100009813337 [0,2,0,0,0,0|1,0,1]=4 23117 B14R0.392 N#CCCCCCCOCCCCCI 7a_200012148887_100009813337 [0,2,0,0,0,0|1,0,1]=4 23118 B14R0.392 N#CCCCCCCSCCCCCF 62a_100000729378_100009813337 [0,2,0,0,0,0|1,0,1]=4 23119 B14R0.392 N#CCCCCCCSCCCCCF 62a_100009813337_100000729378 [0,2,0,0,0,0|1,0,1]=4 23120 B14R0.392 N#CCCCCCCSCCCCCO 62a_100000746330_100009813337 [0,2,0,0,0,0|0,0,1]=3 23121 B14R0.392 N#CCCCCCCSCCCCCO 62a_100009813337_100000746330 [0,2,0,0,0,0|0,0,1]=3 23122 B14R0.392 N#CCCCCCCSCCOCCO 62a_100009813337_100011215305 [0,2,0,0,0,0|1,0,1]=4 23123 B14R0.392 N#CCCCCCCSCCOCCO 62a_100011215305_100009813337 [0,2,0,0,0,0|1,0,1]=4 23124 B14R0.392 N#CCCCCCNCCCCCCO 2230a_100000686447_100009813376 [0,2,0,0,0,0|0,0,1]=3 23125 B14R0.392 N#CCCCCCOCCCCCCBr 7a_100011215345_100009813376 [0,2,0,0,0,0|1,0,1]=4 23126 B14R0.392 N#CCCCCCOCCCCCCCl 7a_100000766143_100009813376 [0,2,0,0,0,0|1,0,1]=4 23127 B14R0.392 N#CCCCCCOCCCCCCF 7a_100000732779_100009813376 [0,2,0,0,0,0|1,0,1]=4 23128 B14R0.392 N#CCCCCCSCCCCCCF 62a_100009813376_100015922095 [0,2,0,0,0,0|1,0,1]=4 23129 B14R0.392 N#CCCCCCSCCCCCCF 62a_100015922095_100009813376 [0,2,0,0,0,0|1,0,1]=4 23130 B14R0.392 N#CCCCCCSCCCCCCO 62a_100000766143_100009813376 [0,2,0,0,0,0|0,0,1]=3 23131 B14R0.392 N#CCCCCCSCCCCCCO 62a_100009813376_100000766143 [0,2,0,0,0,0|0,0,1]=3 23132 B14R0.392 N#CCCCCNCCCCCCCO 2230a_100011996573_100000211819 [0,2,0,0,0,0|0,0,1]=3 23133 B14R0.392 N#CCCCCNCCCOCCCO 2230a_100011310245_100000211819 [0,2,0,0,0,0|1,0,1]=4 23134 B14R0.392 N#CCCCCOCCCCCCCBr 7a_100000760002_100000211819 [0,2,0,0,0,0|1,0,1]=4 23135 B14R0.392 N#CCCCCSCCCCCCCO 62a_100000760002_100000211819 [0,2,0,0,0,0|0,0,1]=3 23136 B14R0.392 N#CCCCCSCCCCCCCO 62a_100011219923_100000760002 [0,2,0,0,0,0|0,0,1]=3 23137 B14R0.392 N#CCCCNCCCCCCCCO 2230a_102515433106_100000687738 [0,2,0,0,0,0|0,0,1]=3 23138 B14R0.392 N#CCCCOCCCCCCCCBr 7a_100009813846_100000687738 [0,2,0,0,0,0|1,0,1]=4 23139 B14R0.392 N#CCCCOCCCCCCCCCl 7a_100000033203_100000687738 [0,2,0,0,0,0|1,0,1]=4 23140 B14R0.392 N#CCCCSCCCCCCCCO 62a_100000033203_100000687738 [0,2,0,0,0,0|0,0,1]=3 23141 B14R0.392 N#CCCCSCCCCCCCCO 62a_100000687738_100000033203 [0,2,0,0,0,0|0,0,1]=3 23142 B14R0.392 N#CCCNCCCCCCCCCO 2230a_100000078944_100011215226 [0,2,0,0,0,0|0,0,1]=3 23143 B14R0.392 N#CCCOCCCCCCCCCBr 7a_100009813782_100000184422 [0,2,0,0,0,0|1,0,1]=4 23144 B14R0.392 N#CCCOCCCCCCCCCCl 7a_100009868337_100000184422 [0,2,0,0,0,0|1,0,1]=4 23145 B14R0.392 N#CCCSCCCCCCCCCO 62a_100009813782_100011215226 [0,2,0,0,0,0|0,0,1]=3 23146 B14R0.392 N#CCCSCCCCCCCCCO 62a_100011215226_100009813782 [0,2,0,0,0,0|0,0,1]=3 23147 B14R0.392 N#CCNCCCCCCCCCCO 2230a_100000066964_100011215382 [0,2,0,0,0,0|0,0,1]=3 23148 B14R0.392 N#CCOCCCCCCCCCCBr 7a_100009813290_100011215382 [0,2,0,0,0,0|1,0,1]=4 23149 B14R0.392 N#CCOCCCCCCCCCCCl 7a_200000033068_100011215382 [0,2,0,0,0,0|1,0,1]=4 23150 B14R0.392 N#CCOCCNCCCCCCCO 2230a_100011996573_200000047693 [0,2,0,0,0,0|1,0,1]=4 23151 B14R0.392 N#CCOCCSCCCCCCCO 62a_100000760002_200000047693 [0,2,0,0,0,0|1,0,1]=4 23152 B14R0.392 N#CCOCCSCCCCCCCO 62a_200000047693_100000760002 [0,2,0,0,0,0|1,0,1]=4 23153 B14R0.392 N#CCSCCCCCCCCCCO 62a_100009813290_100011215382 [0,2,0,0,0,0|0,0,1]=3 23154 B14R0.392 N#CCSCCCCCCCCCCO 62a_100011215382_200000033068 [0,2,0,0,0,0|0,0,1]=3 23155 B14R0.392 N#CSCCSCCCCCCCCO 62a_100000033203_100000034367 [0,2,0,0,0,0|1,0,1]=4 23156 B14R0.392 N#CSCCSCCCCCCCCO 62a_100000034367_100000033203 [0,2,0,0,0,0|1,0,1]=4 23157 B14R0.392 N#CSCSCCCCCCCCCO 62a_100000211825_100009813782 [0,2,0,0,0,0|1,0,1]=4 23158 B14R0.392 N#CSCSCCCCCCCCCO 62a_100009813782_100000211825 [0,2,0,0,0,0|1,0,1]=4 23159 B14R0.392 NCCCCCCCCCCOCC=O 34a_100000066964_200009817547 [0,2,0,0,0,0|0,0,2]=4 23160 B14R0.392 NCCCCCCCCCCOCCF 34a_100000066964_100011217306 [0,2,0,0,0,0|1,0,0]=3 23161 B14R0.392 NCCCCCCCCCCOCCO 34a_100000066964_100000211926 [0,2,0,0,0,0|0,0,0]=2 23162 B14R0.392 NCCCCCCCCCOCCCF 34a_100000078944_100011934791 [0,2,0,0,0,0|1,0,0]=3 23163 B14R0.392 NCCCCCCCCCOCCCO 34a_100000078944_100000230001 [0,2,0,0,0,0|0,0,0]=2 23164 B14R0.392 NCCCCCCCCOCC#CCO 34a_102515433106_200000047223 [0,2,0,0,0,0|0,0,2]=4 23165 B14R0.392 NCCCCCCCCOCCCCF 34a_102515433106_100000729493 [0,2,0,0,0,0|1,0,0]=3 23166 B14R0.392 NCCCCCCCCOCCCCO 34a_102515433106_100011216708 [0,2,0,0,0,0|0,0,0]=2 23167 B14R0.392 NCCCCCCCOCCCCCF 34a_100011996573_100000729378 [0,2,0,0,0,0|1,0,0]=3 23168 B14R0.392 NCCCCCCCOCCCCCO 34a_100011996573_100000746330 [0,2,0,0,0,0|0,0,0]=2 23169 B14R0.392 NCCCCCCCOCCOCCO 34a_100011996573_100000692535 [0,2,0,0,0,0|1,0,0]=3 23170 B14R0.392 NCCCCCCOCCCCCCF 34a_100000686447_100015922095 [0,2,0,0,0,0|1,0,0]=3 23171 B14R0.392 NCCCCCCOCCCCCCO 34a_100000686447_100000766143 [0,2,0,0,0,0|0,0,0]=2 23172 B14R0.392 NCCCCCOCCCCCCCO 34a_100000762737_100000760002 [0,2,0,0,0,0|0,0,0]=2 23173 B14R0.392 NCCCCOCCCCCCCCO 34a_100000750430_100000033203 [0,2,0,0,0,0|0,0,0]=2 23174 B14R0.392 NCCCCOCCOCCOCCO 34a_100000750430_100000032323 [0,2,0,0,0,0|2,0,0]=4 23175 B14R0.392 NCCCOCCCCCCCCCO 34a_100000182051_100009813782 [0,2,0,0,0,0|0,0,0]=2 23176 B14R0.392 NCCCOCCCOCCCCCF 34a_100011310245_100000729378 [0,2,0,0,0,0|2,0,0]=4 23177 B14R0.392 NCCCOCCCOCCCCCO 34a_100011310245_100000746330 [0,2,0,0,0,0|1,0,0]=3 23178 B14R0.392 NCCCOCCCOCCOCCO 34a_100011310245_100000692535 [0,2,0,0,0,0|2,0,0]=4 23179 B14R0.392 NCCCOCCOCCOCCCO 34a_100011996194_100000230001 [0,2,0,0,0,0|2,0,0]=4 23180 B14R0.392 NCCNCCCCCOCCCCF 34a_103619048469_100000729493 [0,2,0,0,0,0|2,0,0]=4 23181 B14R0.392 NCCNCCCCCOCCCCO 34a_103619048469_100011216708 [0,2,0,0,0,0|1,0,0]=3 23182 B14R0.392 NCCOCCCCCCCCCCO 34a_100000210304_100009813290 [0,2,0,0,0,0|0,0,0]=2 23183 B14R0.392 NCCOCCOCCCCCCCO 34a_100000211614_100000760002 [0,2,0,0,0,0|1,0,0]=3 23184 B14R0.392 NCCOCCOCCOCCCCO 34a_100011998139_100011216708 [0,2,0,0,0,0|2,0,0]=4 23185 B14R0.392 NOCCOCCCCCCCCCO 34a_100000700252_100009813782 [0,2,0,0,0,0|1,0,0]=3 23186 B14R0.392 O=CCCCCCNCCCCCCO 2230a_100000686447_100000139337 [0,2,0,0,0,0|0,0,1]=3 23187 B14R0.392 O=CCCCCCOCCCCCCBr 7a_100011215345_100000139337 [0,2,0,0,0,0|0,0,2]=4 23188 B14R0.392 O=CCCCCCOCCCCCCCl 7a_100000766143_100000139337 [0,2,0,0,0,0|0,0,2]=4 23189 B14R0.392 O=CCCCCCOCCCCCCF 7a_100000732779_100000139337 [0,2,0,0,0,0|0,0,2]=4 23190 B14R0.392 O=CCCCCCSCCCCCCF 62a_100000139337_100015922095 [0,2,0,0,0,0|0,0,2]=4 23191 B14R0.392 O=CCCCCCSCCCCCCF 62a_100015922095_100000139337 [0,2,0,0,0,0|0,0,2]=4 23192 B14R0.392 O=CCCCCCSCCCCCCO 62a_100000139337_100000766143 [0,2,0,0,0,0|0,0,1]=3 23193 B14R0.392 O=CCCCCCSCCCCCCO 62a_100000766143_100000139337 [0,2,0,0,0,0|0,0,1]=3 23194 B14R0.392 O=CCCCCNCCCCCCCO 2230a_100011996573_100000139335 [0,2,0,0,0,0|0,0,1]=3 23195 B14R0.392 O=CCCCCNCCCOCCCO 2230a_100011310245_100000139335 [0,2,0,0,0,0|1,0,1]=4 23196 B14R0.392 O=CCCCCOCCCCCCCBr 7a_100000760002_100000139335 [0,2,0,0,0,0|0,0,2]=4 23197 B14R0.392 O=CCCCCSCCCCCCCO 62a_100000139335_100000760002 [0,2,0,0,0,0|0,0,1]=3 23198 B14R0.392 O=CCCCCSCCCCCCCO 62a_100000760002_100000139335 [0,2,0,0,0,0|0,0,1]=3 23199 B14R0.392 O=CCCCNCCCCCCCCO 2230a_102515433106_200011292268 [0,2,0,0,0,0|0,0,1]=3 23200 B14R0.392 O=CCCCOCCCCCCCCBr 7a_100009813846_200011292268 [0,2,0,0,0,0|0,0,2]=4 23201 B14R0.392 O=CCCCOCCCCCCCCCl 7a_100000033203_200011292268 [0,2,0,0,0,0|0,0,2]=4 23202 B14R0.392 O=CCCCSCCCCCCCCO 62a_100000033203_200011292268 [0,2,0,0,0,0|0,0,1]=3 23203 B14R0.392 O=CCCCSCCCCCCCCO 62a_200011292268_100000033203 [0,2,0,0,0,0|0,0,1]=3 23204 B14R0.392 O=CCNCCCCCCCCCCO 2230a_100000066964_200015260668 [0,2,0,0,0,0|0,0,1]=3 23205 B14R0.392 O=CCNCCCCCCCCCCO 34a_100000066964_200009817547 [0,2,0,0,0,0|0,0,1]=3 23206 B14R0.392 O=CCOCCCCCCCCCCBr 34a_100009813290_200009817547 [0,2,0,0,0,0|0,0,2]=4 23207 B14R0.392 O=CCOCCCCCCCCCCBr 7a_100009813290_200015260668 [0,2,0,0,0,0|0,0,2]=4 23208 B14R0.392 O=CCOCCCCCCCCCCCl 34a_200000033068_200009817547 [0,2,0,0,0,0|0,0,2]=4 23209 B14R0.392 O=CCOCCCCCCCCCCCl 7a_200000033068_200015260668 [0,2,0,0,0,0|0,0,2]=4 23210 B14R0.392 O=CCSCCCCCCCCCCO 62a_100009813290_200015260668 [0,2,0,0,0,0|0,0,1]=3 23211 B14R0.392 O=CCSCCCCCCCCCCO 62a_200015260668_200000033068 [0,2,0,0,0,0|0,0,1]=3 23212 B14R0.392 OCC#CCNCCCCCCCCO 2230a_102515433106_200000047223 [0,2,0,0,0,0|0,0,2]=4 23213 B14R0.392 OCC#CCNCCCCCCCCO 34a_102515433106_200000047223 [0,2,0,0,0,0|0,0,2]=4 23214 B14R0.392 OCC#CCOCCCCCCCCBr 34a_100009813846_200000047223 [0,2,0,0,0,0|0,0,2]=4 23215 B14R0.392 OCC#CCOCCCCCCCCBr 7a_100009813846_200000047223 [0,2,0,0,0,0|0,0,2]=4 23216 B14R0.392 OCC#CCOCCCCCCCCCl 34a_100000033203_200000047223 [0,2,0,0,0,0|0,0,2]=4 23217 B14R0.392 OCC#CCOCCCCCCCCCl 7a_100000033203_200000047223 [0,2,0,0,0,0|0,0,2]=4 23218 B14R0.392 OCC#CCSCCCCCCCCO 62a_100000033203_200000047223 [0,2,0,0,0,0|0,0,2]=4 23219 B14R0.392 OCC#CCSCCCCCCCCO 62a_200000047223_100000033203 [0,2,0,0,0,0|0,0,2]=4 23220 B14R0.392 OCCCCCCCCCCCSCF 62a_100009812471_100015361967 [0,2,0,0,0,0|0,0,0]=2 23221 B14R0.392 OCCCCCCCCCCNCCF 2230a_100000066964_100011217306 [0,2,0,0,0,0|0,0,0]=2 23222 B14R0.392 OCCCCCCCCCCNCCF 34a_100000066964_100011217306 [0,2,0,0,0,0|0,0,0]=2 23223 B14R0.392 OCCCCCCCCCCNCCF 34a_100000724931_100009813290 [0,2,0,0,0,0|0,0,0]=2 23224 B14R0.392 OCCCCCCCCCCNCCO 2230a_100000066964_100000211926 [0,2,0,0,0,0|0,0,0]=2 23225 B14R0.392 OCCCCCCCCCCNCCO 2230a_100016997473_100009813290 [0,2,0,0,0,0|0,0,0]=2 23226 B14R0.392 OCCCCCCCCCCNCCO 34a_100000066964_100000211926 [0,2,0,0,0,0|0,0,0]=2 23227 B14R0.392 OCCCCCCCCCCNCCO 34a_100016990907_100009813290 [0,2,0,0,0,0|0,0,0]=2 23228 B14R0.392 OCCCCCCCCCCOCCBr 34a_100000211926_100009813290 [0,2,0,0,0,0|0,0,0]=2 23229 B14R0.392 OCCCCCCCCCCSCCF 62a_100009813290_100011217306 [0,2,0,0,0,0|0,0,0]=2 23230 B14R0.392 OCCCCCCCCCCSCCF 62a_100011217306_200000033068 [0,2,0,0,0,0|0,0,0]=2 23231 B14R0.392 OCCCCCCCCCCSCCO 62a_100000211926_200000033068 [0,2,0,0,0,0|0,0,0]=2 23232 B14R0.392 OCCCCCCCCCCSCCO 62a_100009813290_100000211926 [0,2,0,0,0,0|0,0,0]=2 23233 B14R0.392 OCCCCCCCCCNCCCF 2230a_100000078944_100011934791 [0,2,0,0,0,0|0,0,0]=2 23234 B14R0.392 OCCCCCCCCCNCCCF 2230a_100015189416_100009813782 [0,2,0,0,0,0|0,0,0]=2 23235 B14R0.392 OCCCCCCCCCNCCCF 34a_100000078944_100011934791 [0,2,0,0,0,0|0,0,0]=2 23236 B14R0.392 OCCCCCCCCCNCCCF 34a_100015189416_100009813782 [0,2,0,0,0,0|0,0,0]=2 23237 B14R0.392 OCCCCCCCCCNCCCO 2230a_100000078944_100000230001 [0,2,0,0,0,0|0,0,0]=2 23238 B14R0.392 OCCCCCCCCCNCCCO 34a_100000078944_100000230001 [0,2,0,0,0,0|0,0,0]=2 23239 B14R0.392 OCCCCCCCCCOCCCBr 34a_100011217188_100009813782 [0,2,0,0,0,0|0,0,0]=2 23240 B14R0.392 OCCCCCCCCCOCCCCl 34a_100000230001_100009813782 [0,2,0,0,0,0|0,0,0]=2 23241 B14R0.392 OCCCCCCCCCOCCCF 34a_100000759539_100009813782 [0,2,0,0,0,0|0,0,0]=2 23242 B14R0.392 OCCCCCCCCCSCCCF 62a_100009813782_100011934791 [0,2,0,0,0,0|0,0,0]=2 23243 B14R0.392 OCCCCCCCCCSCCCF 62a_100011934791_100009813782 [0,2,0,0,0,0|0,0,0]=2 23244 B14R0.392 OCCCCCCCCCSCCCO 62a_100009813782_100011215043 [0,2,0,0,0,0|0,0,0]=2 23245 B14R0.392 OCCCCCCCCCSCCCO 62a_100011215043_100009813782 [0,2,0,0,0,0|0,0,0]=2 23246 B14R0.392 OCCCCCCCCNCCCCF 2230a_102515433106_100000729493 [0,2,0,0,0,0|0,0,0]=2 23247 B14R0.392 OCCCCCCCCNCCCCF 34a_102515433106_100000729493 [0,2,0,0,0,0|0,0,0]=2 23248 B14R0.392 OCCCCCCCCNCCCCO 2230a_100000750430_100000033203 [0,2,0,0,0,0|0,0,0]=2 23249 B14R0.392 OCCCCCCCCNCCCCO 2230a_102515433106_100000210776 [0,2,0,0,0,0|0,0,0]=2 23250 B14R0.392 OCCCCCCCCNCCCCO 34a_100000750430_100000033203 [0,2,0,0,0,0|0,0,0]=2 23251 B14R0.392 OCCCCCCCCNCCCCO 34a_102515433106_100011216708 [0,2,0,0,0,0|0,0,0]=2 23252 B14R0.392 OCCCCCCCCOCC#CCCl 34a_200000047223_100000033203 [0,2,0,0,0,0|0,0,2]=4 23253 B14R0.392 OCCCCCCCCOCCCCBr 34a_100011216708_100000033203 [0,2,0,0,0,0|0,0,0]=2 23254 B14R0.392 OCCCCCCCCOCCCCCl 34a_100000210776_100000033203 [0,2,0,0,0,0|0,0,0]=2 23255 B14R0.392 OCCCCCCCCOCCCCCl 7a_100000210776_100000033203 [0,2,0,0,0,0|0,0,0]=2 23256 B14R0.392 OCCCCCCCCOCCCCF 34a_100011995726_100000033203 [0,2,0,0,0,0|0,0,0]=2 23257 B14R0.392 OCCCCCCCCOCCCCF 7a_100011995726_100000033203 [0,2,0,0,0,0|0,0,0]=2 23258 B14R0.392 OCCCCCCCCOCCCCI 34a_200012148704_100000033203 [0,2,0,0,0,0|0,0,0]=2 23259 B14R0.392 OCCCCCCCCSCCCCF 62a_100000033203_100000729493 [0,2,0,0,0,0|0,0,0]=2 23260 B14R0.392 OCCCCCCCCSCCCCF 62a_100000729493_100000033203 [0,2,0,0,0,0|0,0,0]=2 23261 B14R0.392 OCCCCCCCCSCCCCO 62a_100000033203_100000210776 [0,2,0,0,0,0|0,0,0]=2 23262 B14R0.392 OCCCCCCCCSCCCCO 62a_100000210776_100000033203 [0,2,0,0,0,0|0,0,0]=2 23263 B14R0.392 OCCCCCCCNCCCCCF 2230a_100011996573_100000729378 [0,2,0,0,0,0|0,0,0]=2 23264 B14R0.392 OCCCCCCCNCCCCCF 34a_100011996573_100000729378 [0,2,0,0,0,0|0,0,0]=2 23265 B14R0.392 OCCCCCCCNCCCCCO 2230a_100000762737_100000760002 [0,2,0,0,0,0|0,0,0]=2 23266 B14R0.392 OCCCCCCCNCCCCCO 2230a_100011996573_100000746330 [0,2,0,0,0,0|0,0,0]=2 23267 B14R0.392 OCCCCCCCNCCCCCO 34a_100000762737_100000760002 [0,2,0,0,0,0|0,0,0]=2 23268 B14R0.392 OCCCCCCCNCCCCCO 34a_100011996573_100000746330 [0,2,0,0,0,0|0,0,0]=2 23269 B14R0.392 OCCCCCCCNCCOCCO 2230a_100000211614_100000760002 [0,2,0,0,0,0|1,0,0]=3 23270 B14R0.392 OCCCCCCCNCCOCCO 2230a_100011996573_100011215305 [0,2,0,0,0,0|1,0,0]=3 23271 B14R0.392 OCCCCCCCNCCOCCO 34a_100000211614_100000760002 [0,2,0,0,0,0|1,0,0]=3 23272 B14R0.392 OCCCCCCCNCCOCCO 34a_100011996573_100000692535 [0,2,0,0,0,0|1,0,0]=3 23273 B14R0.392 OCCCCCCCNCCSCCO 2230a_100011219999_100000760002 [0,2,0,0,0,0|1,0,0]=3 23274 B14R0.392 OCCCCCCCOCCCCCBr 34a_100000746331_100000760002 [0,2,0,0,0,0|0,0,0]=2 23275 B14R0.392 OCCCCCCCOCCCCCBr 7a_100000746331_100000760002 [0,2,0,0,0,0|0,0,0]=2 23276 B14R0.392 OCCCCCCCOCCCCCCl 34a_100000746330_100000760002 [0,2,0,0,0,0|0,0,0]=2 23277 B14R0.392 OCCCCCCCOCCCCCCl 7a_100000746330_100000760002 [0,2,0,0,0,0|0,0,0]=2 23278 B14R0.392 OCCCCCCCOCCCCCI 34a_200012148887_100000760002 [0,2,0,0,0,0|0,0,0]=2 23279 B14R0.392 OCCCCCCCOCCCCCI 7a_200012148887_100000760002 [0,2,0,0,0,0|0,0,0]=2 23280 B14R0.392 OCCCCCCCOCCOCCBr 34a_100000692535_100000760002 [0,2,0,0,0,0|1,0,0]=3 23281 B14R0.392 OCCCCCCCOCCOCCBr 7a_100000692535_100000760002 [0,2,0,0,0,0|1,0,0]=3 23282 B14R0.392 OCCCCCCCOCCOCCCl 34a_100011215305_100000760002 [0,2,0,0,0,0|1,0,0]=3 23283 B14R0.392 OCCCCCCCOCCOCCCl 7a_100011215305_100000760002 [0,2,0,0,0,0|1,0,0]=3 23284 B14R0.392 OCCCCCCCOCCOCCF 34a_200015357709_100000760002 [0,2,0,0,0,0|1,0,0]=3 23285 B14R0.392 OCCCCCCCOCCOCCF 7a_200015357709_100000760002 [0,2,0,0,0,0|1,0,0]=3 23286 B14R0.392 OCCCCCCCOCCOCCI 34a_100012149058_100000760002 [0,2,0,0,0,0|1,0,0]=3 23287 B14R0.392 OCCCCCCCOCCOCCI 7a_100012149058_100000760002 [0,2,0,0,0,0|1,0,0]=3 23288 B14R0.392 OCCCCCCCSCCCCCF 62a_100000729378_100000760002 [0,2,0,0,0,0|0,0,0]=2 23289 B14R0.392 OCCCCCCCSCCCCCF 62a_100000760002_100000729378 [0,2,0,0,0,0|0,0,0]=2 23290 B14R0.392 OCCCCCCCSCCCCCO 62a_100000746330_100000760002 [0,2,0,0,0,0|0,0,0]=2 23291 B14R0.392 OCCCCCCCSCCCCCO 62a_100000760002_100000746330 [0,2,0,0,0,0|0,0,0]=2 23292 B14R0.392 OCCCCCCCSCCOCCO 62a_100000760002_100011215305 [0,2,0,0,0,0|1,0,0]=3 23293 B14R0.392 OCCCCCCCSCCOCCO 62a_100011215305_100000760002 [0,2,0,0,0,0|1,0,0]=3 23294 B14R0.392 OCCCCCCNCCCCCCF 2230a_100000686447_100015922095 [0,2,0,0,0,0|0,0,0]=2 23295 B14R0.392 OCCCCCCNCCCCCCF 34a_100000686447_100015922095 [0,2,0,0,0,0|0,0,0]=2 23296 B14R0.392 OCCCCCCNCCCCCCO 2230a_100000686447_100000766143 [0,2,0,0,0,0|0,0,0]=2 23297 B14R0.392 OCCCCCCNCCCCCCO 34a_100000686447_100000766143 [0,2,0,0,0,0|0,0,0]=2 23298 B14R0.392 OCCCCCCOCCCCCCBr 34a_100011215345_100000766143 [0,2,0,0,0,0|0,0,0]=2 23299 B14R0.392 OCCCCCCOCCCCCCBr 7a_100011215345_100000766143 [0,2,0,0,0,0|0,0,0]=2 23300 B14R0.392 OCCCCCCOCCCCCCCl 34a_100000766143_100000766143 [0,2,0,0,0,0|0,0,0]=2 23301 B14R0.392 OCCCCCCOCCCCCCCl 7a_100000766143_100000766143 [0,2,0,0,0,0|0,0,0]=2 23302 B14R0.392 OCCCCCCOCCCCCCF 34a_100000732779_100000766143 [0,2,0,0,0,0|0,0,0]=2 23303 B14R0.392 OCCCCCCOCCCCCCF 7a_100000732779_100000766143 [0,2,0,0,0,0|0,0,0]=2 23304 B14R0.392 OCCCCCCSCCCCCCF 62a_100000766143_100015922095 [0,2,0,0,0,0|0,0,0]=2 23305 B14R0.392 OCCCCCCSCCCCCCF 62a_100015922095_100000766143 [0,2,0,0,0,0|0,0,0]=2 23306 B14R0.392 OCCCCCCSCCCCCCO 62a_100000766143_100000766143 [0,2,0,0,0,0|0,0,0]=2 23307 B14R0.392 OCCCCCNCCCOCCCO 2230a_100011310245_100000746330 [0,2,0,0,0,0|1,0,0]=3 23308 B14R0.392 OCCCCCNCCCOCCCO 34a_100011310245_100000746330 [0,2,0,0,0,0|1,0,0]=3 23309 B14R0.392 OCCCCCOCCCCCCCBr 34a_100000760002_100000746330 [0,2,0,0,0,0|0,0,0]=2 23310 B14R0.392 OCCCCCOCCCCCCCBr 7a_100000760002_100000746330 [0,2,0,0,0,0|0,0,0]=2 23311 B14R0.392 OCCCCNCCOCCOCCO 2230a_100000750430_100000032323 [0,2,0,0,0,0|2,0,0]=4 23312 B14R0.392 OCCCCNCCOCCOCCO 2230a_100011998139_100000210776 [0,2,0,0,0,0|2,0,0]=4 23313 B14R0.392 OCCCCNCCOCCOCCO 34a_100000750430_100000032323 [0,2,0,0,0,0|2,0,0]=4 23314 B14R0.392 OCCCCNCCOCCOCCO 34a_100011998139_100011216708 [0,2,0,0,0,0|2,0,0]=4 23315 B14R0.392 OCCCCOCCCCCCCCBr 34a_100009813846_100011216708 [0,2,0,0,0,0|0,0,0]=2 23316 B14R0.392 OCCCCOCCCCCCCCBr 7a_100009813846_100000210776 [0,2,0,0,0,0|0,0,0]=2 23317 B14R0.392 OCCCCOCCCCCCCCCl 34a_100000033203_100011216708 [0,2,0,0,0,0|0,0,0]=2 23318 B14R0.392 OCCCCOCCCCCCCCCl 7a_100000033203_100000210776 [0,2,0,0,0,0|0,0,0]=2 23319 B14R0.392 OCCCCOCCOCCOCCBr 34a_100010132937_100011216708 [0,2,0,0,0,0|2,0,0]=4 23320 B14R0.392 OCCCCOCCOCCOCCBr 7a_100010132937_100000210776 [0,2,0,0,0,0|2,0,0]=4 23321 B14R0.392 OCCCCOCCOCCOCCCl 34a_100000032323_100011216708 [0,2,0,0,0,0|2,0,0]=4 23322 B14R0.392 OCCCCOCCOCCOCCCl 7a_100000032323_100000210776 [0,2,0,0,0,0|2,0,0]=4 23323 B14R0.392 OCCCCSCCOCCOCCO 62a_100000032323_100000210776 [0,2,0,0,0,0|2,0,0]=4 23324 B14R0.392 OCCCCSCCOCCOCCO 62a_100000210776_100000032323 [0,2,0,0,0,0|2,0,0]=4 23325 B14R0.392 OCCCNCCCOCCOCCO 2230a_100011996194_100000230001 [0,2,0,0,0,0|2,0,0]=4 23326 B14R0.392 OCCCNCCCOCCOCCO 34a_100011996194_100000230001 [0,2,0,0,0,0|2,0,0]=4 23327 B14R0.392 OCCCOCCCCCCCCCBr 34a_100009813782_100000230001 [0,2,0,0,0,0|0,0,0]=2 23328 B14R0.392 OCCCOCCCCCCCCCBr 7a_100009813782_100011215043 [0,2,0,0,0,0|0,0,0]=2 23329 B14R0.392 OCCCOCCCCCCCCCCl 34a_100009868337_100000230001 [0,2,0,0,0,0|0,0,0]=2 23330 B14R0.392 OCCCOCCCCCCCCCCl 7a_100009868337_100011215043 [0,2,0,0,0,0|0,0,0]=2 23331 B14R0.392 OCCCOCCCNCCCCCF 2230a_100011310245_100000729378 [0,2,0,0,0,0|1,0,0]=3 23332 B14R0.392 OCCCOCCCNCCCCCF 34a_100011310245_100000729378 [0,2,0,0,0,0|1,0,0]=3 23333 B14R0.392 OCCCOCCCNCCOCCO 2230a_100011310245_100011215305 [0,2,0,0,0,0|2,0,0]=4 23334 B14R0.392 OCCCOCCCNCCOCCO 34a_100011310245_100000692535 [0,2,0,0,0,0|2,0,0]=4 23335 B14R0.392 OCCOCCCCCCCCCCBr 34a_100009813290_100000211926 [0,2,0,0,0,0|0,0,0]=2 23336 B14R0.392 OCCOCCCCCCCCCCBr 7a_100009813290_100000211926 [0,2,0,0,0,0|0,0,0]=2 23337 B14R0.392 OCCOCCCCCCCCCCCl 34a_200000033068_100000211926 [0,2,0,0,0,0|0,0,0]=2 23338 B14R0.392 OCCOCCCCCCCCCCCl 7a_200000033068_100000211926 [0,2,0,0,0,0|0,0,0]=2 23339 B14R0.392 OCCOCCOCCCCCCCBr 34a_100000760002_100000692535 [0,2,0,0,0,0|1,0,0]=3 23340 B14R0.392 OCCOCCOCCCCCCCBr 7a_100000760002_100011215305 [0,2,0,0,0,0|1,0,0]=3 23341 B14R0.392 OCCOCCOCCCNCCCF 2230a_100011996194_100011934791 [0,2,0,0,0,0|2,0,0]=4 23342 B14R0.392 OCCOCCOCCCNCCCF 34a_100011996194_100011934791 [0,2,0,0,0,0|2,0,0]=4 23343 B14R0.392 OCCOCCOCCNCCCCF 2230a_100011998139_100000729493 [0,2,0,0,0,0|2,0,0]=4 23344 B14R0.392 OCCOCCOCCNCCCCF 34a_100011998139_100000729493 [0,2,0,0,0,0|2,0,0]=4 23345 B14R0.392 OCCOCCOCCOCCCCBr 34a_100011216708_100000032323 [0,2,0,0,0,0|2,0,0]=4 23346 B14R0.392 OCCOCCOCCOCCCCCl 34a_100000210776_100000032323 [0,2,0,0,0,0|2,0,0]=4 23347 B14R0.392 OCCOCCOCCOCCCCCl 7a_100000210776_100000032323 [0,2,0,0,0,0|2,0,0]=4 23348 B14R0.392 OCCOCCOCCOCCCCF 34a_100011995726_100000032323 [0,2,0,0,0,0|2,0,0]=4 23349 B14R0.392 OCCOCCOCCOCCCCF 7a_100011995726_100000032323 [0,2,0,0,0,0|2,0,0]=4 23350 B14R0.392 OCCOCCOCCOCCCCI 34a_200012148704_100000032323 [0,2,0,0,0,0|2,0,0]=4 23351 B14R0.392 OCCOCCOCCSCCCCF 62a_100000032323_100000729493 [0,2,0,0,0,0|2,0,0]=4 23352 B14R0.392 OCCOCCOCCSCCCCF 62a_100000729493_100000032323 [0,2,0,0,0,0|2,0,0]=4 23353 B14R0.392 [13CH3]NCCCCCCCCCCCCO 2230a_100000066677_200025704644 [0,2,0,0,0,0|0,0,0]=2 23354 B14R0.392 [13CH3]NCCCCCCCCCCCCO 34a_100000066677_200025704644 [0,2,0,0,0,0|0,0,0]=2 23355 B14R0.392 [13CH3]OCCCCCCCCCCCCBr 34a_100009813331_200025704644 [0,2,0,0,0,0|0,0,0]=2 23356 B14R0.392 [13CH3]OCCCCCCCCCCCCBr 7a_100009813331_200025704644 [0,2,0,0,0,0|0,0,0]=2 23357 B14R0.392 [13CH3]OCCCCCCCCCCCCN 34a_100000066677_200025704644 [0,2,0,0,0,0|0,0,0]=2 23358 B14R0.392 [13CH3]OCCCCCOCCCCCCCl 34a_200132310570_200025704644 [0,2,0,0,0,0|1,0,0]=3 23359 B14R0.392 [13CH3]OCCCCCOCCCCCCCl 7a_200132310570_200025704644 [0,2,0,0,0,0|1,0,0]=3 23360 B14R0.392 [13CH3]SCCCCCCCCCCCCO 62a_100009813331_200025704644 [0,2,0,0,0,0|0,0,0]=2 23361 B14R0.392 [13CH3]SCCCCCCOCCCCCO 62a_200025704644_200132310570 [0,2,0,0,0,0|0,0,0]=2 23362 B14R0.392 [13CH3]SCCCCCCOCCCCCO 62a_200132310570_200025704644 [0,2,0,0,0,0|0,0,0]=2 23363 B14R0.392 [N-]=[N+]=NCCCCCCNCCCCO 2230a_200000049180_100000210776 [0,2,0,0,0,0|2,0,0]=4 23364 B14R0.392 [N-]=[N+]=NCCCCNCCCCCCO 2230a_100000101370_100000766143 [0,2,0,0,0,0|2,0,0]=4 23365 B14R0.392 [N-]=[N+]=NCCCNCCCCCCCO 2230a_100000744732_100000760002 [0,2,0,0,0,0|2,0,0]=4 23366 B14R0.86 C#CC(CCCCC)OCCCCCC 34a_100011216489_100000210314 [0,2,0,0,0,0|2,0,0]=4 23367 B14R0.86 C#CC(CCCCC)OCCCCCC 7a_100011216489_100000210314 [0,2,0,0,0,0|2,0,0]=4 23368 B14R0.86 C#CC(CCCCC)OCCCCCF 34a_100011216489_100000729378 [0,2,0,0,0,0|2,0,0]=4 23369 B14R0.86 C#CC(CCCCC)OCCCCCF 7a_100011216489_100000729378 [0,2,0,0,0,0|2,0,0]=4 23370 B14R0.86 C#CC(CCCCC)OCCCCCO 34a_100011216489_100000746330 [0,2,0,0,0,0|1,0,0]=3 23371 B14R0.86 C#CC(CCCCC)OCCCCCO 7a_100011216489_100000746330 [0,2,0,0,0,0|1,0,0]=3 23372 B14R0.86 C#CC(CCCCC)OCCOCCO 34a_100011216489_100000692535 [0,2,0,0,0,0|2,0,0]=4 23373 B14R0.86 C#CC(CCCCC)OCCOCCO 7a_100011216489_100011215305 [0,2,0,0,0,0|2,0,0]=4 23374 B14R0.86 C=CC(CCCCC)OCCCCCC 34a_100011216863_100000210314 [0,2,0,0,0,0|2,0,0]=4 23375 B14R0.86 C=CC(CCCCC)OCCCCCC 7a_100011216863_100000210314 [0,2,0,0,0,0|2,0,0]=4 23376 B14R0.86 C=CC(CCCCC)OCCCCCF 34a_100011216863_100000729378 [0,2,0,0,0,0|2,0,0]=4 23377 B14R0.86 C=CC(CCCCC)OCCCCCF 7a_100011216863_100000729378 [0,2,0,0,0,0|2,0,0]=4 23378 B14R0.86 C=CC(CCCCC)OCCCCCO 34a_100011216863_100000746330 [0,2,0,0,0,0|1,0,0]=3 23379 B14R0.86 C=CC(CCCCC)OCCCCCO 7a_100011216863_100000746330 [0,2,0,0,0,0|1,0,0]=3 23380 B14R0.86 C=CC(CCCCC)OCCOCCO 34a_100011216863_100000692535 [0,2,0,0,0,0|2,0,0]=4 23381 B14R0.86 C=CC(CCCCC)OCCOCCO 7a_100011216863_100011215305 [0,2,0,0,0,0|2,0,0]=4 23382 B14R0.86 C=CC(CCCCCCC)OCCCC 34a_200011934235_100000210210 [0,2,0,0,0,0|2,0,0]=4 23383 B14R0.86 C=CC(CCCCCCC)OCCCC 7a_200011934235_100000210211 [0,2,0,0,0,0|2,0,0]=4 23384 B14R0.86 C=CC(CCCCCCC)OCCCF 34a_200011934235_100011934791 [0,2,0,0,0,0|2,0,0]=4 23385 B14R0.86 C=CC(CCCCCCC)OCCCF 7a_200011934235_100011934791 [0,2,0,0,0,0|2,0,0]=4 23386 B14R0.86 C=CC(CCCCCCC)OCCCO 34a_200011934235_100000230001 [0,2,0,0,0,0|1,0,0]=3 23387 B14R0.86 C=CC(CCCCCCC)OCCCO 7a_200011934235_100011215043 [0,2,0,0,0,0|1,0,0]=3 23388 B14R0.86 CCCCCC(CC)NCCCCCO 270004a_100000762737_100011215316 [0,2,0,0,0,0|1,0,0]=3 23389 B14R0.86 CCCCCC(CC)NCCOCCO 270004a_100000211614_100011215316 [0,2,0,0,0,0|2,0,0]=4 23390 B14R0.86 CCCCCC(CC)NCCSCCO 270004a_100011219999_100011215316 [0,2,0,0,0,0|2,0,0]=4 23391 B14R0.86 CCCCCC(CC)OCCCCCF 34a_100011215405_100000729378 [0,2,0,0,0,0|2,0,0]=4 23392 B14R0.86 CCCCCC(CC)OCCCCCF 7a_100011215405_100000729378 [0,2,0,0,0,0|2,0,0]=4 23393 B14R0.86 CCCCCC(CC)OCCCCCO 34a_100011215405_100000746330 [0,2,0,0,0,0|1,0,0]=3 23394 B14R0.86 CCCCCC(CC)OCCCCCO 7a_100011215405_100000746330 [0,2,0,0,0,0|1,0,0]=3 23395 B14R0.86 CCCCCC(CC)OCCOCCO 34a_100011215405_100000692535 [0,2,0,0,0,0|2,0,0]=4 23396 B14R0.86 CCCCCC(CC)OCCOCCO 7a_100011215405_100011215305 [0,2,0,0,0,0|2,0,0]=4 23397 B14R0.86 CCCCCCCC(CC)NCCCC 270004a_100000102301_200011217162 [0,2,0,0,0,0|2,0,0]=4 23398 B14R0.86 CCCCCCCC(CC)NCCCF 270004a_100015189416_200011217162 [0,2,0,0,0,0|2,0,0]=4 23399 B14R0.86 CCCCCCCC(CC)NCCCO 270004a_100000182051_200011217162 [0,2,0,0,0,0|1,0,0]=3 23400 B14R0.86 CCCCCCCC(CC)OCCCC 34a_200011217053_100000210210 [0,2,0,0,0,0|2,0,0]=4 23401 B14R0.86 CCCCCCCC(CC)OCCCC 7a_200011217053_100000210211 [0,2,0,0,0,0|2,0,0]=4 23402 B14R0.86 CCCCCCCC(CC)OCCCF 34a_200011217053_100011934791 [0,2,0,0,0,0|2,0,0]=4 23403 B14R0.86 CCCCCCCC(CC)OCCCF 7a_200011217053_100011934791 [0,2,0,0,0,0|2,0,0]=4 23404 B14R0.86 CCCCCCCC(CC)OCCCO 34a_200011217053_100000230001 [0,2,0,0,0,0|1,0,0]=3 23405 B14R0.86 CCCCCCCC(CC)OCCCO 7a_200011217053_100011215043 [0,2,0,0,0,0|1,0,0]=3 23406 B14R0.86 CCCCCCCN(CC)CCCCC 2230a_100000228213_100000210326 [0,2,0,0,0,0|2,0,0]=4 23407 B14R0.86 CCCCCCCN(CC)CCCCC 269982a_100000228213_100000210215 [0,2,0,0,0,0|2,0,0]=4 23408 B14R0.86 CCCCCCCN(CC)CCCCF 2230a_100000228213_100000729493 [0,2,0,0,0,0|2,0,0]=4 23409 B14R0.86 CCCCCCCN(CC)CCCCF 269982a_100000228213_100000729493 [0,2,0,0,0,0|2,0,0]=4 23410 B14R0.86 CCCCCCCN(CC)CCCCO 2230a_100000228213_100000210776 [0,2,0,0,0,0|1,0,0]=3 23411 B14R0.86 CCCCCCCN(CC)CCCCO 2230a_100011217355_100000210681 [0,2,0,0,0,0|1,0,0]=3 23412 B14R0.86 CCCCCCCN(CC)CCCCO 269982a_100000228213_100000210776 [0,2,0,0,0,0|1,0,0]=3 23413 B14R0.86 CCCCCCCN(CC)CCCCO 269982a_100011217355_100000210681 [0,2,0,0,0,0|1,0,0]=3 23414 B14R0.86 CCCCCCNC(CC)CCCCC 270004a_100000210581_100011215316 [0,2,0,0,0,0|2,0,0]=4 23415 B14R0.86 CCCCCCOC(CC)CCCCC 34a_100011215405_100000210314 [0,2,0,0,0,0|2,0,0]=4 23416 B14R0.86 CCCCCCOC(CC)CCCCC 7a_100011215405_100000210314 [0,2,0,0,0,0|2,0,0]=4 23417 B14R0.86 CCCCOCCN(CC)CCCCO 2230a_100011217355_100000743108 [0,2,0,0,0,0|2,0,0]=4 23418 B14R0.86 CCCCOCCN(CC)CCCCO 269982a_100011217355_100000743108 [0,2,0,0,0,0|2,0,0]=4 23419 B14R0.86 CCN(CCCCO)CCCCCCF 2230a_100011217355_100015922095 [0,2,0,0,0,0|2,0,0]=4 23420 B14R0.86 CCN(CCCCO)CCCCCCF 269982a_100011217355_100015922095 [0,2,0,0,0,0|2,0,0]=4 23421 B14R0.86 CCN(CCCCO)CCCCCCO 2230a_100011217355_100000766143 [0,2,0,0,0,0|2,0,0]=4 23422 B14R0.86 CCN(CCCCO)CCCCCCO 269982a_100011217355_100000766143 [0,2,0,0,0,0|2,0,0]=4 23423 B14R0.1041 CCCCCCCC(C)(C)NCCCC 7a_106832991798_200000046972 [0,2,0,0,0,0|2,0,0]=4 23424 B14R0.1041 CCCCCCCC(C)(C)NCCCF 34a_100015189416_200000046972 [0,2,0,0,0,0|2,0,0]=4 23425 B14R0.1041 CCCCCCCC(C)(C)OCCCBr 34a_100011217188_200000046972 [0,2,0,0,0,0|2,0,0]=4 23426 B14R0.1041 CCCCCCCC(C)(C)OCCCC 34a_100000210227_200000046972 [0,2,0,0,0,0|2,0,0]=4 23427 B14R0.1041 CCCCCCCC(C)(C)OCCCC 7a_100000210227_200000046972 [0,2,0,0,0,0|2,0,0]=4 23428 B14R0.1041 CCCCCCCC(C)(C)OCCCCl 34a_100000230001_200000046972 [0,2,0,0,0,0|2,0,0]=4 23429 B14R0.1041 CCCCCCCC(C)(C)OCCCF 34a_100000759539_200000046972 [0,2,0,0,0,0|2,0,0]=4 23430 B14R0.1041 CCCCCCCC(C)(C)OCCCN 34a_100000182051_200000046972 [0,2,0,0,0,0|2,0,0]=4 23431 B14R0.1041 CCCCCCCC(C)(C)SCCCC 62a_100000210211_200000046972 [0,2,0,0,0,0|2,0,0]=4 23432 B14R0.1041 CCCCCCCC(C)(C)SCCCC 62a_200000046972_100000210210 [0,2,0,0,0,0|2,0,0]=4 23433 B14R0.1041 CCCCCCCC(C)(C)SCCCF 62a_100011934791_200000046972 [0,2,0,0,0,0|2,0,0]=4 23434 B14R0.1041 CCCCCCCC(C)(C)SCCCF 62a_200000046972_100011934791 [0,2,0,0,0,0|2,0,0]=4 23435 B14R0.1041 CCCCCCCC(C)(C)SCCCO 62a_100011215043_200000046972 [0,2,0,0,0,0|1,0,0]=3 23436 B14R0.1041 CCCCCCCC(C)(C)SCCCO 62a_200000046972_100011215043 [0,2,0,0,0,0|1,0,0]=3 23437 B14R0.1041 CCCCCS(=O)(=O)NCCCCCO 270084a_100000762737_100000753860 [0,2,0,0,0,0|2,0,0]=4 23438 B14R0.1041 CCCCCS(=O)(=O)NCCCCCO 274078a_100000762737_100000753860 [0,2,0,0,0,0|2,0,0]=4 23439 B14R0.1444 CCCCCC(=O)CC(=O)CCCCO 1458a_100000695505_200012276598 [0,2,0,0,0,0|0,0,2]=4 23440 B14R0.1444 CCCCCC(=O)CN(C)CCCCO 2230a_100000717598_200012276598 [0,2,0,0,0,0|1,0,1]=4 23441 B14R0.1444 CCCCCC(=O)CN(C)CCCCO 269982a_100000717598_200012276598 [0,2,0,0,0,0|1,0,1]=4 23442 B14R0.1444 CCCCCC(C)NC(=O)CCCCO 1626a_100000211957_100000695505 [0,2,0,0,0,0|1,0,1]=4 23443 B14R0.1444 CCCCCC(C)NC(C)CCCCC 2230a_100000211957_200011218191 [0,2,0,0,0,0|2,0,0]=4 23444 B14R0.1444 CCCCCC(C)NC(C)CCCCC 270004a_100000211957_100000211708 [0,2,0,0,0,0|2,0,0]=4 23445 B14R0.1444 CCCCCC(C)OC(C)CCCCC 34a_100011215632_200011218191 [0,2,0,0,0,0|2,0,0]=4 23446 B14R0.1444 CCCCCC(C)OC(C)CCCCC 7a_100011215632_200011218191 [0,2,0,0,0,0|2,0,0]=4 23447 B14R0.1444 CCCCCC(C)SC(C)CCCCC 62a_200011218191_200011218191 [0,2,0,0,0,0|2,0,0]=4 23448 B12R1.8 BrCCCCOC1CCCCC1 34a_100011216708_100000210327 [1,0,0,1,0,0|2,0,0]=4 23449 B12R1.8 BrCCCOCC1CCCCC1 34a_100011217188_100000211423 [1,0,0,1,0,0|2,0,0]=4 23450 B12R1.8 BrCCCOCC1CCCCO1 34a_100011217188_100000211543 [1,0,0,1,0,0|2,0,0]=4 23451 B12R1.8 BrCCOCCC1CCCCC1 34a_100000211926_100011209188 [1,0,0,1,0,0|2,0,0]=4 23452 B12R1.8 CCCCCCN1CCCOC1 2230a_100000131196_100000210314 [1,0,0,1,0,0|2,0,0]=4 23453 B12R1.8 CCCCCCN1CCCOC1 269982a_100000131196_100000210757 [1,0,0,1,0,0|2,0,0]=4 23454 B12R1.8 CCCCCCN1CCCOC1 34a_100000131196_100000210314 [1,0,0,1,0,0|2,0,0]=4 23455 B12R1.8 CCCCCCN1CCOCC1 2230a_100015191051_100000210314 [1,0,0,1,0,0|2,0,0]=4 23456 B12R1.8 CCCCCCN1CCOCC1 269982a_100015191051_100000210757 [1,0,0,1,0,0|2,0,0]=4 23457 B12R1.8 CCCCCCN1CCOCC1 34a_100015191051_100000210314 [1,0,0,1,0,0|2,0,0]=4 23458 B12R1.8 CCCCCCN1CCSCC1 2230a_100000737611_100000210314 [1,0,0,1,0,0|2,0,0]=4 23459 B12R1.8 CCCCCCN1CCSCC1 269982a_100000737611_100000210757 [1,0,0,1,0,0|2,0,0]=4 23460 B12R1.8 CCCCCNC1CCCCC1 2230a_100000182618_100000210326 [1,0,0,1,0,0|1,0,0]=3 23461 B12R1.8 CCCCCNC1CCCCC1 270004a_100000209983_100000210434 [1,0,0,1,0,0|1,0,0]=3 23462 B12R1.8 CCCCCNC1CCCCC1 34a_100000182618_100000718602 [1,0,0,1,0,0|1,0,0]=3 23463 B12R1.8 CCCCCNC1CCCOC1 2230a_100000719290_100000210326 [1,0,0,1,0,0|2,0,0]=4 23464 B12R1.8 CCCCCNC1CCCOC1 270004a_100000209983_100000753404 [1,0,0,1,0,0|2,0,0]=4 23465 B12R1.8 CCCCCNC1CCCOC1 34a_100000719290_100000718602 [1,0,0,1,0,0|2,0,0]=4 23466 B12R1.8 CCCCCNC1CCCSC1 270004a_100000209983_100000057913 [1,0,0,1,0,0|2,0,0]=4 23467 B12R1.8 CCCCCNC1CCNCC1 270004a_100000209983_100015192401 [1,0,0,1,0,0|2,0,0]=4 23468 B12R1.8 CCCCCNC1CCOCC1 2230a_100000741149_100000210326 [1,0,0,1,0,0|2,0,0]=4 23469 B12R1.8 CCCCCNC1CCOCC1 270004a_100000209983_100011217826 [1,0,0,1,0,0|2,0,0]=4 23470 B12R1.8 CCCCCNC1CCOCC1 34a_100000741149_100000718602 [1,0,0,1,0,0|2,0,0]=4 23471 B12R1.8 CCCCCNC1CCSCC1 2230a_100000748639_100000210326 [1,0,0,1,0,0|2,0,0]=4 23472 B12R1.8 CCCCCNC1CCSCC1 270004a_100000209983_100000203788 [1,0,0,1,0,0|2,0,0]=4 23473 B12R1.8 CCCCCNC1CCSCC1 34a_100000748639_100000718602 [1,0,0,1,0,0|2,0,0]=4 23474 B12R1.8 CCCCCOC1CCCCC1 34a_100000210231_100000718602 [1,0,0,1,0,0|1,0,0]=3 23475 B12R1.8 CCCCCOC1CCCCC1 34a_100000210253_100000210327 [1,0,0,1,0,0|1,0,0]=3 23476 B12R1.8 CCCCCOC1CCCCC1 7a_100000210231_100000210326 [1,0,0,1,0,0|1,0,0]=3 23477 B12R1.8 CCCCCOC1CCCCC1 7a_100000210253_100000210327 [1,0,0,1,0,0|1,0,0]=3 23478 B12R1.8 CCCCCOC1CCCCO1 34a_100000033831_100000718602 [1,0,0,1,0,0|1,0,0]=3 23479 B12R1.8 CCCCCOC1CCCOC1 34a_100000210253_100000693364 [1,0,0,1,0,0|2,0,0]=4 23480 B12R1.8 CCCCCOC1CCCOC1 34a_100000754041_100000718602 [1,0,0,1,0,0|2,0,0]=4 23481 B12R1.8 CCCCCOC1CCCOC1 7a_100000210253_100000693364 [1,0,0,1,0,0|2,0,0]=4 23482 B12R1.8 CCCCCOC1CCCSC1 7a_100015962668_100000210326 [1,0,0,1,0,0|2,0,0]=4 23483 B12R1.8 CCCCCOC1CCOCC1 34a_100000744328_100000718602 [1,0,0,1,0,0|2,0,0]=4 23484 B12R1.8 CCCCCOC1CCOCC1 7a_100000210253_100000686592 [1,0,0,1,0,0|2,0,0]=4 23485 B12R1.8 CCCCCOC1CCSCC1 34a_100000210253_100000069128 [1,0,0,1,0,0|2,0,0]=4 23486 B12R1.8 CCCCCOC1CCSCC1 34a_100000731022_100000718602 [1,0,0,1,0,0|2,0,0]=4 23487 B12R1.8 CCCCCOC1CCSCC1 7a_100000210253_100011500858 [1,0,0,1,0,0|2,0,0]=4 23488 B12R1.8 CCCCCOC1CCSCC1 7a_100000731022_100000210326 [1,0,0,1,0,0|2,0,0]=4 23489 B12R1.8 CCCCCSC1CCCCC1 62a_100000210326_100000210327 [1,0,0,1,0,0|1,0,0]=3 23490 B12R1.8 CCCCCSC1CCCCC1 62a_100000210327_100000210326 [1,0,0,1,0,0|1,0,0]=3 23491 B12R1.8 CCCCCSC1CCCOC1 62a_100000210326_100000693364 [1,0,0,1,0,0|2,0,0]=4 23492 B12R1.8 CCCCCSC1CCOCC1 62a_100000210326_100011324220 [1,0,0,1,0,0|2,0,0]=4 23493 B12R1.8 CCCCCSC1CCSCC1 62a_100000210326_100000069128 [1,0,0,1,0,0|2,0,0]=4 23494 B12R1.8 CCCCNCC1CCCCC1 2230a_100000102301_100000211423 [1,0,0,1,0,0|1,0,0]=3 23495 B12R1.8 CCCCNCC1CCCCC1 2230a_100000210473_100000210211 [1,0,0,1,0,0|1,0,0]=3 23496 B12R1.8 CCCCNCC1CCCCC1 269862a_100000102301_100000211278 [1,0,0,1,0,0|1,0,0]=3 23497 B12R1.8 CCCCNCC1CCCCC1 34a_100000210473_100000210210 [1,0,0,1,0,0|1,0,0]=3 23498 B12R1.8 CCCCNCC1CCCCC1 7a_106832991798_100000211423 [1,0,0,1,0,0|1,0,0]=3 23499 B12R1.8 CCCCNCC1CCCCO1 2230a_100000102301_100000211543 [1,0,0,1,0,0|1,0,0]=3 23500 B12R1.8 CCCCNCC1CCCCO1 2230a_100000174945_100000210211 [1,0,0,1,0,0|1,0,0]=3 23501 B12R1.8 CCCCNCC1CCCCO1 34a_100000174945_100000210210 [1,0,0,1,0,0|1,0,0]=3 23502 B12R1.8 CCCCNCC1CCCCO1 7a_106832991798_100000211543 [1,0,0,1,0,0|1,0,0]=3 23503 B12R1.8 CCCCNCC1CCCOC1 2230a_100000102301_100000741521 [1,0,0,1,0,0|2,0,0]=4 23504 B12R1.8 CCCCNCC1CCCOC1 2230a_100000720124_100000210211 [1,0,0,1,0,0|2,0,0]=4 23505 B12R1.8 CCCCNCC1CCCOC1 34a_100000720124_100000210210 [1,0,0,1,0,0|2,0,0]=4 23506 B12R1.8 CCCCNCC1CCCOC1 7a_106832991798_100000741521 [1,0,0,1,0,0|2,0,0]=4 23507 B12R1.8 CCCCNCC1CCOCC1 2230a_100000102301_100000754603 [1,0,0,1,0,0|2,0,0]=4 23508 B12R1.8 CCCCNCC1CCOCC1 2230a_100000746373_100000210211 [1,0,0,1,0,0|2,0,0]=4 23509 B12R1.8 CCCCNCC1CCOCC1 269862a_100000102301_100000749017 [1,0,0,1,0,0|2,0,0]=4 23510 B12R1.8 CCCCNCC1CCOCC1 34a_100000746373_100000210210 [1,0,0,1,0,0|2,0,0]=4 23511 B12R1.8 CCCCNCC1CCOCC1 7a_106832991798_100000754603 [1,0,0,1,0,0|2,0,0]=4 23512 B12R1.8 CCCCNCC1CCSCC1 2230a_100015188806_100000210211 [1,0,0,1,0,0|2,0,0]=4 23513 B12R1.8 CCCCNCC1CCSCC1 269862a_100000102301_100000067145 [1,0,0,1,0,0|2,0,0]=4 23514 B12R1.8 CCCCNCC1CCSCC1 270004a_100000102301_100000067145 [1,0,0,1,0,0|2,0,0]=4 23515 B12R1.8 CCCCNCC1CCSCC1 34a_100015188806_100000210210 [1,0,0,1,0,0|2,0,0]=4 23516 B12R1.8 CCCCNC[C@H]1COCCO1 2230a_100010981119_100000210211 [1,0,0,1,0,0|2,0,0]=4 23517 B12R1.8 CCCCNC[C@H]1COCCO1 34a_100010981119_100000210210 [1,0,0,1,0,0|2,0,0]=4 23518 B12R1.8 CCCCOCC1CCCCC1 34a_100000210227_100000211423 [1,0,0,1,0,0|1,0,0]=3 23519 B12R1.8 CCCCOCC1CCCCC1 34a_100000212181_100000210210 [1,0,0,1,0,0|1,0,0]=3 23520 B12R1.8 CCCCOCC1CCCCC1 7a_100000210227_100000211423 [1,0,0,1,0,0|1,0,0]=3 23521 B12R1.8 CCCCOCC1CCCCC1 7a_100000212181_100000210211 [1,0,0,1,0,0|1,0,0]=3 23522 B12R1.8 CCCCOCC1CCCCN1 34a_100000210821_100000210210 [1,0,0,1,0,0|2,0,0]=4 23523 B12R1.8 CCCCOCC1CCCCO1 34a_100000210227_100000211543 [1,0,0,1,0,0|1,0,0]=3 23524 B12R1.8 CCCCOCC1CCCCO1 34a_100000211370_100000210210 [1,0,0,1,0,0|1,0,0]=3 23525 B12R1.8 CCCCOCC1CCCCO1 7a_100000210227_100000211543 [1,0,0,1,0,0|1,0,0]=3 23526 B12R1.8 CCCCOCC1CCCCO1 7a_100000211370_100000210211 [1,0,0,1,0,0|1,0,0]=3 23527 B12R1.8 CCCCOCC1CCCNC1 34a_100000211344_100000210210 [1,0,0,1,0,0|2,0,0]=4 23528 B12R1.8 CCCCOCC1CCCOC1 34a_100000210227_100000741521 [1,0,0,1,0,0|2,0,0]=4 23529 B12R1.8 CCCCOCC1CCCOC1 34a_100000741520_100000210210 [1,0,0,1,0,0|2,0,0]=4 23530 B12R1.8 CCCCOCC1CCCOC1 7a_100000210227_100000741521 [1,0,0,1,0,0|2,0,0]=4 23531 B12R1.8 CCCCOCC1CCNCC1 34a_100000738675_100000210210 [1,0,0,1,0,0|2,0,0]=4 23532 B12R1.8 CCCCOCC1CCOCC1 34a_100000210227_100000754603 [1,0,0,1,0,0|2,0,0]=4 23533 B12R1.8 CCCCOCC1CCOCC1 34a_100000749013_100000210210 [1,0,0,1,0,0|2,0,0]=4 23534 B12R1.8 CCCCOCC1CCOCC1 7a_100000210227_100000754603 [1,0,0,1,0,0|2,0,0]=4 23535 B12R1.8 CCCCOCC1CCSCC1 34a_100000070558_100000210210 [1,0,0,1,0,0|2,0,0]=4 23536 B12R1.8 CCCCOCC1CCSCC1 7a_100000070558_100000210211 [1,0,0,1,0,0|2,0,0]=4 23537 B12R1.8 CCCCOC[C@@H]1CNCCO1 34a_100015189573_100000210210 [1,0,0,1,0,0|2,0,0]=4 23538 B12R1.8 CCCCOC[C@H]1COCCO1 34a_100009875890_100000210210 [1,0,0,1,0,0|2,0,0]=4 23539 B12R1.8 CCCCSCC1CCCCC1 62a_100000210211_100000211423 [1,0,0,1,0,0|1,0,0]=3 23540 B12R1.8 CCCCSCC1CCCCC1 62a_100000211423_100000210210 [1,0,0,1,0,0|1,0,0]=3 23541 B12R1.8 CCCCSCC1CCCCO1 62a_100000210211_100000211543 [1,0,0,1,0,0|1,0,0]=3 23542 B12R1.8 CCCCSCC1CCCCO1 62a_100000211543_100000210210 [1,0,0,1,0,0|1,0,0]=3 23543 B12R1.8 CCCCSCC1CCCOC1 62a_100000210211_100000741521 [1,0,0,1,0,0|2,0,0]=4 23544 B12R1.8 CCCCSCC1CCCOC1 62a_100000741521_100000210210 [1,0,0,1,0,0|2,0,0]=4 23545 B12R1.8 CCCCSCC1CCOCC1 62a_100000210211_100000749018 [1,0,0,1,0,0|2,0,0]=4 23546 B12R1.8 CCCCSCC1CCOCC1 62a_100000754603_100000210210 [1,0,0,1,0,0|2,0,0]=4 23547 B12R1.8 CCCNCCC1CCCCC1 2230a_100000738074_100000210303 [1,0,0,1,0,0|1,0,0]=3 23548 B12R1.8 CCCNCCC1CCCCC1 270004a_100020643023_100011713444 [1,0,0,1,0,0|1,0,0]=3 23549 B12R1.8 CCCNCCC1CCCCC1 34a_100000738074_100000210303 [1,0,0,1,0,0|1,0,0]=3 23550 B12R1.8 CCCNCCC1CCCCO1 2230a_100015183643_100000210303 [1,0,0,1,0,0|1,0,0]=3 23551 B12R1.8 CCCNCCC1CCCCO1 34a_100015183643_100000210303 [1,0,0,1,0,0|1,0,0]=3 23552 B12R1.8 CCCNCCC1CCOCC1 2230a_100000755988_100000210303 [1,0,0,1,0,0|2,0,0]=4 23553 B12R1.8 CCCNCCC1CCOCC1 34a_100000755988_100000210303 [1,0,0,1,0,0|2,0,0]=4 23554 B12R1.8 CCCOCCC1CCCCC1 34a_100000210258_100011209188 [1,0,0,1,0,0|1,0,0]=3 23555 B12R1.8 CCCOCCC1CCCCC1 34a_100011217863_100000210303 [1,0,0,1,0,0|1,0,0]=3 23556 B12R1.8 CCCOCCC1CCCCC1 7a_100011217863_100000210303 [1,0,0,1,0,0|1,0,0]=3 23557 B12R1.8 CCCOCCC1CCCCN1 34a_100000211664_100000210303 [1,0,0,1,0,0|2,0,0]=4 23558 B12R1.8 CCCOCCC1CCCNC1 34a_100000752241_100000210303 [1,0,0,1,0,0|2,0,0]=4 23559 B12R1.8 CCCOCCC1CCNCC1 34a_100015190746_100000210303 [1,0,0,1,0,0|2,0,0]=4 23560 B12R1.8 CCCOCCC1CCOCC1 34a_100000210258_100011934994 [1,0,0,1,0,0|2,0,0]=4 23561 B12R1.8 CCCOCCC1CCOCC1 34a_100011933979_100000210303 [1,0,0,1,0,0|2,0,0]=4 23562 B12R1.8 CCCOCCC1CCOCC1 7a_100011933979_100000210303 [1,0,0,1,0,0|2,0,0]=4 23563 B12R1.8 CCCOCCC1OCCCO1 34a_100000210258_100000764188 [1,0,0,1,0,0|2,0,0]=4 23564 B12R1.8 CCCOCCN1CCCCC1 34a_100000210258_100000739454 [1,0,0,1,0,0|2,0,0]=4 23565 B12R1.8 CCCOCOC1CCCCC1 34a_100000210258_100011935260 [1,0,0,1,0,0|2,0,0]=4 23566 B12R1.8 CCCSCCC1CCCCC1 62a_100000210303_100012355289 [1,0,0,1,0,0|1,0,0]=3 23567 B12R1.8 CCCSCCC1CCCCC1 62a_100012355289_100000210303 [1,0,0,1,0,0|1,0,0]=3 23568 B12R1.8 CCCSCCC1CCOCC1 62a_100000210303_100011934994 [1,0,0,1,0,0|2,0,0]=4 23569 B12R1.8 CCCSCCC1CCOCC1 62a_100011934994_100000210303 [1,0,0,1,0,0|2,0,0]=4 23570 B12R1.8 CCCSCCC1OCCCO1 62a_100000210303_100000764188 [1,0,0,1,0,0|2,0,0]=4 23571 B12R1.8 CCCSCCC1OCCCO1 62a_100000764188_100000210303 [1,0,0,1,0,0|2,0,0]=4 23572 B12R1.8 CCCSCCN1CCCCC1 62a_100000210303_100000739454 [1,0,0,1,0,0|2,0,0]=4 23573 B12R1.8 CCCSCCN1CCCCC1 62a_100000739454_100000210303 [1,0,0,1,0,0|2,0,0]=4 23574 B12R1.8 CCCSCOC1CCCCC1 62a_100000210303_100011935260 [1,0,0,1,0,0|2,0,0]=4 23575 B12R1.8 CCCSCOC1CCCCC1 62a_100011935260_100000210303 [1,0,0,1,0,0|2,0,0]=4 23576 B12R1.8 CCNCCCC1CCCCC1 2230a_100011211642_100000210202 [1,0,0,1,0,0|1,0,0]=3 23577 B12R1.8 CCNCCCC1CCCCC1 2230a_100015525214_100011713725 [1,0,0,1,0,0|1,0,0]=3 23578 B12R1.8 CCNCCCC1CCCCC1 34a_100011211642_100000210202 [1,0,0,1,0,0|1,0,0]=3 23579 B12R1.8 CCNCCCN1CCCCC1 2230a_100015525214_100000690320 [1,0,0,1,0,0|2,0,0]=4 23580 B12R1.8 CCNCCOC1CCCCC1 2230a_100015525214_100011211530 [1,0,0,1,0,0|2,0,0]=4 23581 B12R1.8 CCNCCOC1CCCCC1 34a_100015206981_100000210202 [1,0,0,1,0,0|2,0,0]=4 23582 B12R1.8 CCNCCOC1CCCCO1 2230a_100015525214_100000744793 [1,0,0,1,0,0|2,0,0]=4 23583 B12R1.8 CCOCCCC1CCCCC1 34a_100000198086_100000210202 [1,0,0,1,0,0|1,0,0]=3 23584 B12R1.8 CCOCCCC1CCCCC1 34a_100121572206_100011713725 [1,0,0,1,0,0|1,0,0]=3 23585 B12R1.8 CCOCCCC1CCCCC1 7a_100000198086_100000210202 [1,0,0,1,0,0|1,0,0]=3 23586 B12R1.8 CCOCCCC1CCCCN1 34a_100011934581_100000210202 [1,0,0,1,0,0|2,0,0]=4 23587 B12R1.8 CCOCCCC1CCCNC1 34a_100150707839_100000210202 [1,0,0,1,0,0|2,0,0]=4 23588 B12R1.8 CCOCCCC1CCNCC1 34a_100016988962_100000210202 [1,0,0,1,0,0|2,0,0]=4 23589 B12R1.8 CCOCCCN1CCCCC1 34a_100000212458_100000210202 [1,0,0,1,0,0|2,0,0]=4 23590 B12R1.8 CCOCCCN1CCCCC1 34a_100121572206_100000690320 [1,0,0,1,0,0|2,0,0]=4 23591 B12R1.8 CCOCCNC1CCCCC1 2230a_100000182618_100011215890 [1,0,0,1,0,0|2,0,0]=4 23592 B12R1.8 CCOCCNC1CCCCC1 270004a_102516460346_100000210434 [1,0,0,1,0,0|2,0,0]=4 23593 B12R1.8 CCOCCNC1CCCCC1 34a_100000182618_100000210147 [1,0,0,1,0,0|2,0,0]=4 23594 B12R1.8 CCOCCNC1CCCCC1 34a_100000200466_100000210202 [1,0,0,1,0,0|2,0,0]=4 23595 B12R1.8 CCOCCNC1CCCCC1 34a_102516460346_100000210327 [1,0,0,1,0,0|2,0,0]=4 23596 B12R1.8 CCOCCOC1CCCCC1 34a_100000210136_100000210327 [1,0,0,1,0,0|2,0,0]=4 23597 B12R1.8 CCOCCOC1CCCCC1 34a_100000210231_100000210147 [1,0,0,1,0,0|2,0,0]=4 23598 B12R1.8 CCOCCOC1CCCCC1 34a_100011249652_100000210202 [1,0,0,1,0,0|2,0,0]=4 23599 B12R1.8 CCOCCOC1CCCCC1 34a_100121572206_100011211530 [1,0,0,1,0,0|2,0,0]=4 23600 B12R1.8 CCOCCOC1CCCCC1 7a_100000210136_100000210327 [1,0,0,1,0,0|2,0,0]=4 23601 B12R1.8 CCOCCOC1CCCCC1 7a_100000210231_100011215890 [1,0,0,1,0,0|2,0,0]=4 23602 B12R1.8 CCOCCOC1CCCCC1 7a_100011249652_100000210202 [1,0,0,1,0,0|2,0,0]=4 23603 B12R1.8 CCOCCOC1CCCCO1 34a_100000033831_100000210147 [1,0,0,1,0,0|2,0,0]=4 23604 B12R1.8 CCOCCOC1CCCCO1 34a_100000034223_100000210202 [1,0,0,1,0,0|2,0,0]=4 23605 B12R1.8 CCOCCOC1CCCCO1 34a_100121572206_100000744793 [1,0,0,1,0,0|2,0,0]=4 23606 B12R1.8 CCOCCOC1CCCCO1 7a_100000034223_100000210202 [1,0,0,1,0,0|2,0,0]=4 23607 B12R1.8 CCOCCSC1CCCCC1 62a_100000210147_100000210327 [1,0,0,1,0,0|2,0,0]=4 23608 B12R1.8 CCOCCSC1CCCCC1 62a_100000210327_100011215890 [1,0,0,1,0,0|2,0,0]=4 23609 B12R1.8 CCOCSCC1CCCCC1 62a_100000211423_100000739092 [1,0,0,1,0,0|2,0,0]=4 23610 B12R1.8 CCOCSCC1CCCCC1 62a_100000739092_100000211423 [1,0,0,1,0,0|2,0,0]=4 23611 B12R1.8 CCOCSCC1CCCCO1 62a_100000211543_100000739092 [1,0,0,1,0,0|2,0,0]=4 23612 B12R1.8 CCOCSCC1CCCCO1 62a_100000739092_100000211543 [1,0,0,1,0,0|2,0,0]=4 23613 B12R1.8 CCSCCCC1CCCCC1 62a_100000210202_100011713725 [1,0,0,1,0,0|1,0,0]=3 23614 B12R1.8 CCSCCCC1CCCCC1 62a_100011713725_100000210202 [1,0,0,1,0,0|1,0,0]=3 23615 B12R1.8 CCSCCCN1CCCCC1 62a_100000210202_100000007876 [1,0,0,1,0,0|2,0,0]=4 23616 B12R1.8 CCSCCCN1CCCCC1 62a_100132302099_100000210202 [1,0,0,1,0,0|2,0,0]=4 23617 B12R1.8 CCSCCNC1CCCCC1 2230a_100000182618_100000757381 [1,0,0,1,0,0|2,0,0]=4 23618 B12R1.8 CCSCCNC1CCCCC1 270004a_100000106463_100000210434 [1,0,0,1,0,0|2,0,0]=4 23619 B12R1.8 CCSCCNC1CCCCC1 34a_100000182618_100000757381 [1,0,0,1,0,0|2,0,0]=4 23620 B12R1.8 CCSCCOC1CCCCC1 34a_100000210231_100000757381 [1,0,0,1,0,0|2,0,0]=4 23621 B12R1.8 CCSCCOC1CCCCC1 34a_100000212035_100000210327 [1,0,0,1,0,0|2,0,0]=4 23622 B12R1.8 CCSCCOC1CCCCC1 62a_100000210202_100011211530 [1,0,0,1,0,0|2,0,0]=4 23623 B12R1.8 CCSCCOC1CCCCC1 62a_100011211530_100000210202 [1,0,0,1,0,0|2,0,0]=4 23624 B12R1.8 CCSCCOC1CCCCC1 7a_100000210231_100000757381 [1,0,0,1,0,0|2,0,0]=4 23625 B12R1.8 CCSCCOC1CCCCC1 7a_100000212035_100000210327 [1,0,0,1,0,0|2,0,0]=4 23626 B12R1.8 CCSCCOC1CCCCO1 34a_100000033831_100000757381 [1,0,0,1,0,0|2,0,0]=4 23627 B12R1.8 CCSCCOC1CCCCO1 62a_100000210202_100000744793 [1,0,0,1,0,0|2,0,0]=4 23628 B12R1.8 CCSCCOC1CCCCO1 62a_100000744793_100000210202 [1,0,0,1,0,0|2,0,0]=4 23629 B12R1.8 CCSCCSC1CCCCC1 62a_100000210327_100000757381 [1,0,0,1,0,0|2,0,0]=4 23630 B12R1.8 CCSCCSC1CCCCC1 62a_100000757381_100000210327 [1,0,0,1,0,0|2,0,0]=4 23631 B12R1.8 CNCCCOC1CCCCC1 34a_100000205933_200000210301 [1,0,0,1,0,0|2,0,0]=4 23632 B12R1.8 CNCCCOC1CCCCC1 34a_100000213112_100000210327 [1,0,0,1,0,0|2,0,0]=4 23633 B12R1.8 CNCCCOC1CCCCO1 2230a_106832991635_100000700653 [1,0,0,1,0,0|2,0,0]=4 23634 B12R1.8 CNCCCOC1CCCCO1 34a_100102657272_100000700653 [1,0,0,1,0,0|2,0,0]=4 23635 B12R1.8 CNCCCOC1CCCCO1 7a_106832991635_100000700653 [1,0,0,1,0,0|2,0,0]=4 23636 B12R1.8 COCCCCC1CCCCC1 34a_100011215267_200000210301 [1,0,0,1,0,0|1,0,0]=3 23637 B12R1.8 COCCCCC1CCCCC1 7a_100011215267_200000210301 [1,0,0,1,0,0|1,0,0]=3 23638 B12R1.8 COCCCCC1CCNCC1 34a_100016989291_200000210301 [1,0,0,1,0,0|2,0,0]=4 23639 B12R1.8 COCCCNC1CCCCC1 2230a_100000182618_100000740836 [1,0,0,1,0,0|2,0,0]=4 23640 B12R1.8 COCCCNC1CCCCC1 270004a_100150723488_100000210434 [1,0,0,1,0,0|2,0,0]=4 23641 B12R1.8 COCCCNC1CCCCC1 34a_100000182618_100000740836 [1,0,0,1,0,0|2,0,0]=4 23642 B12R1.8 COCCCNC1CCCCC1 34a_100150723488_100000210327 [1,0,0,1,0,0|2,0,0]=4 23643 B12R1.8 COCCCOC1CCCCC1 34a_100000210231_100000740836 [1,0,0,1,0,0|2,0,0]=4 23644 B12R1.8 COCCCOC1CCCCC1 34a_100000740835_100000210327 [1,0,0,1,0,0|2,0,0]=4 23645 B12R1.8 COCCCOC1CCCCC1 7a_100000210231_100000740836 [1,0,0,1,0,0|2,0,0]=4 23646 B12R1.8 COCCCOC1CCCCO1 34a_100000033831_100000740836 [1,0,0,1,0,0|2,0,0]=4 23647 B12R1.8 COCCCOC1CCCCO1 34a_100138415774_100000700653 [1,0,0,1,0,0|2,0,0]=4 23648 B12R1.8 COCCCSC1CCCCC1 62a_100000210327_100000709357 [1,0,0,1,0,0|2,0,0]=4 23649 B12R1.8 COCCCSC1CCCCC1 62a_100000709357_100000210327 [1,0,0,1,0,0|2,0,0]=4 23650 B12R1.8 COCCNCC1CCCCC1 2230a_100000209980_100000211423 [1,0,0,1,0,0|2,0,0]=4 23651 B12R1.8 COCCNCC1CCCCC1 2230a_100000210473_100011201679 [1,0,0,1,0,0|2,0,0]=4 23652 B12R1.8 COCCNCC1CCCCC1 269862a_100000209980_100000211278 [1,0,0,1,0,0|2,0,0]=4 23653 B12R1.8 COCCNCC1CCCCC1 34a_100000210473_100011201679 [1,0,0,1,0,0|2,0,0]=4 23654 B12R1.8 COCCNCC1CCCCO1 2230a_100000174945_100011201679 [1,0,0,1,0,0|2,0,0]=4 23655 B12R1.8 COCCNCC1CCCCO1 2230a_100000209980_100000211543 [1,0,0,1,0,0|2,0,0]=4 23656 B12R1.8 COCCNCC1CCCCO1 34a_100000174945_100011201679 [1,0,0,1,0,0|2,0,0]=4 23657 B12R1.8 COCCOCC1CCCCC1 34a_100000210237_100000211423 [1,0,0,1,0,0|2,0,0]=4 23658 B12R1.8 COCCOCC1CCCCC1 34a_100000212181_100011201679 [1,0,0,1,0,0|2,0,0]=4 23659 B12R1.8 COCCOCC1CCCCC1 7a_100000212181_100000233755 [1,0,0,1,0,0|2,0,0]=4 23660 B12R1.8 COCCOCC1CCCCO1 34a_100000210237_100000211543 [1,0,0,1,0,0|2,0,0]=4 23661 B12R1.8 COCCOCC1CCCCO1 34a_100000211370_100011201679 [1,0,0,1,0,0|2,0,0]=4 23662 B12R1.8 COCCOCC1CCCCO1 7a_100000211370_100000233755 [1,0,0,1,0,0|2,0,0]=4 23663 B12R1.8 COCCSCC1CCCCC1 62a_100000211423_100000233755 [1,0,0,1,0,0|2,0,0]=4 23664 B12R1.8 COCCSCC1CCCCC1 62a_100000233755_100000211423 [1,0,0,1,0,0|2,0,0]=4 23665 B12R1.8 COCCSCC1CCCCO1 62a_100000211543_100000233755 [1,0,0,1,0,0|2,0,0]=4 23666 B12R1.8 COCCSCC1CCCCO1 62a_100000233755_100000211543 [1,0,0,1,0,0|2,0,0]=4 23667 B12R1.8 COCNCCC1CCCCC1 2230a_100000738074_100000766300 [1,0,0,1,0,0|2,0,0]=4 23668 B12R1.8 COCNCCC1CCCCO1 2230a_100015183643_100000766300 [1,0,0,1,0,0|2,0,0]=4 23669 B12R1.8 COCSCCC1CCCCC1 62a_100000766300_100012355289 [1,0,0,1,0,0|2,0,0]=4 23670 B12R1.8 COCSCCC1CCCCC1 62a_100012355289_100000766300 [1,0,0,1,0,0|2,0,0]=4 23671 B12R1.8 CSCCCNC1CCCCC1 270004a_100000749238_100000210434 [1,0,0,1,0,0|2,0,0]=4 23672 B12R1.8 CSCCCOC1CCCCC1 34a_100000690336_100000210327 [1,0,0,1,0,0|2,0,0]=4 23673 B12R1.8 CSCCCOC1CCCCC1 7a_100000690336_100000210327 [1,0,0,1,0,0|2,0,0]=4 23674 B12R1.8 CSCCCOC1CCCCO1 62a_100000700653_200000210301 [1,0,0,1,0,0|2,0,0]=4 23675 B12R1.8 CSCCCOC1CCCCO1 62a_200000210301_100000700653 [1,0,0,1,0,0|2,0,0]=4 23676 B12R1.8 CSCCNCC1CCCCC1 2230a_100000210473_100000751147 [1,0,0,1,0,0|2,0,0]=4 23677 B12R1.8 CSCCNCC1CCCCC1 2230a_100020590264_100000211423 [1,0,0,1,0,0|2,0,0]=4 23678 B12R1.8 CSCCNCC1CCCCC1 269862a_100020590264_100000211278 [1,0,0,1,0,0|2,0,0]=4 23679 B12R1.8 CSCCNCC1CCCCC1 34a_100000210473_100000212216 [1,0,0,1,0,0|2,0,0]=4 23680 B12R1.8 CSCCNCC1CCCCO1 2230a_100000174945_100000751147 [1,0,0,1,0,0|2,0,0]=4 23681 B12R1.8 CSCCNCC1CCCCO1 2230a_100020590264_100000211543 [1,0,0,1,0,0|2,0,0]=4 23682 B12R1.8 CSCCNCC1CCCCO1 34a_100000174945_100000212216 [1,0,0,1,0,0|2,0,0]=4 23683 B12R1.8 CSCCOCC1CCCCC1 34a_100000212181_100000212216 [1,0,0,1,0,0|2,0,0]=4 23684 B12R1.8 CSCCOCC1CCCCC1 34a_100000230434_100000211423 [1,0,0,1,0,0|2,0,0]=4 23685 B12R1.8 CSCCOCC1CCCCC1 7a_100000212181_100000212216 [1,0,0,1,0,0|2,0,0]=4 23686 B12R1.8 CSCCOCC1CCCCC1 7a_100000230434_100000211423 [1,0,0,1,0,0|2,0,0]=4 23687 B12R1.8 CSCCOCC1CCCCO1 34a_100000211370_100000212216 [1,0,0,1,0,0|2,0,0]=4 23688 B12R1.8 CSCCOCC1CCCCO1 34a_100000230434_100000211543 [1,0,0,1,0,0|2,0,0]=4 23689 B12R1.8 CSCCOCC1CCCCO1 7a_100000211370_100000212216 [1,0,0,1,0,0|2,0,0]=4 23690 B12R1.8 CSCCOCC1CCCCO1 7a_100000230434_100000211543 [1,0,0,1,0,0|2,0,0]=4 23691 B12R1.8 CSCCSCC1CCCCC1 62a_100000211423_100000751147 [1,0,0,1,0,0|2,0,0]=4 23692 B12R1.8 CSCCSCC1CCCCC1 62a_100000212216_100000211423 [1,0,0,1,0,0|2,0,0]=4 23693 B12R1.8 CSCCSCC1CCCCO1 62a_100000211543_100000751147 [1,0,0,1,0,0|2,0,0]=4 23694 B12R1.8 CSCCSCC1CCCCO1 62a_100000212216_100000211543 [1,0,0,1,0,0|2,0,0]=4 23695 B12R1.8 CSCNCCC1CCCCC1 2230a_100000738074_100011218213 [1,0,0,1,0,0|2,0,0]=4 23696 B12R1.8 CSCNCCC1CCCCC1 34a_100000738074_100011218213 [1,0,0,1,0,0|2,0,0]=4 23697 B12R1.8 CSCNCCC1CCCCO1 2230a_100015183643_100011218213 [1,0,0,1,0,0|2,0,0]=4 23698 B12R1.8 CSCNCCC1CCCCO1 34a_100015183643_100011218213 [1,0,0,1,0,0|2,0,0]=4 23699 B12R1.8 CSCOCCC1CCCCC1 34a_100011217863_100011218213 [1,0,0,1,0,0|2,0,0]=4 23700 B12R1.8 CSCSCCC1CCCCC1 62a_100011218213_100012355289 [1,0,0,1,0,0|2,0,0]=4 23701 B12R1.8 CSCSCCC1CCCCC1 62a_100012355289_100011218213 [1,0,0,1,0,0|2,0,0]=4 23702 B12R1.8 ClCCCCOC1CCCCC1 34a_100000210776_100000210327 [1,0,0,1,0,0|2,0,0]=4 23703 B12R1.8 ClCCCCOC1CCCCC1 7a_100000210776_100000210327 [1,0,0,1,0,0|2,0,0]=4 23704 B12R1.8 ClCCCOCC1CCCCC1 34a_100000230001_100000211423 [1,0,0,1,0,0|2,0,0]=4 23705 B12R1.8 ClCCCOCC1CCCCO1 34a_100000230001_100000211543 [1,0,0,1,0,0|2,0,0]=4 23706 B12R1.8 FCCCCNC1CCCCC1 2230a_100000182618_100000729493 [1,0,0,1,0,0|2,0,0]=4 23707 B12R1.8 FCCCCNC1CCCCC1 34a_100000182618_100000729493 [1,0,0,1,0,0|2,0,0]=4 23708 B12R1.8 FCCCCOC1CCCCC1 34a_100000210231_100000729493 [1,0,0,1,0,0|2,0,0]=4 23709 B12R1.8 FCCCCOC1CCCCC1 34a_100011995726_100000210327 [1,0,0,1,0,0|2,0,0]=4 23710 B12R1.8 FCCCCOC1CCCCC1 7a_100000210231_100000729493 [1,0,0,1,0,0|2,0,0]=4 23711 B12R1.8 FCCCCOC1CCCCC1 7a_100011995726_100000210327 [1,0,0,1,0,0|2,0,0]=4 23712 B12R1.8 FCCCCOC1CCCCO1 34a_100000033831_100000729493 [1,0,0,1,0,0|2,0,0]=4 23713 B12R1.8 FCCCCSC1CCCCC1 62a_100000210327_100000729493 [1,0,0,1,0,0|2,0,0]=4 23714 B12R1.8 FCCCCSC1CCCCC1 62a_100000729493_100000210327 [1,0,0,1,0,0|2,0,0]=4 23715 B12R1.8 FCCCNCC1CCCCC1 2230a_100000210473_100011934791 [1,0,0,1,0,0|2,0,0]=4 23716 B12R1.8 FCCCNCC1CCCCC1 2230a_100015189416_100000211423 [1,0,0,1,0,0|2,0,0]=4 23717 B12R1.8 FCCCNCC1CCCCC1 269862a_100015189416_100000211278 [1,0,0,1,0,0|2,0,0]=4 23718 B12R1.8 FCCCNCC1CCCCC1 34a_100000210473_100011934791 [1,0,0,1,0,0|2,0,0]=4 23719 B12R1.8 FCCCNCC1CCCCC1 34a_100015189416_100000211423 [1,0,0,1,0,0|2,0,0]=4 23720 B12R1.8 FCCCNCC1CCCCO1 2230a_100000174945_100011934791 [1,0,0,1,0,0|2,0,0]=4 23721 B12R1.8 FCCCNCC1CCCCO1 2230a_100015189416_100000211543 [1,0,0,1,0,0|2,0,0]=4 23722 B12R1.8 FCCCNCC1CCCCO1 34a_100000174945_100011934791 [1,0,0,1,0,0|2,0,0]=4 23723 B12R1.8 FCCCNCC1CCCCO1 34a_100015189416_100000211543 [1,0,0,1,0,0|2,0,0]=4 23724 B12R1.8 FCCCOCC1CCCCC1 34a_100000212181_100011934791 [1,0,0,1,0,0|2,0,0]=4 23725 B12R1.8 FCCCOCC1CCCCC1 34a_100000759539_100000211423 [1,0,0,1,0,0|2,0,0]=4 23726 B12R1.8 FCCCOCC1CCCCC1 7a_100000212181_100011934791 [1,0,0,1,0,0|2,0,0]=4 23727 B12R1.8 FCCCOCC1CCCCO1 34a_100000211370_100011934791 [1,0,0,1,0,0|2,0,0]=4 23728 B12R1.8 FCCCOCC1CCCCO1 34a_100000759539_100000211543 [1,0,0,1,0,0|2,0,0]=4 23729 B12R1.8 FCCCOCC1CCCCO1 7a_100000211370_100011934791 [1,0,0,1,0,0|2,0,0]=4 23730 B12R1.8 FCCCSCC1CCCCC1 62a_100000211423_100011934791 [1,0,0,1,0,0|2,0,0]=4 23731 B12R1.8 FCCCSCC1CCCCC1 62a_100011934791_100000211423 [1,0,0,1,0,0|2,0,0]=4 23732 B12R1.8 FCCCSCC1CCCCO1 62a_100000211543_100011934791 [1,0,0,1,0,0|2,0,0]=4 23733 B12R1.8 FCCCSCC1CCCCO1 62a_100011934791_100000211543 [1,0,0,1,0,0|2,0,0]=4 23734 B12R1.8 FCCNCCC1CCCCC1 2230a_100000738074_100011217306 [1,0,0,1,0,0|2,0,0]=4 23735 B12R1.8 FCCNCCC1CCCCC1 34a_100000724931_100011209188 [1,0,0,1,0,0|2,0,0]=4 23736 B12R1.8 FCCNCCC1CCCCC1 34a_100000738074_100011217306 [1,0,0,1,0,0|2,0,0]=4 23737 B12R1.8 FCCNCCC1CCCCO1 2230a_100015183643_100011217306 [1,0,0,1,0,0|2,0,0]=4 23738 B12R1.8 FCCNCCC1CCCCO1 34a_100015183643_100011217306 [1,0,0,1,0,0|2,0,0]=4 23739 B12R1.8 FCCOCCC1CCCCC1 34a_100011217863_100011217306 [1,0,0,1,0,0|2,0,0]=4 23740 B12R1.8 FCCOCCC1CCCCC1 7a_100011217863_100011217306 [1,0,0,1,0,0|2,0,0]=4 23741 B12R1.8 FCCSCCC1CCCCC1 62a_100011217306_100012355289 [1,0,0,1,0,0|2,0,0]=4 23742 B12R1.8 FCCSCCC1CCCCC1 62a_100012355289_100011217306 [1,0,0,1,0,0|2,0,0]=4 23743 B12R1.8 FCNCCCC1CCCCC1 34a_100011211642_100015361967 [1,0,0,1,0,0|2,0,0]=4 23744 B12R1.8 FCOCCCC1CCCCC1 34a_100000198086_100015361967 [1,0,0,1,0,0|2,0,0]=4 23745 B12R1.8 FCOCCCC1CCCCC1 7a_100000198086_100015361967 [1,0,0,1,0,0|2,0,0]=4 23746 B12R1.8 FCSCCCC1CCCCC1 62a_100011713725_100015361967 [1,0,0,1,0,0|2,0,0]=4 23747 B12R1.8 FCSCCCC1CCCCC1 62a_100015361967_100011713725 [1,0,0,1,0,0|2,0,0]=4 23748 B12R1.8 ICCCCOC1CCCCC1 34a_200012148704_100000210327 [1,0,0,1,0,0|2,0,0]=4 23749 B12R1.8 NCCCCOC1CCCCC1 34a_100000750430_100000210327 [1,0,0,1,0,0|2,0,0]=4 23750 B12R1.8 NCCCOCC1CCCCC1 34a_100000182051_100000211423 [1,0,0,1,0,0|2,0,0]=4 23751 B12R1.8 NCCCOCC1CCCCO1 34a_100000182051_100000211543 [1,0,0,1,0,0|2,0,0]=4 23752 B12R1.8 NCCOCCC1CCCCC1 34a_100000210304_100011209188 [1,0,0,1,0,0|2,0,0]=4 23753 B12R1.8 OCCCCCN1CCCOC1 2230a_100000131196_100000746330 [1,0,0,1,0,0|2,0,0]=4 23754 B12R1.8 OCCCCCN1CCCOC1 269982a_100000131196_100000746330 [1,0,0,1,0,0|2,0,0]=4 23755 B12R1.8 OCCCCCN1CCCOC1 34a_100000131196_100000746330 [1,0,0,1,0,0|2,0,0]=4 23756 B12R1.8 OCCCCCN1CCOCC1 2230a_100015191051_100000746330 [1,0,0,1,0,0|2,0,0]=4 23757 B12R1.8 OCCCCCN1CCOCC1 269982a_100015191051_100000746330 [1,0,0,1,0,0|2,0,0]=4 23758 B12R1.8 OCCCCCN1CCOCC1 34a_100015191051_100000746330 [1,0,0,1,0,0|2,0,0]=4 23759 B12R1.8 OCCCCCN1CCSCC1 2230a_100000737611_100000746330 [1,0,0,1,0,0|2,0,0]=4 23760 B12R1.8 OCCCCCN1CCSCC1 269982a_100000737611_100000746330 [1,0,0,1,0,0|2,0,0]=4 23761 B12R1.8 OCCCCNC1CCCCC1 2230a_100000182618_100000210776 [1,0,0,1,0,0|1,0,0]=3 23762 B12R1.8 OCCCCNC1CCCCC1 270004a_100000750430_100000210434 [1,0,0,1,0,0|1,0,0]=3 23763 B12R1.8 OCCCCNC1CCCCC1 34a_100000182618_100011216708 [1,0,0,1,0,0|1,0,0]=3 23764 B12R1.8 OCCCCNC1CCCCC1 34a_100000750430_100000210327 [1,0,0,1,0,0|1,0,0]=3 23765 B12R1.8 OCCCCNC1CCCOC1 2230a_100000719290_100000210776 [1,0,0,1,0,0|2,0,0]=4 23766 B12R1.8 OCCCCNC1CCCOC1 270004a_100000750430_100000753404 [1,0,0,1,0,0|2,0,0]=4 23767 B12R1.8 OCCCCNC1CCCOC1 34a_100000719290_100011216708 [1,0,0,1,0,0|2,0,0]=4 23768 B12R1.8 OCCCCNC1CCCOC1 34a_100000750430_100000693364 [1,0,0,1,0,0|2,0,0]=4 23769 B12R1.8 OCCCCNC1CCCSC1 270004a_100000750430_100000057913 [1,0,0,1,0,0|2,0,0]=4 23770 B12R1.8 OCCCCNC1CCNCC1 270004a_100000750430_100015192401 [1,0,0,1,0,0|2,0,0]=4 23771 B12R1.8 OCCCCNC1CCOCC1 2230a_100000741149_100000210776 [1,0,0,1,0,0|2,0,0]=4 23772 B12R1.8 OCCCCNC1CCOCC1 270004a_100000750430_100011217826 [1,0,0,1,0,0|2,0,0]=4 23773 B12R1.8 OCCCCNC1CCOCC1 34a_100000741149_100011216708 [1,0,0,1,0,0|2,0,0]=4 23774 B12R1.8 OCCCCNC1CCSCC1 2230a_100000748639_100000210776 [1,0,0,1,0,0|2,0,0]=4 23775 B12R1.8 OCCCCNC1CCSCC1 270004a_100000750430_100000203788 [1,0,0,1,0,0|2,0,0]=4 23776 B12R1.8 OCCCCNC1CCSCC1 34a_100000748639_100011216708 [1,0,0,1,0,0|2,0,0]=4 23777 B12R1.8 OCCCCNC1CCSCC1 34a_100000750430_100000069128 [1,0,0,1,0,0|2,0,0]=4 23778 B12R1.8 OCCCCOC1CCCCC1 34a_100000210231_100011216708 [1,0,0,1,0,0|1,0,0]=3 23779 B12R1.8 OCCCCOC1CCCCC1 7a_100000210231_100000210776 [1,0,0,1,0,0|1,0,0]=3 23780 B12R1.8 OCCCCOC1CCCCO1 34a_100000033831_100011216708 [1,0,0,1,0,0|2,0,0]=4 23781 B12R1.8 OCCCCOC1CCCOC1 34a_100000754041_100011216708 [1,0,0,1,0,0|2,0,0]=4 23782 B12R1.8 OCCCCOC1CCCSC1 7a_100015962668_100000210776 [1,0,0,1,0,0|2,0,0]=4 23783 B12R1.8 OCCCCOC1CCOCC1 34a_100000744328_100011216708 [1,0,0,1,0,0|2,0,0]=4 23784 B12R1.8 OCCCCOC1CCSCC1 34a_100000731022_100011216708 [1,0,0,1,0,0|2,0,0]=4 23785 B12R1.8 OCCCCOC1CCSCC1 7a_100000731022_100000210776 [1,0,0,1,0,0|2,0,0]=4 23786 B12R1.8 OCCCCSC1CCCCC1 62a_100000210327_100000210776 [1,0,0,1,0,0|1,0,0]=3 23787 B12R1.8 OCCCCSC1CCCCC1 62a_100000210776_100000210327 [1,0,0,1,0,0|1,0,0]=3 23788 B12R1.8 OCCCCSC1CCCOC1 62a_100000210776_100000693364 [1,0,0,1,0,0|2,0,0]=4 23789 B12R1.8 OCCCCSC1CCOCC1 62a_100000210776_100011324220 [1,0,0,1,0,0|2,0,0]=4 23790 B12R1.8 OCCCCSC1CCSCC1 62a_100000210776_100000069128 [1,0,0,1,0,0|2,0,0]=4 23791 B12R1.8 OCCCNCC1CCCCC1 2230a_100000210473_100000230001 [1,0,0,1,0,0|1,0,0]=3 23792 B12R1.8 OCCCNCC1CCCCC1 269862a_100000182051_100000211278 [1,0,0,1,0,0|1,0,0]=3 23793 B12R1.8 OCCCNCC1CCCCC1 34a_100000210473_100000230001 [1,0,0,1,0,0|1,0,0]=3 23794 B12R1.8 OCCCNCC1CCCCO1 2230a_100000174945_100000230001 [1,0,0,1,0,0|2,0,0]=4 23795 B12R1.8 OCCCNCC1CCCCO1 34a_100000174945_100000230001 [1,0,0,1,0,0|2,0,0]=4 23796 B12R1.8 OCCCNCC1CCCOC1 2230a_100000720124_100000230001 [1,0,0,1,0,0|2,0,0]=4 23797 B12R1.8 OCCCNCC1CCCOC1 34a_100000720124_100000230001 [1,0,0,1,0,0|2,0,0]=4 23798 B12R1.8 OCCCNCC1CCOCC1 2230a_100000746373_100000230001 [1,0,0,1,0,0|2,0,0]=4 23799 B12R1.8 OCCCNCC1CCOCC1 269862a_100000182051_100000749017 [1,0,0,1,0,0|2,0,0]=4 23800 B12R1.8 OCCCNCC1CCOCC1 34a_100000746373_100000230001 [1,0,0,1,0,0|2,0,0]=4 23801 B12R1.8 OCCCNCC1CCSCC1 2230a_100015188806_100000230001 [1,0,0,1,0,0|2,0,0]=4 23802 B12R1.8 OCCCNCC1CCSCC1 269862a_100000182051_100000067145 [1,0,0,1,0,0|2,0,0]=4 23803 B12R1.8 OCCCNCC1CCSCC1 270004a_100000182051_100000067145 [1,0,0,1,0,0|2,0,0]=4 23804 B12R1.8 OCCCNCC1CCSCC1 34a_100015188806_100000230001 [1,0,0,1,0,0|2,0,0]=4 23805 B12R1.8 OCCCOCC1CCCCC1 34a_100000212181_100000230001 [1,0,0,1,0,0|1,0,0]=3 23806 B12R1.8 OCCCOCC1CCCCC1 7a_100000212181_100011215043 [1,0,0,1,0,0|1,0,0]=3 23807 B12R1.8 OCCCOCC1CCCCN1 34a_100000210821_100000230001 [1,0,0,1,0,0|2,0,0]=4 23808 B12R1.8 OCCCOCC1CCCCO1 34a_100000211370_100000230001 [1,0,0,1,0,0|2,0,0]=4 23809 B12R1.8 OCCCOCC1CCCCO1 7a_100000211370_100011215043 [1,0,0,1,0,0|2,0,0]=4 23810 B12R1.8 OCCCOCC1CCCNC1 34a_100000211344_100000230001 [1,0,0,1,0,0|2,0,0]=4 23811 B12R1.8 OCCCOCC1CCCOC1 34a_100000741520_100000230001 [1,0,0,1,0,0|2,0,0]=4 23812 B12R1.8 OCCCOCC1CCNCC1 34a_100000738675_100000230001 [1,0,0,1,0,0|2,0,0]=4 23813 B12R1.8 OCCCOCC1CCOCC1 34a_100000749013_100000230001 [1,0,0,1,0,0|2,0,0]=4 23814 B12R1.8 OCCCOCC1CCSCC1 34a_100000070558_100000230001 [1,0,0,1,0,0|2,0,0]=4 23815 B12R1.8 OCCCOCC1CCSCC1 7a_100000070558_100011215043 [1,0,0,1,0,0|2,0,0]=4 23816 B12R1.8 OCCCSCC1CCCCC1 62a_100000211423_100011215043 [1,0,0,1,0,0|1,0,0]=3 23817 B12R1.8 OCCCSCC1CCCCC1 62a_100011215043_100000211423 [1,0,0,1,0,0|1,0,0]=3 23818 B12R1.8 OCCCSCC1CCCCO1 62a_100000211543_100011215043 [1,0,0,1,0,0|2,0,0]=4 23819 B12R1.8 OCCCSCC1CCCCO1 62a_100011215043_100000211543 [1,0,0,1,0,0|2,0,0]=4 23820 B12R1.8 OCCCSCC1CCCOC1 62a_100000741521_100011215043 [1,0,0,1,0,0|2,0,0]=4 23821 B12R1.8 OCCCSCC1CCCOC1 62a_100011215043_100000741521 [1,0,0,1,0,0|2,0,0]=4 23822 B12R1.8 OCCCSCC1CCOCC1 62a_100000754603_100011215043 [1,0,0,1,0,0|2,0,0]=4 23823 B12R1.8 OCCCSCC1CCOCC1 62a_100011215043_100000749018 [1,0,0,1,0,0|2,0,0]=4 23824 B12R1.8 OCCNCCC1CCCCC1 2230a_100000738074_100000211926 [1,0,0,1,0,0|1,0,0]=3 23825 B12R1.8 OCCNCCC1CCCCC1 2230a_100016997473_100012355289 [1,0,0,1,0,0|1,0,0]=3 23826 B12R1.8 OCCNCCC1CCCCC1 270004a_100000210304_100011713444 [1,0,0,1,0,0|1,0,0]=3 23827 B12R1.8 OCCNCCC1CCCCC1 34a_100000738074_100000211926 [1,0,0,1,0,0|1,0,0]=3 23828 B12R1.8 OCCNCCC1CCCCC1 34a_100016990907_100011209188 [1,0,0,1,0,0|1,0,0]=3 23829 B12R1.8 OCCNCCC1CCCCO1 2230a_100015183643_100000211926 [1,0,0,1,0,0|2,0,0]=4 23830 B12R1.8 OCCNCCC1CCCCO1 34a_100015183643_100000211926 [1,0,0,1,0,0|2,0,0]=4 23831 B12R1.8 OCCNCCC1CCOCC1 2230a_100000755988_100000211926 [1,0,0,1,0,0|2,0,0]=4 23832 B12R1.8 OCCNCCC1CCOCC1 2230a_100016997473_100011934994 [1,0,0,1,0,0|2,0,0]=4 23833 B12R1.8 OCCNCCC1CCOCC1 34a_100000755988_100000211926 [1,0,0,1,0,0|2,0,0]=4 23834 B12R1.8 OCCNCCC1CCOCC1 34a_100016990907_100011934994 [1,0,0,1,0,0|2,0,0]=4 23835 B12R1.8 OCCNCCN1CCCCC1 2230a_100016997473_100000739454 [1,0,0,1,0,0|2,0,0]=4 23836 B12R1.8 OCCNCCN1CCCCC1 34a_100016990907_100000739454 [1,0,0,1,0,0|2,0,0]=4 23837 B12R1.8 OCCNCOC1CCCCC1 2230a_100016997473_100011935260 [1,0,0,1,0,0|2,0,0]=4 23838 B12R1.8 OCCNCOC1CCCCC1 34a_100016990907_100011935260 [1,0,0,1,0,0|2,0,0]=4 23839 B12R1.8 OCCOCCC1CCCCC1 34a_100011217863_100000211926 [1,0,0,1,0,0|1,0,0]=3 23840 B12R1.8 OCCOCCC1CCCCC1 7a_100011217863_100000211926 [1,0,0,1,0,0|1,0,0]=3 23841 B12R1.8 OCCOCCC1CCCCN1 34a_100000211664_100000211926 [1,0,0,1,0,0|2,0,0]=4 23842 B12R1.8 OCCOCCC1CCCNC1 34a_100000752241_100000211926 [1,0,0,1,0,0|2,0,0]=4 23843 B12R1.8 OCCOCCC1CCNCC1 34a_100015190746_100000211926 [1,0,0,1,0,0|2,0,0]=4 23844 B12R1.8 OCCOCCC1CCOCC1 34a_100011933979_100000211926 [1,0,0,1,0,0|2,0,0]=4 23845 B12R1.8 OCCOCCC1CCOCC1 7a_100011933979_100000211926 [1,0,0,1,0,0|2,0,0]=4 23846 B12R1.8 OCCSCCC1CCCCC1 62a_100000211926_100012355289 [1,0,0,1,0,0|1,0,0]=3 23847 B12R1.8 OCCSCCC1CCCCC1 62a_100012355289_100000211926 [1,0,0,1,0,0|1,0,0]=3 23848 B12R1.8 OCCSCCC1CCOCC1 62a_100000211926_100011934994 [1,0,0,1,0,0|2,0,0]=4 23849 B12R1.8 OCCSCCC1CCOCC1 62a_100011934994_100000211926 [1,0,0,1,0,0|2,0,0]=4 23850 B12R1.8 OCCSCCN1CCCCC1 62a_100000211926_100000739454 [1,0,0,1,0,0|2,0,0]=4 23851 B12R1.8 OCCSCCN1CCCCC1 62a_100000739454_100000211926 [1,0,0,1,0,0|2,0,0]=4 23852 B12R1.8 OCCSCOC1CCCCC1 62a_100000211926_100011935260 [1,0,0,1,0,0|2,0,0]=4 23853 B12R1.8 OCCSCOC1CCCCC1 62a_100011935260_100000211926 [1,0,0,1,0,0|2,0,0]=4 23854 B12R1.8 [13CH3]NCCCOC1CCCCC1 34a_100000205933_200025704644 [1,0,0,1,0,0|2,0,0]=4 23855 B12R1.8 [13CH3]OCCCCC1CCCCC1 34a_100011215267_200025704644 [1,0,0,1,0,0|1,0,0]=3 23856 B12R1.8 [13CH3]OCCCCC1CCCCC1 7a_100011215267_200025704644 [1,0,0,1,0,0|1,0,0]=3 23857 B12R1.8 [13CH3]OCCCCC1CCNCC1 34a_100016989291_200025704644 [1,0,0,1,0,0|2,0,0]=4 23858 B12R1.8 [13CH3]SCCCOC1CCCCO1 62a_100000700653_200025704644 [1,0,0,1,0,0|2,0,0]=4 23859 B12R1.8 [13CH3]SCCCOC1CCCCO1 62a_200025704644_100000700653 [1,0,0,1,0,0|2,0,0]=4 23860 B12R1.37 BrCCCCCOC1CCCC1 34a_100000746331_100000179811 [1,0,0,1,0,0|2,0,0]=4 23861 B12R1.37 BrCCCCCOC1CCCC1 7a_100000746331_100000179811 [1,0,0,1,0,0|2,0,0]=4 23862 B12R1.37 BrCCCCOCC1CCCC1 34a_100011216708_100000740388 [1,0,0,1,0,0|2,0,0]=4 23863 B12R1.37 BrCCCOCCC1CCCC1 34a_100011217188_100000760354 [1,0,0,1,0,0|2,0,0]=4 23864 B12R1.37 BrCCOCCCC1CCCC1 34a_100000211926_100011713738 [1,0,0,1,0,0|2,0,0]=4 23865 B12R1.37 CCCCCCCN1CCCC1 2230a_100000188435_100000210681 [1,0,0,1,0,0|1,0,0]=3 23866 B12R1.37 CCCCCCCN1CCCC1 269982a_100000188435_100000210681 [1,0,0,1,0,0|1,0,0]=3 23867 B12R1.37 CCCCCCCN1CCSC1 2230a_100011215254_100000210681 [1,0,0,1,0,0|2,0,0]=4 23868 B12R1.37 CCCCCCCN1CCSC1 269982a_100011215254_100000210681 [1,0,0,1,0,0|2,0,0]=4 23869 B12R1.37 CCCCCCNC1CCCC1 2230a_100000210581_100000179811 [1,0,0,1,0,0|1,0,0]=3 23870 B12R1.37 CCCCCCNC1CCCC1 2230a_100000211070_100000210314 [1,0,0,1,0,0|1,0,0]=3 23871 B12R1.37 CCCCCCNC1CCCC1 270004a_100000210581_100000210133 [1,0,0,1,0,0|1,0,0]=3 23872 B12R1.37 CCCCCCNC1CCCC1 34a_100000211070_100000210314 [1,0,0,1,0,0|1,0,0]=3 23873 B12R1.37 CCCCCCNC1CCOC1 2230a_100000210581_100000731011 [1,0,0,1,0,0|2,0,0]=4 23874 B12R1.37 CCCCCCNC1CCOC1 270004a_100000210581_100000752484 [1,0,0,1,0,0|2,0,0]=4 23875 B12R1.37 CCCCCCNC1CCSC1 270004a_100000210581_100000212027 [1,0,0,1,0,0|2,0,0]=4 23876 B12R1.37 CCCCCCN[C@@H]1CCOC1 2230a_200015188469_100000210314 [1,0,0,1,0,0|2,0,0]=4 23877 B12R1.37 CCCCCCN[C@H]1CCOC1 2230a_100015188467_100000210314 [1,0,0,1,0,0|2,0,0]=4 23878 B12R1.37 CCCCCCN[C@H]1CCOC1 34a_100015188467_100000210314 [1,0,0,1,0,0|2,0,0]=4 23879 B12R1.37 CCCCCCOC1CCCC1 34a_100000210259_100000179811 [1,0,0,1,0,0|1,0,0]=3 23880 B12R1.37 CCCCCCOC1CCCC1 34a_100000210269_100000210314 [1,0,0,1,0,0|1,0,0]=3 23881 B12R1.37 CCCCCCOC1CCCC1 7a_100000210259_100000179811 [1,0,0,1,0,0|1,0,0]=3 23882 B12R1.37 CCCCCCOC1CCCC1 7a_100000210269_100000210314 [1,0,0,1,0,0|1,0,0]=3 23883 B12R1.37 CCCCCCOC1CCCO1 34a_100000085407_100000210314 [1,0,0,1,0,0|1,0,0]=3 23884 B12R1.37 CCCCCCOC1CCOC1 34a_100000210259_100000690089 [1,0,0,1,0,0|2,0,0]=4 23885 B12R1.37 CCCCCCOC1CCOC1 7a_100000210259_100000731011 [1,0,0,1,0,0|2,0,0]=4 23886 B12R1.37 CCCCCCOC1CCSC1 7a_100011232664_100000210314 [1,0,0,1,0,0|2,0,0]=4 23887 B12R1.37 CCCCCCO[C@H]1CCOC1 34a_100000717292_100000210314 [1,0,0,1,0,0|2,0,0]=4 23888 B12R1.37 CCCCCCSC1CCCC1 62a_100000210314_100000179811 [1,0,0,1,0,0|1,0,0]=3 23889 B12R1.37 CCCCCCSC1CCCC1 62a_100011217020_100000210757 [1,0,0,1,0,0|1,0,0]=3 23890 B12R1.37 CCCCCCSC1CCOC1 62a_100000210314_100000690089 [1,0,0,1,0,0|2,0,0]=4 23891 B12R1.37 CCCCCNCC1CCCC1 2230a_100000209983_100000740388 [1,0,0,1,0,0|1,0,0]=3 23892 B12R1.37 CCCCCNCC1CCCC1 2230a_100000737975_100000210326 [1,0,0,1,0,0|1,0,0]=3 23893 B12R1.37 CCCCCNCC1CCCC1 269862a_100000209983_100000746403 [1,0,0,1,0,0|1,0,0]=3 23894 B12R1.37 CCCCCNCC1CCCC1 34a_100000737975_100000718602 [1,0,0,1,0,0|1,0,0]=3 23895 B12R1.37 CCCCCNCC1CCCO1 2230a_100000209983_100000203698 [1,0,0,1,0,0|1,0,0]=3 23896 B12R1.37 CCCCCNCC1CCOC1 2230a_100000209983_100000702531 [1,0,0,1,0,0|2,0,0]=4 23897 B12R1.37 CCCCCNCC1CCOC1 2230a_100000737293_100000210326 [1,0,0,1,0,0|2,0,0]=4 23898 B12R1.37 CCCCCNCC1CCOC1 34a_100000737293_100000718602 [1,0,0,1,0,0|2,0,0]=4 23899 B12R1.37 CCCCCNCC1OCCO1 2230a_100000036311_100000210326 [1,0,0,1,0,0|2,0,0]=4 23900 B12R1.37 CCCCCNCC1OCCO1 2230a_100000209983_100000755774 [1,0,0,1,0,0|2,0,0]=4 23901 B12R1.37 CCCCCNCC1OCCO1 34a_100000036311_100000718602 [1,0,0,1,0,0|2,0,0]=4 23902 B12R1.37 CCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210326 [1,0,0,1,0,0|1,0,0]=3 23903 B12R1.37 CCCCCNC[C@@H]1CCCO1 34a_100020590478_100000718602 [1,0,0,1,0,0|1,0,0]=3 23904 B12R1.37 CCCCCOCC1CCCC1 34a_100000210253_100000740388 [1,0,0,1,0,0|1,0,0]=3 23905 B12R1.37 CCCCCOCC1CCCC1 34a_100000742336_100000718602 [1,0,0,1,0,0|1,0,0]=3 23906 B12R1.37 CCCCCOCC1CCCC1 7a_100000210253_100000740388 [1,0,0,1,0,0|1,0,0]=3 23907 B12R1.37 CCCCCOCC1CCCC1 7a_100000742336_100000210326 [1,0,0,1,0,0|1,0,0]=3 23908 B12R1.37 CCCCCOCC1CCCO1 34a_100000210270_100000718602 [1,0,0,1,0,0|1,0,0]=3 23909 B12R1.37 CCCCCOCC1CCCO1 7a_100000210253_100000203698 [1,0,0,1,0,0|1,0,0]=3 23910 B12R1.37 CCCCCOCC1CCCO1 7a_100000210270_100000210326 [1,0,0,1,0,0|1,0,0]=3 23911 B12R1.37 CCCCCOCC1CCNC1 34a_100000748654_100000718602 [1,0,0,1,0,0|2,0,0]=4 23912 B12R1.37 CCCCCOCC1CCOC1 34a_100000210253_100011261433 [1,0,0,1,0,0|2,0,0]=4 23913 B12R1.37 CCCCCOCC1CCOC1 34a_100000740260_100000718602 [1,0,0,1,0,0|2,0,0]=4 23914 B12R1.37 CCCCCOCC1CCOC1 7a_100000210253_100000702531 [1,0,0,1,0,0|2,0,0]=4 23915 B12R1.37 CCCCCOCC1COCO1 34a_100011216627_100000718602 [1,0,0,1,0,0|2,0,0]=4 23916 B12R1.37 CCCCCOCC1OCCO1 34a_100000087154_100000718602 [1,0,0,1,0,0|2,0,0]=4 23917 B12R1.37 CCCCCOCC1OCCO1 34a_100000210253_100000755774 [1,0,0,1,0,0|2,0,0]=4 23918 B12R1.37 CCCCCOCC1OCCO1 7a_100000210253_100000755774 [1,0,0,1,0,0|2,0,0]=4 23919 B12R1.37 CCCCCOC[C@H]1CCCN1 34a_100000745186_100000718602 [1,0,0,1,0,0|2,0,0]=4 23920 B12R1.37 CCCCCSCC1CCCC1 62a_100000210326_100000740388 [1,0,0,1,0,0|1,0,0]=3 23921 B12R1.37 CCCCCSCC1CCCC1 62a_100000740388_100000210326 [1,0,0,1,0,0|1,0,0]=3 23922 B12R1.37 CCCCCSCC1CCCO1 62a_100000203698_100000210326 [1,0,0,1,0,0|1,0,0]=3 23923 B12R1.37 CCCCCSCC1CCCO1 62a_100000210326_100000203698 [1,0,0,1,0,0|1,0,0]=3 23924 B12R1.37 CCCCCSCC1CCOC1 62a_100000210326_100000702531 [1,0,0,1,0,0|2,0,0]=4 23925 B12R1.37 CCCCCSCC1CCOC1 62a_100000702531_100000210326 [1,0,0,1,0,0|2,0,0]=4 23926 B12R1.37 CCCCCSCC1OCCO1 62a_100000210326_100000755774 [1,0,0,1,0,0|2,0,0]=4 23927 B12R1.37 CCCCCSCC1OCCO1 62a_100000755774_100000210326 [1,0,0,1,0,0|2,0,0]=4 23928 B12R1.37 CCCCNCCC1CCCC1 2230a_100000102301_100000760354 [1,0,0,1,0,0|1,0,0]=3 23929 B12R1.37 CCCCNCCC1CCCC1 2230a_100000739158_100000210211 [1,0,0,1,0,0|1,0,0]=3 23930 B12R1.37 CCCCNCCC1CCCC1 34a_100000739158_100000210210 [1,0,0,1,0,0|1,0,0]=3 23931 B12R1.37 CCCCNCCC1CCCC1 7a_106832991798_100000760354 [1,0,0,1,0,0|1,0,0]=3 23932 B12R1.37 CCCCNCCC1OCCO1 2230a_100000034215_100000210211 [1,0,0,1,0,0|2,0,0]=4 23933 B12R1.37 CCCCNCCC1OCCO1 2230a_100000102301_100000740749 [1,0,0,1,0,0|2,0,0]=4 23934 B12R1.37 CCCCNCCC1OCCO1 34a_100000034215_100000210210 [1,0,0,1,0,0|2,0,0]=4 23935 B12R1.37 CCCCNCCC1OCCO1 7a_106832991798_100000740749 [1,0,0,1,0,0|2,0,0]=4 23936 B12R1.37 CCCCNCCN1CCCC1 7a_106832991798_100000004467 [1,0,0,1,0,0|2,0,0]=4 23937 B12R1.37 CCCCOCCC1CCCC1 34a_100000210227_100000760354 [1,0,0,1,0,0|1,0,0]=3 23938 B12R1.37 CCCCOCCC1CCCC1 34a_100000749090_100000210210 [1,0,0,1,0,0|1,0,0]=3 23939 B12R1.37 CCCCOCCC1CCCC1 7a_100000210227_100000760354 [1,0,0,1,0,0|1,0,0]=3 23940 B12R1.37 CCCCOCCC1CCCC1 7a_100000749090_100000210211 [1,0,0,1,0,0|1,0,0]=3 23941 B12R1.37 CCCCOCCC1CCNC1 34a_100016987287_100000210210 [1,0,0,1,0,0|2,0,0]=4 23942 B12R1.37 CCCCOCCC1CCOC1 34a_100011879284_100000210210 [1,0,0,1,0,0|2,0,0]=4 23943 B12R1.37 CCCCOCCC1OCCO1 34a_100000210227_100000740749 [1,0,0,1,0,0|2,0,0]=4 23944 B12R1.37 CCCCOCCC1OCCO1 7a_100000210227_100000740749 [1,0,0,1,0,0|2,0,0]=4 23945 B12R1.37 CCCCOCCN1CCCC1 2230a_100000188435_100000743108 [1,0,0,1,0,0|2,0,0]=4 23946 B12R1.37 CCCCOCCN1CCCC1 269982a_100000188435_100000743108 [1,0,0,1,0,0|2,0,0]=4 23947 B12R1.37 CCCCOCCN1CCCC1 7a_100000210227_100000004467 [1,0,0,1,0,0|2,0,0]=4 23948 B12R1.37 CCCCOCNC1CCCC1 2230a_100000211070_100011995733 [1,0,0,1,0,0|2,0,0]=4 23949 B12R1.37 CCCCOCNC1CCCC1 34a_100000211070_100011995733 [1,0,0,1,0,0|2,0,0]=4 23950 B12R1.37 CCCCOCOC1CCCC1 34a_100000210269_100011995733 [1,0,0,1,0,0|2,0,0]=4 23951 B12R1.37 CCCCOCOC1CCCO1 34a_100000085407_100011995733 [1,0,0,1,0,0|2,0,0]=4 23952 B12R1.37 CCCCOCSC1CCCC1 62a_100011217020_100011995733 [1,0,0,1,0,0|2,0,0]=4 23953 B12R1.37 CCCCOCSC1CCCC1 62a_100011995733_100000179811 [1,0,0,1,0,0|2,0,0]=4 23954 B12R1.37 CCCCSCCC1CCCC1 62a_100000210211_100000760354 [1,0,0,1,0,0|1,0,0]=3 23955 B12R1.37 CCCCSCCC1CCCC1 62a_100000760354_100000210210 [1,0,0,1,0,0|1,0,0]=3 23956 B12R1.37 CCCCSCCC1OCCO1 62a_100000210211_100000740749 [1,0,0,1,0,0|2,0,0]=4 23957 B12R1.37 CCCCSCCN1CCCC1 62a_100000210211_100000004467 [1,0,0,1,0,0|2,0,0]=4 23958 B12R1.37 CCCCSCCN1CCCC1 62a_100000700749_100000210210 [1,0,0,1,0,0|2,0,0]=4 23959 B12R1.37 CCCNCCCC1CCCC1 2230a_100000736752_100000210303 [1,0,0,1,0,0|1,0,0]=3 23960 B12R1.37 CCCNCCCC1CCCC1 34a_100000736752_100000210303 [1,0,0,1,0,0|1,0,0]=3 23961 B12R1.37 CCCNCCOC1CCCC1 34a_100000741755_100000210303 [1,0,0,1,0,0|2,0,0]=4 23962 B12R1.37 CCCOCCCC1CCCC1 34a_100000210258_100011713738 [1,0,0,1,0,0|1,0,0]=3 23963 B12R1.37 CCCOCCCC1CCCC1 34a_100011215328_100000210303 [1,0,0,1,0,0|1,0,0]=3 23964 B12R1.37 CCCOCCCC1CCCC1 7a_100011215328_100000210303 [1,0,0,1,0,0|1,0,0]=3 23965 B12R1.37 CCCOCCCC1OCCO1 34a_100000210258_100009861162 [1,0,0,1,0,0|2,0,0]=4 23966 B12R1.37 CCCOCCCC1OCCO1 34a_100009871617_100000210303 [1,0,0,1,0,0|2,0,0]=4 23967 B12R1.37 CCCOCCCC1OCCO1 7a_100009871617_100000210303 [1,0,0,1,0,0|2,0,0]=4 23968 B12R1.37 CCCOCCCN1CCCC1 34a_100000210258_100016991639 [1,0,0,1,0,0|2,0,0]=4 23969 B12R1.37 CCCOCCNC1CCCC1 2230a_100000211070_100011215938 [1,0,0,1,0,0|2,0,0]=4 23970 B12R1.37 CCCOCCNC1CCCC1 2230a_100161115042_100000179811 [1,0,0,1,0,0|2,0,0]=4 23971 B12R1.37 CCCOCCNC1CCCC1 270004a_100161115042_100000210133 [1,0,0,1,0,0|2,0,0]=4 23972 B12R1.37 CCCOCCNC1CCCC1 34a_100000211070_100011215938 [1,0,0,1,0,0|2,0,0]=4 23973 B12R1.37 CCCOCCNC1CCCC1 34a_100161115042_100000179811 [1,0,0,1,0,0|2,0,0]=4 23974 B12R1.37 CCCOCCNC1CCCC1 34a_200000200444_100000210303 [1,0,0,1,0,0|2,0,0]=4 23975 B12R1.37 CCCOCCOC1CCCC1 34a_100000210269_100011215938 [1,0,0,1,0,0|2,0,0]=4 23976 B12R1.37 CCCOCCOC1CCCC1 34a_100000738311_100000210303 [1,0,0,1,0,0|2,0,0]=4 23977 B12R1.37 CCCOCCOC1CCCC1 34a_100000752267_100000179811 [1,0,0,1,0,0|2,0,0]=4 23978 B12R1.37 CCCOCCOC1CCCC1 7a_100000210269_100011215938 [1,0,0,1,0,0|2,0,0]=4 23979 B12R1.37 CCCOCCOC1CCCC1 7a_100000738311_100000210303 [1,0,0,1,0,0|2,0,0]=4 23980 B12R1.37 CCCOCCOC1CCCC1 7a_100000752267_100000179811 [1,0,0,1,0,0|2,0,0]=4 23981 B12R1.37 CCCOCCOC1CCCO1 34a_100000085407_100011215938 [1,0,0,1,0,0|2,0,0]=4 23982 B12R1.37 CCCOCCSC1CCCC1 62a_100011215938_100000179811 [1,0,0,1,0,0|2,0,0]=4 23983 B12R1.37 CCCOCCSC1CCCC1 62a_100011217020_100011215938 [1,0,0,1,0,0|2,0,0]=4 23984 B12R1.37 CCCSCCCC1CCCC1 62a_100000210303_100011713738 [1,0,0,1,0,0|1,0,0]=3 23985 B12R1.37 CCCSCCCC1CCCC1 62a_100011713738_100000210303 [1,0,0,1,0,0|1,0,0]=3 23986 B12R1.37 CCCSCCCC1OCCO1 62a_100000210303_100000042513 [1,0,0,1,0,0|2,0,0]=4 23987 B12R1.37 CCCSCCCN1CCCC1 62a_100000210303_100011445909 [1,0,0,1,0,0|2,0,0]=4 23988 B12R1.37 CCCSCCCN1CCCC1 62a_100016991639_100000210303 [1,0,0,1,0,0|2,0,0]=4 23989 B12R1.37 CCCSCCNC1CCCC1 2230a_100020603323_100000179811 [1,0,0,1,0,0|2,0,0]=4 23990 B12R1.37 CCCSCCNC1CCCC1 270004a_100020603323_100000210133 [1,0,0,1,0,0|2,0,0]=4 23991 B12R1.37 CCCSCCOC1CCCC1 34a_200000230433_100000179811 [1,0,0,1,0,0|2,0,0]=4 23992 B12R1.37 CCCSCCOC1CCCC1 7a_200000230433_100000179811 [1,0,0,1,0,0|2,0,0]=4 23993 B12R1.37 CCNCCCCC1OCCO1 2230a_100015525214_100000034956 [1,0,0,1,0,0|2,0,0]=4 23994 B12R1.37 CCNCCCOC1CCCC1 34a_100000747560_100000210202 [1,0,0,1,0,0|2,0,0]=4 23995 B12R1.37 CCOCCCCC1OCCO1 34a_100121572206_200009813554 [1,0,0,1,0,0|2,0,0]=4 23996 B12R1.37 CCOCCCNC1CCCC1 2230a_100000210961_100000179811 [1,0,0,1,0,0|2,0,0]=4 23997 B12R1.37 CCOCCCNC1CCCC1 2230a_100000211070_100012232248 [1,0,0,1,0,0|2,0,0]=4 23998 B12R1.37 CCOCCCNC1CCCC1 270004a_100000210961_100000210133 [1,0,0,1,0,0|2,0,0]=4 23999 B12R1.37 CCOCCCNC1CCCC1 34a_100000210961_100000179811 [1,0,0,1,0,0|2,0,0]=4 24000 B12R1.37 CCOCCCNC1CCCC1 34a_100000211070_100012232248 [1,0,0,1,0,0|2,0,0]=4 24001 B12R1.37 CCOCCCOC1CCCC1 34a_100000210269_100012232248 [1,0,0,1,0,0|2,0,0]=4 24002 B12R1.37 CCOCCCOC1CCCC1 34a_100000757476_100000179811 [1,0,0,1,0,0|2,0,0]=4 24003 B12R1.37 CCOCCCOC1CCCC1 7a_100000210269_100012232248 [1,0,0,1,0,0|2,0,0]=4 24004 B12R1.37 CCOCCCOC1CCCC1 7a_100000757476_100000179811 [1,0,0,1,0,0|2,0,0]=4 24005 B12R1.37 CCOCCCOC1CCCO1 34a_100000085407_100012232248 [1,0,0,1,0,0|2,0,0]=4 24006 B12R1.37 CCOCCCSC1CCCC1 62a_100011217020_100012232248 [1,0,0,1,0,0|2,0,0]=4 24007 B12R1.37 CCOCCCSC1CCCC1 62a_100012232248_100000179811 [1,0,0,1,0,0|2,0,0]=4 24008 B12R1.37 CCOCCNCC1CCCC1 2230a_100000737975_100011215890 [1,0,0,1,0,0|2,0,0]=4 24009 B12R1.37 CCOCCNCC1CCCC1 2230a_102516460346_100000740388 [1,0,0,1,0,0|2,0,0]=4 24010 B12R1.37 CCOCCNCC1CCCC1 269862a_100011200944_100000746403 [1,0,0,1,0,0|2,0,0]=4 24011 B12R1.37 CCOCCNCC1CCCC1 34a_100000737975_100000210147 [1,0,0,1,0,0|2,0,0]=4 24012 B12R1.37 CCOCCNCC1CCCC1 34a_102516460346_100000740388 [1,0,0,1,0,0|2,0,0]=4 24013 B12R1.37 CCOCCNCC1CCCO1 2230a_102516460346_100000203698 [1,0,0,1,0,0|2,0,0]=4 24014 B12R1.37 CCOCCNC[C@@H]1CCCO1 2230a_100020590478_100011215890 [1,0,0,1,0,0|2,0,0]=4 24015 B12R1.37 CCOCCNC[C@@H]1CCCO1 34a_100020590478_100000210147 [1,0,0,1,0,0|2,0,0]=4 24016 B12R1.37 CCOCCOCC1CCCC1 34a_100000210136_100000740388 [1,0,0,1,0,0|2,0,0]=4 24017 B12R1.37 CCOCCOCC1CCCC1 34a_100000742336_100000210147 [1,0,0,1,0,0|2,0,0]=4 24018 B12R1.37 CCOCCOCC1CCCC1 7a_100000210136_100000740388 [1,0,0,1,0,0|2,0,0]=4 24019 B12R1.37 CCOCCOCC1CCCC1 7a_100000742336_100011215890 [1,0,0,1,0,0|2,0,0]=4 24020 B12R1.37 CCOCCOCC1CCCO1 34a_100000210270_100000210147 [1,0,0,1,0,0|2,0,0]=4 24021 B12R1.37 CCOCCOCC1CCCO1 7a_100000210136_100000203698 [1,0,0,1,0,0|2,0,0]=4 24022 B12R1.37 CCOCCOCC1CCCO1 7a_100000210270_100011215890 [1,0,0,1,0,0|2,0,0]=4 24023 B12R1.37 CCOCCSCC1CCCC1 62a_100000210147_100000740388 [1,0,0,1,0,0|2,0,0]=4 24024 B12R1.37 CCOCCSCC1CCCC1 62a_100000740388_100011215890 [1,0,0,1,0,0|2,0,0]=4 24025 B12R1.37 CCOCCSCC1CCCO1 62a_100000203698_100011215890 [1,0,0,1,0,0|2,0,0]=4 24026 B12R1.37 CCOCCSCC1CCCO1 62a_100000210147_100000203698 [1,0,0,1,0,0|2,0,0]=4 24027 B12R1.37 CCOCSCCC1CCCC1 62a_100000739092_100000760354 [1,0,0,1,0,0|2,0,0]=4 24028 B12R1.37 CCOCSCCC1CCCC1 62a_100000760354_100000739092 [1,0,0,1,0,0|2,0,0]=4 24029 B12R1.37 CCSCCCCC1OCCO1 62a_100000210202_100000034956 [1,0,0,1,0,0|2,0,0]=4 24030 B12R1.37 CCSCCCOC1CCCC1 34a_100011216438_100000179811 [1,0,0,1,0,0|2,0,0]=4 24031 B12R1.37 CCSCCCOC1CCCC1 7a_100011216438_100000179811 [1,0,0,1,0,0|2,0,0]=4 24032 B12R1.37 CCSCCNCC1CCCC1 2230a_100000106463_100000740388 [1,0,0,1,0,0|2,0,0]=4 24033 B12R1.37 CCSCCNCC1CCCC1 2230a_100000737975_100000757381 [1,0,0,1,0,0|2,0,0]=4 24034 B12R1.37 CCSCCNCC1CCCC1 269862a_100000106463_100000746403 [1,0,0,1,0,0|2,0,0]=4 24035 B12R1.37 CCSCCNCC1CCCC1 34a_100000737975_100000757381 [1,0,0,1,0,0|2,0,0]=4 24036 B12R1.37 CCSCCNCC1CCCO1 2230a_100000106463_100000203698 [1,0,0,1,0,0|2,0,0]=4 24037 B12R1.37 CCSCCNC[C@@H]1CCCO1 2230a_100020590478_100000757381 [1,0,0,1,0,0|2,0,0]=4 24038 B12R1.37 CCSCCNC[C@@H]1CCCO1 34a_100020590478_100000757381 [1,0,0,1,0,0|2,0,0]=4 24039 B12R1.37 CCSCCOCC1CCCC1 34a_100000212035_100000740388 [1,0,0,1,0,0|2,0,0]=4 24040 B12R1.37 CCSCCOCC1CCCC1 34a_100000742336_100000757381 [1,0,0,1,0,0|2,0,0]=4 24041 B12R1.37 CCSCCOCC1CCCC1 7a_100000212035_100000740388 [1,0,0,1,0,0|2,0,0]=4 24042 B12R1.37 CCSCCOCC1CCCC1 7a_100000742336_100000757381 [1,0,0,1,0,0|2,0,0]=4 24043 B12R1.37 CCSCCOCC1CCCO1 34a_100000210270_100000757381 [1,0,0,1,0,0|2,0,0]=4 24044 B12R1.37 CCSCCOCC1CCCO1 7a_100000210270_100000757381 [1,0,0,1,0,0|2,0,0]=4 24045 B12R1.37 CCSCCOCC1CCCO1 7a_100000212035_100000203698 [1,0,0,1,0,0|2,0,0]=4 24046 B12R1.37 CCSCCSCC1CCCC1 62a_100000740388_100000757381 [1,0,0,1,0,0|2,0,0]=4 24047 B12R1.37 CCSCCSCC1CCCC1 62a_100000757381_100000740388 [1,0,0,1,0,0|2,0,0]=4 24048 B12R1.37 CCSCCSCC1CCCO1 62a_100000203698_100000757381 [1,0,0,1,0,0|2,0,0]=4 24049 B12R1.37 CCSCCSCC1CCCO1 62a_100000757381_100000203698 [1,0,0,1,0,0|2,0,0]=4 24050 B12R1.37 CNCCCOCC1CCCC1 34a_100000213112_100000740388 [1,0,0,1,0,0|2,0,0]=4 24051 B12R1.37 COCCCCNC1CCCC1 2230a_100000211070_100000730899 [1,0,0,1,0,0|2,0,0]=4 24052 B12R1.37 COCCCCNC1CCCC1 34a_100000211070_100000755781 [1,0,0,1,0,0|2,0,0]=4 24053 B12R1.37 COCCCCOC1CCCC1 34a_100000210269_100000755781 [1,0,0,1,0,0|2,0,0]=4 24054 B12R1.37 COCCCCOC1CCCC1 34a_100000740925_100000179811 [1,0,0,1,0,0|2,0,0]=4 24055 B12R1.37 COCCCCOC1CCCC1 7a_100000210269_100000730899 [1,0,0,1,0,0|2,0,0]=4 24056 B12R1.37 COCCCCOC1CCCO1 34a_100000085407_100000755781 [1,0,0,1,0,0|2,0,0]=4 24057 B12R1.37 COCCCCOC1CCCO1 34a_100011018183_200000210301 [1,0,0,1,0,0|2,0,0]=4 24058 B12R1.37 COCCCCOC1CCCO1 7a_100011018183_200000210301 [1,0,0,1,0,0|2,0,0]=4 24059 B12R1.37 COCCCCSC1CCCC1 62a_100000730899_100000179811 [1,0,0,1,0,0|2,0,0]=4 24060 B12R1.37 COCCCCSC1CCCC1 62a_100011217020_100000730899 [1,0,0,1,0,0|2,0,0]=4 24061 B12R1.37 COCCCNCC1CCCC1 2230a_100000737975_100000740836 [1,0,0,1,0,0|2,0,0]=4 24062 B12R1.37 COCCCNCC1CCCC1 269862a_100150723488_100000746403 [1,0,0,1,0,0|2,0,0]=4 24063 B12R1.37 COCCCNCC1CCCC1 34a_100000737975_100000740836 [1,0,0,1,0,0|2,0,0]=4 24064 B12R1.37 COCCCNCC1CCCC1 34a_100150723488_100000740388 [1,0,0,1,0,0|2,0,0]=4 24065 B12R1.37 COCCCNC[C@@H]1CCCO1 2230a_100020590478_100000740836 [1,0,0,1,0,0|2,0,0]=4 24066 B12R1.37 COCCCNC[C@@H]1CCCO1 34a_100020590478_100000740836 [1,0,0,1,0,0|2,0,0]=4 24067 B12R1.37 COCCCOCC1CCCC1 34a_100000740835_100000740388 [1,0,0,1,0,0|2,0,0]=4 24068 B12R1.37 COCCCOCC1CCCC1 34a_100000742336_100000740836 [1,0,0,1,0,0|2,0,0]=4 24069 B12R1.37 COCCCOCC1CCCC1 7a_100000742336_100000740836 [1,0,0,1,0,0|2,0,0]=4 24070 B12R1.37 COCCCOCC1CCCO1 34a_100000210270_100000740836 [1,0,0,1,0,0|2,0,0]=4 24071 B12R1.37 COCCCOCC1CCCO1 7a_100000210270_100000740836 [1,0,0,1,0,0|2,0,0]=4 24072 B12R1.37 COCCCSCC1CCCC1 62a_100000709357_100000740388 [1,0,0,1,0,0|2,0,0]=4 24073 B12R1.37 COCCCSCC1CCCC1 62a_100000740388_100000709357 [1,0,0,1,0,0|2,0,0]=4 24074 B12R1.37 COCCCSCC1CCCO1 62a_100000203698_100000709357 [1,0,0,1,0,0|2,0,0]=4 24075 B12R1.37 COCCCSCC1CCCO1 62a_100000709357_100000203698 [1,0,0,1,0,0|2,0,0]=4 24076 B12R1.37 COCCNCCC1CCCC1 2230a_100000209980_100000760354 [1,0,0,1,0,0|2,0,0]=4 24077 B12R1.37 COCCNCCC1CCCC1 2230a_100000739158_100011201679 [1,0,0,1,0,0|2,0,0]=4 24078 B12R1.37 COCCNCCC1CCCC1 34a_100000739158_100011201679 [1,0,0,1,0,0|2,0,0]=4 24079 B12R1.37 COCCOCCC1CCCC1 34a_100000210237_100000760354 [1,0,0,1,0,0|2,0,0]=4 24080 B12R1.37 COCCOCCC1CCCC1 34a_100000749090_100011201679 [1,0,0,1,0,0|2,0,0]=4 24081 B12R1.37 COCCOCCC1CCCC1 7a_100000749090_100000233755 [1,0,0,1,0,0|2,0,0]=4 24082 B12R1.37 COCCSCCC1CCCC1 62a_100000233755_100000760354 [1,0,0,1,0,0|2,0,0]=4 24083 B12R1.37 COCCSCCC1CCCC1 62a_100000760354_100000233755 [1,0,0,1,0,0|2,0,0]=4 24084 B12R1.37 COCNCCCC1CCCC1 2230a_100000736752_100000766300 [1,0,0,1,0,0|2,0,0]=4 24085 B12R1.37 COCSCCCC1CCCC1 62a_100000766300_100011713738 [1,0,0,1,0,0|2,0,0]=4 24086 B12R1.37 COCSCCCC1CCCC1 62a_100011713738_100000766300 [1,0,0,1,0,0|2,0,0]=4 24087 B12R1.37 CSCCCCOC1CCCC1 34a_100011217163_100000179811 [1,0,0,1,0,0|2,0,0]=4 24088 B12R1.37 CSCCCCOC1CCCC1 7a_100011217163_100000179811 [1,0,0,1,0,0|2,0,0]=4 24089 B12R1.37 CSCCCNCC1CCCC1 2230a_100000749238_100000740388 [1,0,0,1,0,0|2,0,0]=4 24090 B12R1.37 CSCCCNCC1CCCC1 269862a_100000749238_100000746403 [1,0,0,1,0,0|2,0,0]=4 24091 B12R1.37 CSCCCNCC1CCCO1 2230a_100000749238_100000203698 [1,0,0,1,0,0|2,0,0]=4 24092 B12R1.37 CSCCCOCC1CCCC1 34a_100000690336_100000740388 [1,0,0,1,0,0|2,0,0]=4 24093 B12R1.37 CSCCCOCC1CCCC1 7a_100000690336_100000740388 [1,0,0,1,0,0|2,0,0]=4 24094 B12R1.37 CSCCCOCC1CCCO1 7a_100000690336_100000203698 [1,0,0,1,0,0|2,0,0]=4 24095 B12R1.37 CSCCNCCC1CCCC1 2230a_100000739158_100000751147 [1,0,0,1,0,0|2,0,0]=4 24096 B12R1.37 CSCCNCCC1CCCC1 2230a_100020590264_100000760354 [1,0,0,1,0,0|2,0,0]=4 24097 B12R1.37 CSCCNCCC1CCCC1 34a_100000739158_100000212216 [1,0,0,1,0,0|2,0,0]=4 24098 B12R1.37 CSCCOCCC1CCCC1 34a_100000230434_100000760354 [1,0,0,1,0,0|2,0,0]=4 24099 B12R1.37 CSCCOCCC1CCCC1 34a_100000749090_100000212216 [1,0,0,1,0,0|2,0,0]=4 24100 B12R1.37 CSCCOCCC1CCCC1 7a_100000230434_100000760354 [1,0,0,1,0,0|2,0,0]=4 24101 B12R1.37 CSCCOCCC1CCCC1 7a_100000749090_100000212216 [1,0,0,1,0,0|2,0,0]=4 24102 B12R1.37 CSCCSCCC1CCCC1 62a_100000212216_100000760354 [1,0,0,1,0,0|2,0,0]=4 24103 B12R1.37 CSCCSCCC1CCCC1 62a_100000760354_100000751147 [1,0,0,1,0,0|2,0,0]=4 24104 B12R1.37 CSCNCCCC1CCCC1 2230a_100000736752_100011218213 [1,0,0,1,0,0|2,0,0]=4 24105 B12R1.37 CSCNCCCC1CCCC1 34a_100000736752_100011218213 [1,0,0,1,0,0|2,0,0]=4 24106 B12R1.37 CSCOCCCC1CCCC1 34a_100011215328_100011218213 [1,0,0,1,0,0|2,0,0]=4 24107 B12R1.37 CSCSCCCC1CCCC1 62a_100011218213_100011713738 [1,0,0,1,0,0|2,0,0]=4 24108 B12R1.37 CSCSCCCC1CCCC1 62a_100011713738_100011218213 [1,0,0,1,0,0|2,0,0]=4 24109 B12R1.37 ClCCCCCOC1CCCC1 34a_100000746330_100000179811 [1,0,0,1,0,0|2,0,0]=4 24110 B12R1.37 ClCCCCCOC1CCCC1 7a_100000746330_100000179811 [1,0,0,1,0,0|2,0,0]=4 24111 B12R1.37 ClCCCCOCC1CCCC1 34a_100000210776_100000740388 [1,0,0,1,0,0|2,0,0]=4 24112 B12R1.37 ClCCCCOCC1CCCC1 7a_100000210776_100000740388 [1,0,0,1,0,0|2,0,0]=4 24113 B12R1.37 ClCCCCOCC1CCCO1 7a_100000210776_100000203698 [1,0,0,1,0,0|2,0,0]=4 24114 B12R1.37 ClCCCOCCC1CCCC1 34a_100000230001_100000760354 [1,0,0,1,0,0|2,0,0]=4 24115 B12R1.37 FCCCCCCN1CCCC1 2230a_100000188435_100015922095 [1,0,0,1,0,0|2,0,0]=4 24116 B12R1.37 FCCCCCCN1CCCC1 269982a_100000188435_100015922095 [1,0,0,1,0,0|2,0,0]=4 24117 B12R1.37 FCCCCCNC1CCCC1 2230a_100000211070_100000729378 [1,0,0,1,0,0|2,0,0]=4 24118 B12R1.37 FCCCCCNC1CCCC1 34a_100000211070_100000729378 [1,0,0,1,0,0|2,0,0]=4 24119 B12R1.37 FCCCCCOC1CCCC1 34a_100000210269_100000729378 [1,0,0,1,0,0|2,0,0]=4 24120 B12R1.37 FCCCCCOC1CCCC1 7a_100000210269_100000729378 [1,0,0,1,0,0|2,0,0]=4 24121 B12R1.37 FCCCCCOC1CCCO1 34a_100000085407_100000729378 [1,0,0,1,0,0|2,0,0]=4 24122 B12R1.37 FCCCCCSC1CCCC1 62a_100000729378_100000179811 [1,0,0,1,0,0|2,0,0]=4 24123 B12R1.37 FCCCCCSC1CCCC1 62a_100011217020_100000729378 [1,0,0,1,0,0|2,0,0]=4 24124 B12R1.37 FCCCCNCC1CCCC1 2230a_100000737975_100000729493 [1,0,0,1,0,0|2,0,0]=4 24125 B12R1.37 FCCCCNCC1CCCC1 34a_100000737975_100000729493 [1,0,0,1,0,0|2,0,0]=4 24126 B12R1.37 FCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000729493 [1,0,0,1,0,0|2,0,0]=4 24127 B12R1.37 FCCCCNC[C@@H]1CCCO1 34a_100020590478_100000729493 [1,0,0,1,0,0|2,0,0]=4 24128 B12R1.37 FCCCCOCC1CCCC1 34a_100000742336_100000729493 [1,0,0,1,0,0|2,0,0]=4 24129 B12R1.37 FCCCCOCC1CCCC1 34a_100011995726_100000740388 [1,0,0,1,0,0|2,0,0]=4 24130 B12R1.37 FCCCCOCC1CCCC1 7a_100000742336_100000729493 [1,0,0,1,0,0|2,0,0]=4 24131 B12R1.37 FCCCCOCC1CCCC1 7a_100011995726_100000740388 [1,0,0,1,0,0|2,0,0]=4 24132 B12R1.37 FCCCCOCC1CCCO1 34a_100000210270_100000729493 [1,0,0,1,0,0|2,0,0]=4 24133 B12R1.37 FCCCCOCC1CCCO1 7a_100000210270_100000729493 [1,0,0,1,0,0|2,0,0]=4 24134 B12R1.37 FCCCCOCC1CCCO1 7a_100011995726_100000203698 [1,0,0,1,0,0|2,0,0]=4 24135 B12R1.37 FCCCCSCC1CCCC1 62a_100000729493_100000740388 [1,0,0,1,0,0|2,0,0]=4 24136 B12R1.37 FCCCCSCC1CCCC1 62a_100000740388_100000729493 [1,0,0,1,0,0|2,0,0]=4 24137 B12R1.37 FCCCCSCC1CCCO1 62a_100000203698_100000729493 [1,0,0,1,0,0|2,0,0]=4 24138 B12R1.37 FCCCCSCC1CCCO1 62a_100000729493_100000203698 [1,0,0,1,0,0|2,0,0]=4 24139 B12R1.37 FCCCNCCC1CCCC1 2230a_100000739158_100011934791 [1,0,0,1,0,0|2,0,0]=4 24140 B12R1.37 FCCCNCCC1CCCC1 2230a_100015189416_100000760354 [1,0,0,1,0,0|2,0,0]=4 24141 B12R1.37 FCCCNCCC1CCCC1 34a_100000739158_100011934791 [1,0,0,1,0,0|2,0,0]=4 24142 B12R1.37 FCCCNCCC1CCCC1 34a_100015189416_100000760354 [1,0,0,1,0,0|2,0,0]=4 24143 B12R1.37 FCCCOCCC1CCCC1 34a_100000749090_100011934791 [1,0,0,1,0,0|2,0,0]=4 24144 B12R1.37 FCCCOCCC1CCCC1 34a_100000759539_100000760354 [1,0,0,1,0,0|2,0,0]=4 24145 B12R1.37 FCCCOCCC1CCCC1 7a_100000749090_100011934791 [1,0,0,1,0,0|2,0,0]=4 24146 B12R1.37 FCCCSCCC1CCCC1 62a_100000760354_100011934791 [1,0,0,1,0,0|2,0,0]=4 24147 B12R1.37 FCCCSCCC1CCCC1 62a_100011934791_100000760354 [1,0,0,1,0,0|2,0,0]=4 24148 B12R1.37 FCCNCCCC1CCCC1 2230a_100000736752_100011217306 [1,0,0,1,0,0|2,0,0]=4 24149 B12R1.37 FCCNCCCC1CCCC1 34a_100000724931_100011713738 [1,0,0,1,0,0|2,0,0]=4 24150 B12R1.37 FCCNCCCC1CCCC1 34a_100000736752_100011217306 [1,0,0,1,0,0|2,0,0]=4 24151 B12R1.37 FCCOCCCC1CCCC1 34a_100011215328_100011217306 [1,0,0,1,0,0|2,0,0]=4 24152 B12R1.37 FCCOCCCC1CCCC1 7a_100011215328_100011217306 [1,0,0,1,0,0|2,0,0]=4 24153 B12R1.37 FCCSCCCC1CCCC1 62a_100011217306_100011713738 [1,0,0,1,0,0|2,0,0]=4 24154 B12R1.37 FCCSCCCC1CCCC1 62a_100011713738_100011217306 [1,0,0,1,0,0|2,0,0]=4 24155 B12R1.37 ICCCCCOC1CCCC1 34a_200012148887_100000179811 [1,0,0,1,0,0|2,0,0]=4 24156 B12R1.37 ICCCCCOC1CCCC1 7a_200012148887_100000179811 [1,0,0,1,0,0|2,0,0]=4 24157 B12R1.37 ICCCCOCC1CCCC1 34a_200012148704_100000740388 [1,0,0,1,0,0|2,0,0]=4 24158 B12R1.37 NCCCCCOC1CCCC1 34a_100000762737_100000179811 [1,0,0,1,0,0|2,0,0]=4 24159 B12R1.37 NCCCCOCC1CCCC1 34a_100000750430_100000740388 [1,0,0,1,0,0|2,0,0]=4 24160 B12R1.37 NCCCOCCC1CCCC1 34a_100000182051_100000760354 [1,0,0,1,0,0|2,0,0]=4 24161 B12R1.37 NCCOCCCC1CCCC1 34a_100000210304_100011713738 [1,0,0,1,0,0|2,0,0]=4 24162 B12R1.37 OCCCCCCN1CCCC1 2230a_100000188435_100000766143 [1,0,0,1,0,0|1,0,0]=3 24163 B12R1.37 OCCCCCCN1CCCC1 269982a_100000188435_100000766143 [1,0,0,1,0,0|1,0,0]=3 24164 B12R1.37 OCCCCCCN1CCSC1 2230a_100011215254_100000766143 [1,0,0,1,0,0|2,0,0]=4 24165 B12R1.37 OCCCCCCN1CCSC1 269982a_100011215254_100000766143 [1,0,0,1,0,0|2,0,0]=4 24166 B12R1.37 OCCCCCNC1CCCC1 2230a_100000211070_100000746330 [1,0,0,1,0,0|1,0,0]=3 24167 B12R1.37 OCCCCCNC1CCCC1 2230a_100000762737_100000179811 [1,0,0,1,0,0|1,0,0]=3 24168 B12R1.37 OCCCCCNC1CCCC1 270004a_100000762737_100000210133 [1,0,0,1,0,0|1,0,0]=3 24169 B12R1.37 OCCCCCNC1CCCC1 34a_100000211070_100000746330 [1,0,0,1,0,0|1,0,0]=3 24170 B12R1.37 OCCCCCNC1CCCC1 34a_100000762737_100000179811 [1,0,0,1,0,0|1,0,0]=3 24171 B12R1.37 OCCCCCNC1CCOC1 2230a_100000762737_100000731011 [1,0,0,1,0,0|2,0,0]=4 24172 B12R1.37 OCCCCCNC1CCOC1 270004a_100000762737_100000752484 [1,0,0,1,0,0|2,0,0]=4 24173 B12R1.37 OCCCCCNC1CCOC1 34a_100000762737_100000690089 [1,0,0,1,0,0|2,0,0]=4 24174 B12R1.37 OCCCCCNC1CCSC1 270004a_100000762737_100000212027 [1,0,0,1,0,0|2,0,0]=4 24175 B12R1.37 OCCCCCN[C@@H]1CCOC1 2230a_200015188469_100000746330 [1,0,0,1,0,0|2,0,0]=4 24176 B12R1.37 OCCCCCN[C@H]1CCOC1 2230a_100015188467_100000746330 [1,0,0,1,0,0|2,0,0]=4 24177 B12R1.37 OCCCCCN[C@H]1CCOC1 34a_100015188467_100000746330 [1,0,0,1,0,0|2,0,0]=4 24178 B12R1.37 OCCCCCOC1CCCC1 34a_100000210269_100000746330 [1,0,0,1,0,0|1,0,0]=3 24179 B12R1.37 OCCCCCOC1CCCC1 7a_100000210269_100000746330 [1,0,0,1,0,0|1,0,0]=3 24180 B12R1.37 OCCCCCOC1CCCO1 34a_100000085407_100000746330 [1,0,0,1,0,0|2,0,0]=4 24181 B12R1.37 OCCCCCOC1CCSC1 7a_100011232664_100000746330 [1,0,0,1,0,0|2,0,0]=4 24182 B12R1.37 OCCCCCO[C@H]1CCOC1 34a_100000717292_100000746330 [1,0,0,1,0,0|2,0,0]=4 24183 B12R1.37 OCCCCCSC1CCCC1 62a_100000746330_100000179811 [1,0,0,1,0,0|1,0,0]=3 24184 B12R1.37 OCCCCCSC1CCCC1 62a_100011217020_100000746330 [1,0,0,1,0,0|1,0,0]=3 24185 B12R1.37 OCCCCCSC1CCOC1 62a_100000746330_100000690089 [1,0,0,1,0,0|2,0,0]=4 24186 B12R1.37 OCCCCNCC1CCCC1 2230a_100000737975_100000210776 [1,0,0,1,0,0|1,0,0]=3 24187 B12R1.37 OCCCCNCC1CCCC1 2230a_100000750430_100000740388 [1,0,0,1,0,0|1,0,0]=3 24188 B12R1.37 OCCCCNCC1CCCC1 269862a_100000750430_100000746403 [1,0,0,1,0,0|1,0,0]=3 24189 B12R1.37 OCCCCNCC1CCCC1 34a_100000737975_100011216708 [1,0,0,1,0,0|1,0,0]=3 24190 B12R1.37 OCCCCNCC1CCCC1 34a_100000750430_100000740388 [1,0,0,1,0,0|1,0,0]=3 24191 B12R1.37 OCCCCNCC1CCCO1 2230a_100000750430_100000203698 [1,0,0,1,0,0|2,0,0]=4 24192 B12R1.37 OCCCCNCC1CCOC1 2230a_100000737293_100000210776 [1,0,0,1,0,0|2,0,0]=4 24193 B12R1.37 OCCCCNCC1CCOC1 2230a_100000750430_100000702531 [1,0,0,1,0,0|2,0,0]=4 24194 B12R1.37 OCCCCNCC1CCOC1 34a_100000737293_100011216708 [1,0,0,1,0,0|2,0,0]=4 24195 B12R1.37 OCCCCNCC1CCOC1 34a_100000750430_100011261433 [1,0,0,1,0,0|2,0,0]=4 24196 B12R1.37 OCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210776 [1,0,0,1,0,0|2,0,0]=4 24197 B12R1.37 OCCCCNC[C@@H]1CCCO1 34a_100020590478_100011216708 [1,0,0,1,0,0|2,0,0]=4 24198 B12R1.37 OCCCCOCC1CCCC1 34a_100000742336_100011216708 [1,0,0,1,0,0|1,0,0]=3 24199 B12R1.37 OCCCCOCC1CCCC1 7a_100000742336_100000210776 [1,0,0,1,0,0|1,0,0]=3 24200 B12R1.37 OCCCCOCC1CCCO1 34a_100000210270_100011216708 [1,0,0,1,0,0|2,0,0]=4 24201 B12R1.37 OCCCCOCC1CCCO1 7a_100000210270_100000210776 [1,0,0,1,0,0|2,0,0]=4 24202 B12R1.37 OCCCCOCC1CCNC1 34a_100000748654_100011216708 [1,0,0,1,0,0|2,0,0]=4 24203 B12R1.37 OCCCCOCC1CCOC1 34a_100000740260_100011216708 [1,0,0,1,0,0|2,0,0]=4 24204 B12R1.37 OCCCCOC[C@H]1CCCN1 34a_100000745186_100011216708 [1,0,0,1,0,0|2,0,0]=4 24205 B12R1.37 OCCCCSCC1CCCC1 62a_100000210776_100000740388 [1,0,0,1,0,0|1,0,0]=3 24206 B12R1.37 OCCCCSCC1CCCC1 62a_100000740388_100000210776 [1,0,0,1,0,0|1,0,0]=3 24207 B12R1.37 OCCCCSCC1CCCO1 62a_100000203698_100000210776 [1,0,0,1,0,0|2,0,0]=4 24208 B12R1.37 OCCCCSCC1CCCO1 62a_100000210776_100000203698 [1,0,0,1,0,0|2,0,0]=4 24209 B12R1.37 OCCCCSCC1CCOC1 62a_100000210776_100000702531 [1,0,0,1,0,0|2,0,0]=4 24210 B12R1.37 OCCCCSCC1CCOC1 62a_100000702531_100000210776 [1,0,0,1,0,0|2,0,0]=4 24211 B12R1.37 OCCCNCCC1CCCC1 2230a_100000739158_100000230001 [1,0,0,1,0,0|1,0,0]=3 24212 B12R1.37 OCCCNCCC1CCCC1 34a_100000739158_100000230001 [1,0,0,1,0,0|1,0,0]=3 24213 B12R1.37 OCCCOCCC1CCCC1 34a_100000749090_100000230001 [1,0,0,1,0,0|1,0,0]=3 24214 B12R1.37 OCCCOCCC1CCCC1 7a_100000749090_100011215043 [1,0,0,1,0,0|1,0,0]=3 24215 B12R1.37 OCCCOCCC1CCNC1 34a_100016987287_100000230001 [1,0,0,1,0,0|2,0,0]=4 24216 B12R1.37 OCCCOCCC1CCOC1 34a_100011879284_100000230001 [1,0,0,1,0,0|2,0,0]=4 24217 B12R1.37 OCCCSCCC1CCCC1 62a_100000760354_100011215043 [1,0,0,1,0,0|1,0,0]=3 24218 B12R1.37 OCCCSCCC1CCCC1 62a_100011215043_100000760354 [1,0,0,1,0,0|1,0,0]=3 24219 B12R1.37 OCCCSCCN1CCCC1 62a_100000700749_100011215043 [1,0,0,1,0,0|2,0,0]=4 24220 B12R1.37 OCCCSCCN1CCCC1 62a_100011215043_100000004467 [1,0,0,1,0,0|2,0,0]=4 24221 B12R1.37 OCCNCCCC1CCCC1 2230a_100000736752_100000211926 [1,0,0,1,0,0|1,0,0]=3 24222 B12R1.37 OCCNCCCC1CCCC1 2230a_100016997473_100011713738 [1,0,0,1,0,0|1,0,0]=3 24223 B12R1.37 OCCNCCCC1CCCC1 34a_100000736752_100000211926 [1,0,0,1,0,0|1,0,0]=3 24224 B12R1.37 OCCNCCCC1CCCC1 34a_100016990907_100011713738 [1,0,0,1,0,0|1,0,0]=3 24225 B12R1.37 OCCNCCCN1CCCC1 2230a_100016997473_100011445909 [1,0,0,1,0,0|2,0,0]=4 24226 B12R1.37 OCCNCCCN1CCCC1 34a_100016990907_100016991639 [1,0,0,1,0,0|2,0,0]=4 24227 B12R1.37 OCCNCCOC1CCCC1 34a_100000741755_100000211926 [1,0,0,1,0,0|2,0,0]=4 24228 B12R1.37 OCCOCCCC1CCCC1 34a_100011215328_100000211926 [1,0,0,1,0,0|1,0,0]=3 24229 B12R1.37 OCCOCCCC1CCCC1 7a_100011215328_100000211926 [1,0,0,1,0,0|1,0,0]=3 24230 B12R1.37 OCCOCCNC1CCCC1 2230a_100000211070_100011215305 [1,0,0,1,0,0|2,0,0]=4 24231 B12R1.37 OCCOCCNC1CCCC1 2230a_100000211614_100000179811 [1,0,0,1,0,0|2,0,0]=4 24232 B12R1.37 OCCOCCNC1CCCC1 270004a_100000211614_100000210133 [1,0,0,1,0,0|2,0,0]=4 24233 B12R1.37 OCCOCCNC1CCCC1 34a_100000211070_100000692535 [1,0,0,1,0,0|2,0,0]=4 24234 B12R1.37 OCCOCCNC1CCCC1 34a_100000211614_100000179811 [1,0,0,1,0,0|2,0,0]=4 24235 B12R1.37 OCCOCCNC1CCCC1 34a_200000200444_100000211926 [1,0,0,1,0,0|2,0,0]=4 24236 B12R1.37 OCCOCCOC1CCCC1 34a_100000210269_100000692535 [1,0,0,1,0,0|2,0,0]=4 24237 B12R1.37 OCCOCCOC1CCCC1 34a_100000738311_100000211926 [1,0,0,1,0,0|2,0,0]=4 24238 B12R1.37 OCCOCCOC1CCCC1 7a_100000210269_100011215305 [1,0,0,1,0,0|2,0,0]=4 24239 B12R1.37 OCCOCCOC1CCCC1 7a_100000738311_100000211926 [1,0,0,1,0,0|2,0,0]=4 24240 B12R1.37 OCCOCCSC1CCCC1 62a_100011215305_100000179811 [1,0,0,1,0,0|2,0,0]=4 24241 B12R1.37 OCCOCCSC1CCCC1 62a_100011217020_100011215305 [1,0,0,1,0,0|2,0,0]=4 24242 B12R1.37 OCCSCCCC1CCCC1 62a_100000211926_100011713738 [1,0,0,1,0,0|1,0,0]=3 24243 B12R1.37 OCCSCCCC1CCCC1 62a_100011713738_100000211926 [1,0,0,1,0,0|1,0,0]=3 24244 B12R1.37 OCCSCCCN1CCCC1 62a_100000211926_100011445909 [1,0,0,1,0,0|2,0,0]=4 24245 B12R1.37 OCCSCCCN1CCCC1 62a_100016991639_100000211926 [1,0,0,1,0,0|2,0,0]=4 24246 B12R1.37 OCCSCCNC1CCCC1 2230a_100011219999_100000179811 [1,0,0,1,0,0|2,0,0]=4 24247 B12R1.37 OCCSCCNC1CCCC1 270004a_100011219999_100000210133 [1,0,0,1,0,0|2,0,0]=4 24248 B12R1.37 [13CH3]OCCCCOC1CCCO1 34a_100011018183_200025704644 [1,0,0,1,0,0|2,0,0]=4 24249 B12R1.37 [13CH3]OCCCCOC1CCCO1 7a_100011018183_200025704644 [1,0,0,1,0,0|2,0,0]=4 24250 B12R1.45 CCC1CCCC1NCCCF 269862a_100015189416_100000749056 [1,0,0,1,0,0|2,0,0]=4 24251 B12R1.45 CCC1CCCC1NCCCF 270004a_100015189416_100000749056 [1,0,0,1,0,0|2,0,0]=4 24252 B12R1.45 CCC1CCCC1NCCCO 269862a_100000182051_100000749056 [1,0,0,1,0,0|1,0,0]=3 24253 B12R1.45 CCC1CCCC1NCCCO 270004a_100000182051_100000749056 [1,0,0,1,0,0|1,0,0]=3 24254 B12R1.45 CCC1CCCC1NCCOC 269862a_100000209980_100000749056 [1,0,0,1,0,0|2,0,0]=4 24255 B12R1.45 CCC1CCCC1NCCOC 270004a_100000209980_100000749056 [1,0,0,1,0,0|2,0,0]=4 24256 B12R1.45 CCC1CCCC1NCCSC 269862a_100020590264_100000749056 [1,0,0,1,0,0|2,0,0]=4 24257 B12R1.45 CCC1CCCC1NCCSC 270004a_100020590264_100000749056 [1,0,0,1,0,0|2,0,0]=4 24258 B12R1.45 CCC1CCCN1CCCCF 2230a_100000754278_100000729493 [1,0,0,1,0,0|2,0,0]=4 24259 B12R1.45 CCC1CCCN1CCCCF 269982a_100000754278_100000729493 [1,0,0,1,0,0|2,0,0]=4 24260 B12R1.45 CCC1CCCN1CCCCF 34a_100000754278_100000729493 [1,0,0,1,0,0|2,0,0]=4 24261 B12R1.45 CCC1CCCN1CCCCO 2230a_100000754278_100000210776 [1,0,0,1,0,0|1,0,0]=3 24262 B12R1.45 CCC1CCCN1CCCCO 269982a_100000754278_100000210776 [1,0,0,1,0,0|1,0,0]=3 24263 B12R1.45 CCC1CCCN1CCCCO 34a_100000754278_100011216708 [1,0,0,1,0,0|1,0,0]=3 24264 B12R1.45 CCC1CCCN1CCCOC 2230a_100000754278_100000740836 [1,0,0,1,0,0|2,0,0]=4 24265 B12R1.45 CCC1CCCN1CCCOC 269982a_100000754278_100000740836 [1,0,0,1,0,0|2,0,0]=4 24266 B12R1.45 CCC1CCCN1CCCOC 34a_100000754278_100000740836 [1,0,0,1,0,0|2,0,0]=4 24267 B12R1.45 CCCCCC1CCCC1NC 269862a_106832991636_200000198059 [1,0,0,1,0,0|1,0,0]=3 24268 B12R1.45 CCCCCC1CCCC1NC 270004a_106832991635_200000198059 [1,0,0,1,0,0|1,0,0]=3 24269 B12R1.45 CCCCCN1CCCC1CC 2230a_100000754278_100000210326 [1,0,0,1,0,0|1,0,0]=3 24270 B12R1.45 CCCCCN1CCCC1CC 269982a_100000754278_100000210215 [1,0,0,1,0,0|1,0,0]=3 24271 B12R1.45 CCCCCN1CCCC1CC 34a_100000754278_100000718602 [1,0,0,1,0,0|1,0,0]=3 24272 B12R1.45 CCCCCN1CCC[C@@H]1CO 2230a_100000745186_100000210326 [1,0,0,1,0,0|1,0,0]=3 24273 B12R1.45 CCCCCN1CCC[C@@H]1CO 269982a_100000745186_100000210215 [1,0,0,1,0,0|1,0,0]=3 24274 B12R1.45 CCCCCN1CCC[C@@H]1CO 34a_100000745186_100000718602 [1,0,0,1,0,0|1,0,0]=3 24275 B12R1.45 CCCCNC1CCCC1CC 269862a_100000102301_100000749056 [1,0,0,1,0,0|1,0,0]=3 24276 B12R1.45 CCCCNC1CCCC1CC 270004a_100000102301_100000749056 [1,0,0,1,0,0|1,0,0]=3 24277 B12R1.45 CCCNCC1CCCN1CC 2230a_100000211693_100000210303 [1,0,0,1,0,0|2,0,0]=4 24278 B12R1.45 CCCOC[C@H]1CCCN1CC 34a_100011739246_100000210303 [1,0,0,1,0,0|2,0,0]=4 24279 B12R1.45 CCCOC[C@H]1CCCN1CC 7a_100011739246_100000210303 [1,0,0,1,0,0|2,0,0]=4 24280 B12R1.45 CCN1CCCC1CNCCO 2230a_100000211693_100000211926 [1,0,0,1,0,0|2,0,0]=4 24281 B12R1.45 CCN1CCC[C@@H]1COCCO 34a_100011739246_100000211926 [1,0,0,1,0,0|2,0,0]=4 24282 B12R1.45 CCN1CCC[C@@H]1COCCO 7a_100011739246_100000211926 [1,0,0,1,0,0|2,0,0]=4 24283 B12R1.45 CCOCCN1CCCC1CC 2230a_100000754278_100011215890 [1,0,0,1,0,0|2,0,0]=4 24284 B12R1.45 CCOCCN1CCCC1CC 269982a_100000754278_100011215890 [1,0,0,1,0,0|2,0,0]=4 24285 B12R1.45 CCOCCN1CCCC1CC 34a_100000754278_100000210147 [1,0,0,1,0,0|2,0,0]=4 24286 B12R1.45 CCOCCN1CCC[C@@H]1CO 2230a_100000745186_100011215890 [1,0,0,1,0,0|2,0,0]=4 24287 B12R1.45 CCOCCN1CCC[C@@H]1CO 269982a_100000745186_100011215890 [1,0,0,1,0,0|2,0,0]=4 24288 B12R1.45 CCOCCN1CCC[C@@H]1CO 34a_100000745186_100000210147 [1,0,0,1,0,0|2,0,0]=4 24289 B12R1.45 CCSCCN1CCCC1CC 2230a_100000754278_100000757381 [1,0,0,1,0,0|2,0,0]=4 24290 B12R1.45 CCSCCN1CCCC1CC 269982a_100000754278_100000757381 [1,0,0,1,0,0|2,0,0]=4 24291 B12R1.45 CCSCCN1CCCC1CC 34a_100000754278_100000757381 [1,0,0,1,0,0|2,0,0]=4 24292 B12R1.45 CCSCCN1CCC[C@@H]1CO 2230a_100000745186_100000757381 [1,0,0,1,0,0|2,0,0]=4 24293 B12R1.45 CCSCCN1CCC[C@@H]1CO 269982a_100000745186_100000757381 [1,0,0,1,0,0|2,0,0]=4 24294 B12R1.45 CCSCCN1CCC[C@@H]1CO 34a_100000745186_100000757381 [1,0,0,1,0,0|2,0,0]=4 24295 B12R1.45 COCCCN1CCC[C@@H]1CO 2230a_100000745186_100000740836 [1,0,0,1,0,0|2,0,0]=4 24296 B12R1.45 COCCCN1CCC[C@@H]1CO 269982a_100000745186_100000740836 [1,0,0,1,0,0|2,0,0]=4 24297 B12R1.45 COCCCN1CCC[C@@H]1CO 34a_100000745186_100000740836 [1,0,0,1,0,0|2,0,0]=4 24298 B12R1.45 OCCCCN1CCC[C@@H]1CO 2230a_100000745186_100000210776 [1,0,0,1,0,0|2,0,0]=4 24299 B12R1.45 OCCCCN1CCC[C@@H]1CO 269982a_100000745186_100000210776 [1,0,0,1,0,0|2,0,0]=4 24300 B12R1.45 OCCCCN1CCC[C@@H]1CO 34a_100000745186_100011216708 [1,0,0,1,0,0|2,0,0]=4 24301 B12R1.45 OC[C@H]1CCCN1CCCCF 2230a_100000745186_100000729493 [1,0,0,1,0,0|2,0,0]=4 24302 B12R1.45 OC[C@H]1CCCN1CCCCF 269982a_100000745186_100000729493 [1,0,0,1,0,0|2,0,0]=4 24303 B12R1.45 OC[C@H]1CCCN1CCCCF 34a_100000745186_100000729493 [1,0,0,1,0,0|2,0,0]=4 24304 B12R1.121 CCC1CCCCC1NCCF 269862a_100000724931_100000757040 [1,0,0,1,0,0|2,0,0]=4 24305 B12R1.121 CCC1CCCCC1NCCO 269862a_100000210304_100000757040 [1,0,0,1,0,0|1,0,0]=3 24306 B12R1.121 CCC1CCCCC1NCCO 270004a_100000210304_100000757040 [1,0,0,1,0,0|1,0,0]=3 24307 B12R1.121 CCC1CCCCC1OCCF 34a_100000210738_100011217306 [1,0,0,1,0,0|2,0,0]=4 24308 B12R1.121 CCC1CCCCC1OCCF 7a_100000210738_100011217306 [1,0,0,1,0,0|2,0,0]=4 24309 B12R1.121 CCC1CCCCC1OCCO 34a_100000210738_100000211926 [1,0,0,1,0,0|1,0,0]=3 24310 B12R1.121 CCC1CCCCC1OCCO 7a_100000210738_100000211926 [1,0,0,1,0,0|1,0,0]=3 24311 B12R1.121 CCC1CCCCC1OCSC 34a_100000210738_100011218213 [1,0,0,1,0,0|2,0,0]=4 24312 B12R1.121 CCC1CCCCN1CCCF 2230a_100000210034_100011934791 [1,0,0,1,0,0|2,0,0]=4 24313 B12R1.121 CCC1CCCCN1CCCF 269982a_100000210034_100011934791 [1,0,0,1,0,0|2,0,0]=4 24314 B12R1.121 CCC1CCCCN1CCCF 34a_100000210034_100011934791 [1,0,0,1,0,0|2,0,0]=4 24315 B12R1.121 CCC1CCCCN1CCCO 2230a_100000210034_100000230001 [1,0,0,1,0,0|1,0,0]=3 24316 B12R1.121 CCC1CCCCN1CCCO 269982a_100000210034_100011215043 [1,0,0,1,0,0|1,0,0]=3 24317 B12R1.121 CCC1CCCCN1CCCO 34a_100000210034_100000230001 [1,0,0,1,0,0|1,0,0]=3 24318 B12R1.121 CCC1CCCCN1CCNC 2230a_100000755458_200000210301 [1,0,0,1,0,0|2,0,0]=4 24319 B12R1.121 CCC1CCCCN1CCNC 34a_100000755458_200000210301 [1,0,0,1,0,0|2,0,0]=4 24320 B12R1.121 CCC1CCCCN1CCN[13CH3] 2230a_100000755458_200025704644 [1,0,0,1,0,0|2,0,0]=4 24321 B12R1.121 CCC1CCCCN1CCN[13CH3] 34a_100000755458_200025704644 [1,0,0,1,0,0|2,0,0]=4 24322 B12R1.121 CCC1CCCCN1CCOC 2230a_100000210034_100011201679 [1,0,0,1,0,0|2,0,0]=4 24323 B12R1.121 CCC1CCCCN1CCOC 269982a_100000210034_100000233755 [1,0,0,1,0,0|2,0,0]=4 24324 B12R1.121 CCC1CCCCN1CCOC 34a_100000210034_100011201679 [1,0,0,1,0,0|2,0,0]=4 24325 B12R1.121 CCC1CCCCN1CCSC 2230a_100000210034_100000751147 [1,0,0,1,0,0|2,0,0]=4 24326 B12R1.121 CCC1CCCCN1CCSC 269982a_100000210034_100000212216 [1,0,0,1,0,0|2,0,0]=4 24327 B12R1.121 CCC1CCCCN1CCSC 34a_100000210034_100000212216 [1,0,0,1,0,0|2,0,0]=4 24328 B12R1.121 CCCCN1CCCCC1CC 2230a_100000210034_100000210211 [1,0,0,1,0,0|1,0,0]=3 24329 B12R1.121 CCCCN1CCCCC1CC 269982a_100000210034_100000210211 [1,0,0,1,0,0|1,0,0]=3 24330 B12R1.121 CCCCN1CCCCC1CC 34a_100000210034_100000210210 [1,0,0,1,0,0|1,0,0]=3 24331 B12R1.121 CCCCN1CCCCC1CO 2230a_100000210821_100000210211 [1,0,0,1,0,0|1,0,0]=3 24332 B12R1.121 CCCCN1CCCCC1CO 269982a_100000210821_100000210211 [1,0,0,1,0,0|1,0,0]=3 24333 B12R1.121 CCCCN1CCCCC1CO 34a_100000210821_100000210210 [1,0,0,1,0,0|1,0,0]=3 24334 B12R1.121 CCCCN1CCOC[C@@H]1CC 2230a_100016988097_100000210211 [1,0,0,1,0,0|2,0,0]=4 24335 B12R1.121 CCCCN1CCOC[C@@H]1CC 269982a_100016988097_100000210211 [1,0,0,1,0,0|2,0,0]=4 24336 B12R1.121 CCCCN1CCOC[C@@H]1CC 34a_100016988097_100000210210 [1,0,0,1,0,0|2,0,0]=4 24337 B12R1.121 CCCCN1CCOC[C@H]1CO 2230a_100000717676_100000210211 [1,0,0,1,0,0|2,0,0]=4 24338 B12R1.121 CCCCN1CCOC[C@H]1CO 269982a_100000717676_100000210211 [1,0,0,1,0,0|2,0,0]=4 24339 B12R1.121 CCCCN1CCOC[C@H]1CO 34a_100000717676_100000210210 [1,0,0,1,0,0|2,0,0]=4 24340 B12R1.121 CCCNC1CCCCC1CC 269862a_100020643023_100000757040 [1,0,0,1,0,0|1,0,0]=3 24341 B12R1.121 CCCNC1CCCCC1CC 270004a_100020643023_100000757040 [1,0,0,1,0,0|1,0,0]=3 24342 B12R1.121 CCCNC1CCCCC1CO 270004a_100020643023_100009861125 [1,0,0,1,0,0|1,0,0]=3 24343 B12R1.121 CCCNC1CCCCC1OC 270004a_100020643023_100000740605 [1,0,0,1,0,0|2,0,0]=4 24344 B12R1.121 CCCNC1CCCCC1OC 34a_100011208099_100000210303 [1,0,0,1,0,0|2,0,0]=4 24345 B12R1.121 CCCNC1CCOCC1CO 2230a_214813039666_100000210303 [1,0,0,1,0,0|2,0,0]=4 24346 B12R1.121 CCCNC1CCOCC1CO 34a_214813039666_100000210303 [1,0,0,1,0,0|2,0,0]=4 24347 B12R1.121 CCCOC1CCCCC1CC 34a_100000210738_100000210303 [1,0,0,1,0,0|1,0,0]=3 24348 B12R1.121 CCCOC1CCCCC1CC 7a_100000210738_100000210303 [1,0,0,1,0,0|1,0,0]=3 24349 B12R1.121 CCCOC1CCCCC1CN 34a_100011216029_100000210303 [1,0,0,1,0,0|2,0,0]=4 24350 B12R1.121 CCCO[C@@H]1CCCC[C@H]1NC 34a_100000708425_100000210303 [1,0,0,1,0,0|2,0,0]=4 24351 B12R1.121 CCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000210303 [1,0,0,1,0,0|2,0,0]=4 24352 B12R1.121 CCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000210303 [1,0,0,1,0,0|2,0,0]=4 24353 B12R1.121 CCN1CCCCC1CCCO 2230a_100011934581_100000210202 [1,0,0,1,0,0|1,0,0]=3 24354 B12R1.121 CCN1CCCCC1CCCO 269982a_100011934581_100000204670 [1,0,0,1,0,0|1,0,0]=3 24355 B12R1.121 CCN1CCCCC1CCCO 34a_100011934581_100000210202 [1,0,0,1,0,0|1,0,0]=3 24356 B12R1.121 CCN1CCCCC1CCOC 2230a_100015186528_100000210202 [1,0,0,1,0,0|2,0,0]=4 24357 B12R1.121 CCN1CCCCC1CCOC 269982a_100015186528_100000204670 [1,0,0,1,0,0|2,0,0]=4 24358 B12R1.121 CCN1CCCCC1CCOC 34a_100015186528_100000210202 [1,0,0,1,0,0|2,0,0]=4 24359 B12R1.121 CCNCC1CCCCN1CC 2230a_100000754393_100000210202 [1,0,0,1,0,0|2,0,0]=4 24360 B12R1.121 CCNCC1CCCCN1CC 34a_100000754393_100000210202 [1,0,0,1,0,0|2,0,0]=4 24361 B12R1.121 CCOCC1CCCCN1CC 34a_100000225091_100000210202 [1,0,0,1,0,0|2,0,0]=4 24362 B12R1.121 CCOCC1CCCCN1CC 7a_100000225091_100000210202 [1,0,0,1,0,0|2,0,0]=4 24363 B12R1.121 CCOCN1CCCCC1CC 269982a_100000210034_100000739092 [1,0,0,1,0,0|2,0,0]=4 24364 B12R1.121 CCOCN1CCCCC1CO 269982a_100000210821_100000739092 [1,0,0,1,0,0|2,0,0]=4 24365 B12R1.121 CC[C@H]1COCCN1CCCO 2230a_100016988097_100000230001 [1,0,0,1,0,0|2,0,0]=4 24366 B12R1.121 CC[C@H]1COCCN1CCCO 269982a_100016988097_100011215043 [1,0,0,1,0,0|2,0,0]=4 24367 B12R1.121 CC[C@H]1COCCN1CCCO 34a_100016988097_100000230001 [1,0,0,1,0,0|2,0,0]=4 24368 B12R1.121 CNCCN1CCCCC1CO 2230a_100011473795_200000210301 [1,0,0,1,0,0|2,0,0]=4 24369 B12R1.121 CNCCN1CCCCC1CO 34a_100011473795_200000210301 [1,0,0,1,0,0|2,0,0]=4 24370 B12R1.121 CN[C@@H]1CCCC[C@H]1OCCO 34a_100000708425_100000211926 [1,0,0,1,0,0|2,0,0]=4 24371 B12R1.121 COC1CCCCC1NCCO 270004a_100000210304_100000740605 [1,0,0,1,0,0|2,0,0]=4 24372 B12R1.121 COC1CCCCC1NCCO 34a_100011208099_100000211926 [1,0,0,1,0,0|2,0,0]=4 24373 B12R1.121 COCCN1CCCCC1CO 2230a_100000210821_100011201679 [1,0,0,1,0,0|2,0,0]=4 24374 B12R1.121 COCCN1CCCCC1CO 269982a_100000210821_100000233755 [1,0,0,1,0,0|2,0,0]=4 24375 B12R1.121 COCCN1CCCCC1CO 34a_100000210821_100011201679 [1,0,0,1,0,0|2,0,0]=4 24376 B12R1.121 CO[C@H]1CCCC[C@@H]1OCCO 34a_200009815850_100000211926 [1,0,0,1,0,0|2,0,0]=4 24377 B12R1.121 CO[C@H]1CCCC[C@@H]1OCCO 7a_200009815850_100000211926 [1,0,0,1,0,0|2,0,0]=4 24378 B12R1.121 CSCCN1CCCCC1CO 2230a_100000210821_100000751147 [1,0,0,1,0,0|2,0,0]=4 24379 B12R1.121 CSCCN1CCCCC1CO 269982a_100000210821_100000212216 [1,0,0,1,0,0|2,0,0]=4 24380 B12R1.121 CSCCN1CCCCC1CO 34a_100000210821_100000212216 [1,0,0,1,0,0|2,0,0]=4 24381 B12R1.121 NCC1CCCCC1OCCO 34a_100011216029_100000211926 [1,0,0,1,0,0|2,0,0]=4 24382 B12R1.121 OCC1CCCCN1CCCF 2230a_100000210821_100011934791 [1,0,0,1,0,0|2,0,0]=4 24383 B12R1.121 OCC1CCCCN1CCCF 269982a_100000210821_100011934791 [1,0,0,1,0,0|2,0,0]=4 24384 B12R1.121 OCC1CCCCN1CCCF 34a_100000210821_100011934791 [1,0,0,1,0,0|2,0,0]=4 24385 B12R1.121 OCCCC1CCCCN1CF 269982a_100011934581_100015361967 [1,0,0,1,0,0|2,0,0]=4 24386 B12R1.121 OCCCC1CCCCN1CF 34a_100011934581_100015361967 [1,0,0,1,0,0|2,0,0]=4 24387 B12R1.121 OCCCN1CCCCC1CO 2230a_100000210821_100000230001 [1,0,0,1,0,0|2,0,0]=4 24388 B12R1.121 OCCCN1CCCCC1CO 269982a_100000210821_100011215043 [1,0,0,1,0,0|2,0,0]=4 24389 B12R1.121 OCCCN1CCCCC1CO 34a_100000210821_100000230001 [1,0,0,1,0,0|2,0,0]=4 24390 B12R1.121 OCCNC1CCCCC1CO 270004a_100000210304_100009861125 [1,0,0,1,0,0|2,0,0]=4 24391 B12R1.121 [13CH3]NCCN1CCCCC1CO 2230a_100011473795_200025704644 [1,0,0,1,0,0|2,0,0]=4 24392 B12R1.121 [13CH3]NCCN1CCCCC1CO 34a_100011473795_200025704644 [1,0,0,1,0,0|2,0,0]=4 24393 B12R1.169 CCCC1CCCCC1NCC 269862a_100015525214_100011218038 [1,0,0,1,0,0|1,0,0]=3 24394 B12R1.169 CCCC1CCCCC1NCC 270004a_100015525214_100011218038 [1,0,0,1,0,0|1,0,0]=3 24395 B12R1.169 CCCC1CCCCC1OCC 34a_100011217265_100000210202 [1,0,0,1,0,0|1,0,0]=3 24396 B12R1.169 CCCC1CCCCC1OCC 7a_100011217265_100000210202 [1,0,0,1,0,0|1,0,0]=3 24397 B12R1.169 CCCC1CCCCC1OCF 34a_100011217265_100015361967 [1,0,0,1,0,0|2,0,0]=4 24398 B12R1.169 CCCC1CCCCC1OCF 7a_100011217265_100015361967 [1,0,0,1,0,0|2,0,0]=4 24399 B12R1.169 CCCC1CCCCN1CCC 2230a_100000701414_100000210303 [1,0,0,1,0,0|1,0,0]=3 24400 B12R1.169 CCCC1CCCCN1CCC 269982a_100000701414_100000210303 [1,0,0,1,0,0|1,0,0]=3 24401 B12R1.169 CCCC1CCCCN1CCC 34a_100000701414_100000210303 [1,0,0,1,0,0|1,0,0]=3 24402 B12R1.169 CCCC1CCCCN1CCF 2230a_100000701414_100011217306 [1,0,0,1,0,0|2,0,0]=4 24403 B12R1.169 CCCC1CCCCN1CCF 269982a_100000701414_100011217306 [1,0,0,1,0,0|2,0,0]=4 24404 B12R1.169 CCCC1CCCCN1CCF 34a_100000701414_100011217306 [1,0,0,1,0,0|2,0,0]=4 24405 B12R1.169 CCCC1CCCCN1CCO 2230a_100000701414_100000211926 [1,0,0,1,0,0|1,0,0]=3 24406 B12R1.169 CCCC1CCCCN1CCO 269982a_100000701414_100000211926 [1,0,0,1,0,0|1,0,0]=3 24407 B12R1.169 CCCC1CCCCN1CCO 34a_100000701414_100000211926 [1,0,0,1,0,0|1,0,0]=3 24408 B12R1.169 CCCC1CCCCN1COC 2230a_100000701414_100000766300 [1,0,0,1,0,0|2,0,0]=4 24409 B12R1.169 CCCC1CCCCN1COC 269982a_100000701414_100000766300 [1,0,0,1,0,0|2,0,0]=4 24410 B12R1.169 CCCC1CCCCN1CSC 2230a_100000701414_100011218213 [1,0,0,1,0,0|2,0,0]=4 24411 B12R1.169 CCCC1CCCCN1CSC 269982a_100000701414_100011218213 [1,0,0,1,0,0|2,0,0]=4 24412 B12R1.169 CCCC1CCCCN1CSC 34a_100000701414_100011218213 [1,0,0,1,0,0|2,0,0]=4 24413 B12R1.169 CCCC1COCCN1CCC 2230a_102495339903_100000210303 [1,0,0,1,0,0|2,0,0]=4 24414 B12R1.169 CCCC1COCCN1CCC 269982a_102495339903_100000210303 [1,0,0,1,0,0|2,0,0]=4 24415 B12R1.169 CCCC1COCCN1CCC 34a_102495339903_100000210303 [1,0,0,1,0,0|2,0,0]=4 24416 B12R1.169 CCCC1COCCN1CCO 2230a_102495339903_100000211926 [1,0,0,1,0,0|2,0,0]=4 24417 B12R1.169 CCCC1COCCN1CCO 269982a_102495339903_100000211926 [1,0,0,1,0,0|2,0,0]=4 24418 B12R1.169 CCCC1COCCN1CCO 34a_102495339903_100000211926 [1,0,0,1,0,0|2,0,0]=4 24419 B12R1.169 CCCN1CCCCC1CCO 2230a_100000211664_100000210303 [1,0,0,1,0,0|1,0,0]=3 24420 B12R1.169 CCCN1CCCCC1CCO 269982a_100000211664_100000210303 [1,0,0,1,0,0|1,0,0]=3 24421 B12R1.169 CCCN1CCCCC1CCO 34a_100000211664_100000210303 [1,0,0,1,0,0|1,0,0]=3 24422 B12R1.169 CCCN1CCCCC1COC 2230a_100015184032_100000210303 [1,0,0,1,0,0|2,0,0]=4 24423 B12R1.169 CCCN1CCCCC1COC 269982a_100015184032_100000210303 [1,0,0,1,0,0|2,0,0]=4 24424 B12R1.169 CCCN1CCCCC1COC 34a_100015184032_100000210303 [1,0,0,1,0,0|2,0,0]=4 24425 B12R1.169 CCNC1CCCCC1OCC 270004a_100015525214_200000031474 [1,0,0,1,0,0|2,0,0]=4 24426 B12R1.169 COCC1CCCCN1CCO 2230a_100015184032_100000211926 [1,0,0,1,0,0|2,0,0]=4 24427 B12R1.169 COCC1CCCCN1CCO 269982a_100015184032_100000211926 [1,0,0,1,0,0|2,0,0]=4 24428 B12R1.169 COCC1CCCCN1CCO 34a_100015184032_100000211926 [1,0,0,1,0,0|2,0,0]=4 24429 B12R1.169 COCN1CCCCC1CCO 2230a_100000211664_100000766300 [1,0,0,1,0,0|2,0,0]=4 24430 B12R1.169 COCN1CCCCC1CCO 269982a_100000211664_100000766300 [1,0,0,1,0,0|2,0,0]=4 24431 B12R1.169 CSCN1CCCCC1CCO 2230a_100000211664_100011218213 [1,0,0,1,0,0|2,0,0]=4 24432 B12R1.169 CSCN1CCCCC1CCO 269982a_100000211664_100011218213 [1,0,0,1,0,0|2,0,0]=4 24433 B12R1.169 CSCN1CCCCC1CCO 34a_100000211664_100011218213 [1,0,0,1,0,0|2,0,0]=4 24434 B12R1.169 OCCC1CCCCN1CCF 2230a_100000211664_100011217306 [1,0,0,1,0,0|2,0,0]=4 24435 B12R1.169 OCCC1CCCCN1CCF 269982a_100000211664_100011217306 [1,0,0,1,0,0|2,0,0]=4 24436 B12R1.169 OCCC1CCCCN1CCF 34a_100000211664_100011217306 [1,0,0,1,0,0|2,0,0]=4 24437 B12R1.169 OCCC1CCCCN1CCO 2230a_100000211664_100000211926 [1,0,0,1,0,0|2,0,0]=4 24438 B12R1.169 OCCC1CCCCN1CCO 269982a_100000211664_100000211926 [1,0,0,1,0,0|2,0,0]=4 24439 B12R1.169 OCCC1CCCCN1CCO 34a_100000211664_100000211926 [1,0,0,1,0,0|2,0,0]=4 24440 B12R1.173 CCCN1CCCCCCCC1 2230a_100000039187_100000210303 [1,0,0,1,0,0|1,0,0]=3 24441 B12R1.173 CCCN1CCCCCCCC1 269982a_100000039187_100000210303 [1,0,0,1,0,0|1,0,0]=3 24442 B12R1.173 CCCN1CCCCCCCC1 34a_100000039187_100000210303 [1,0,0,1,0,0|1,0,0]=3 24443 B12R1.173 CCNC1CCCCCCCC1 270004a_100015525214_100000038600 [1,0,0,1,0,0|1,0,0]=3 24444 B12R1.173 COCN1CCCCCCCC1 2230a_100000039187_100000766300 [1,0,0,1,0,0|2,0,0]=4 24445 B12R1.173 COCN1CCCCCCCC1 269982a_100000039187_100000766300 [1,0,0,1,0,0|2,0,0]=4 24446 B12R1.173 CSCN1CCCCCCCC1 2230a_100000039187_100011218213 [1,0,0,1,0,0|2,0,0]=4 24447 B12R1.173 CSCN1CCCCCCCC1 269982a_100000039187_100011218213 [1,0,0,1,0,0|2,0,0]=4 24448 B12R1.173 CSCN1CCCCCCCC1 34a_100000039187_100011218213 [1,0,0,1,0,0|2,0,0]=4 24449 B12R1.173 FCCN1CCCCCCCC1 2230a_100000039187_100011217306 [1,0,0,1,0,0|2,0,0]=4 24450 B12R1.173 FCCN1CCCCCCCC1 269982a_100000039187_100011217306 [1,0,0,1,0,0|2,0,0]=4 24451 B12R1.173 FCCN1CCCCCCCC1 34a_100000039187_100011217306 [1,0,0,1,0,0|2,0,0]=4 24452 B12R1.173 OCCN1CCCCCCCC1 2230a_100000039187_100000211926 [1,0,0,1,0,0|1,0,0]=3 24453 B12R1.173 OCCN1CCCCCCCC1 269982a_100000039187_100000211926 [1,0,0,1,0,0|1,0,0]=3 24454 B12R1.173 OCCN1CCCCCCCC1 34a_100000039187_100000211926 [1,0,0,1,0,0|1,0,0]=3 24455 B12R1.267 CC1CCCCC1NCCCF 2230a_100000211402_100011934791 [1,0,0,1,0,0|2,0,0]=4 24456 B12R1.267 CC1CCCCC1NCCCF 269862a_100015189416_100000210921 [1,0,0,1,0,0|2,0,0]=4 24457 B12R1.267 CC1CCCCC1NCCCF 270004a_100015189416_100000210921 [1,0,0,1,0,0|2,0,0]=4 24458 B12R1.267 CC1CCCCC1NCCCF 34a_100000211402_100011934791 [1,0,0,1,0,0|2,0,0]=4 24459 B12R1.267 CC1CCCCC1NCCCO 2230a_100000211402_100000230001 [1,0,0,1,0,0|1,0,0]=3 24460 B12R1.267 CC1CCCCC1NCCCO 269862a_100000182051_100000210921 [1,0,0,1,0,0|1,0,0]=3 24461 B12R1.267 CC1CCCCC1NCCCO 270004a_100000182051_100000210921 [1,0,0,1,0,0|1,0,0]=3 24462 B12R1.267 CC1CCCCC1NCCCO 34a_100000211402_100000230001 [1,0,0,1,0,0|1,0,0]=3 24463 B12R1.267 CC1CCCCC1OCCCF 34a_100000211207_100011934791 [1,0,0,1,0,0|2,0,0]=4 24464 B12R1.267 CC1CCCCC1OCCCF 7a_100000211207_100011934791 [1,0,0,1,0,0|2,0,0]=4 24465 B12R1.267 CC1CCCCC1OCCCO 34a_100000211207_100000230001 [1,0,0,1,0,0|1,0,0]=3 24466 B12R1.267 CC1CCCCC1OCCCO 7a_100000211207_100011215043 [1,0,0,1,0,0|1,0,0]=3 24467 B12R1.267 CC1CCCCN1CCCCF 2230a_100000211376_100000729493 [1,0,0,1,0,0|2,0,0]=4 24468 B12R1.267 CC1CCCCN1CCCCF 269982a_100000211376_100000729493 [1,0,0,1,0,0|2,0,0]=4 24469 B12R1.267 CC1CCCCN1CCCCF 34a_100000211376_100000729493 [1,0,0,1,0,0|2,0,0]=4 24470 B12R1.267 CC1CCCCN1CCCCO 2230a_100000211376_100000210776 [1,0,0,1,0,0|1,0,0]=3 24471 B12R1.267 CC1CCCCN1CCCCO 269982a_100000211376_100000210776 [1,0,0,1,0,0|1,0,0]=3 24472 B12R1.267 CC1CCCCN1CCCCO 34a_100000211376_100011216708 [1,0,0,1,0,0|1,0,0]=3 24473 B12R1.267 CC1CCCCN1CCCN[13CH3] 34a_100000212276_200025704644 [1,0,0,1,0,0|2,0,0]=4 24474 B12R1.267 CC1CCCCN1CCCO[13CH3] 34a_100000213889_200025704644 [1,0,0,1,0,0|2,0,0]=4 24475 B12R1.267 CC1CCCCN1CCCO[13CH3] 7a_100000213889_200025704644 [1,0,0,1,0,0|2,0,0]=4 24476 B12R1.267 CC1CCNCC1OCCCO 34a_100000696640_100000230001 [1,0,0,1,0,0|2,0,0]=4 24477 B12R1.267 CC1CNCCC1NCCCO 270004a_100000182051_100000703950 [1,0,0,1,0,0|2,0,0]=4 24478 B12R1.267 CC1CNCCC1OCCCO 34a_100011998114_100000230001 [1,0,0,1,0,0|2,0,0]=4 24479 B12R1.267 CC1COCCC1NCCCO 270004a_100000182051_100000755695 [1,0,0,1,0,0|2,0,0]=4 24480 B12R1.267 CCCCCN1CCCCC1C 2230a_100000211376_100000210326 [1,0,0,1,0,0|1,0,0]=3 24481 B12R1.267 CCCCCN1CCCCC1C 269982a_100000211376_100000210215 [1,0,0,1,0,0|1,0,0]=3 24482 B12R1.267 CCCCCN1CCCCC1C 34a_100000211376_100000718602 [1,0,0,1,0,0|1,0,0]=3 24483 B12R1.267 CCCCCN1CCOC[C@@H]1C 2230a_100009815349_100000210326 [1,0,0,1,0,0|2,0,0]=4 24484 B12R1.267 CCCCCN1CCOC[C@@H]1C 269982a_100009815349_100000210215 [1,0,0,1,0,0|2,0,0]=4 24485 B12R1.267 CCCCCN1CCOC[C@@H]1C 34a_100009815349_100000718602 [1,0,0,1,0,0|2,0,0]=4 24486 B12R1.267 CCCCNC1CCCCC1C 2230a_100000211402_100000210211 [1,0,0,1,0,0|1,0,0]=3 24487 B12R1.267 CCCCNC1CCCCC1C 269862a_100000102301_100000210921 [1,0,0,1,0,0|1,0,0]=3 24488 B12R1.267 CCCCNC1CCCCC1C 270004a_100000102301_100000210921 [1,0,0,1,0,0|1,0,0]=3 24489 B12R1.267 CCCCNC1CCCCC1C 34a_100000211402_100000210210 [1,0,0,1,0,0|1,0,0]=3 24490 B12R1.267 CCCCNC1CCNCC1C 270004a_100000102301_100000703950 [1,0,0,1,0,0|2,0,0]=4 24491 B12R1.267 CCCCNC1CCOCC1C 270004a_100000102301_100000755695 [1,0,0,1,0,0|2,0,0]=4 24492 B12R1.267 CCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000210211 [1,0,0,1,0,0|2,0,0]=4 24493 B12R1.267 CCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000210210 [1,0,0,1,0,0|2,0,0]=4 24494 B12R1.267 CCCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100000210211 [1,0,0,1,0,0|2,0,0]=4 24495 B12R1.267 CCCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000210211 [1,0,0,1,0,0|2,0,0]=4 24496 B12R1.267 CCCCOC1CCCCC1C 34a_100000211207_100000210210 [1,0,0,1,0,0|1,0,0]=3 24497 B12R1.267 CCCCOC1CCCCC1C 7a_100000211207_100000210211 [1,0,0,1,0,0|1,0,0]=3 24498 B12R1.267 CCCCOC1CCCCC1Cl 34a_100000038908_100000210210 [1,0,0,1,0,0|2,0,0]=4 24499 B12R1.267 CCCCOC1CCCCC1Cl 7a_100000038908_100000210211 [1,0,0,1,0,0|2,0,0]=4 24500 B12R1.267 CCCCOC1CCCCC1F 34a_100000210227_100015423560 [1,0,0,1,0,0|2,0,0]=4 24501 B12R1.267 CCCCOC1CCCCC1O 34a_100000210227_100000038908 [1,0,0,1,0,0|1,0,0]=3 24502 B12R1.267 CCCCOC1CCNCC1C 34a_100011998114_100000210210 [1,0,0,1,0,0|2,0,0]=4 24503 B12R1.267 CCCCOC1CNCCC1C 34a_100000696640_100000210210 [1,0,0,1,0,0|2,0,0]=4 24504 B12R1.267 CCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000210210 [1,0,0,1,0,0|2,0,0]=4 24505 B12R1.267 CCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000210211 [1,0,0,1,0,0|2,0,0]=4 24506 B12R1.267 CCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000210210 [1,0,0,1,0,0|2,0,0]=4 24507 B12R1.267 CCCCSC1CCCCC1F 62a_100000210211_100015423560 [1,0,0,1,0,0|2,0,0]=4 24508 B12R1.267 CCCCSC1CCCCC1F 62a_100015423560_100000210210 [1,0,0,1,0,0|2,0,0]=4 24509 B12R1.267 CCCCSC1CCCCC1O 62a_100000038908_100000210210 [1,0,0,1,0,0|1,0,0]=3 24510 B12R1.267 CCCCSC1CCCCC1O 62a_100000210211_100000038908 [1,0,0,1,0,0|1,0,0]=3 24511 B12R1.267 CCCNCC1CCCCC1O 34a_100011216029_100000210303 [1,0,0,1,0,0|1,0,0]=3 24512 B12R1.267 CCCNCC1CCCCN1C 34a_100011228421_100000210303 [1,0,0,1,0,0|2,0,0]=4 24513 B12R1.267 CCCOCC1CCCCN1C 34a_100000210258_100015186950 [1,0,0,1,0,0|2,0,0]=4 24514 B12R1.267 CCCOCC1CCCCN1C 34a_100000225079_100000210303 [1,0,0,1,0,0|2,0,0]=4 24515 B12R1.267 CCCSCC1CCCCN1C 62a_100000210303_100015185383 [1,0,0,1,0,0|2,0,0]=4 24516 B12R1.267 CCCSCC1CCCCN1C 62a_100015185383_100000210303 [1,0,0,1,0,0|2,0,0]=4 24517 B12R1.267 CCNCCC1CCCCN1C 2230a_100015525214_100000211948 [1,0,0,1,0,0|2,0,0]=4 24518 B12R1.267 CCNCCN1CCCCC1C 2230a_100000739827_100000210202 [1,0,0,1,0,0|2,0,0]=4 24519 B12R1.267 CCNCCN1CCCCC1C 34a_100000739827_100000210202 [1,0,0,1,0,0|2,0,0]=4 24520 B12R1.267 CCOCCC1CCCCN1C 34a_100121572206_100000211948 [1,0,0,1,0,0|2,0,0]=4 24521 B12R1.267 CCOCCN1CCCCC1C 2230a_100000211376_100011215890 [1,0,0,1,0,0|2,0,0]=4 24522 B12R1.267 CCOCCN1CCCCC1C 269982a_100000211376_100011215890 [1,0,0,1,0,0|2,0,0]=4 24523 B12R1.267 CCOCCN1CCCCC1C 34a_100000211376_100000210147 [1,0,0,1,0,0|2,0,0]=4 24524 B12R1.267 CCOCCN1CCCCC1C 34a_100011305533_100000210202 [1,0,0,1,0,0|2,0,0]=4 24525 B12R1.267 CCOCSC1CCCCC1O 62a_100000038908_100000739092 [1,0,0,1,0,0|2,0,0]=4 24526 B12R1.267 CCOCSC1CCCCC1O 62a_100000739092_100000038908 [1,0,0,1,0,0|2,0,0]=4 24527 B12R1.267 CCSCCC1CCCCN1C 62a_100000210202_100000211948 [1,0,0,1,0,0|2,0,0]=4 24528 B12R1.267 CCSCCC1CCCCN1C 62a_100000211948_100000210202 [1,0,0,1,0,0|2,0,0]=4 24529 B12R1.267 CCSCCN1CCCCC1C 2230a_100000211376_100000757381 [1,0,0,1,0,0|2,0,0]=4 24530 B12R1.267 CCSCCN1CCCCC1C 269982a_100000211376_100000757381 [1,0,0,1,0,0|2,0,0]=4 24531 B12R1.267 CCSCCN1CCCCC1C 34a_100000211376_100000757381 [1,0,0,1,0,0|2,0,0]=4 24532 B12R1.267 CN1CCCCC1CNCCO 34a_100011228421_100000211926 [1,0,0,1,0,0|2,0,0]=4 24533 B12R1.267 CN1CCCCC1CNCCO 34a_100016990907_100015186950 [1,0,0,1,0,0|2,0,0]=4 24534 B12R1.267 CN1CCCCC1COCCO 34a_100000225079_100000211926 [1,0,0,1,0,0|2,0,0]=4 24535 B12R1.267 CN1CCCCC1CSCCO 62a_100000211926_100015185383 [1,0,0,1,0,0|2,0,0]=4 24536 B12R1.267 CN1CCCCC1CSCCO 62a_100015185383_100000211926 [1,0,0,1,0,0|2,0,0]=4 24537 B12R1.267 CNCCCN1CCCCC1C 34a_100000212276_200000210301 [1,0,0,1,0,0|2,0,0]=4 24538 B12R1.267 COCCCC1CCCCN1C 2230a_100011804088_200000210301 [1,0,0,1,0,0|2,0,0]=4 24539 B12R1.267 COCCCC1CCCCN1C 269982a_100011804088_200000210301 [1,0,0,1,0,0|2,0,0]=4 24540 B12R1.267 COCCCC1CCCCN1C 34a_100011804088_200000210301 [1,0,0,1,0,0|2,0,0]=4 24541 B12R1.267 COCCCC1CCCCN1[13CH3] 2230a_100011804088_200025704644 [1,0,0,1,0,0|2,0,0]=4 24542 B12R1.267 COCCCC1CCCCN1[13CH3] 269982a_100011804088_200025704644 [1,0,0,1,0,0|2,0,0]=4 24543 B12R1.267 COCCCC1CCCCN1[13CH3] 34a_100011804088_200025704644 [1,0,0,1,0,0|2,0,0]=4 24544 B12R1.267 COCCCN1CCCCC1C 2230a_100000211376_100000740836 [1,0,0,1,0,0|2,0,0]=4 24545 B12R1.267 COCCCN1CCCCC1C 269982a_100000211376_100000740836 [1,0,0,1,0,0|2,0,0]=4 24546 B12R1.267 COCCCN1CCCCC1C 34a_100000211376_100000740836 [1,0,0,1,0,0|2,0,0]=4 24547 B12R1.267 COCCCN1CCCCC1C 34a_100000213889_200000210301 [1,0,0,1,0,0|2,0,0]=4 24548 B12R1.267 COCCCN1CCCCC1C 7a_100000213889_200000210301 [1,0,0,1,0,0|2,0,0]=4 24549 B12R1.267 COCCNC1CCCCC1C 2230a_100000211402_100011201679 [1,0,0,1,0,0|2,0,0]=4 24550 B12R1.267 COCCNC1CCCCC1C 269862a_100000209980_100000210921 [1,0,0,1,0,0|2,0,0]=4 24551 B12R1.267 COCCNC1CCCCC1C 270004a_100000209980_100000210921 [1,0,0,1,0,0|2,0,0]=4 24552 B12R1.267 COCCNC1CCCCC1C 34a_100000211402_100011201679 [1,0,0,1,0,0|2,0,0]=4 24553 B12R1.267 COCCOC1CCCCC1C 34a_100000211207_100011201679 [1,0,0,1,0,0|2,0,0]=4 24554 B12R1.267 COCCOC1CCCCC1C 7a_100000211207_100000233755 [1,0,0,1,0,0|2,0,0]=4 24555 B12R1.267 COCCOC1CCCCC1O 34a_100000210237_100000038908 [1,0,0,1,0,0|2,0,0]=4 24556 B12R1.267 COCCSC1CCCCC1O 62a_100000038908_100000233755 [1,0,0,1,0,0|2,0,0]=4 24557 B12R1.267 COCCSC1CCCCC1O 62a_100000233755_100000038908 [1,0,0,1,0,0|2,0,0]=4 24558 B12R1.267 CSCCNC1CCCCC1C 2230a_100000211402_100000751147 [1,0,0,1,0,0|2,0,0]=4 24559 B12R1.267 CSCCNC1CCCCC1C 269862a_100020590264_100000210921 [1,0,0,1,0,0|2,0,0]=4 24560 B12R1.267 CSCCNC1CCCCC1C 270004a_100020590264_100000210921 [1,0,0,1,0,0|2,0,0]=4 24561 B12R1.267 CSCCNC1CCCCC1C 34a_100000211402_100000212216 [1,0,0,1,0,0|2,0,0]=4 24562 B12R1.267 CSCCOC1CCCCC1C 34a_100000211207_100000212216 [1,0,0,1,0,0|2,0,0]=4 24563 B12R1.267 CSCCOC1CCCCC1C 7a_100000211207_100000212216 [1,0,0,1,0,0|2,0,0]=4 24564 B12R1.267 CSCCOC1CCCCC1O 34a_100000230434_100000038908 [1,0,0,1,0,0|2,0,0]=4 24565 B12R1.267 CSCCSC1CCCCC1O 62a_100000038908_100000751147 [1,0,0,1,0,0|2,0,0]=4 24566 B12R1.267 CSCCSC1CCCCC1O 62a_100000212216_100000038908 [1,0,0,1,0,0|2,0,0]=4 24567 B12R1.267 CSCNCC1CCCCC1O 34a_100011216029_100011218213 [1,0,0,1,0,0|2,0,0]=4 24568 B12R1.267 C[C@H]1COCCN1CCCCO 2230a_100009815349_100000210776 [1,0,0,1,0,0|2,0,0]=4 24569 B12R1.267 C[C@H]1COCCN1CCCCO 269982a_100009815349_100000210776 [1,0,0,1,0,0|2,0,0]=4 24570 B12R1.267 C[C@H]1COCCN1CCCCO 34a_100009815349_100011216708 [1,0,0,1,0,0|2,0,0]=4 24571 B12R1.267 NCCCOC1CCCCC1O 34a_100000182051_100000038908 [1,0,0,1,0,0|2,0,0]=4 24572 B12R1.267 N[C@@H]1CCCC[C@@H]1OCCCO 34a_100015191688_100000230001 [1,0,0,1,0,0|2,0,0]=4 24573 B12R1.267 OC1CCCCC1CNCCF 34a_100011216029_100011217306 [1,0,0,1,0,0|2,0,0]=4 24574 B12R1.267 OC1CCCCC1NCCCF 34a_100015189416_100000038908 [1,0,0,1,0,0|2,0,0]=4 24575 B12R1.267 OC1CCCCC1OCCCBr 34a_100011217188_100000038908 [1,0,0,1,0,0|2,0,0]=4 24576 B12R1.267 OC1CCCCC1OCCCCl 34a_100000230001_100000038908 [1,0,0,1,0,0|2,0,0]=4 24577 B12R1.267 OC1CCCCC1OCCCF 34a_100000759539_100000038908 [1,0,0,1,0,0|2,0,0]=4 24578 B12R1.267 OC1CCCCC1SCCCF 62a_100000038908_100011934791 [1,0,0,1,0,0|2,0,0]=4 24579 B12R1.267 OC1CCCCC1SCCCF 62a_100011934791_100000038908 [1,0,0,1,0,0|2,0,0]=4 24580 B12R1.267 OCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000230001 [1,0,0,1,0,0|2,0,0]=4 24581 B12R1.267 OCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000230001 [1,0,0,1,0,0|2,0,0]=4 24582 B12R1.267 OCCCOC1CCCCC1Cl 34a_100000038908_100000230001 [1,0,0,1,0,0|2,0,0]=4 24583 B12R1.267 OCCCOC1CCCCC1Cl 7a_100000038908_100011215043 [1,0,0,1,0,0|2,0,0]=4 24584 B12R1.267 OCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000230001 [1,0,0,1,0,0|2,0,0]=4 24585 B12R1.267 OCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100011215043 [1,0,0,1,0,0|2,0,0]=4 24586 B12R1.267 OCCCSC1CCCCC1F 62a_100011215043_100015423560 [1,0,0,1,0,0|2,0,0]=4 24587 B12R1.267 OCCCSC1CCCCC1F 62a_100015423560_100011215043 [1,0,0,1,0,0|2,0,0]=4 24588 B12R1.267 OCCCSC1CCCCC1O 62a_100000038908_100011215043 [1,0,0,1,0,0|2,0,0]=4 24589 B12R1.267 OCCCSC1CCCCC1O 62a_100011215043_100000038908 [1,0,0,1,0,0|2,0,0]=4 24590 B12R1.267 OCCNCC1CCCCC1O 34a_100011216029_100000211926 [1,0,0,1,0,0|2,0,0]=4 24591 B12R1.271 CC1CC1COCCCCCF 34a_100000744939_100000729378 [1,0,0,1,0,0|2,0,0]=4 24592 B12R1.271 CC1CC1COCCCCCF 7a_100000744939_100000729378 [1,0,0,1,0,0|2,0,0]=4 24593 B12R1.271 CC1CC1COCCCCCO 34a_100000744939_100000746330 [1,0,0,1,0,0|1,0,0]=3 24594 B12R1.271 CC1CC1COCCCCCO 7a_100000744939_100000746330 [1,0,0,1,0,0|1,0,0]=3 24595 B12R1.271 CC1CC1COCCOCCO 34a_100000744939_100000692535 [1,0,0,1,0,0|2,0,0]=4 24596 B12R1.271 CC1CC1COCCOCCO 7a_100000744939_100011215305 [1,0,0,1,0,0|2,0,0]=4 24597 B12R1.271 CCCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100000210681 [1,0,0,1,0,0|2,0,0]=4 24598 B12R1.271 CCCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100000210681 [1,0,0,1,0,0|2,0,0]=4 24599 B12R1.271 CCCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100000210614 [1,0,0,1,0,0|2,0,0]=4 24600 B12R1.271 CCCCCCOCC1CC1C 34a_100000744939_100000210314 [1,0,0,1,0,0|1,0,0]=3 24601 B12R1.271 CCCCCCOCC1CC1C 7a_100000744939_100000210314 [1,0,0,1,0,0|1,0,0]=3 24602 B12R1.271 CCCCOCOCC1CC1C 34a_100000744939_100011995733 [1,0,0,1,0,0|2,0,0]=4 24603 B12R1.271 CCCOCCOCC1CC1C 34a_100000744939_100011215938 [1,0,0,1,0,0|2,0,0]=4 24604 B12R1.271 CCCOCCOCC1CC1C 7a_100000744939_100011215938 [1,0,0,1,0,0|2,0,0]=4 24605 B12R1.271 CCOCCCOCC1CC1C 34a_100000744939_100012232248 [1,0,0,1,0,0|2,0,0]=4 24606 B12R1.271 CCOCCCOCC1CC1C 7a_100000744939_100012232248 [1,0,0,1,0,0|2,0,0]=4 24607 B12R1.271 COCCCCOCC1CC1C 34a_100000744939_100000755781 [1,0,0,1,0,0|2,0,0]=4 24608 B12R1.271 COCCCCOCC1CC1C 7a_100000744939_100000730899 [1,0,0,1,0,0|2,0,0]=4 24609 B12R1.271 OCCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100000766143 [1,0,0,1,0,0|2,0,0]=4 24610 B12R1.271 OCCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100000766143 [1,0,0,1,0,0|2,0,0]=4 24611 B12R1.271 OCCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100000766143 [1,0,0,1,0,0|2,0,0]=4 24612 B12R1.272 BrCCCCCCOC1CCC1 34a_100011215345_100000749161 [1,0,0,1,0,0|2,0,0]=4 24613 B12R1.272 BrCCCCCOCC1CCC1 34a_100000746331_100000763275 [1,0,0,1,0,0|2,0,0]=4 24614 B12R1.272 BrCCCCCOCC1CCC1 7a_100000746331_100000763275 [1,0,0,1,0,0|2,0,0]=4 24615 B12R1.272 BrCCCCCOCC1CCO1 34a_100000746331_100000103362 [1,0,0,1,0,0|2,0,0]=4 24616 B12R1.272 BrCCCCCOCC1CCO1 7a_100000746331_100000103362 [1,0,0,1,0,0|2,0,0]=4 24617 B12R1.272 CCCCCCCCN1CCC1 269982a_100000754969_100000210759 [1,0,0,1,0,0|1,0,0]=3 24618 B12R1.272 CCCCCCCNC1CCC1 2230a_100000749019_100000210681 [1,0,0,1,0,0|1,0,0]=3 24619 B12R1.272 CCCCCCCNC1CCC1 270004a_100000229938_100000241760 [1,0,0,1,0,0|1,0,0]=3 24620 B12R1.272 CCCCCCCNC1CCC1 34a_100000749019_100000210614 [1,0,0,1,0,0|1,0,0]=3 24621 B12R1.272 CCCCCCCNC1COC1 2230a_100016991112_100000210681 [1,0,0,1,0,0|2,0,0]=4 24622 B12R1.272 CCCCCCCOC1CCC1 34a_100000210272_100000749161 [1,0,0,1,0,0|1,0,0]=3 24623 B12R1.272 CCCCCCCOC1CCC1 34a_100000748187_100000210614 [1,0,0,1,0,0|1,0,0]=3 24624 B12R1.272 CCCCCCCOC1COC1 34a_100000210272_100009818527 [1,0,0,1,0,0|2,0,0]=4 24625 B12R1.272 CCCCCCCOC1COC1 7a_100000210272_100009818527 [1,0,0,1,0,0|2,0,0]=4 24626 B12R1.272 CCCCCCCOC1CSC1 7a_100000072292_100000210614 [1,0,0,1,0,0|2,0,0]=4 24627 B12R1.272 CCCCCCCSC1CCC1 62a_100000210614_100000749161 [1,0,0,1,0,0|1,0,0]=3 24628 B12R1.272 CCCCCCCSC1COC1 62a_100000210614_100009818527 [1,0,0,1,0,0|2,0,0]=4 24629 B12R1.272 CCCCCCNCC1CCC1 2230a_100000210581_100000763275 [1,0,0,1,0,0|1,0,0]=3 24630 B12R1.272 CCCCCCNCC1CCC1 2230a_100000738700_100000210314 [1,0,0,1,0,0|1,0,0]=3 24631 B12R1.272 CCCCCCNCC1CCC1 269862a_100000210581_100000753134 [1,0,0,1,0,0|1,0,0]=3 24632 B12R1.272 CCCCCCNCC1CCC1 34a_100000738700_100000210314 [1,0,0,1,0,0|1,0,0]=3 24633 B12R1.272 CCCCCCNCC1CCO1 2230a_100000210581_100000103362 [1,0,0,1,0,0|1,0,0]=3 24634 B12R1.272 CCCCCCNCC1COC1 2230a_100000210581_100010264016 [1,0,0,1,0,0|2,0,0]=4 24635 B12R1.272 CCCCCCNCC1COC1 2230a_100015281925_100000210314 [1,0,0,1,0,0|2,0,0]=4 24636 B12R1.272 CCCCCCNCC1COC1 34a_100015281925_100000210314 [1,0,0,1,0,0|2,0,0]=4 24637 B12R1.272 CCCCCCNC[C@@H]1CCO1 2230a_100020831831_100000210314 [1,0,0,1,0,0|1,0,0]=3 24638 B12R1.272 CCCCCCNC[C@@H]1CCO1 34a_100020831831_100000210314 [1,0,0,1,0,0|1,0,0]=3 24639 B12R1.272 CCCCCCOCC1CCC1 34a_100000210259_100000763275 [1,0,0,1,0,0|1,0,0]=3 24640 B12R1.272 CCCCCCOCC1CCC1 34a_100000760304_100000210314 [1,0,0,1,0,0|1,0,0]=3 24641 B12R1.272 CCCCCCOCC1CCC1 7a_100000210259_100000763275 [1,0,0,1,0,0|1,0,0]=3 24642 B12R1.272 CCCCCCOCC1CCO1 34a_100000039022_100000210314 [1,0,0,1,0,0|1,0,0]=3 24643 B12R1.272 CCCCCCOCC1CCO1 34a_100000210259_100000103362 [1,0,0,1,0,0|1,0,0]=3 24644 B12R1.272 CCCCCCOCC1CCO1 7a_100000210259_100000103362 [1,0,0,1,0,0|1,0,0]=3 24645 B12R1.272 CCCCCCOCC1CNC1 34a_100016987283_100000210314 [1,0,0,1,0,0|2,0,0]=4 24646 B12R1.272 CCCCCCOCC1COC1 34a_100000060846_100000210314 [1,0,0,1,0,0|2,0,0]=4 24647 B12R1.272 CCCCCCOCC1COC1 34a_100000210259_100010264016 [1,0,0,1,0,0|2,0,0]=4 24648 B12R1.272 CCCCCCOCC1COC1 7a_100000210259_100010264016 [1,0,0,1,0,0|2,0,0]=4 24649 B12R1.272 CCCCCCSCC1CCC1 62a_100000210314_100000763275 [1,0,0,1,0,0|1,0,0]=3 24650 B12R1.272 CCCCCCSCC1CCC1 62a_100000763275_100000210757 [1,0,0,1,0,0|1,0,0]=3 24651 B12R1.272 CCCCCCSCC1CCO1 62a_100000103362_100000210757 [1,0,0,1,0,0|1,0,0]=3 24652 B12R1.272 CCCCCCSCC1CCO1 62a_100000210314_100000103362 [1,0,0,1,0,0|1,0,0]=3 24653 B12R1.272 CCCCCCSCC1COC1 62a_100000210314_100010264016 [1,0,0,1,0,0|2,0,0]=4 24654 B12R1.272 CCCCCCSCC1COC1 62a_100010264016_100000210757 [1,0,0,1,0,0|2,0,0]=4 24655 B12R1.272 CCCCCOCCC1COC1 34a_100009855314_100000718602 [1,0,0,1,0,0|2,0,0]=4 24656 B12R1.272 CCCCOCCNC1CCC1 2230a_100000749019_100000743108 [1,0,0,1,0,0|2,0,0]=4 24657 B12R1.272 CCCCOCCNC1CCC1 34a_100000749019_100000743108 [1,0,0,1,0,0|2,0,0]=4 24658 B12R1.272 CCCCOCCOC1CCC1 34a_100000210238_100000749161 [1,0,0,1,0,0|2,0,0]=4 24659 B12R1.272 CCCCOCCOC1CCC1 34a_100000748187_100000743108 [1,0,0,1,0,0|2,0,0]=4 24660 B12R1.272 CCCCOCCSC1CCC1 62a_100000743108_100000749161 [1,0,0,1,0,0|2,0,0]=4 24661 B12R1.272 CCCCOCNCC1CCC1 2230a_100000738700_100011995733 [1,0,0,1,0,0|2,0,0]=4 24662 B12R1.272 CCCCOCNCC1CCC1 34a_100000738700_100011995733 [1,0,0,1,0,0|2,0,0]=4 24663 B12R1.272 CCCCOCNC[C@@H]1CCO1 2230a_100020831831_100011995733 [1,0,0,1,0,0|2,0,0]=4 24664 B12R1.272 CCCCOCNC[C@@H]1CCO1 34a_100020831831_100011995733 [1,0,0,1,0,0|2,0,0]=4 24665 B12R1.272 CCCCOCOCC1CCC1 34a_100000760304_100011995733 [1,0,0,1,0,0|2,0,0]=4 24666 B12R1.272 CCCCOCOCC1CCO1 34a_100000039022_100011995733 [1,0,0,1,0,0|2,0,0]=4 24667 B12R1.272 CCCCOCSCC1CCC1 62a_100000763275_100011995733 [1,0,0,1,0,0|2,0,0]=4 24668 B12R1.272 CCCCOCSCC1CCC1 62a_100011995733_100000763275 [1,0,0,1,0,0|2,0,0]=4 24669 B12R1.272 CCCCOCSCC1CCO1 62a_100000103362_100011995733 [1,0,0,1,0,0|2,0,0]=4 24670 B12R1.272 CCCCOCSCC1CCO1 62a_100011995733_100000103362 [1,0,0,1,0,0|2,0,0]=4 24671 B12R1.272 CCCCSCCNC1CCC1 270004a_100025743550_100000241760 [1,0,0,1,0,0|2,0,0]=4 24672 B12R1.272 CCCCSCCOC1CCC1 34a_200000230436_100000749161 [1,0,0,1,0,0|2,0,0]=4 24673 B12R1.272 CCCOCCCNC1CCC1 270004a_100011217757_100000241760 [1,0,0,1,0,0|2,0,0]=4 24674 B12R1.272 CCCOCCCNC1CCC1 34a_100011217757_100000749161 [1,0,0,1,0,0|2,0,0]=4 24675 B12R1.272 CCCOCCNCC1CCC1 2230a_100000738700_100011215938 [1,0,0,1,0,0|2,0,0]=4 24676 B12R1.272 CCCOCCNCC1CCC1 2230a_100161115042_100000763275 [1,0,0,1,0,0|2,0,0]=4 24677 B12R1.272 CCCOCCNCC1CCC1 269862a_100161115042_100000753134 [1,0,0,1,0,0|2,0,0]=4 24678 B12R1.272 CCCOCCNCC1CCC1 34a_100000738700_100011215938 [1,0,0,1,0,0|2,0,0]=4 24679 B12R1.272 CCCOCCNCC1CCC1 34a_100161115042_100000763275 [1,0,0,1,0,0|2,0,0]=4 24680 B12R1.272 CCCOCCNCC1CCO1 2230a_100161115042_100000103362 [1,0,0,1,0,0|2,0,0]=4 24681 B12R1.272 CCCOCCNCC1CCO1 34a_100161115042_100000103362 [1,0,0,1,0,0|2,0,0]=4 24682 B12R1.272 CCCOCCNC[C@@H]1CCO1 2230a_100020831831_100011215938 [1,0,0,1,0,0|2,0,0]=4 24683 B12R1.272 CCCOCCNC[C@@H]1CCO1 34a_100020831831_100011215938 [1,0,0,1,0,0|2,0,0]=4 24684 B12R1.272 CCCOCCOCC1CCC1 34a_100000752267_100000763275 [1,0,0,1,0,0|2,0,0]=4 24685 B12R1.272 CCCOCCOCC1CCC1 34a_100000760304_100011215938 [1,0,0,1,0,0|2,0,0]=4 24686 B12R1.272 CCCOCCOCC1CCC1 7a_100000752267_100000763275 [1,0,0,1,0,0|2,0,0]=4 24687 B12R1.272 CCCOCCOCC1CCO1 34a_100000039022_100011215938 [1,0,0,1,0,0|2,0,0]=4 24688 B12R1.272 CCCOCCOCC1CCO1 34a_100000752267_100000103362 [1,0,0,1,0,0|2,0,0]=4 24689 B12R1.272 CCCOCCOCC1CCO1 7a_100000752267_100000103362 [1,0,0,1,0,0|2,0,0]=4 24690 B12R1.272 CCCOCCSCC1CCC1 62a_100000763275_100011215938 [1,0,0,1,0,0|2,0,0]=4 24691 B12R1.272 CCCOCCSCC1CCC1 62a_100011215938_100000763275 [1,0,0,1,0,0|2,0,0]=4 24692 B12R1.272 CCCOCCSCC1CCO1 62a_100000103362_100011215938 [1,0,0,1,0,0|2,0,0]=4 24693 B12R1.272 CCCOCCSCC1CCO1 62a_100011215938_100000103362 [1,0,0,1,0,0|2,0,0]=4 24694 B12R1.272 CCCSCCNCC1CCC1 2230a_100020603323_100000763275 [1,0,0,1,0,0|2,0,0]=4 24695 B12R1.272 CCCSCCNCC1CCC1 269862a_100020603323_100000753134 [1,0,0,1,0,0|2,0,0]=4 24696 B12R1.272 CCCSCCNCC1CCO1 2230a_100020603323_100000103362 [1,0,0,1,0,0|2,0,0]=4 24697 B12R1.272 CCCSCCOCC1CCC1 34a_200000230433_100000763275 [1,0,0,1,0,0|2,0,0]=4 24698 B12R1.272 CCCSCCOCC1CCC1 7a_200000230433_100000763275 [1,0,0,1,0,0|2,0,0]=4 24699 B12R1.272 CCCSCCOCC1CCO1 34a_200000230433_100000103362 [1,0,0,1,0,0|2,0,0]=4 24700 B12R1.272 CCCSCCOCC1CCO1 7a_200000230433_100000103362 [1,0,0,1,0,0|2,0,0]=4 24701 B12R1.272 CCOCCCNCC1CCC1 2230a_100000210961_100000763275 [1,0,0,1,0,0|2,0,0]=4 24702 B12R1.272 CCOCCCNCC1CCC1 2230a_100000738700_100012232248 [1,0,0,1,0,0|2,0,0]=4 24703 B12R1.272 CCOCCCNCC1CCC1 269862a_100000210961_100000753134 [1,0,0,1,0,0|2,0,0]=4 24704 B12R1.272 CCOCCCNCC1CCC1 34a_100000210961_100000763275 [1,0,0,1,0,0|2,0,0]=4 24705 B12R1.272 CCOCCCNCC1CCC1 34a_100000738700_100012232248 [1,0,0,1,0,0|2,0,0]=4 24706 B12R1.272 CCOCCCNCC1CCO1 2230a_100000210961_100000103362 [1,0,0,1,0,0|2,0,0]=4 24707 B12R1.272 CCOCCCNCC1CCO1 34a_100000210961_100000103362 [1,0,0,1,0,0|2,0,0]=4 24708 B12R1.272 CCOCCCNC[C@@H]1CCO1 2230a_100020831831_100012232248 [1,0,0,1,0,0|2,0,0]=4 24709 B12R1.272 CCOCCCNC[C@@H]1CCO1 34a_100020831831_100012232248 [1,0,0,1,0,0|2,0,0]=4 24710 B12R1.272 CCOCCCOCC1CCC1 34a_100000757476_100000763275 [1,0,0,1,0,0|2,0,0]=4 24711 B12R1.272 CCOCCCOCC1CCC1 34a_100000760304_100012232248 [1,0,0,1,0,0|2,0,0]=4 24712 B12R1.272 CCOCCCOCC1CCC1 7a_100000757476_100000763275 [1,0,0,1,0,0|2,0,0]=4 24713 B12R1.272 CCOCCCOCC1CCO1 34a_100000039022_100012232248 [1,0,0,1,0,0|2,0,0]=4 24714 B12R1.272 CCOCCCOCC1CCO1 34a_100000757476_100000103362 [1,0,0,1,0,0|2,0,0]=4 24715 B12R1.272 CCOCCCOCC1CCO1 7a_100000757476_100000103362 [1,0,0,1,0,0|2,0,0]=4 24716 B12R1.272 CCOCCCSCC1CCC1 62a_100000763275_100012232248 [1,0,0,1,0,0|2,0,0]=4 24717 B12R1.272 CCOCCCSCC1CCC1 62a_100012232248_100000763275 [1,0,0,1,0,0|2,0,0]=4 24718 B12R1.272 CCOCCCSCC1CCO1 62a_100000103362_100012232248 [1,0,0,1,0,0|2,0,0]=4 24719 B12R1.272 CCOCCCSCC1CCO1 62a_100012232248_100000103362 [1,0,0,1,0,0|2,0,0]=4 24720 B12R1.272 CCSCCCOCC1CCC1 34a_100011216438_100000763275 [1,0,0,1,0,0|2,0,0]=4 24721 B12R1.272 CCSCCCOCC1CCC1 7a_100011216438_100000763275 [1,0,0,1,0,0|2,0,0]=4 24722 B12R1.272 CCSCCCOCC1CCO1 34a_100011216438_100000103362 [1,0,0,1,0,0|2,0,0]=4 24723 B12R1.272 CCSCCCOCC1CCO1 7a_100011216438_100000103362 [1,0,0,1,0,0|2,0,0]=4 24724 B12R1.272 CNCCCCCOC1CCC1 34a_100000722520_100000749161 [1,0,0,1,0,0|2,0,0]=4 24725 B12R1.272 COCCCCCCN1CCC1 269982a_100000754969_100011998445 [1,0,0,1,0,0|2,0,0]=4 24726 B12R1.272 COCCCCCNC1CCC1 270004a_100000747528_100000241760 [1,0,0,1,0,0|2,0,0]=4 24727 B12R1.272 COCCCCCNC1CCC1 34a_100000747528_100000749161 [1,0,0,1,0,0|2,0,0]=4 24728 B12R1.272 COCCCCNCC1CCC1 2230a_100000738700_100000730899 [1,0,0,1,0,0|2,0,0]=4 24729 B12R1.272 COCCCCNCC1CCC1 34a_100000738700_100000755781 [1,0,0,1,0,0|2,0,0]=4 24730 B12R1.272 COCCCCNC[C@@H]1CCO1 2230a_100020831831_100000730899 [1,0,0,1,0,0|2,0,0]=4 24731 B12R1.272 COCCCCNC[C@@H]1CCO1 34a_100020831831_100000755781 [1,0,0,1,0,0|2,0,0]=4 24732 B12R1.272 COCCCCOCC1CCC1 34a_100000740925_100000763275 [1,0,0,1,0,0|2,0,0]=4 24733 B12R1.272 COCCCCOCC1CCC1 34a_100000760304_100000755781 [1,0,0,1,0,0|2,0,0]=4 24734 B12R1.272 COCCCCOCC1CCO1 34a_100000039022_100000755781 [1,0,0,1,0,0|2,0,0]=4 24735 B12R1.272 COCCCCOCC1CCO1 34a_100000740925_100000103362 [1,0,0,1,0,0|2,0,0]=4 24736 B12R1.272 COCCCCSCC1CCC1 62a_100000730899_100000763275 [1,0,0,1,0,0|2,0,0]=4 24737 B12R1.272 COCCCCSCC1CCC1 62a_100000763275_100000730899 [1,0,0,1,0,0|2,0,0]=4 24738 B12R1.272 COCCCCSCC1CCO1 62a_100000103362_100000730899 [1,0,0,1,0,0|2,0,0]=4 24739 B12R1.272 COCCCCSCC1CCO1 62a_100000730899_100000103362 [1,0,0,1,0,0|2,0,0]=4 24740 B12R1.272 CSCCCCOCC1CCC1 34a_100011217163_100000763275 [1,0,0,1,0,0|2,0,0]=4 24741 B12R1.272 CSCCCCOCC1CCC1 7a_100011217163_100000763275 [1,0,0,1,0,0|2,0,0]=4 24742 B12R1.272 CSCCCCOCC1CCO1 34a_100011217163_100000103362 [1,0,0,1,0,0|2,0,0]=4 24743 B12R1.272 CSCCCCOCC1CCO1 7a_100011217163_100000103362 [1,0,0,1,0,0|2,0,0]=4 24744 B12R1.272 ClCCCCCCOC1CCC1 34a_100000766143_100000749161 [1,0,0,1,0,0|2,0,0]=4 24745 B12R1.272 ClCCCCCOCC1CCC1 34a_100000746330_100000763275 [1,0,0,1,0,0|2,0,0]=4 24746 B12R1.272 ClCCCCCOCC1CCC1 7a_100000746330_100000763275 [1,0,0,1,0,0|2,0,0]=4 24747 B12R1.272 ClCCCCCOCC1CCO1 34a_100000746330_100000103362 [1,0,0,1,0,0|2,0,0]=4 24748 B12R1.272 ClCCCCCOCC1CCO1 7a_100000746330_100000103362 [1,0,0,1,0,0|2,0,0]=4 24749 B12R1.272 FCCCCCCNC1CCC1 2230a_100000749019_100015922095 [1,0,0,1,0,0|2,0,0]=4 24750 B12R1.272 FCCCCCCNC1CCC1 34a_100000749019_100015922095 [1,0,0,1,0,0|2,0,0]=4 24751 B12R1.272 FCCCCCCOC1CCC1 34a_100000732779_100000749161 [1,0,0,1,0,0|2,0,0]=4 24752 B12R1.272 FCCCCCCOC1CCC1 34a_100000748187_100015922095 [1,0,0,1,0,0|2,0,0]=4 24753 B12R1.272 FCCCCCCSC1CCC1 62a_100015922095_100000749161 [1,0,0,1,0,0|2,0,0]=4 24754 B12R1.272 FCCCCCNCC1CCC1 2230a_100000738700_100000729378 [1,0,0,1,0,0|2,0,0]=4 24755 B12R1.272 FCCCCCNCC1CCC1 34a_100000738700_100000729378 [1,0,0,1,0,0|2,0,0]=4 24756 B12R1.272 FCCCCCNC[C@@H]1CCO1 2230a_100020831831_100000729378 [1,0,0,1,0,0|2,0,0]=4 24757 B12R1.272 FCCCCCNC[C@@H]1CCO1 34a_100020831831_100000729378 [1,0,0,1,0,0|2,0,0]=4 24758 B12R1.272 FCCCCCOCC1CCC1 34a_100000760304_100000729378 [1,0,0,1,0,0|2,0,0]=4 24759 B12R1.272 FCCCCCOCC1CCO1 34a_100000039022_100000729378 [1,0,0,1,0,0|2,0,0]=4 24760 B12R1.272 FCCCCCSCC1CCC1 62a_100000729378_100000763275 [1,0,0,1,0,0|2,0,0]=4 24761 B12R1.272 FCCCCCSCC1CCC1 62a_100000763275_100000729378 [1,0,0,1,0,0|2,0,0]=4 24762 B12R1.272 FCCCCCSCC1CCO1 62a_100000103362_100000729378 [1,0,0,1,0,0|2,0,0]=4 24763 B12R1.272 FCCCCCSCC1CCO1 62a_100000729378_100000103362 [1,0,0,1,0,0|2,0,0]=4 24764 B12R1.272 ICCCCCOCC1CCC1 34a_200012148887_100000763275 [1,0,0,1,0,0|2,0,0]=4 24765 B12R1.272 ICCCCCOCC1CCC1 7a_200012148887_100000763275 [1,0,0,1,0,0|2,0,0]=4 24766 B12R1.272 ICCCCCOCC1CCO1 34a_200012148887_100000103362 [1,0,0,1,0,0|2,0,0]=4 24767 B12R1.272 ICCCCCOCC1CCO1 7a_200012148887_100000103362 [1,0,0,1,0,0|2,0,0]=4 24768 B12R1.272 NCCCCCCOC1CCC1 34a_100000686447_100000749161 [1,0,0,1,0,0|2,0,0]=4 24769 B12R1.272 NCCCCCOCC1CCC1 34a_100000762737_100000763275 [1,0,0,1,0,0|2,0,0]=4 24770 B12R1.272 NCCCCCOCC1CCO1 34a_100000762737_100000103362 [1,0,0,1,0,0|2,0,0]=4 24771 B12R1.272 OCCCCCCCN1CCC1 269982a_100000754969_100000760002 [1,0,0,1,0,0|1,0,0]=3 24772 B12R1.272 OCCCCCCNC1CCC1 2230a_100000749019_100000766143 [1,0,0,1,0,0|1,0,0]=3 24773 B12R1.272 OCCCCCCNC1CCC1 270004a_100000686447_100000241760 [1,0,0,1,0,0|1,0,0]=3 24774 B12R1.272 OCCCCCCNC1CCC1 34a_100000686447_100000749161 [1,0,0,1,0,0|1,0,0]=3 24775 B12R1.272 OCCCCCCNC1CCC1 34a_100000749019_100000766143 [1,0,0,1,0,0|1,0,0]=3 24776 B12R1.272 OCCCCCCNC1COC1 2230a_100016991112_100000766143 [1,0,0,1,0,0|2,0,0]=4 24777 B12R1.272 OCCCCCCNC1COC1 34a_100000686447_100009818527 [1,0,0,1,0,0|2,0,0]=4 24778 B12R1.272 OCCCCCCOC1CCC1 34a_100000748187_100000766143 [1,0,0,1,0,0|1,0,0]=3 24779 B12R1.272 OCCCCCCOC1CSC1 7a_100000072292_100000766143 [1,0,0,1,0,0|2,0,0]=4 24780 B12R1.272 OCCCCCCSC1CCC1 62a_100000766143_100000749161 [1,0,0,1,0,0|1,0,0]=3 24781 B12R1.272 OCCCCCCSC1COC1 62a_100000766143_100009818527 [1,0,0,1,0,0|2,0,0]=4 24782 B12R1.272 OCCCCCNCC1CCC1 2230a_100000738700_100000746330 [1,0,0,1,0,0|1,0,0]=3 24783 B12R1.272 OCCCCCNCC1CCC1 2230a_100000762737_100000763275 [1,0,0,1,0,0|1,0,0]=3 24784 B12R1.272 OCCCCCNCC1CCC1 269862a_100000762737_100000753134 [1,0,0,1,0,0|1,0,0]=3 24785 B12R1.272 OCCCCCNCC1CCC1 34a_100000738700_100000746330 [1,0,0,1,0,0|1,0,0]=3 24786 B12R1.272 OCCCCCNCC1CCC1 34a_100000762737_100000763275 [1,0,0,1,0,0|1,0,0]=3 24787 B12R1.272 OCCCCCNCC1CCO1 2230a_100000762737_100000103362 [1,0,0,1,0,0|2,0,0]=4 24788 B12R1.272 OCCCCCNCC1CCO1 34a_100000762737_100000103362 [1,0,0,1,0,0|2,0,0]=4 24789 B12R1.272 OCCCCCNCC1COC1 2230a_100000762737_100010264016 [1,0,0,1,0,0|2,0,0]=4 24790 B12R1.272 OCCCCCNCC1COC1 2230a_100015281925_100000746330 [1,0,0,1,0,0|2,0,0]=4 24791 B12R1.272 OCCCCCNCC1COC1 34a_100000762737_100010264016 [1,0,0,1,0,0|2,0,0]=4 24792 B12R1.272 OCCCCCNCC1COC1 34a_100015281925_100000746330 [1,0,0,1,0,0|2,0,0]=4 24793 B12R1.272 OCCCCCNC[C@@H]1CCO1 2230a_100020831831_100000746330 [1,0,0,1,0,0|2,0,0]=4 24794 B12R1.272 OCCCCCNC[C@@H]1CCO1 34a_100020831831_100000746330 [1,0,0,1,0,0|2,0,0]=4 24795 B12R1.272 OCCCCCOCC1CCC1 34a_100000760304_100000746330 [1,0,0,1,0,0|1,0,0]=3 24796 B12R1.272 OCCCCCOCC1CCO1 34a_100000039022_100000746330 [1,0,0,1,0,0|2,0,0]=4 24797 B12R1.272 OCCCCCOCC1CNC1 34a_100016987283_100000746330 [1,0,0,1,0,0|2,0,0]=4 24798 B12R1.272 OCCCCCOCC1COC1 34a_100000060846_100000746330 [1,0,0,1,0,0|2,0,0]=4 24799 B12R1.272 OCCCCCSCC1CCC1 62a_100000746330_100000763275 [1,0,0,1,0,0|1,0,0]=3 24800 B12R1.272 OCCCCCSCC1CCC1 62a_100000763275_100000746330 [1,0,0,1,0,0|1,0,0]=3 24801 B12R1.272 OCCCCCSCC1CCO1 62a_100000103362_100000746330 [1,0,0,1,0,0|2,0,0]=4 24802 B12R1.272 OCCCCCSCC1CCO1 62a_100000746330_100000103362 [1,0,0,1,0,0|2,0,0]=4 24803 B12R1.272 OCCCCCSCC1COC1 62a_100000746330_100010264016 [1,0,0,1,0,0|2,0,0]=4 24804 B12R1.272 OCCCCCSCC1COC1 62a_100010264016_100000746330 [1,0,0,1,0,0|2,0,0]=4 24805 B12R1.272 OCCCCOCCC1COC1 34a_100009855314_100011216708 [1,0,0,1,0,0|2,0,0]=4 24806 B12R1.272 OCCOCCNCC1CCC1 2230a_100000211614_100000763275 [1,0,0,1,0,0|2,0,0]=4 24807 B12R1.272 OCCOCCNCC1CCC1 2230a_100000738700_100011215305 [1,0,0,1,0,0|2,0,0]=4 24808 B12R1.272 OCCOCCNCC1CCC1 269862a_100000211614_100000753134 [1,0,0,1,0,0|2,0,0]=4 24809 B12R1.272 OCCOCCNCC1CCC1 34a_100000211614_100000763275 [1,0,0,1,0,0|2,0,0]=4 24810 B12R1.272 OCCOCCNCC1CCC1 34a_100000738700_100000692535 [1,0,0,1,0,0|2,0,0]=4 24811 B12R1.272 OCCOCCOCC1CCC1 34a_100000760304_100000692535 [1,0,0,1,0,0|2,0,0]=4 24812 B12R1.272 OCCOCCSCC1CCC1 62a_100000763275_100011215305 [1,0,0,1,0,0|2,0,0]=4 24813 B12R1.272 OCCOCCSCC1CCC1 62a_100011215305_100000763275 [1,0,0,1,0,0|2,0,0]=4 24814 B12R1.272 OCCSCCNCC1CCC1 2230a_100011219999_100000763275 [1,0,0,1,0,0|2,0,0]=4 24815 B12R1.272 OCCSCCNCC1CCC1 269862a_100011219999_100000753134 [1,0,0,1,0,0|2,0,0]=4 24816 B12R1.320 CCCC1CCCC1NCCF 269862a_100000724931_100000723119 [1,0,0,1,0,0|2,0,0]=4 24817 B12R1.320 CCCC1CCCC1NCCO 269862a_100000210304_100000723119 [1,0,0,1,0,0|1,0,0]=3 24818 B12R1.320 CCCC1CCCC1NCCO 270004a_100000210304_100000723119 [1,0,0,1,0,0|1,0,0]=3 24819 B12R1.320 CCCCC1CCCC1NCC 269862a_100015525214_100000750825 [1,0,0,1,0,0|1,0,0]=3 24820 B12R1.320 CCCCC1CCCC1NCC 270004a_100015525214_100000750825 [1,0,0,1,0,0|1,0,0]=3 24821 B12R1.320 CCCCN1CCC[C@H]1COC 2230a_100020646714_100000210211 [1,0,0,1,0,0|2,0,0]=4 24822 B12R1.320 CCCCN1CCC[C@H]1COC 269982a_100020646714_100000210211 [1,0,0,1,0,0|2,0,0]=4 24823 B12R1.320 CCCCN1CCC[C@H]1COC 34a_100020646714_100000210210 [1,0,0,1,0,0|2,0,0]=4 24824 B12R1.320 CCCN1CCCC1COCC 34a_200000694710_100000210202 [1,0,0,1,0,0|2,0,0]=4 24825 B12R1.320 CCCN1CCCC1COCC 7a_200000694710_100000210202 [1,0,0,1,0,0|2,0,0]=4 24826 B12R1.320 CCCNC1CCCC1CCC 269862a_100020643023_100000723119 [1,0,0,1,0,0|1,0,0]=3 24827 B12R1.320 CCCNC1CCCC1CCC 270004a_100020643023_100000723119 [1,0,0,1,0,0|1,0,0]=3 24828 B12R1.320 COC[C@@H]1CCCN1CCCO 2230a_100020646714_100000230001 [1,0,0,1,0,0|2,0,0]=4 24829 B12R1.320 COC[C@@H]1CCCN1CCCO 269982a_100020646714_100011215043 [1,0,0,1,0,0|2,0,0]=4 24830 B12R1.320 COC[C@@H]1CCCN1CCCO 34a_100020646714_100000230001 [1,0,0,1,0,0|2,0,0]=4 24831 B12R1.329 CCCCN1CCCCCCC1 2230a_100000211400_100000210211 [1,0,0,1,0,0|1,0,0]=3 24832 B12R1.329 CCCCN1CCCCCCC1 269982a_100000211400_100000210211 [1,0,0,1,0,0|1,0,0]=3 24833 B12R1.329 CCCCN1CCCCCCC1 34a_100000211400_100000210210 [1,0,0,1,0,0|1,0,0]=3 24834 B12R1.329 CCCNC1CCCCCCC1 2230a_100000211152_100000210303 [1,0,0,1,0,0|1,0,0]=3 24835 B12R1.329 CCCNC1CCCCCCC1 270004a_100020643023_100000210524 [1,0,0,1,0,0|1,0,0]=3 24836 B12R1.329 CCCNC1CCCCCCC1 34a_100000211152_100000210303 [1,0,0,1,0,0|1,0,0]=3 24837 B12R1.329 CCCOC1CCCCCCC1 34a_100000210054_100000210303 [1,0,0,1,0,0|1,0,0]=3 24838 B12R1.329 CCCOC1CCCCCCC1 7a_100000210054_100000210303 [1,0,0,1,0,0|1,0,0]=3 24839 B12R1.329 CCOCC1CCCCCCC1 34a_100011216312_100000210202 [1,0,0,1,0,0|1,0,0]=3 24840 B12R1.329 CCOCC1CCCCCCC1 7a_100011216312_100000210202 [1,0,0,1,0,0|1,0,0]=3 24841 B12R1.329 CCOCN1CCCCCCC1 269982a_100000211400_100000739092 [1,0,0,1,0,0|2,0,0]=4 24842 B12R1.329 CNCCC1CCCCCCC1 2230a_100011532352_200000210301 [1,0,0,1,0,0|1,0,0]=3 24843 B12R1.329 CNCCC1CCCCCCC1 34a_100011532352_200000210301 [1,0,0,1,0,0|1,0,0]=3 24844 B12R1.329 COCCN1CCCCCCC1 2230a_100000211400_100011201679 [1,0,0,1,0,0|2,0,0]=4 24845 B12R1.329 COCCN1CCCCCCC1 269982a_100000211400_100000233755 [1,0,0,1,0,0|2,0,0]=4 24846 B12R1.329 COCCN1CCCCCCC1 34a_100000211400_100011201679 [1,0,0,1,0,0|2,0,0]=4 24847 B12R1.329 COCNC1CCCCCCC1 2230a_100000211152_100000766300 [1,0,0,1,0,0|2,0,0]=4 24848 B12R1.329 CSCCN1CCCCCCC1 2230a_100000211400_100000751147 [1,0,0,1,0,0|2,0,0]=4 24849 B12R1.329 CSCCN1CCCCCCC1 269982a_100000211400_100000212216 [1,0,0,1,0,0|2,0,0]=4 24850 B12R1.329 CSCCN1CCCCCCC1 34a_100000211400_100000212216 [1,0,0,1,0,0|2,0,0]=4 24851 B12R1.329 CSCNC1CCCCCCC1 2230a_100000211152_100011218213 [1,0,0,1,0,0|2,0,0]=4 24852 B12R1.329 CSCNC1CCCCCCC1 34a_100000211152_100011218213 [1,0,0,1,0,0|2,0,0]=4 24853 B12R1.329 CSCOC1CCCCCCC1 34a_100000210054_100011218213 [1,0,0,1,0,0|2,0,0]=4 24854 B12R1.329 FCCCN1CCCCCCC1 2230a_100000211400_100011934791 [1,0,0,1,0,0|2,0,0]=4 24855 B12R1.329 FCCCN1CCCCCCC1 269982a_100000211400_100011934791 [1,0,0,1,0,0|2,0,0]=4 24856 B12R1.329 FCCCN1CCCCCCC1 34a_100000211400_100011934791 [1,0,0,1,0,0|2,0,0]=4 24857 B12R1.329 FCCNC1CCCCCCC1 2230a_100000211152_100011217306 [1,0,0,1,0,0|2,0,0]=4 24858 B12R1.329 FCCNC1CCCCCCC1 34a_100000211152_100011217306 [1,0,0,1,0,0|2,0,0]=4 24859 B12R1.329 FCCOC1CCCCCCC1 34a_100000210054_100011217306 [1,0,0,1,0,0|2,0,0]=4 24860 B12R1.329 FCCOC1CCCCCCC1 7a_100000210054_100011217306 [1,0,0,1,0,0|2,0,0]=4 24861 B12R1.329 FCOCC1CCCCCCC1 34a_100011216312_100015361967 [1,0,0,1,0,0|2,0,0]=4 24862 B12R1.329 FCOCC1CCCCCCC1 7a_100011216312_100015361967 [1,0,0,1,0,0|2,0,0]=4 24863 B12R1.329 OCCCN1CCCCCCC1 2230a_100000211400_100000230001 [1,0,0,1,0,0|1,0,0]=3 24864 B12R1.329 OCCCN1CCCCCCC1 269982a_100000211400_100011215043 [1,0,0,1,0,0|1,0,0]=3 24865 B12R1.329 OCCCN1CCCCCCC1 34a_100000211400_100000230001 [1,0,0,1,0,0|1,0,0]=3 24866 B12R1.329 OCCNC1CCCCCCC1 2230a_100000211152_100000211926 [1,0,0,1,0,0|1,0,0]=3 24867 B12R1.329 OCCNC1CCCCCCC1 270004a_100000210304_100000210524 [1,0,0,1,0,0|1,0,0]=3 24868 B12R1.329 OCCNC1CCCCCCC1 34a_100000211152_100000211926 [1,0,0,1,0,0|1,0,0]=3 24869 B12R1.329 OCCOC1CCCCCCC1 34a_100000210054_100000211926 [1,0,0,1,0,0|1,0,0]=3 24870 B12R1.329 OCCOC1CCCCCCC1 7a_100000210054_100000211926 [1,0,0,1,0,0|1,0,0]=3 24871 B12R1.329 [13CH3]NCCC1CCCCCCC1 2230a_100011532352_200025704644 [1,0,0,1,0,0|1,0,0]=3 24872 B12R1.329 [13CH3]NCCC1CCCCCCC1 34a_100011532352_200025704644 [1,0,0,1,0,0|1,0,0]=3 24873 B12R1.372 CC1CCCC1NCCCCO 269862a_100000750430_100000752053 [1,0,0,1,0,0|1,0,0]=3 24874 B12R1.372 CC1CCCC1OCCCCF 34a_100011216460_100000729493 [1,0,0,1,0,0|2,0,0]=4 24875 B12R1.372 CC1CCCC1OCCCCF 7a_100011216460_100000729493 [1,0,0,1,0,0|2,0,0]=4 24876 B12R1.372 CC1CCCC1OCCCCO 34a_100011216460_100011216708 [1,0,0,1,0,0|1,0,0]=3 24877 B12R1.372 CC1CCCC1OCCCCO 7a_100011216460_100000210776 [1,0,0,1,0,0|1,0,0]=3 24878 B12R1.372 CC1OCCC1NCCCCO 270004a_100000750430_100000691750 [1,0,0,1,0,0|2,0,0]=4 24879 B12R1.372 CC1SCCN1CCCCCO 2230a_200011216479_100000746330 [1,0,0,1,0,0|2,0,0]=4 24880 B12R1.372 CC1SCCN1CCCCCO 269982a_200011216479_100000746330 [1,0,0,1,0,0|2,0,0]=4 24881 B12R1.372 CC1SCCN1CCCCCO 34a_200011216479_100000746330 [1,0,0,1,0,0|2,0,0]=4 24882 B12R1.372 CCCCCCN1CCC[C@@H]1C 2230a_100020605311_100000210314 [1,0,0,1,0,0|1,0,0]=3 24883 B12R1.372 CCCCCCN1CCC[C@@H]1C 269982a_100020605311_100000210757 [1,0,0,1,0,0|1,0,0]=3 24884 B12R1.372 CCCCCCN1CCC[C@H]1C 2230a_100015189458_100000210314 [1,0,0,1,0,0|1,0,0]=3 24885 B12R1.372 CCCCCCN1CCC[C@H]1C 269982a_100015189458_100000210757 [1,0,0,1,0,0|1,0,0]=3 24886 B12R1.372 CCCCCCN1CCC[C@H]1C 34a_100015189458_100000210314 [1,0,0,1,0,0|1,0,0]=3 24887 B12R1.372 CCCCCCN1CCSC1C 2230a_200011216479_100000210314 [1,0,0,1,0,0|2,0,0]=4 24888 B12R1.372 CCCCCCN1CCSC1C 269982a_200011216479_100000210757 [1,0,0,1,0,0|2,0,0]=4 24889 B12R1.372 CCCCCCN1CCSC1C 34a_200011216479_100000210314 [1,0,0,1,0,0|2,0,0]=4 24890 B12R1.372 CCCCCNC1CCCC1C 269862a_100000209983_100000752053 [1,0,0,1,0,0|1,0,0]=3 24891 B12R1.372 CCCCCNC1CCOC1C 270004a_100000209983_100000691750 [1,0,0,1,0,0|2,0,0]=4 24892 B12R1.372 CCCCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100000210326 [1,0,0,1,0,0|2,0,0]=4 24893 B12R1.372 CCCCCOC1CCCC1C 34a_100011216460_100000718602 [1,0,0,1,0,0|1,0,0]=3 24894 B12R1.372 CCCCCOC1CCCC1C 7a_100011216460_100000210326 [1,0,0,1,0,0|1,0,0]=3 24895 B12R1.372 CCCCCOC1COCC1O 34a_100000210253_200000725654 [1,0,0,1,0,0|2,0,0]=4 24896 B12R1.372 CCCCCOC1COCC1O 7a_100000210253_200000725654 [1,0,0,1,0,0|2,0,0]=4 24897 B12R1.372 CCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000718602 [1,0,0,1,0,0|2,0,0]=4 24898 B12R1.372 CCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000718602 [1,0,0,1,0,0|2,0,0]=4 24899 B12R1.372 CCCCCO[C@H]1CNC[C@H]1C 34a_200015306588_100000718602 [1,0,0,1,0,0|2,0,0]=4 24900 B12R1.372 CCCCCSC1COCC1O 62a_100000210326_200000725654 [1,0,0,1,0,0|2,0,0]=4 24901 B12R1.372 CCCCCSC1COCC1O 62a_200000725654_100000210326 [1,0,0,1,0,0|2,0,0]=4 24902 B12R1.372 CCCCCS[C@@H]1CCC[C@H]1O 62a_100000210326_200016002552 [1,0,0,1,0,0|1,0,0]=3 24903 B12R1.372 CCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000210326 [1,0,0,1,0,0|1,0,0]=3 24904 B12R1.372 CCCCOCC1CCCN1C 34a_100000743107_100000210210 [1,0,0,1,0,0|2,0,0]=4 24905 B12R1.372 CCCCOCN1CCC[C@@H]1C 2230a_100020605311_100011995733 [1,0,0,1,0,0|2,0,0]=4 24906 B12R1.372 CCCCOCN1CCC[C@@H]1C 269982a_100020605311_100011995733 [1,0,0,1,0,0|2,0,0]=4 24907 B12R1.372 CCCCOCN1CCC[C@H]1C 2230a_100015189458_100011995733 [1,0,0,1,0,0|2,0,0]=4 24908 B12R1.372 CCCCOCN1CCC[C@H]1C 269982a_100015189458_100011995733 [1,0,0,1,0,0|2,0,0]=4 24909 B12R1.372 CCCCOCN1CCC[C@H]1C 34a_100015189458_100011995733 [1,0,0,1,0,0|2,0,0]=4 24910 B12R1.372 CCCOCCC1CCCN1C 34a_100000210258_100000005710 [1,0,0,1,0,0|2,0,0]=4 24911 B12R1.372 CCCOCCC1CCCN1C 34a_100011215177_100000210303 [1,0,0,1,0,0|2,0,0]=4 24912 B12R1.372 CCCOCCC1CCCN1C 7a_100011215177_100000210303 [1,0,0,1,0,0|2,0,0]=4 24913 B12R1.372 CCCOCCN1CCC[C@@H]1C 2230a_100020605311_100011215938 [1,0,0,1,0,0|2,0,0]=4 24914 B12R1.372 CCCOCCN1CCC[C@@H]1C 269982a_100020605311_100011215938 [1,0,0,1,0,0|2,0,0]=4 24915 B12R1.372 CCCOCCN1CCC[C@H]1C 2230a_100015189458_100011215938 [1,0,0,1,0,0|2,0,0]=4 24916 B12R1.372 CCCOCCN1CCC[C@H]1C 269982a_100015189458_100011215938 [1,0,0,1,0,0|2,0,0]=4 24917 B12R1.372 CCCOCCN1CCC[C@H]1C 34a_100015189458_100011215938 [1,0,0,1,0,0|2,0,0]=4 24918 B12R1.372 CCCSCCC1CCCN1C 62a_100000005710_100000210303 [1,0,0,1,0,0|2,0,0]=4 24919 B12R1.372 CCCSCCC1CCCN1C 62a_100000210303_100000005710 [1,0,0,1,0,0|2,0,0]=4 24920 B12R1.372 CCOCCCN1CCC[C@@H]1C 2230a_100020605311_100012232248 [1,0,0,1,0,0|2,0,0]=4 24921 B12R1.372 CCOCCCN1CCC[C@@H]1C 269982a_100020605311_100012232248 [1,0,0,1,0,0|2,0,0]=4 24922 B12R1.372 CCOCCCN1CCC[C@H]1C 2230a_100015189458_100012232248 [1,0,0,1,0,0|2,0,0]=4 24923 B12R1.372 CCOCCCN1CCC[C@H]1C 269982a_100015189458_100012232248 [1,0,0,1,0,0|2,0,0]=4 24924 B12R1.372 CCOCCCN1CCC[C@H]1C 34a_100015189458_100012232248 [1,0,0,1,0,0|2,0,0]=4 24925 B12R1.372 CCOCCNC1CCCC1C 269862a_100011200944_100000752053 [1,0,0,1,0,0|2,0,0]=4 24926 B12R1.372 CCOCCOC1CCCC1C 34a_100011216460_100000210147 [1,0,0,1,0,0|2,0,0]=4 24927 B12R1.372 CCOCCOC1CCCC1C 7a_100011216460_100011215890 [1,0,0,1,0,0|2,0,0]=4 24928 B12R1.372 CCOCCS[C@@H]1CCC[C@H]1O 62a_100000210147_200016002552 [1,0,0,1,0,0|2,0,0]=4 24929 B12R1.372 CCOCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100011215890 [1,0,0,1,0,0|2,0,0]=4 24930 B12R1.372 CCSCCNC1CCCC1C 269862a_100000106463_100000752053 [1,0,0,1,0,0|2,0,0]=4 24931 B12R1.372 CCSCCOC1CCCC1C 34a_100011216460_100000757381 [1,0,0,1,0,0|2,0,0]=4 24932 B12R1.372 CCSCCOC1CCCC1C 7a_100011216460_100000757381 [1,0,0,1,0,0|2,0,0]=4 24933 B12R1.372 CCSCCS[C@@H]1CCC[C@H]1O 62a_100000757381_200016002552 [1,0,0,1,0,0|2,0,0]=4 24934 B12R1.372 CCSCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000757381 [1,0,0,1,0,0|2,0,0]=4 24935 B12R1.372 CN1CCCC1CCNCCO 2230a_100016997473_100000005710 [1,0,0,1,0,0|2,0,0]=4 24936 B12R1.372 CN1CCCC1CCNCCO 34a_100016990907_100000005710 [1,0,0,1,0,0|2,0,0]=4 24937 B12R1.372 CN1CCCC1CCOCCO 34a_100011215177_100000211926 [1,0,0,1,0,0|2,0,0]=4 24938 B12R1.372 CN1CCCC1CCOCCO 7a_100011215177_100000211926 [1,0,0,1,0,0|2,0,0]=4 24939 B12R1.372 CN1CCCC1CCSCCO 62a_100000005710_100000211926 [1,0,0,1,0,0|2,0,0]=4 24940 B12R1.372 CN1CCCC1CCSCCO 62a_100000211926_100000005710 [1,0,0,1,0,0|2,0,0]=4 24941 B12R1.372 CN1CCCC1COCCCO 34a_100000743107_100000230001 [1,0,0,1,0,0|2,0,0]=4 24942 B12R1.372 COCCCCN1CCC[C@@H]1C 2230a_100020605311_100000730899 [1,0,0,1,0,0|2,0,0]=4 24943 B12R1.372 COCCCCN1CCC[C@@H]1C 269982a_100020605311_100000730899 [1,0,0,1,0,0|2,0,0]=4 24944 B12R1.372 COCCCCN1CCC[C@H]1C 2230a_100015189458_100000730899 [1,0,0,1,0,0|2,0,0]=4 24945 B12R1.372 COCCCCN1CCC[C@H]1C 269982a_100015189458_100000730899 [1,0,0,1,0,0|2,0,0]=4 24946 B12R1.372 COCCCCN1CCC[C@H]1C 34a_100015189458_100000755781 [1,0,0,1,0,0|2,0,0]=4 24947 B12R1.372 COCCCNC1CCCC1C 269862a_100150723488_100000752053 [1,0,0,1,0,0|2,0,0]=4 24948 B12R1.372 COCCCOC1CCCC1C 34a_100011216460_100000740836 [1,0,0,1,0,0|2,0,0]=4 24949 B12R1.372 COCCCOC1CCCC1C 7a_100011216460_100000740836 [1,0,0,1,0,0|2,0,0]=4 24950 B12R1.372 COCCCS[C@@H]1CCC[C@H]1O 62a_100000709357_200016002552 [1,0,0,1,0,0|2,0,0]=4 24951 B12R1.372 COCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000709357 [1,0,0,1,0,0|2,0,0]=4 24952 B12R1.372 CSCCCNC1CCCC1C 269862a_100000749238_100000752053 [1,0,0,1,0,0|2,0,0]=4 24953 B12R1.372 C[C@@H]1CCCN1CCCCCF 2230a_100015189458_100000729378 [1,0,0,1,0,0|2,0,0]=4 24954 B12R1.372 C[C@@H]1CCCN1CCCCCF 269982a_100015189458_100000729378 [1,0,0,1,0,0|2,0,0]=4 24955 B12R1.372 C[C@@H]1CCCN1CCCCCF 34a_100015189458_100000729378 [1,0,0,1,0,0|2,0,0]=4 24956 B12R1.372 C[C@@H]1CCCN1CCCCCO 2230a_100015189458_100000746330 [1,0,0,1,0,0|1,0,0]=3 24957 B12R1.372 C[C@@H]1CCCN1CCCCCO 269982a_100015189458_100000746330 [1,0,0,1,0,0|1,0,0]=3 24958 B12R1.372 C[C@@H]1CCCN1CCCCCO 34a_100015189458_100000746330 [1,0,0,1,0,0|1,0,0]=3 24959 B12R1.372 C[C@@H]1CCCN1CCOCCO 2230a_100015189458_100011215305 [1,0,0,1,0,0|2,0,0]=4 24960 B12R1.372 C[C@@H]1CCCN1CCOCCO 269982a_100015189458_100011215305 [1,0,0,1,0,0|2,0,0]=4 24961 B12R1.372 C[C@@H]1CCCN1CCOCCO 34a_100015189458_100000692535 [1,0,0,1,0,0|2,0,0]=4 24962 B12R1.372 C[C@@H]1CNC[C@@H]1OCCCCO 34a_200015306588_100011216708 [1,0,0,1,0,0|2,0,0]=4 24963 B12R1.372 C[C@H]1CCCN1CCCCCF 2230a_100020605311_100000729378 [1,0,0,1,0,0|2,0,0]=4 24964 B12R1.372 C[C@H]1CCCN1CCCCCF 269982a_100020605311_100000729378 [1,0,0,1,0,0|2,0,0]=4 24965 B12R1.372 C[C@H]1CCCN1CCCCCO 2230a_100020605311_100000746330 [1,0,0,1,0,0|1,0,0]=3 24966 B12R1.372 C[C@H]1CCCN1CCCCCO 269982a_100020605311_100000746330 [1,0,0,1,0,0|1,0,0]=3 24967 B12R1.372 C[C@H]1CCCN1CCOCCO 2230a_100020605311_100011215305 [1,0,0,1,0,0|2,0,0]=4 24968 B12R1.372 C[C@H]1CCCN1CCOCCO 269982a_100020605311_100011215305 [1,0,0,1,0,0|2,0,0]=4 24969 B12R1.372 N[C@H]1CCC[C@@H]1OCCCCO 34a_100000748460_100011216708 [1,0,0,1,0,0|2,0,0]=4 24970 B12R1.372 OCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100011216708 [1,0,0,1,0,0|2,0,0]=4 24971 B12R1.372 OCCCCS[C@@H]1CCC[C@H]1O 62a_100000210776_200016002552 [1,0,0,1,0,0|2,0,0]=4 24972 B12R1.372 OCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000210776 [1,0,0,1,0,0|2,0,0]=4 24973 B12R1.372 O[C@@H]1CCC[C@H]1SCCCCF 62a_100000729493_200016002552 [1,0,0,1,0,0|2,0,0]=4 24974 B12R1.372 O[C@@H]1CCC[C@H]1SCCCCF 62a_200016002552_100000729493 [1,0,0,1,0,0|2,0,0]=4 24975 B12R1.375 BrCCCCCCCOC1CC1 34a_100000760002_100000211595 [1,0,0,1,0,0|2,0,0]=4 24976 B12R1.375 BrCCCCCCOCC1CC1 34a_100011215345_100000742324 [1,0,0,1,0,0|2,0,0]=4 24977 B12R1.375 BrCCCCCCOCC1CC1 7a_100011215345_100000742324 [1,0,0,1,0,0|2,0,0]=4 24978 B12R1.375 BrCCCCCCOCC1CO1 34a_100011215345_102125554688 [1,0,0,1,0,0|2,0,0]=4 24979 B12R1.375 BrCCCCCCOCC1CO1 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B12R1.458 COCC1CCN1CCCCO 269982a_100015195929_100000210776 [1,0,0,1,0,0|2,0,0]=4 25265 B12R1.458 COCC1CCN1CCCCO 34a_100015195929_100011216708 [1,0,0,1,0,0|2,0,0]=4 25266 B12R1.1414 BrCCCOC1CCCCCC1 34a_100011217188_100011217769 [1,0,0,1,0,0|2,0,0]=4 25267 B12R1.1414 BrCCOCC1CCCCCC1 34a_100000211926_200000696569 [1,0,0,1,0,0|2,0,0]=4 25268 B12R1.1414 CCCCCN1CCCCCC1 2230a_100000185865_100000210326 [1,0,0,1,0,0|1,0,0]=3 25269 B12R1.1414 CCCCCN1CCCCCC1 269982a_100000185865_100000210215 [1,0,0,1,0,0|1,0,0]=3 25270 B12R1.1414 CCCCCN1CCCCCC1 34a_100000185865_100000718602 [1,0,0,1,0,0|1,0,0]=3 25271 B12R1.1414 CCCCCN1CCCOCC1 2230a_100000685342_100000210326 [1,0,0,1,0,0|2,0,0]=4 25272 B12R1.1414 CCCCCN1CCCOCC1 269982a_100000685342_100000210215 [1,0,0,1,0,0|2,0,0]=4 25273 B12R1.1414 CCCCCN1CCCOCC1 34a_100000685342_100000718602 [1,0,0,1,0,0|2,0,0]=4 25274 B12R1.1414 CCCCNC1CCCCCC1 2230a_100000210984_100000210211 [1,0,0,1,0,0|1,0,0]=3 25275 B12R1.1414 CCCCNC1CCCCCC1 270004a_100000102301_100000210131 [1,0,0,1,0,0|1,0,0]=3 25276 B12R1.1414 CCCCNC1CCCCCC1 34a_100000210984_100000210210 [1,0,0,1,0,0|1,0,0]=3 25277 B12R1.1414 CCCCNC1CCCNCC1 270004a_100000102301_100015187895 [1,0,0,1,0,0|2,0,0]=4 25278 B12R1.1414 CCCCOC1CCCCCC1 34a_100000210227_100011217769 [1,0,0,1,0,0|1,0,0]=3 25279 B12R1.1414 CCCCOC1CCCCCC1 34a_100000210887_100000210210 [1,0,0,1,0,0|1,0,0]=3 25280 B12R1.1414 CCCCOC1CCCCCC1 7a_100000210887_100000210211 [1,0,0,1,0,0|1,0,0]=3 25281 B12R1.1414 CCCCSC1CCCCCC1 62a_100000210211_100011217769 [1,0,0,1,0,0|1,0,0]=3 25282 B12R1.1414 CCCCSC1CCCCCC1 62a_100011217769_100000210210 [1,0,0,1,0,0|1,0,0]=3 25283 B12R1.1414 CCCNCC1CCCCCC1 2230a_100015204231_100000210303 [1,0,0,1,0,0|1,0,0]=3 25284 B12R1.1414 CCCNCC1CCCCCC1 269862a_100020643023_200000763224 [1,0,0,1,0,0|1,0,0]=3 25285 B12R1.1414 CCCNCC1CCCCCC1 34a_100015204231_100000210303 [1,0,0,1,0,0|1,0,0]=3 25286 B12R1.1414 CCCOCC1CCCCCC1 34a_100000210258_200000696569 [1,0,0,1,0,0|1,0,0]=3 25287 B12R1.1414 CCCOCC1CCCCCC1 34a_100000699130_100000210303 [1,0,0,1,0,0|1,0,0]=3 25288 B12R1.1414 CCCOCC1CCCCCC1 7a_100000699130_100000210303 [1,0,0,1,0,0|1,0,0]=3 25289 B12R1.1414 CCCSCC1CCCCCC1 62a_100000210303_200000696569 [1,0,0,1,0,0|1,0,0]=3 25290 B12R1.1414 CCCSCC1CCCCCC1 62a_200000696569_100000210303 [1,0,0,1,0,0|1,0,0]=3 25291 B12R1.1414 CCNCCC1CCCCCC1 2230a_100011532351_100000210202 [1,0,0,1,0,0|1,0,0]=3 25292 B12R1.1414 CCNCCC1CCCCCC1 34a_100011532351_100000210202 [1,0,0,1,0,0|1,0,0]=3 25293 B12R1.1414 CCOCCN1CCCCCC1 2230a_100000185865_100011215890 [1,0,0,1,0,0|2,0,0]=4 25294 B12R1.1414 CCOCCN1CCCCCC1 269982a_100000185865_100011215890 [1,0,0,1,0,0|2,0,0]=4 25295 B12R1.1414 CCOCCN1CCCCCC1 34a_100000185865_100000210147 [1,0,0,1,0,0|2,0,0]=4 25296 B12R1.1414 CCOCCN1CCCCCC1 34a_100000238007_100000210202 [1,0,0,1,0,0|2,0,0]=4 25297 B12R1.1414 CCOCSC1CCCCCC1 62a_100000739092_100011217769 [1,0,0,1,0,0|2,0,0]=4 25298 B12R1.1414 CCOCSC1CCCCCC1 62a_100011217769_100000739092 [1,0,0,1,0,0|2,0,0]=4 25299 B12R1.1414 CCSCCN1CCCCCC1 2230a_100000185865_100000757381 [1,0,0,1,0,0|2,0,0]=4 25300 B12R1.1414 CCSCCN1CCCCCC1 269982a_100000185865_100000757381 [1,0,0,1,0,0|2,0,0]=4 25301 B12R1.1414 CCSCCN1CCCCCC1 34a_100000185865_100000757381 [1,0,0,1,0,0|2,0,0]=4 25302 B12R1.1414 CCSCCN1CCCCCC1 62a_100000210202_100000722644 [1,0,0,1,0,0|2,0,0]=4 25303 B12R1.1414 CCSCCN1CCCCCC1 62a_100000722644_100000210202 [1,0,0,1,0,0|2,0,0]=4 25304 B12R1.1414 COCCCN1CCCCCC1 2230a_100000185865_100000740836 [1,0,0,1,0,0|2,0,0]=4 25305 B12R1.1414 COCCCN1CCCCCC1 269982a_100000185865_100000740836 [1,0,0,1,0,0|2,0,0]=4 25306 B12R1.1414 COCCCN1CCCCCC1 34a_100000185865_100000740836 [1,0,0,1,0,0|2,0,0]=4 25307 B12R1.1414 COCCCN1CCCCCC1 34a_100102886287_200000210301 [1,0,0,1,0,0|2,0,0]=4 25308 B12R1.1414 COCCCN1CCCCCC1 7a_100102886287_200000210301 [1,0,0,1,0,0|2,0,0]=4 25309 B12R1.1414 COCCNC1CCCCCC1 2230a_100000210984_100011201679 [1,0,0,1,0,0|2,0,0]=4 25310 B12R1.1414 COCCNC1CCCCCC1 270004a_100000209980_100000210131 [1,0,0,1,0,0|2,0,0]=4 25311 B12R1.1414 COCCNC1CCCCCC1 34a_100000210984_100011201679 [1,0,0,1,0,0|2,0,0]=4 25312 B12R1.1414 COCCOC1CCCCCC1 34a_100000210237_100011217769 [1,0,0,1,0,0|2,0,0]=4 25313 B12R1.1414 COCCOC1CCCCCC1 34a_100000210887_100011201679 [1,0,0,1,0,0|2,0,0]=4 25314 B12R1.1414 COCCOC1CCCCCC1 7a_100000210887_100000233755 [1,0,0,1,0,0|2,0,0]=4 25315 B12R1.1414 COCCSC1CCCCCC1 62a_100000233755_100011217769 [1,0,0,1,0,0|2,0,0]=4 25316 B12R1.1414 COCCSC1CCCCCC1 62a_100011217769_100000233755 [1,0,0,1,0,0|2,0,0]=4 25317 B12R1.1414 COCNCC1CCCCCC1 2230a_100015204231_100000766300 [1,0,0,1,0,0|2,0,0]=4 25318 B12R1.1414 COCSCC1CCCCCC1 62a_100000766300_200000696569 [1,0,0,1,0,0|2,0,0]=4 25319 B12R1.1414 COCSCC1CCCCCC1 62a_200000696569_100000766300 [1,0,0,1,0,0|2,0,0]=4 25320 B12R1.1414 CSCCNC1CCCCCC1 2230a_100000210984_100000751147 [1,0,0,1,0,0|2,0,0]=4 25321 B12R1.1414 CSCCNC1CCCCCC1 270004a_100020590264_100000210131 [1,0,0,1,0,0|2,0,0]=4 25322 B12R1.1414 CSCCNC1CCCCCC1 34a_100000210984_100000212216 [1,0,0,1,0,0|2,0,0]=4 25323 B12R1.1414 CSCCOC1CCCCCC1 34a_100000210887_100000212216 [1,0,0,1,0,0|2,0,0]=4 25324 B12R1.1414 CSCCOC1CCCCCC1 34a_100000230434_100011217769 [1,0,0,1,0,0|2,0,0]=4 25325 B12R1.1414 CSCCOC1CCCCCC1 7a_100000210887_100000212216 [1,0,0,1,0,0|2,0,0]=4 25326 B12R1.1414 CSCCSC1CCCCCC1 62a_100000212216_100011217769 [1,0,0,1,0,0|2,0,0]=4 25327 B12R1.1414 CSCCSC1CCCCCC1 62a_100011217769_100000751147 [1,0,0,1,0,0|2,0,0]=4 25328 B12R1.1414 CSCNCC1CCCCCC1 2230a_100015204231_100011218213 [1,0,0,1,0,0|2,0,0]=4 25329 B12R1.1414 CSCNCC1CCCCCC1 34a_100015204231_100011218213 [1,0,0,1,0,0|2,0,0]=4 25330 B12R1.1414 CSCOCC1CCCCCC1 34a_100000699130_100011218213 [1,0,0,1,0,0|2,0,0]=4 25331 B12R1.1414 CSCSCC1CCCCCC1 62a_100011218213_200000696569 [1,0,0,1,0,0|2,0,0]=4 25332 B12R1.1414 CSCSCC1CCCCCC1 62a_200000696569_100011218213 [1,0,0,1,0,0|2,0,0]=4 25333 B12R1.1414 ClCCCOC1CCCCCC1 34a_100000230001_100011217769 [1,0,0,1,0,0|2,0,0]=4 25334 B12R1.1414 FCCCCN1CCCCCC1 2230a_100000185865_100000729493 [1,0,0,1,0,0|2,0,0]=4 25335 B12R1.1414 FCCCCN1CCCCCC1 269982a_100000185865_100000729493 [1,0,0,1,0,0|2,0,0]=4 25336 B12R1.1414 FCCCCN1CCCCCC1 34a_100000185865_100000729493 [1,0,0,1,0,0|2,0,0]=4 25337 B12R1.1414 FCCCNC1CCCCCC1 2230a_100000210984_100011934791 [1,0,0,1,0,0|2,0,0]=4 25338 B12R1.1414 FCCCNC1CCCCCC1 270004a_100015189416_100000210131 [1,0,0,1,0,0|2,0,0]=4 25339 B12R1.1414 FCCCNC1CCCCCC1 34a_100000210984_100011934791 [1,0,0,1,0,0|2,0,0]=4 25340 B12R1.1414 FCCCNC1CCCCCC1 34a_100015189416_100011217769 [1,0,0,1,0,0|2,0,0]=4 25341 B12R1.1414 FCCCOC1CCCCCC1 34a_100000210887_100011934791 [1,0,0,1,0,0|2,0,0]=4 25342 B12R1.1414 FCCCOC1CCCCCC1 34a_100000759539_100011217769 [1,0,0,1,0,0|2,0,0]=4 25343 B12R1.1414 FCCCOC1CCCCCC1 7a_100000210887_100011934791 [1,0,0,1,0,0|2,0,0]=4 25344 B12R1.1414 FCCCSC1CCCCCC1 62a_100011217769_100011934791 [1,0,0,1,0,0|2,0,0]=4 25345 B12R1.1414 FCCCSC1CCCCCC1 62a_100011934791_100011217769 [1,0,0,1,0,0|2,0,0]=4 25346 B12R1.1414 FCCNCC1CCCCCC1 2230a_100015204231_100011217306 [1,0,0,1,0,0|2,0,0]=4 25347 B12R1.1414 FCCNCC1CCCCCC1 269862a_100000724931_200000763224 [1,0,0,1,0,0|2,0,0]=4 25348 B12R1.1414 FCCNCC1CCCCCC1 34a_100000724931_200000696569 [1,0,0,1,0,0|2,0,0]=4 25349 B12R1.1414 FCCNCC1CCCCCC1 34a_100015204231_100011217306 [1,0,0,1,0,0|2,0,0]=4 25350 B12R1.1414 FCCOCC1CCCCCC1 34a_100000699130_100011217306 [1,0,0,1,0,0|2,0,0]=4 25351 B12R1.1414 FCCOCC1CCCCCC1 7a_100000699130_100011217306 [1,0,0,1,0,0|2,0,0]=4 25352 B12R1.1414 FCCSCC1CCCCCC1 62a_100011217306_200000696569 [1,0,0,1,0,0|2,0,0]=4 25353 B12R1.1414 FCCSCC1CCCCCC1 62a_200000696569_100011217306 [1,0,0,1,0,0|2,0,0]=4 25354 B12R1.1414 FCNCCC1CCCCCC1 34a_100011532351_100015361967 [1,0,0,1,0,0|2,0,0]=4 25355 B12R1.1414 NCCCOC1CCCCCC1 34a_100000182051_100011217769 [1,0,0,1,0,0|2,0,0]=4 25356 B12R1.1414 NCCOCC1CCCCCC1 34a_100000210304_200000696569 [1,0,0,1,0,0|2,0,0]=4 25357 B12R1.1414 OCCCCN1CCCCCC1 2230a_100000185865_100000210776 [1,0,0,1,0,0|1,0,0]=3 25358 B12R1.1414 OCCCCN1CCCCCC1 269982a_100000185865_100000210776 [1,0,0,1,0,0|1,0,0]=3 25359 B12R1.1414 OCCCCN1CCCCCC1 34a_100000185865_100011216708 [1,0,0,1,0,0|1,0,0]=3 25360 B12R1.1414 OCCCCN1CCCOCC1 2230a_100000685342_100000210776 [1,0,0,1,0,0|2,0,0]=4 25361 B12R1.1414 OCCCCN1CCCOCC1 269982a_100000685342_100000210776 [1,0,0,1,0,0|2,0,0]=4 25362 B12R1.1414 OCCCCN1CCCOCC1 34a_100000685342_100011216708 [1,0,0,1,0,0|2,0,0]=4 25363 B12R1.1414 OCCCNC1CCCCCC1 2230a_100000210984_100000230001 [1,0,0,1,0,0|1,0,0]=3 25364 B12R1.1414 OCCCNC1CCCCCC1 270004a_100000182051_100000210131 [1,0,0,1,0,0|1,0,0]=3 25365 B12R1.1414 OCCCNC1CCCCCC1 34a_100000210984_100000230001 [1,0,0,1,0,0|1,0,0]=3 25366 B12R1.1414 OCCCNC1CCCNCC1 270004a_100000182051_100015187895 [1,0,0,1,0,0|2,0,0]=4 25367 B12R1.1414 OCCCOC1CCCCCC1 34a_100000210887_100000230001 [1,0,0,1,0,0|1,0,0]=3 25368 B12R1.1414 OCCCOC1CCCCCC1 7a_100000210887_100011215043 [1,0,0,1,0,0|1,0,0]=3 25369 B12R1.1414 OCCCSC1CCCCCC1 62a_100011215043_100011217769 [1,0,0,1,0,0|1,0,0]=3 25370 B12R1.1414 OCCCSC1CCCCCC1 62a_100011217769_100011215043 [1,0,0,1,0,0|1,0,0]=3 25371 B12R1.1414 OCCNCC1CCCCCC1 2230a_100015204231_100000211926 [1,0,0,1,0,0|1,0,0]=3 25372 B12R1.1414 OCCNCC1CCCCCC1 2230a_100016997473_200000696569 [1,0,0,1,0,0|1,0,0]=3 25373 B12R1.1414 OCCNCC1CCCCCC1 269862a_100000210304_200000763224 [1,0,0,1,0,0|1,0,0]=3 25374 B12R1.1414 OCCNCC1CCCCCC1 34a_100015204231_100000211926 [1,0,0,1,0,0|1,0,0]=3 25375 B12R1.1414 OCCNCC1CCCCCC1 34a_100016990907_200000696569 [1,0,0,1,0,0|1,0,0]=3 25376 B12R1.1414 OCCOCC1CCCCCC1 34a_100000699130_100000211926 [1,0,0,1,0,0|1,0,0]=3 25377 B12R1.1414 OCCOCC1CCCCCC1 7a_100000699130_100000211926 [1,0,0,1,0,0|1,0,0]=3 25378 B12R1.1414 OCCSCC1CCCCCC1 62a_100000211926_200000696569 [1,0,0,1,0,0|1,0,0]=3 25379 B12R1.1414 OCCSCC1CCCCCC1 62a_200000696569_100000211926 [1,0,0,1,0,0|1,0,0]=3 25380 B12R1.1414 [13CH3]OCCCN1CCCCCC1 34a_100102886287_200025704644 [1,0,0,1,0,0|2,0,0]=4 25381 B12R1.1414 [13CH3]OCCCN1CCCCCC1 7a_100102886287_200025704644 [1,0,0,1,0,0|2,0,0]=4 25382 B14R1.26 CC1=CC(CCC1)OCCCCCO 34a_100011218613_100000746330 [0,1,0,1,0,0|1,0,1]=4 25383 B14R1.26 CC1CC(CCO1)NCCCCCO 270004a_100000762737_100000755752 [0,1,0,1,0,0|2,0,0]=4 25384 B14R1.26 CC1CC(CCO1)OCCCCCO 34a_100011986385_100000746330 [0,1,0,1,0,0|2,0,0]=4 25385 B14R1.26 CC1CC(CCO1)OCCCCCO 7a_100011986385_100000746330 [0,1,0,1,0,0|2,0,0]=4 25386 B14R1.26 CC1CCCC(C1)NCCCCCF 2230a_100011194320_100000729378 [0,1,0,1,0,0|2,0,0]=4 25387 B14R1.26 CC1CCCC(C1)NCCCCCF 34a_100011194320_100000729378 [0,1,0,1,0,0|2,0,0]=4 25388 B14R1.26 CC1CCCC(C1)NCCCCCO 2230a_100011194320_100000746330 [0,1,0,1,0,0|1,0,0]=3 25389 B14R1.26 CC1CCCC(C1)NCCCCCO 270004a_100000762737_100000183594 [0,1,0,1,0,0|1,0,0]=3 25390 B14R1.26 CC1CCCC(C1)NCCCCCO 34a_100011194320_100000746330 [0,1,0,1,0,0|1,0,0]=3 25391 B14R1.26 CC1CCCC(C1)NCCOCCO 2230a_100011194320_100011215305 [0,1,0,1,0,0|2,0,0]=4 25392 B14R1.26 CC1CCCC(C1)NCCOCCO 270004a_100000211614_100000183594 [0,1,0,1,0,0|2,0,0]=4 25393 B14R1.26 CC1CCCC(C1)NCCOCCO 34a_100011194320_100000692535 [0,1,0,1,0,0|2,0,0]=4 25394 B14R1.26 CC1CCCC(C1)NCCSCCO 270004a_100011219999_100000183594 [0,1,0,1,0,0|2,0,0]=4 25395 B14R1.26 CC1CCCC(C1)OCCCCCF 34a_100000211399_100000729378 [0,1,0,1,0,0|2,0,0]=4 25396 B14R1.26 CC1CCCC(C1)OCCCCCO 34a_100000211399_100000746330 [0,1,0,1,0,0|1,0,0]=3 25397 B14R1.26 CC1CCCC(C1)OCCOCCO 34a_100000211399_100000692535 [0,1,0,1,0,0|2,0,0]=4 25398 B14R1.26 CC1CCCN(C1)CCNCCCO 2230a_100000739826_100000230001 [0,1,0,1,0,0|2,0,0]=4 25399 B14R1.26 CC1CCCN(C1)CCSCCCO 62a_100011215043_100000766211 [0,1,0,1,0,0|2,0,0]=4 25400 B14R1.26 CC1CN(CCO1)CCCCCCO 2230a_100000729577_100000766143 [0,1,0,1,0,0|2,0,0]=4 25401 B14R1.26 CC1CN(CCO1)CCCCCCO 269982a_100000729577_100000766143 [0,1,0,1,0,0|2,0,0]=4 25402 B14R1.26 CC1CN(CCO1)CCCCCCO 34a_100000729577_100000766143 [0,1,0,1,0,0|2,0,0]=4 25403 B14R1.26 CC1CNCC(C1)COCCCCO 34a_200012821172_100011216708 [0,1,0,1,0,0|2,0,0]=4 25404 B14R1.26 CCCCCCCN1CCCC(C1)F 2230a_100000697950_100000210681 [0,1,0,1,0,0|2,0,0]=4 25405 B14R1.26 CCCCCCCN1CCCC(C1)F 269982a_100000697950_100000210681 [0,1,0,1,0,0|2,0,0]=4 25406 B14R1.26 CCCCCCCN1CCCC(C1)F 34a_100000697950_100000210614 [0,1,0,1,0,0|2,0,0]=4 25407 B14R1.26 CCCCCCCN1CCCC(C1)O 2230a_100000211013_100000210681 [0,1,0,1,0,0|1,0,0]=3 25408 B14R1.26 CCCCCCCN1CCCC(C1)O 269982a_100000211013_100000210681 [0,1,0,1,0,0|1,0,0]=3 25409 B14R1.26 CCCCCCCN1CCC[C@@H](C1)C 2230a_100000717927_100000210681 [0,1,0,1,0,0|2,0,0]=4 25410 B14R1.26 CCCCCCCN1CCC[C@@H](C1)C 269982a_100000717927_100000210681 [0,1,0,1,0,0|2,0,0]=4 25411 B14R1.26 CCCCCCCN1CCC[C@@H](C1)C 34a_100000717927_100000210614 [0,1,0,1,0,0|2,0,0]=4 25412 B14R1.26 CCCCCCCN1CCOC(C1)O 2230a_100000688207_100000210681 [0,1,0,1,0,0|2,0,0]=4 25413 B14R1.26 CCCCCCCN1CCOC(C1)O 269982a_100000688207_100000210681 [0,1,0,1,0,0|2,0,0]=4 25414 B14R1.26 CCCCCCNC1CCCC(C1)C 2230a_100011194320_100000210314 [0,1,0,1,0,0|2,0,0]=4 25415 B14R1.26 CCCCCCNC1CCCC(C1)C 270004a_100000210581_100000183594 [0,1,0,1,0,0|2,0,0]=4 25416 B14R1.26 CCCCCCNC1CCCC(C1)C 34a_100011194320_100000210314 [0,1,0,1,0,0|2,0,0]=4 25417 B14R1.26 CCCCCCNC1CCCC(C1)O 2230a_100015190357_100000210314 [0,1,0,1,0,0|1,0,0]=3 25418 B14R1.26 CCCCCCNC1CCCC(C1)O 270004a_100000210581_100012613340 [0,1,0,1,0,0|1,0,0]=3 25419 B14R1.26 CCCCCCOC1CCCC(C1)C 34a_100000211399_100000210314 [0,1,0,1,0,0|2,0,0]=4 25420 B14R1.26 CCCCCNCC1CCCC(C1)O 2230a_100011254705_100000210326 [0,1,0,1,0,0|1,0,0]=3 25421 B14R1.26 CCCCOCCN1CCCC(C1)O 2230a_100000211013_100000743108 [0,1,0,1,0,0|2,0,0]=4 25422 B14R1.26 CCCCOCCN1CCCC(C1)O 269982a_100000211013_100000743108 [0,1,0,1,0,0|2,0,0]=4 25423 B14R1.26 CCCCOCNC1CCCC(C1)O 2230a_100015190357_100011995733 [0,1,0,1,0,0|2,0,0]=4 25424 B14R1.26 CCCOCCNC1CCCC(C1)O 2230a_100015190357_100011215938 [0,1,0,1,0,0|2,0,0]=4 25425 B14R1.26 CCCOCCNC1CCCC(C1)O 270004a_100161115042_100012613340 [0,1,0,1,0,0|2,0,0]=4 25426 B14R1.26 CCCSCCNC1CCCC(C1)O 270004a_100020603323_100012613340 [0,1,0,1,0,0|2,0,0]=4 25427 B14R1.26 CCOCCCNC1CCCC(C1)O 2230a_100015190357_100012232248 [0,1,0,1,0,0|2,0,0]=4 25428 B14R1.26 CCOCCCNC1CCCC(C1)O 270004a_100000210961_100012613340 [0,1,0,1,0,0|2,0,0]=4 25429 B14R1.26 CCOCCNCC1CCCC(C1)O 2230a_100011254705_100011215890 [0,1,0,1,0,0|2,0,0]=4 25430 B14R1.26 CCSCCNCC1CCCC(C1)O 2230a_100011254705_100000757381 [0,1,0,1,0,0|2,0,0]=4 25431 B14R1.26 CN1CCCC(C1)CNCCCCO 34a_100000750430_100015183302 [0,1,0,1,0,0|2,0,0]=4 25432 B14R1.26 CN1CCCC(C1)CSCCCCO 62a_100000210776_100000752043 [0,1,0,1,0,0|2,0,0]=4 25433 B14R1.26 CN1CCCC(C1)CSCCCCO 62a_100000752043_100000210776 [0,1,0,1,0,0|2,0,0]=4 25434 B14R1.26 COCCCCNC1CCCC(C1)O 2230a_100015190357_100000730899 [0,1,0,1,0,0|2,0,0]=4 25435 B14R1.26 COCCCNCC1CCCC(C1)O 2230a_100011254705_100000740836 [0,1,0,1,0,0|2,0,0]=4 25436 B14R1.26 C[C@@H]1CC(CCN1)NCCCCCO 270004a_100000762737_100016994030 [0,1,0,1,0,0|2,0,0]=4 25437 B14R1.26 C[C@H]1CCCN(C1)CCCCCCF 2230a_100000717927_100015922095 [0,1,0,1,0,0|2,0,0]=4 25438 B14R1.26 C[C@H]1CCCN(C1)CCCCCCF 269982a_100000717927_100015922095 [0,1,0,1,0,0|2,0,0]=4 25439 B14R1.26 C[C@H]1CCCN(C1)CCCCCCF 34a_100000717927_100015922095 [0,1,0,1,0,0|2,0,0]=4 25440 B14R1.26 C[C@H]1CCCN(C1)CCCCCCO 2230a_100000717927_100000766143 [0,1,0,1,0,0|1,0,0]=3 25441 B14R1.26 C[C@H]1CCCN(C1)CCCCCCO 269982a_100000717927_100000766143 [0,1,0,1,0,0|1,0,0]=3 25442 B14R1.26 C[C@H]1CCCN(C1)CCCCCCO 34a_100000717927_100000766143 [0,1,0,1,0,0|1,0,0]=3 25443 B14R1.26 FCCCCCCN1CCCC(C1)F 2230a_100000697950_100015922095 [0,1,0,1,0,0|2,0,0]=4 25444 B14R1.26 FCCCCCCN1CCCC(C1)F 269982a_100000697950_100015922095 [0,1,0,1,0,0|2,0,0]=4 25445 B14R1.26 FCCCCCCN1CCCC(C1)F 34a_100000697950_100015922095 [0,1,0,1,0,0|2,0,0]=4 25446 B14R1.26 O=C1CCCC(C1)OCCCCCO 34a_100012613340_100000746330 [0,1,0,1,0,0|1,0,1]=4 25447 B14R1.26 OC1CCCC(C1)CNCCCCF 2230a_100011254705_100000729493 [0,1,0,1,0,0|2,0,0]=4 25448 B14R1.26 OC1CCCC(C1)NCCCCCF 2230a_100015190357_100000729378 [0,1,0,1,0,0|2,0,0]=4 25449 B14R1.26 OC1CCCN(C1)CCCCCCF 2230a_100000211013_100015922095 [0,1,0,1,0,0|2,0,0]=4 25450 B14R1.26 OC1CCCN(C1)CCCCCCF 269982a_100000211013_100015922095 [0,1,0,1,0,0|2,0,0]=4 25451 B14R1.26 OCCCCCCN1CCCC(C1)F 2230a_100000697950_100000766143 [0,1,0,1,0,0|1,0,0]=3 25452 B14R1.26 OCCCCCCN1CCCC(C1)F 269982a_100000697950_100000766143 [0,1,0,1,0,0|1,0,0]=3 25453 B14R1.26 OCCCCCCN1CCCC(C1)F 34a_100000697950_100000766143 [0,1,0,1,0,0|1,0,0]=3 25454 B14R1.26 OCCCCCCN1CCCC(C1)O 2230a_100000211013_100000766143 [0,1,0,1,0,0|1,0,0]=3 25455 B14R1.26 OCCCCCCN1CCCC(C1)O 269982a_100000211013_100000766143 [0,1,0,1,0,0|1,0,0]=3 25456 B14R1.26 OCCCCCCN1CCOC(C1)O 2230a_100000688207_100000766143 [0,1,0,1,0,0|2,0,0]=4 25457 B14R1.26 OCCCCCCN1CCOC(C1)O 269982a_100000688207_100000766143 [0,1,0,1,0,0|2,0,0]=4 25458 B14R1.26 OCCCCCNC1CCCC(C1)O 2230a_100015190357_100000746330 [0,1,0,1,0,0|1,0,0]=3 25459 B14R1.26 OCCCCCNC1CCCC(C1)O 270004a_100000762737_100012613340 [0,1,0,1,0,0|1,0,0]=3 25460 B14R1.26 OCCCCNCC1CCCC(C1)O 2230a_100011254705_100000210776 [0,1,0,1,0,0|1,0,0]=3 25461 B14R1.26 OCCOCCNC1CCCC(C1)O 2230a_100015190357_100011215305 [0,1,0,1,0,0|2,0,0]=4 25462 B14R1.26 OCCOCCNC1CCCC(C1)O 270004a_100000211614_100012613340 [0,1,0,1,0,0|2,0,0]=4 25463 B14R1.26 OCCSCCNC1CCCC(C1)O 270004a_100011219999_100012613340 [0,1,0,1,0,0|2,0,0]=4 25464 B14R1.40 BrCCCCCCCOC1CCCC1 34a_100000760002_100000179811 [0,1,0,1,0,0|1,0,0]=3 25465 B14R1.40 BrCCCCCCCOC1CCCC1 7a_100000760002_100000179811 [0,1,0,1,0,0|1,0,0]=3 25466 B14R1.40 BrCCCCCCCOC1CCOC1 34a_100000760002_100000690089 [0,1,0,1,0,0|2,0,0]=4 25467 B14R1.40 BrCCCCCCCOC1CCOC1 7a_100000760002_100000731011 [0,1,0,1,0,0|2,0,0]=4 25468 B14R1.40 BrCCCCCCOCC1CCCC1 34a_100011215345_100000740388 [0,1,0,1,0,0|1,0,0]=3 25469 B14R1.40 BrCCCCCCOCC1CCCC1 7a_100011215345_100000740388 [0,1,0,1,0,0|1,0,0]=3 25470 B14R1.40 BrCCCCCCOCC1CCCO1 7a_100011215345_100000203698 [0,1,0,1,0,0|1,0,0]=3 25471 B14R1.40 BrCCCCCCOCC1CCOC1 34a_100011215345_100011261433 [0,1,0,1,0,0|2,0,0]=4 25472 B14R1.40 BrCCCCCCOCC1CCOC1 7a_100011215345_100000702531 [0,1,0,1,0,0|2,0,0]=4 25473 B14R1.40 BrCCCCCCOCC1OCCO1 34a_100011215345_100000755774 [0,1,0,1,0,0|2,0,0]=4 25474 B14R1.40 BrCCCCCCOCC1OCCO1 7a_100011215345_100000755774 [0,1,0,1,0,0|2,0,0]=4 25475 B14R1.40 BrCCCCCOCCC1CCCC1 34a_100000746331_100000760354 [0,1,0,1,0,0|1,0,0]=3 25476 B14R1.40 BrCCCCCOCCC1CCCC1 7a_100000746331_100000760354 [0,1,0,1,0,0|1,0,0]=3 25477 B14R1.40 BrCCCCCOCCC1OCCO1 34a_100000746331_100000740749 [0,1,0,1,0,0|2,0,0]=4 25478 B14R1.40 BrCCCCCOCCC1OCCO1 7a_100000746331_100000740749 [0,1,0,1,0,0|2,0,0]=4 25479 B14R1.40 BrCCCCCOCCN1CCCC1 7a_100000746331_100000004467 [0,1,0,1,0,0|2,0,0]=4 25480 B14R1.40 BrCCCCOCCCC1CCCC1 34a_100011216708_100011713738 [0,1,0,1,0,0|1,0,0]=3 25481 B14R1.40 BrCCCCOCCCC1OCCO1 34a_100011216708_100009861162 [0,1,0,1,0,0|2,0,0]=4 25482 B14R1.40 BrCCCCOCCCN1CCCC1 34a_100011216708_100016991639 [0,1,0,1,0,0|2,0,0]=4 25483 B14R1.40 BrCCCOCCCCC1OCCO1 34a_100011217188_200009813554 [0,1,0,1,0,0|2,0,0]=4 25484 B14R1.40 BrCCOCCOCCC1CCCC1 34a_100000692535_100000760354 [0,1,0,1,0,0|2,0,0]=4 25485 B14R1.40 BrCCOCCOCCC1CCCC1 7a_100000692535_100000760354 [0,1,0,1,0,0|2,0,0]=4 25486 B14R1.40 C#CCCCCCCCN1CCCC1 2230a_100000188435_100153394163 [0,1,0,1,0,0|1,0,1]=4 25487 B14R1.40 C#CCCCCCCCN1CCCC1 269982a_100000188435_100153394163 [0,1,0,1,0,0|1,0,1]=4 25488 B14R1.40 C#CCCCCCCNC1CCCC1 2230a_100000211070_100012276617 [0,1,0,1,0,0|1,0,1]=4 25489 B14R1.40 C#CCCCCCCNC1CCCC1 34a_100000211070_100012276617 [0,1,0,1,0,0|1,0,1]=4 25490 B14R1.40 C#CCCCCCCOC1CCCC1 34a_100000210269_100012276617 [0,1,0,1,0,0|1,0,1]=4 25491 B14R1.40 C#CCCCCCCOC1CCCC1 34a_100011217361_100000179811 [0,1,0,1,0,0|1,0,1]=4 25492 B14R1.40 C#CCCCCCCOC1CCCC1 7a_100000210269_100012276617 [0,1,0,1,0,0|1,0,1]=4 25493 B14R1.40 C#CCCCCCCOC1CCCC1 7a_100011217361_100000179811 [0,1,0,1,0,0|1,0,1]=4 25494 B14R1.40 C#CCCCCCCOC1CCCO1 34a_100000085407_100012276617 [0,1,0,1,0,0|0,0,2]=4 25495 B14R1.40 C#CCCCCCCSC1CCCC1 62a_100011217020_100012276617 [0,1,0,1,0,0|1,0,1]=4 25496 B14R1.40 C#CCCCCCCSC1CCCC1 62a_100012276617_100000179811 [0,1,0,1,0,0|1,0,1]=4 25497 B14R1.40 C#CCCCCCNCC1CCCC1 2230a_100000737975_100012094781 [0,1,0,1,0,0|1,0,1]=4 25498 B14R1.40 C#CCCCCCNCC1CCCC1 34a_100000737975_100012094781 [0,1,0,1,0,0|1,0,1]=4 25499 B14R1.40 C#CCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100012094781 [0,1,0,1,0,0|0,0,2]=4 25500 B14R1.40 C#CCCCCCNC[C@@H]1CCCO1 34a_100020590478_100012094781 [0,1,0,1,0,0|0,0,2]=4 25501 B14R1.40 C#CCCCCCOCC1CCCC1 34a_100000742336_100012094781 [0,1,0,1,0,0|1,0,1]=4 25502 B14R1.40 C#CCCCCCOCC1CCCC1 34a_100000766912_100000740388 [0,1,0,1,0,0|1,0,1]=4 25503 B14R1.40 C#CCCCCCOCC1CCCC1 7a_100000742336_100012094781 [0,1,0,1,0,0|1,0,1]=4 25504 B14R1.40 C#CCCCCCOCC1CCCC1 7a_100000766912_100000740388 [0,1,0,1,0,0|1,0,1]=4 25505 B14R1.40 C#CCCCCCOCC1CCCO1 34a_100000210270_100012094781 [0,1,0,1,0,0|0,0,2]=4 25506 B14R1.40 C#CCCCCCOCC1CCCO1 7a_100000210270_100012094781 [0,1,0,1,0,0|0,0,2]=4 25507 B14R1.40 C#CCCCCCOCC1CCCO1 7a_100000766912_100000203698 [0,1,0,1,0,0|0,0,2]=4 25508 B14R1.40 C#CCCCCCSCC1CCCC1 62a_100000740388_100012094781 [0,1,0,1,0,0|1,0,1]=4 25509 B14R1.40 C#CCCCCCSCC1CCCC1 62a_100012094781_100000740388 [0,1,0,1,0,0|1,0,1]=4 25510 B14R1.40 C#CCCCCCSCC1CCCO1 62a_100000203698_100012094781 [0,1,0,1,0,0|0,0,2]=4 25511 B14R1.40 C#CCCCCCSCC1CCCO1 62a_100012094781_100000203698 [0,1,0,1,0,0|0,0,2]=4 25512 B14R1.40 C#CCCCCNCCC1CCCC1 2230a_100000706060_100000760354 [0,1,0,1,0,0|1,0,1]=4 25513 B14R1.40 C#CCCCCNCCC1CCCC1 2230a_100000739158_100010269958 [0,1,0,1,0,0|1,0,1]=4 25514 B14R1.40 C#CCCCCNCCC1CCCC1 34a_100000706060_100000760354 [0,1,0,1,0,0|1,0,1]=4 25515 B14R1.40 C#CCCCCNCCC1CCCC1 34a_100000739158_100010269958 [0,1,0,1,0,0|1,0,1]=4 25516 B14R1.40 C#CCCCCOCCC1CCCC1 34a_100000749090_100010269958 [0,1,0,1,0,0|1,0,1]=4 25517 B14R1.40 C#CCCCCOCCC1CCCC1 34a_100000766709_100000760354 [0,1,0,1,0,0|1,0,1]=4 25518 B14R1.40 C#CCCCCOCCC1CCCC1 7a_100000749090_100010269958 [0,1,0,1,0,0|1,0,1]=4 25519 B14R1.40 C#CCCCCOCCC1CCCC1 7a_100000766709_100000760354 [0,1,0,1,0,0|1,0,1]=4 25520 B14R1.40 C#CCCCCSCCC1CCCC1 62a_100000760354_100010269958 [0,1,0,1,0,0|1,0,1]=4 25521 B14R1.40 C#CCCCCSCCC1CCCC1 62a_100010269958_100000760354 [0,1,0,1,0,0|1,0,1]=4 25522 B14R1.40 C#CCCCNCCCC1CCCC1 2230a_100000736752_100000731252 [0,1,0,1,0,0|1,0,1]=4 25523 B14R1.40 C#CCCCNCCCC1CCCC1 34a_100000718082_100011713738 [0,1,0,1,0,0|1,0,1]=4 25524 B14R1.40 C#CCCCNCCCC1CCCC1 34a_100000736752_100000695029 [0,1,0,1,0,0|1,0,1]=4 25525 B14R1.40 C#CCCCOCCCC1CCCC1 34a_100000215630_100011713738 [0,1,0,1,0,0|1,0,1]=4 25526 B14R1.40 C#CCCCOCCCC1CCCC1 34a_100011215328_100000695029 [0,1,0,1,0,0|1,0,1]=4 25527 B14R1.40 C#CCCCOCCCC1CCCC1 7a_100000215630_100011713738 [0,1,0,1,0,0|1,0,1]=4 25528 B14R1.40 C#CCCCOCCCC1CCCC1 7a_100011215328_100011215417 [0,1,0,1,0,0|1,0,1]=4 25529 B14R1.40 C#CCCCSCCCC1CCCC1 62a_100011215417_100011713738 [0,1,0,1,0,0|1,0,1]=4 25530 B14R1.40 C#CCCCSCCCC1CCCC1 62a_100011713738_100011215417 [0,1,0,1,0,0|1,0,1]=4 25531 B14R1.40 C=CCCCCCCCN1CCCC1 2230a_100000188435_100012355270 [0,1,0,1,0,0|1,0,1]=4 25532 B14R1.40 C=CCCCCCCCN1CCCC1 269982a_100000188435_100012355270 [0,1,0,1,0,0|1,0,1]=4 25533 B14R1.40 C=CCCCCCCNC1CCCC1 2230a_100000211070_100011215473 [0,1,0,1,0,0|1,0,1]=4 25534 B14R1.40 C=CCCCCCCNC1CCCC1 34a_100000211070_100011215473 [0,1,0,1,0,0|1,0,1]=4 25535 B14R1.40 C=CCCCCCCOC1CCCC1 34a_100000210269_100011215473 [0,1,0,1,0,0|1,0,1]=4 25536 B14R1.40 C=CCCCCCCOC1CCCC1 34a_200011216477_100000179811 [0,1,0,1,0,0|1,0,1]=4 25537 B14R1.40 C=CCCCCCCOC1CCCC1 7a_100000210269_100011215473 [0,1,0,1,0,0|1,0,1]=4 25538 B14R1.40 C=CCCCCCCOC1CCCC1 7a_200011216477_100000179811 [0,1,0,1,0,0|1,0,1]=4 25539 B14R1.40 C=CCCCCCCOC1CCCO1 34a_100000085407_100011215473 [0,1,0,1,0,0|0,0,2]=4 25540 B14R1.40 C=CCCCCCCSC1CCCC1 62a_100011215473_100000179811 [0,1,0,1,0,0|1,0,1]=4 25541 B14R1.40 C=CCCCCCCSC1CCCC1 62a_100011217020_100011215473 [0,1,0,1,0,0|1,0,1]=4 25542 B14R1.40 C=CCCCCCNCC1CCCC1 2230a_100000737975_100000700193 [0,1,0,1,0,0|1,0,1]=4 25543 B14R1.40 C=CCCCCCNCC1CCCC1 34a_100000737975_100000700193 [0,1,0,1,0,0|1,0,1]=4 25544 B14R1.40 C=CCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000700193 [0,1,0,1,0,0|0,0,2]=4 25545 B14R1.40 C=CCCCCCNC[C@@H]1CCCO1 34a_100020590478_100000700193 [0,1,0,1,0,0|0,0,2]=4 25546 B14R1.40 C=CCCCCCOCC1CCCC1 34a_100000742336_100000700193 [0,1,0,1,0,0|1,0,1]=4 25547 B14R1.40 C=CCCCCCOCC1CCCC1 34a_100011216702_100000740388 [0,1,0,1,0,0|1,0,1]=4 25548 B14R1.40 C=CCCCCCOCC1CCCC1 7a_100000742336_100000700193 [0,1,0,1,0,0|1,0,1]=4 25549 B14R1.40 C=CCCCCCOCC1CCCC1 7a_100011216702_100000740388 [0,1,0,1,0,0|1,0,1]=4 25550 B14R1.40 C=CCCCCCOCC1CCCO1 34a_100000210270_100000700193 [0,1,0,1,0,0|0,0,2]=4 25551 B14R1.40 C=CCCCCCOCC1CCCO1 7a_100000210270_100000700193 [0,1,0,1,0,0|0,0,2]=4 25552 B14R1.40 C=CCCCCCOCC1CCCO1 7a_100011216702_100000203698 [0,1,0,1,0,0|0,0,2]=4 25553 B14R1.40 C=CCCCCCSCC1CCCC1 62a_100000700193_100000740388 [0,1,0,1,0,0|1,0,1]=4 25554 B14R1.40 C=CCCCCCSCC1CCCC1 62a_100000740388_100000700193 [0,1,0,1,0,0|1,0,1]=4 25555 B14R1.40 C=CCCCCCSCC1CCCO1 62a_100000203698_100000700193 [0,1,0,1,0,0|0,0,2]=4 25556 B14R1.40 C=CCCCCCSCC1CCCO1 62a_100000700193_100000203698 [0,1,0,1,0,0|0,0,2]=4 25557 B14R1.40 C=CCCCCNCCC1CCCC1 2230a_100000703577_100000760354 [0,1,0,1,0,0|1,0,1]=4 25558 B14R1.40 C=CCCCCNCCC1CCCC1 2230a_100000739158_100011215482 [0,1,0,1,0,0|1,0,1]=4 25559 B14R1.40 C=CCCCCNCCC1CCCC1 34a_100000703577_100000760354 [0,1,0,1,0,0|1,0,1]=4 25560 B14R1.40 C=CCCCCNCCC1CCCC1 34a_100000739158_100011215482 [0,1,0,1,0,0|1,0,1]=4 25561 B14R1.40 C=CCCCCOCCC1CCCC1 34a_100000749090_100011215482 [0,1,0,1,0,0|1,0,1]=4 25562 B14R1.40 C=CCCCCOCCC1CCCC1 34a_100000766645_100000760354 [0,1,0,1,0,0|1,0,1]=4 25563 B14R1.40 C=CCCCCOCCC1CCCC1 7a_100000749090_100011215482 [0,1,0,1,0,0|1,0,1]=4 25564 B14R1.40 C=CCCCCOCCC1CCCC1 7a_100000766645_100000760354 [0,1,0,1,0,0|1,0,1]=4 25565 B14R1.40 C=CCCCCSCCC1CCCC1 62a_100000760354_100011215482 [0,1,0,1,0,0|1,0,1]=4 25566 B14R1.40 C=CCCCCSCCC1CCCC1 62a_100011215482_100000760354 [0,1,0,1,0,0|1,0,1]=4 25567 B14R1.40 C=CCCCNCCCC1CCCC1 2230a_100000700776_100011713738 [0,1,0,1,0,0|1,0,1]=4 25568 B14R1.40 C=CCCCNCCCC1CCCC1 2230a_100000736752_100011713584 [0,1,0,1,0,0|1,0,1]=4 25569 B14R1.40 C=CCCCNCCCC1CCCC1 34a_100000700776_100011713738 [0,1,0,1,0,0|1,0,1]=4 25570 B14R1.40 C=CCCCNCCCC1CCCC1 34a_100000736752_100000757094 [0,1,0,1,0,0|1,0,1]=4 25571 B14R1.40 C=CCCCOCCCC1CCCC1 34a_100000758997_100011713738 [0,1,0,1,0,0|1,0,1]=4 25572 B14R1.40 C=CCCCOCCCC1CCCC1 34a_100011215328_100000757094 [0,1,0,1,0,0|1,0,1]=4 25573 B14R1.40 C=CCCCOCCCC1CCCC1 7a_100000758997_100011713738 [0,1,0,1,0,0|1,0,1]=4 25574 B14R1.40 C=CCCCOCCCC1CCCC1 7a_100011215328_100000757094 [0,1,0,1,0,0|1,0,1]=4 25575 B14R1.40 C=CCCCSCCCC1CCCC1 62a_100011713584_100011713738 [0,1,0,1,0,0|1,0,1]=4 25576 B14R1.40 C=CCCCSCCCC1CCCC1 62a_100011713738_100000757094 [0,1,0,1,0,0|1,0,1]=4 25577 B14R1.40 CC/C=C/CCCOCC1CCCO1 7a_100016287902_100000203698 [0,1,0,1,0,0|0,0,2]=4 25578 B14R1.40 CCCC#CCCOCC1CCCO1 7a_100000042726_100000203698 [0,1,0,1,0,0|0,0,2]=4 25579 B14R1.40 CCCC/C=C/COCC1CCCO1 7a_200016272032_100000203698 [0,1,0,1,0,0|0,0,2]=4 25580 B14R1.40 CCCCC#CCOCC1CCCO1 7a_200000034558_100000203698 [0,1,0,1,0,0|0,0,2]=4 25581 B14R1.40 CCCCCC#CCOC1CCCO1 34a_100000085407_100009816472 [0,1,0,1,0,0|0,0,2]=4 25582 B14R1.40 CCCCCCCCCN1CCCC1 2230a_100000188435_100011214924 [0,1,0,1,0,0|1,0,0]=3 25583 B14R1.40 CCCCCCCCCN1CCCC1 269982a_100000188435_100000210670 [0,1,0,1,0,0|1,0,0]=3 25584 B14R1.40 CCCCCCCCCN1CCSC1 2230a_100011215254_100011214924 [0,1,0,1,0,0|1,1,0]=4 25585 B14R1.40 CCCCCCCCCN1CCSC1 269982a_100011215254_100000210670 [0,1,0,1,0,0|1,1,0]=4 25586 B14R1.40 CCCCCCCCNC1CCCC1 2230a_100000211070_100000210759 [0,1,0,1,0,0|1,0,0]=3 25587 B14R1.40 CCCCCCCCNC1CCCC1 2230a_100000229939_100000179811 [0,1,0,1,0,0|1,0,0]=3 25588 B14R1.40 CCCCCCCCNC1CCCC1 270004a_100000229939_100000210133 [0,1,0,1,0,0|1,0,0]=3 25589 B14R1.40 CCCCCCCCNC1CCCC1 34a_100000211070_100000210759 [0,1,0,1,0,0|1,0,0]=3 25590 B14R1.40 CCCCCCCCNC1CCCC1 34a_100000229939_100000179811 [0,1,0,1,0,0|1,0,0]=3 25591 B14R1.40 CCCCCCCCNC1CCOC1 2230a_100000229939_100000731011 [0,1,0,1,0,0|1,0,0]=3 25592 B14R1.40 CCCCCCCCNC1CCOC1 270004a_100000229939_100000752484 [0,1,0,1,0,0|1,0,0]=3 25593 B14R1.40 CCCCCCCCNC1CCOC1 34a_100000229939_100000690089 [0,1,0,1,0,0|1,0,0]=3 25594 B14R1.40 CCCCCCCCNC1CCSC1 270004a_100000229939_100000212027 [0,1,0,1,0,0|1,1,0]=4 25595 B14R1.40 CCCCCCCCN[C@@H]1CCOC1 2230a_200015188469_100000210759 [0,1,0,1,0,0|1,0,0]=3 25596 B14R1.40 CCCCCCCCN[C@H]1CCOC1 2230a_100015188467_100000210759 [0,1,0,1,0,0|1,0,0]=3 25597 B14R1.40 CCCCCCCCN[C@H]1CCOC1 34a_100015188467_100000210759 [0,1,0,1,0,0|1,0,0]=3 25598 B14R1.40 CCCCCCCCOC1CCCC1 34a_100000210232_100000179811 [0,1,0,1,0,0|1,0,0]=3 25599 B14R1.40 CCCCCCCCOC1CCCC1 34a_100000210269_100000210759 [0,1,0,1,0,0|1,0,0]=3 25600 B14R1.40 CCCCCCCCOC1CCCC1 7a_100000210232_100000179811 [0,1,0,1,0,0|1,0,0]=3 25601 B14R1.40 CCCCCCCCOC1CCCC1 7a_100000210269_100000210759 [0,1,0,1,0,0|1,0,0]=3 25602 B14R1.40 CCCCCCCCOC1CCCO1 34a_100000085407_100000210759 [0,1,0,1,0,0|0,0,0]=2 25603 B14R1.40 CCCCCCCCOC1CCOC1 34a_100000210232_100000690089 [0,1,0,1,0,0|1,0,0]=3 25604 B14R1.40 CCCCCCCCOC1CCOC1 7a_100000210232_100000731011 [0,1,0,1,0,0|1,0,0]=3 25605 B14R1.40 CCCCCCCCOC1CCSC1 7a_100011232664_100000210759 [0,1,0,1,0,0|1,1,0]=4 25606 B14R1.40 CCCCCCCCO[C@H]1CCOC1 34a_100000717292_100000210759 [0,1,0,1,0,0|1,0,0]=3 25607 B14R1.40 CCCCCCCCSC1CCCC1 62a_100000210759_100000179811 [0,1,0,1,0,0|1,0,0]=3 25608 B14R1.40 CCCCCCCCSC1CCCC1 62a_100011217020_100000210317 [0,1,0,1,0,0|1,0,0]=3 25609 B14R1.40 CCCCCCCCSC1CCOC1 62a_100000210759_100000690089 [0,1,0,1,0,0|1,0,0]=3 25610 B14R1.40 CCCCCCCNCC1CCCC1 2230a_100000229938_100000740388 [0,1,0,1,0,0|1,0,0]=3 25611 B14R1.40 CCCCCCCNCC1CCCC1 2230a_100000737975_100000210681 [0,1,0,1,0,0|1,0,0]=3 25612 B14R1.40 CCCCCCCNCC1CCCC1 269862a_100000229938_100000746403 [0,1,0,1,0,0|1,0,0]=3 25613 B14R1.40 CCCCCCCNCC1CCCC1 34a_100000737975_100000210614 [0,1,0,1,0,0|1,0,0]=3 25614 B14R1.40 CCCCCCCNCC1CCCO1 2230a_100000229938_100000203698 [0,1,0,1,0,0|0,0,0]=2 25615 B14R1.40 CCCCCCCNCC1CCOC1 2230a_100000229938_100000702531 [0,1,0,1,0,0|1,0,0]=3 25616 B14R1.40 CCCCCCCNCC1CCOC1 2230a_100000737293_100000210681 [0,1,0,1,0,0|1,0,0]=3 25617 B14R1.40 CCCCCCCNCC1CCOC1 34a_100000737293_100000210614 [0,1,0,1,0,0|1,0,0]=3 25618 B14R1.40 CCCCCCCNCC1OCCO1 2230a_100000036311_100000210681 [0,1,0,1,0,0|1,0,0]=3 25619 B14R1.40 CCCCCCCNCC1OCCO1 2230a_100000229938_100000755774 [0,1,0,1,0,0|1,0,0]=3 25620 B14R1.40 CCCCCCCNCC1OCCO1 34a_100000036311_100000210614 [0,1,0,1,0,0|1,0,0]=3 25621 B14R1.40 CCCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210681 [0,1,0,1,0,0|0,0,0]=2 25622 B14R1.40 CCCCCCCNC[C@@H]1CCCO1 34a_100020590478_100000210614 [0,1,0,1,0,0|0,0,0]=2 25623 B14R1.40 CCCCCCCOCC1CCCC1 34a_100000210272_100000740388 [0,1,0,1,0,0|1,0,0]=3 25624 B14R1.40 CCCCCCCOCC1CCCC1 34a_100000742336_100000210614 [0,1,0,1,0,0|1,0,0]=3 25625 B14R1.40 CCCCCCCOCC1CCCC1 7a_100000210272_100000740388 [0,1,0,1,0,0|1,0,0]=3 25626 B14R1.40 CCCCCCCOCC1CCCC1 7a_100000742336_100000210614 [0,1,0,1,0,0|1,0,0]=3 25627 B14R1.40 CCCCCCCOCC1CCCO1 34a_100000210270_100000210614 [0,1,0,1,0,0|0,0,0]=2 25628 B14R1.40 CCCCCCCOCC1CCCO1 7a_100000210270_100000210614 [0,1,0,1,0,0|0,0,0]=2 25629 B14R1.40 CCCCCCCOCC1CCCO1 7a_100000210272_100000203698 [0,1,0,1,0,0|0,0,0]=2 25630 B14R1.40 CCCCCCCOCC1CCNC1 34a_100000748654_100000210614 [0,1,0,1,0,0|2,0,0]=4 25631 B14R1.40 CCCCCCCOCC1CCOC1 34a_100000210272_100011261433 [0,1,0,1,0,0|1,0,0]=3 25632 B14R1.40 CCCCCCCOCC1CCOC1 34a_100000740260_100000210614 [0,1,0,1,0,0|1,0,0]=3 25633 B14R1.40 CCCCCCCOCC1CCOC1 7a_100000210272_100000702531 [0,1,0,1,0,0|1,0,0]=3 25634 B14R1.40 CCCCCCCOCC1COCO1 34a_100011216627_100000210614 [0,1,0,1,0,0|1,0,0]=3 25635 B14R1.40 CCCCCCCOCC1OCCO1 34a_100000087154_100000210614 [0,1,0,1,0,0|1,0,0]=3 25636 B14R1.40 CCCCCCCOCC1OCCO1 34a_100000210272_100000755774 [0,1,0,1,0,0|1,0,0]=3 25637 B14R1.40 CCCCCCCOCC1OCCO1 7a_100000210272_100000755774 [0,1,0,1,0,0|1,0,0]=3 25638 B14R1.40 CCCCCCCOC[C@H]1CCCN1 34a_100000745186_100000210614 [0,1,0,1,0,0|1,0,0]=3 25639 B14R1.40 CCCCCCCSCC1CCCC1 62a_100000210614_100000740388 [0,1,0,1,0,0|1,0,0]=3 25640 B14R1.40 CCCCCCCSCC1CCCC1 62a_100000740388_100000210316 [0,1,0,1,0,0|1,0,0]=3 25641 B14R1.40 CCCCCCCSCC1CCCO1 62a_100000203698_100000210316 [0,1,0,1,0,0|0,0,0]=2 25642 B14R1.40 CCCCCCCSCC1CCCO1 62a_100000210614_100000203698 [0,1,0,1,0,0|0,0,0]=2 25643 B14R1.40 CCCCCCCSCC1CCOC1 62a_100000210614_100000702531 [0,1,0,1,0,0|1,0,0]=3 25644 B14R1.40 CCCCCCCSCC1CCOC1 62a_100000702531_100000210316 [0,1,0,1,0,0|1,0,0]=3 25645 B14R1.40 CCCCCCCSCC1OCCO1 62a_100000210614_100000755774 [0,1,0,1,0,0|1,0,0]=3 25646 B14R1.40 CCCCCCCSCC1OCCO1 62a_100000755774_100000210316 [0,1,0,1,0,0|1,0,0]=3 25647 B14R1.40 CCCCCCNCCC1CCCC1 2230a_100000210581_100000760354 [0,1,0,1,0,0|1,0,0]=3 25648 B14R1.40 CCCCCCNCCC1CCCC1 2230a_100000739158_100000210314 [0,1,0,1,0,0|1,0,0]=3 25649 B14R1.40 CCCCCCNCCC1CCCC1 34a_100000739158_100000210314 [0,1,0,1,0,0|1,0,0]=3 25650 B14R1.40 CCCCCCNCCC1OCCO1 2230a_100000034215_100000210314 [0,1,0,1,0,0|1,0,0]=3 25651 B14R1.40 CCCCCCNCCC1OCCO1 2230a_100000210581_100000740749 [0,1,0,1,0,0|1,0,0]=3 25652 B14R1.40 CCCCCCNCCC1OCCO1 34a_100000034215_100000210314 [0,1,0,1,0,0|1,0,0]=3 25653 B14R1.40 CCCCCCOCCC1CCCC1 34a_100000210259_100000760354 [0,1,0,1,0,0|1,0,0]=3 25654 B14R1.40 CCCCCCOCCC1CCCC1 34a_100000749090_100000210314 [0,1,0,1,0,0|1,0,0]=3 25655 B14R1.40 CCCCCCOCCC1CCCC1 7a_100000210259_100000760354 [0,1,0,1,0,0|1,0,0]=3 25656 B14R1.40 CCCCCCOCCC1CCCC1 7a_100000749090_100000210314 [0,1,0,1,0,0|1,0,0]=3 25657 B14R1.40 CCCCCCOCCC1CCNC1 34a_100016987287_100000210314 [0,1,0,1,0,0|2,0,0]=4 25658 B14R1.40 CCCCCCOCCC1CCOC1 34a_100011879284_100000210314 [0,1,0,1,0,0|1,0,0]=3 25659 B14R1.40 CCCCCCOCCC1OCCO1 34a_100000210259_100000740749 [0,1,0,1,0,0|1,0,0]=3 25660 B14R1.40 CCCCCCOCCC1OCCO1 7a_100000210259_100000740749 [0,1,0,1,0,0|1,0,0]=3 25661 B14R1.40 CCCCCCOCCN1CCCC1 7a_100000210259_100000004467 [0,1,0,1,0,0|2,0,0]=4 25662 B14R1.40 CCCCCCSCCC1CCCC1 62a_100000210314_100000760354 [0,1,0,1,0,0|1,0,0]=3 25663 B14R1.40 CCCCCCSCCC1CCCC1 62a_100000760354_100000210757 [0,1,0,1,0,0|1,0,0]=3 25664 B14R1.40 CCCCCCSCCC1OCCO1 62a_100000210314_100000740749 [0,1,0,1,0,0|1,0,0]=3 25665 B14R1.40 CCCCCCSCCN1CCCC1 62a_100000210314_100000004467 [0,1,0,1,0,0|2,0,0]=4 25666 B14R1.40 CCCCCCSCCN1CCCC1 62a_100000700749_100000210757 [0,1,0,1,0,0|2,0,0]=4 25667 B14R1.40 CCCCCNCCCC1CCCC1 2230a_100000209983_100011713738 [0,1,0,1,0,0|1,0,0]=3 25668 B14R1.40 CCCCCNCCCC1CCCC1 2230a_100000736752_100000210326 [0,1,0,1,0,0|1,0,0]=3 25669 B14R1.40 CCCCCNCCCC1CCCC1 34a_100000736752_100000718602 [0,1,0,1,0,0|1,0,0]=3 25670 B14R1.40 CCCCCNCCCC1OCCO1 2230a_100000209983_100000042513 [0,1,0,1,0,0|1,0,0]=3 25671 B14R1.40 CCCCCNCCCN1CCCC1 2230a_100000209983_100011445909 [0,1,0,1,0,0|2,0,0]=4 25672 B14R1.40 CCCCCNCCOC1CCCC1 34a_100000224656_100000179811 [0,1,0,1,0,0|2,0,0]=4 25673 B14R1.40 CCCCCNCCOC1CCCC1 34a_100000741755_100000718602 [0,1,0,1,0,0|2,0,0]=4 25674 B14R1.40 CCCCCNCCOC1CCOC1 34a_100000224656_100000690089 [0,1,0,1,0,0|2,0,0]=4 25675 B14R1.40 CCCCCOCCCC1CCCC1 34a_100000210253_100011713738 [0,1,0,1,0,0|1,0,0]=3 25676 B14R1.40 CCCCCOCCCC1CCCC1 34a_100011215328_100000718602 [0,1,0,1,0,0|1,0,0]=3 25677 B14R1.40 CCCCCOCCCC1CCCC1 7a_100000210253_100011713738 [0,1,0,1,0,0|1,0,0]=3 25678 B14R1.40 CCCCCOCCCC1CCCC1 7a_100011215328_100000210326 [0,1,0,1,0,0|1,0,0]=3 25679 B14R1.40 CCCCCOCCCC1OCCO1 34a_100000210253_100009861162 [0,1,0,1,0,0|1,0,0]=3 25680 B14R1.40 CCCCCOCCCC1OCCO1 34a_100009871617_100000718602 [0,1,0,1,0,0|1,0,0]=3 25681 B14R1.40 CCCCCOCCCC1OCCO1 7a_100000210253_100000042513 [0,1,0,1,0,0|1,0,0]=3 25682 B14R1.40 CCCCCOCCCC1OCCO1 7a_100009871617_100000210326 [0,1,0,1,0,0|1,0,0]=3 25683 B14R1.40 CCCCCOCCCN1CCCC1 34a_100000210253_100016991639 [0,1,0,1,0,0|2,0,0]=4 25684 B14R1.40 CCCCCOCCCN1CCCC1 7a_100000210253_100011445909 [0,1,0,1,0,0|2,0,0]=4 25685 B14R1.40 CCCCCOCCNC1CCCC1 34a_200000200444_100000718602 [0,1,0,1,0,0|2,0,0]=4 25686 B14R1.40 CCCCCOCCOC1CCCC1 34a_100000738311_100000718602 [0,1,0,1,0,0|2,0,0]=4 25687 B14R1.40 CCCCCOCCOC1CCCC1 34a_100011215259_100000179811 [0,1,0,1,0,0|2,0,0]=4 25688 B14R1.40 CCCCCOCCOC1CCCC1 7a_100000738311_100000210326 [0,1,0,1,0,0|2,0,0]=4 25689 B14R1.40 CCCCCOCCOC1CCCC1 7a_100011215259_100000179811 [0,1,0,1,0,0|2,0,0]=4 25690 B14R1.40 CCCCCOCCOC1CCOC1 34a_100011215259_100000690089 [0,1,0,1,0,0|2,0,0]=4 25691 B14R1.40 CCCCCOCCOC1CCOC1 7a_100011215259_100000731011 [0,1,0,1,0,0|2,0,0]=4 25692 B14R1.40 CCCCCSCCCC1CCCC1 62a_100000210326_100011713738 [0,1,0,1,0,0|1,0,0]=3 25693 B14R1.40 CCCCCSCCCC1CCCC1 62a_100011713738_100000210326 [0,1,0,1,0,0|1,0,0]=3 25694 B14R1.40 CCCCCSCCCC1OCCO1 62a_100000210326_100000042513 [0,1,0,1,0,0|1,0,0]=3 25695 B14R1.40 CCCCCSCCCN1CCCC1 62a_100000210326_100011445909 [0,1,0,1,0,0|2,0,0]=4 25696 B14R1.40 CCCCCSCCCN1CCCC1 62a_100016991639_100000210326 [0,1,0,1,0,0|2,0,0]=4 25697 B14R1.40 CCCCNCCCCC1OCCO1 2230a_100000102301_100000034956 [0,1,0,1,0,0|1,0,0]=3 25698 B14R1.40 CCCCNCCCCC1OCCO1 7a_106832991798_100000034956 [0,1,0,1,0,0|1,0,0]=3 25699 B14R1.40 CCCCNCCCOC1CCCC1 34a_100000747560_100000210210 [0,1,0,1,0,0|2,0,0]=4 25700 B14R1.40 CCCCOCCCCC1OCCO1 34a_100000210227_200009813554 [0,1,0,1,0,0|1,0,0]=3 25701 B14R1.40 CCCCOCCCCC1OCCO1 7a_100000210227_100000034956 [0,1,0,1,0,0|1,0,0]=3 25702 B14R1.40 CCCCOCCCNC1CCCC1 2230a_200000211371_100000179811 [0,1,0,1,0,0|2,0,0]=4 25703 B14R1.40 CCCCOCCCNC1CCCC1 270004a_200000211371_100000210133 [0,1,0,1,0,0|2,0,0]=4 25704 B14R1.40 CCCCOCCCNC1CCCC1 34a_200000211371_100000179811 [0,1,0,1,0,0|2,0,0]=4 25705 B14R1.40 CCCCOCCCNC1CCOC1 2230a_200000211371_100000731011 [0,1,0,1,0,0|2,0,0]=4 25706 B14R1.40 CCCCOCCCNC1CCOC1 270004a_200000211371_100000752484 [0,1,0,1,0,0|2,0,0]=4 25707 B14R1.40 CCCCOCCCNC1CCOC1 34a_200000211371_100000690089 [0,1,0,1,0,0|2,0,0]=4 25708 B14R1.40 CCCCOCCCOC1CCCC1 34a_200011215613_100000179811 [0,1,0,1,0,0|2,0,0]=4 25709 B14R1.40 CCCCOCCCOC1CCCC1 7a_200011215613_100000179811 [0,1,0,1,0,0|2,0,0]=4 25710 B14R1.40 CCCCOCCCOC1CCOC1 34a_200011215613_100000690089 [0,1,0,1,0,0|2,0,0]=4 25711 B14R1.40 CCCCOCCCOC1CCOC1 7a_200011215613_100000731011 [0,1,0,1,0,0|2,0,0]=4 25712 B14R1.40 CCCCOCCNCC1CCCC1 2230a_100000737975_100000743108 [0,1,0,1,0,0|2,0,0]=4 25713 B14R1.40 CCCCOCCNCC1CCCC1 34a_100000737975_100000743108 [0,1,0,1,0,0|2,0,0]=4 25714 B14R1.40 CCCCOCCNCC1CCOC1 2230a_100000737293_100000743108 [0,1,0,1,0,0|2,0,0]=4 25715 B14R1.40 CCCCOCCNCC1CCOC1 34a_100000737293_100000743108 [0,1,0,1,0,0|2,0,0]=4 25716 B14R1.40 CCCCOCCNCC1OCCO1 2230a_100000036311_100000743108 [0,1,0,1,0,0|2,0,0]=4 25717 B14R1.40 CCCCOCCNCC1OCCO1 34a_100000036311_100000743108 [0,1,0,1,0,0|2,0,0]=4 25718 B14R1.40 CCCCOCCNC[C@@H]1CCCO1 2230a_100020590478_100000743108 [0,1,0,1,0,0|1,0,0]=3 25719 B14R1.40 CCCCOCCNC[C@@H]1CCCO1 34a_100020590478_100000743108 [0,1,0,1,0,0|1,0,0]=3 25720 B14R1.40 CCCCOCCOCC1CCCC1 34a_100000210238_100000740388 [0,1,0,1,0,0|2,0,0]=4 25721 B14R1.40 CCCCOCCOCC1CCCC1 34a_100000742336_100000743108 [0,1,0,1,0,0|2,0,0]=4 25722 B14R1.40 CCCCOCCOCC1CCCC1 7a_100000210238_100000740388 [0,1,0,1,0,0|2,0,0]=4 25723 B14R1.40 CCCCOCCOCC1CCCC1 7a_100000742336_100000743108 [0,1,0,1,0,0|2,0,0]=4 25724 B14R1.40 CCCCOCCOCC1CCCO1 34a_100000210270_100000743108 [0,1,0,1,0,0|1,0,0]=3 25725 B14R1.40 CCCCOCCOCC1CCCO1 7a_100000210238_100000203698 [0,1,0,1,0,0|1,0,0]=3 25726 B14R1.40 CCCCOCCOCC1CCCO1 7a_100000210270_100000743108 [0,1,0,1,0,0|1,0,0]=3 25727 B14R1.40 CCCCOCCOCC1CCOC1 34a_100000210238_100011261433 [0,1,0,1,0,0|2,0,0]=4 25728 B14R1.40 CCCCOCCOCC1CCOC1 34a_100000740260_100000743108 [0,1,0,1,0,0|2,0,0]=4 25729 B14R1.40 CCCCOCCOCC1CCOC1 7a_100000210238_100000702531 [0,1,0,1,0,0|2,0,0]=4 25730 B14R1.40 CCCCOCCOCC1COCO1 34a_100011216627_100000743108 [0,1,0,1,0,0|2,0,0]=4 25731 B14R1.40 CCCCOCCOCC1OCCO1 34a_100000087154_100000743108 [0,1,0,1,0,0|2,0,0]=4 25732 B14R1.40 CCCCOCCOCC1OCCO1 34a_100000210238_100000755774 [0,1,0,1,0,0|2,0,0]=4 25733 B14R1.40 CCCCOCCOCC1OCCO1 7a_100000210238_100000755774 [0,1,0,1,0,0|2,0,0]=4 25734 B14R1.40 CCCCOCCOC[C@H]1CCCN1 34a_100000745186_100000743108 [0,1,0,1,0,0|2,0,0]=4 25735 B14R1.40 CCCCOCCSCC1CCCC1 62a_100000740388_100000743108 [0,1,0,1,0,0|2,0,0]=4 25736 B14R1.40 CCCCOCCSCC1CCCC1 62a_100000743108_100000740388 [0,1,0,1,0,0|2,0,0]=4 25737 B14R1.40 CCCCOCCSCC1CCCO1 62a_100000203698_100000743108 [0,1,0,1,0,0|1,0,0]=3 25738 B14R1.40 CCCCOCCSCC1CCCO1 62a_100000743108_100000203698 [0,1,0,1,0,0|1,0,0]=3 25739 B14R1.40 CCCCOCCSCC1CCOC1 62a_100000702531_100000743108 [0,1,0,1,0,0|2,0,0]=4 25740 B14R1.40 CCCCOCCSCC1CCOC1 62a_100000743108_100000702531 [0,1,0,1,0,0|2,0,0]=4 25741 B14R1.40 CCCCOCCSCC1OCCO1 62a_100000743108_100000755774 [0,1,0,1,0,0|2,0,0]=4 25742 B14R1.40 CCCCOCCSCC1OCCO1 62a_100000755774_100000743108 [0,1,0,1,0,0|2,0,0]=4 25743 B14R1.40 CCCCOCNCCC1CCCC1 2230a_100000739158_100011995733 [0,1,0,1,0,0|2,0,0]=4 25744 B14R1.40 CCCCOCNCCC1CCCC1 34a_100000739158_100011995733 [0,1,0,1,0,0|2,0,0]=4 25745 B14R1.40 CCCCOCNCCC1OCCO1 2230a_100000034215_100011995733 [0,1,0,1,0,0|2,0,0]=4 25746 B14R1.40 CCCCOCNCCC1OCCO1 34a_100000034215_100011995733 [0,1,0,1,0,0|2,0,0]=4 25747 B14R1.40 CCCCOCOCCC1CCCC1 34a_100000749090_100011995733 [0,1,0,1,0,0|2,0,0]=4 25748 B14R1.40 CCCCOCOCCC1CCOC1 34a_100011879284_100011995733 [0,1,0,1,0,0|2,0,0]=4 25749 B14R1.40 CCCCOCSCCC1CCCC1 62a_100000760354_100011995733 [0,1,0,1,0,0|2,0,0]=4 25750 B14R1.40 CCCCOCSCCC1CCCC1 62a_100011995733_100000760354 [0,1,0,1,0,0|2,0,0]=4 25751 B14R1.40 CCCCOCSCCC1OCCO1 62a_100011995733_100000740749 [0,1,0,1,0,0|2,0,0]=4 25752 B14R1.40 CCCCSCCCCC1OCCO1 62a_100000210211_100000034956 [0,1,0,1,0,0|1,0,0]=3 25753 B14R1.40 CCCCSCCNCC1CCCC1 2230a_100025743550_100000740388 [0,1,0,1,0,0|2,0,0]=4 25754 B14R1.40 CCCCSCCNCC1CCCC1 269862a_100025743550_100000746403 [0,1,0,1,0,0|2,0,0]=4 25755 B14R1.40 CCCCSCCNCC1CCCO1 2230a_100025743550_100000203698 [0,1,0,1,0,0|1,0,0]=3 25756 B14R1.40 CCCCSCCNCC1CCOC1 2230a_100025743550_100000702531 [0,1,0,1,0,0|2,0,0]=4 25757 B14R1.40 CCCCSCCNCC1OCCO1 2230a_100025743550_100000755774 [0,1,0,1,0,0|2,0,0]=4 25758 B14R1.40 CCCCSCCOCC1CCCC1 34a_200000230436_100000740388 [0,1,0,1,0,0|2,0,0]=4 25759 B14R1.40 CCCCSCCOCC1CCCC1 7a_200000230436_100000740388 [0,1,0,1,0,0|2,0,0]=4 25760 B14R1.40 CCCCSCCOCC1CCCO1 7a_200000230436_100000203698 [0,1,0,1,0,0|1,0,0]=3 25761 B14R1.40 CCCCSCCOCC1CCOC1 34a_200000230436_100011261433 [0,1,0,1,0,0|2,0,0]=4 25762 B14R1.40 CCCCSCCOCC1CCOC1 7a_200000230436_100000702531 [0,1,0,1,0,0|2,0,0]=4 25763 B14R1.40 CCCCSCCOCC1OCCO1 34a_200000230436_100000755774 [0,1,0,1,0,0|2,0,0]=4 25764 B14R1.40 CCCCSCCOCC1OCCO1 7a_200000230436_100000755774 [0,1,0,1,0,0|2,0,0]=4 25765 B14R1.40 CCCOCCCCOC1CCCO1 34a_100011018183_100000210303 [0,1,0,1,0,0|1,0,0]=3 25766 B14R1.40 CCCOCCCCOC1CCCO1 7a_100011018183_100000210303 [0,1,0,1,0,0|1,0,0]=3 25767 B14R1.40 CCCOCCCNCC1CCCC1 2230a_100011217757_100000740388 [0,1,0,1,0,0|2,0,0]=4 25768 B14R1.40 CCCOCCCNCC1CCCC1 269862a_100011217757_100000746403 [0,1,0,1,0,0|2,0,0]=4 25769 B14R1.40 CCCOCCCNCC1CCCC1 34a_100011217757_100000740388 [0,1,0,1,0,0|2,0,0]=4 25770 B14R1.40 CCCOCCCNCC1CCCO1 2230a_100011217757_100000203698 [0,1,0,1,0,0|1,0,0]=3 25771 B14R1.40 CCCOCCCNCC1CCOC1 2230a_100011217757_100000702531 [0,1,0,1,0,0|2,0,0]=4 25772 B14R1.40 CCCOCCCNCC1CCOC1 34a_100011217757_100011261433 [0,1,0,1,0,0|2,0,0]=4 25773 B14R1.40 CCCOCCCNCC1OCCO1 2230a_100011217757_100000755774 [0,1,0,1,0,0|2,0,0]=4 25774 B14R1.40 CCCOCCCNCC1OCCO1 34a_100011217757_100000755774 [0,1,0,1,0,0|2,0,0]=4 25775 B14R1.40 CCCOCCNCCC1CCCC1 2230a_100000739158_100011215938 [0,1,0,1,0,0|2,0,0]=4 25776 B14R1.40 CCCOCCNCCC1CCCC1 2230a_100161115042_100000760354 [0,1,0,1,0,0|2,0,0]=4 25777 B14R1.40 CCCOCCNCCC1CCCC1 34a_100000739158_100011215938 [0,1,0,1,0,0|2,0,0]=4 25778 B14R1.40 CCCOCCNCCC1CCCC1 34a_100161115042_100000760354 [0,1,0,1,0,0|2,0,0]=4 25779 B14R1.40 CCCOCCNCCC1OCCO1 2230a_100000034215_100011215938 [0,1,0,1,0,0|2,0,0]=4 25780 B14R1.40 CCCOCCNCCC1OCCO1 2230a_100161115042_100000740749 [0,1,0,1,0,0|2,0,0]=4 25781 B14R1.40 CCCOCCNCCC1OCCO1 34a_100000034215_100011215938 [0,1,0,1,0,0|2,0,0]=4 25782 B14R1.40 CCCOCCNCCC1OCCO1 34a_100161115042_100000740749 [0,1,0,1,0,0|2,0,0]=4 25783 B14R1.40 CCCOCCOCCC1CCCC1 34a_100000749090_100011215938 [0,1,0,1,0,0|2,0,0]=4 25784 B14R1.40 CCCOCCOCCC1CCCC1 34a_100000752267_100000760354 [0,1,0,1,0,0|2,0,0]=4 25785 B14R1.40 CCCOCCOCCC1CCCC1 7a_100000749090_100011215938 [0,1,0,1,0,0|2,0,0]=4 25786 B14R1.40 CCCOCCOCCC1CCCC1 7a_100000752267_100000760354 [0,1,0,1,0,0|2,0,0]=4 25787 B14R1.40 CCCOCCOCCC1CCOC1 34a_100011879284_100011215938 [0,1,0,1,0,0|2,0,0]=4 25788 B14R1.40 CCCOCCOCCC1OCCO1 34a_100000752267_100000740749 [0,1,0,1,0,0|2,0,0]=4 25789 B14R1.40 CCCOCCOCCC1OCCO1 7a_100000752267_100000740749 [0,1,0,1,0,0|2,0,0]=4 25790 B14R1.40 CCCOCCSCCC1CCCC1 62a_100000760354_100011215938 [0,1,0,1,0,0|2,0,0]=4 25791 B14R1.40 CCCOCCSCCC1CCCC1 62a_100011215938_100000760354 [0,1,0,1,0,0|2,0,0]=4 25792 B14R1.40 CCCOCCSCCC1OCCO1 62a_100011215938_100000740749 [0,1,0,1,0,0|2,0,0]=4 25793 B14R1.40 CCCSCCNCCC1CCCC1 2230a_100020603323_100000760354 [0,1,0,1,0,0|2,0,0]=4 25794 B14R1.40 CCCSCCNCCC1OCCO1 2230a_100020603323_100000740749 [0,1,0,1,0,0|2,0,0]=4 25795 B14R1.40 CCCSCCOCCC1CCCC1 34a_200000230433_100000760354 [0,1,0,1,0,0|2,0,0]=4 25796 B14R1.40 CCCSCCOCCC1CCCC1 7a_200000230433_100000760354 [0,1,0,1,0,0|2,0,0]=4 25797 B14R1.40 CCCSCCOCCC1OCCO1 34a_200000230433_100000740749 [0,1,0,1,0,0|2,0,0]=4 25798 B14R1.40 CCCSCCOCCC1OCCO1 7a_200000230433_100000740749 [0,1,0,1,0,0|2,0,0]=4 25799 B14R1.40 CCOCCCNCCC1CCCC1 2230a_100000210961_100000760354 [0,1,0,1,0,0|2,0,0]=4 25800 B14R1.40 CCOCCCNCCC1CCCC1 2230a_100000739158_100012232248 [0,1,0,1,0,0|2,0,0]=4 25801 B14R1.40 CCOCCCNCCC1CCCC1 34a_100000210961_100000760354 [0,1,0,1,0,0|2,0,0]=4 25802 B14R1.40 CCOCCCNCCC1CCCC1 34a_100000739158_100012232248 [0,1,0,1,0,0|2,0,0]=4 25803 B14R1.40 CCOCCCNCCC1OCCO1 2230a_100000034215_100012232248 [0,1,0,1,0,0|2,0,0]=4 25804 B14R1.40 CCOCCCNCCC1OCCO1 2230a_100000210961_100000740749 [0,1,0,1,0,0|2,0,0]=4 25805 B14R1.40 CCOCCCNCCC1OCCO1 34a_100000034215_100012232248 [0,1,0,1,0,0|2,0,0]=4 25806 B14R1.40 CCOCCCNCCC1OCCO1 34a_100000210961_100000740749 [0,1,0,1,0,0|2,0,0]=4 25807 B14R1.40 CCOCCCOCCC1CCCC1 34a_100000749090_100012232248 [0,1,0,1,0,0|2,0,0]=4 25808 B14R1.40 CCOCCCOCCC1CCCC1 34a_100000757476_100000760354 [0,1,0,1,0,0|2,0,0]=4 25809 B14R1.40 CCOCCCOCCC1CCCC1 7a_100000749090_100012232248 [0,1,0,1,0,0|2,0,0]=4 25810 B14R1.40 CCOCCCOCCC1CCCC1 7a_100000757476_100000760354 [0,1,0,1,0,0|2,0,0]=4 25811 B14R1.40 CCOCCCOCCC1CCOC1 34a_100011879284_100012232248 [0,1,0,1,0,0|2,0,0]=4 25812 B14R1.40 CCOCCCOCCC1OCCO1 34a_100000757476_100000740749 [0,1,0,1,0,0|2,0,0]=4 25813 B14R1.40 CCOCCCOCCC1OCCO1 7a_100000757476_100000740749 [0,1,0,1,0,0|2,0,0]=4 25814 B14R1.40 CCOCCCSCCC1CCCC1 62a_100000760354_100012232248 [0,1,0,1,0,0|2,0,0]=4 25815 B14R1.40 CCOCCCSCCC1CCCC1 62a_100012232248_100000760354 [0,1,0,1,0,0|2,0,0]=4 25816 B14R1.40 CCOCCCSCCC1OCCO1 62a_100012232248_100000740749 [0,1,0,1,0,0|2,0,0]=4 25817 B14R1.40 CCOCCNCCCC1CCCC1 2230a_100000736752_100011215890 [0,1,0,1,0,0|2,0,0]=4 25818 B14R1.40 CCOCCNCCCC1CCCC1 2230a_102516460346_100011713738 [0,1,0,1,0,0|2,0,0]=4 25819 B14R1.40 CCOCCNCCCC1CCCC1 34a_100000736752_100000210147 [0,1,0,1,0,0|2,0,0]=4 25820 B14R1.40 CCOCCNCCCC1CCCC1 34a_102516460346_100011713738 [0,1,0,1,0,0|2,0,0]=4 25821 B14R1.40 CCOCCNCCCC1OCCO1 2230a_102516460346_100000042513 [0,1,0,1,0,0|2,0,0]=4 25822 B14R1.40 CCOCCNCCCC1OCCO1 34a_102516460346_100009861162 [0,1,0,1,0,0|2,0,0]=4 25823 B14R1.40 CCOCCOCCCC1CCCC1 34a_100000210136_100011713738 [0,1,0,1,0,0|2,0,0]=4 25824 B14R1.40 CCOCCOCCCC1CCCC1 34a_100011215328_100000210147 [0,1,0,1,0,0|2,0,0]=4 25825 B14R1.40 CCOCCOCCCC1CCCC1 7a_100000210136_100011713738 [0,1,0,1,0,0|2,0,0]=4 25826 B14R1.40 CCOCCOCCCC1CCCC1 7a_100011215328_100011215890 [0,1,0,1,0,0|2,0,0]=4 25827 B14R1.40 CCOCCOCCCC1OCCO1 34a_100000210136_100009861162 [0,1,0,1,0,0|2,0,0]=4 25828 B14R1.40 CCOCCOCCCC1OCCO1 34a_100009871617_100000210147 [0,1,0,1,0,0|2,0,0]=4 25829 B14R1.40 CCOCCOCCCC1OCCO1 7a_100000210136_100000042513 [0,1,0,1,0,0|2,0,0]=4 25830 B14R1.40 CCOCCOCCCC1OCCO1 7a_100009871617_100011215890 [0,1,0,1,0,0|2,0,0]=4 25831 B14R1.40 CCOCCOCCOC1CCCO1 34a_100000085407_100011211534 [0,1,0,1,0,0|2,0,0]=4 25832 B14R1.40 CCOCCSCCCC1CCCC1 62a_100000210147_100011713738 [0,1,0,1,0,0|2,0,0]=4 25833 B14R1.40 CCOCCSCCCC1CCCC1 62a_100011713738_100011215890 [0,1,0,1,0,0|2,0,0]=4 25834 B14R1.40 CCOCCSCCCC1OCCO1 62a_100000210147_100000042513 [0,1,0,1,0,0|2,0,0]=4 25835 B14R1.40 CCOCSCCCCC1OCCO1 62a_100000739092_100000034956 [0,1,0,1,0,0|2,0,0]=4 25836 B14R1.40 CCSCCCOCCC1CCCC1 34a_100011216438_100000760354 [0,1,0,1,0,0|2,0,0]=4 25837 B14R1.40 CCSCCCOCCC1CCCC1 7a_100011216438_100000760354 [0,1,0,1,0,0|2,0,0]=4 25838 B14R1.40 CCSCCCOCCC1OCCO1 34a_100011216438_100000740749 [0,1,0,1,0,0|2,0,0]=4 25839 B14R1.40 CCSCCCOCCC1OCCO1 7a_100011216438_100000740749 [0,1,0,1,0,0|2,0,0]=4 25840 B14R1.40 CCSCCNCCCC1CCCC1 2230a_100000106463_100011713738 [0,1,0,1,0,0|2,0,0]=4 25841 B14R1.40 CCSCCNCCCC1CCCC1 2230a_100000736752_100000757381 [0,1,0,1,0,0|2,0,0]=4 25842 B14R1.40 CCSCCNCCCC1CCCC1 34a_100000736752_100000757381 [0,1,0,1,0,0|2,0,0]=4 25843 B14R1.40 CCSCCNCCCC1OCCO1 2230a_100000106463_100000042513 [0,1,0,1,0,0|2,0,0]=4 25844 B14R1.40 CCSCCOCCCC1CCCC1 34a_100000212035_100011713738 [0,1,0,1,0,0|2,0,0]=4 25845 B14R1.40 CCSCCOCCCC1CCCC1 34a_100011215328_100000757381 [0,1,0,1,0,0|2,0,0]=4 25846 B14R1.40 CCSCCOCCCC1CCCC1 7a_100000212035_100011713738 [0,1,0,1,0,0|2,0,0]=4 25847 B14R1.40 CCSCCOCCCC1CCCC1 7a_100011215328_100000757381 [0,1,0,1,0,0|2,0,0]=4 25848 B14R1.40 CCSCCOCCCC1OCCO1 34a_100000212035_100009861162 [0,1,0,1,0,0|2,0,0]=4 25849 B14R1.40 CCSCCOCCCC1OCCO1 34a_100009871617_100000757381 [0,1,0,1,0,0|2,0,0]=4 25850 B14R1.40 CCSCCOCCCC1OCCO1 7a_100000212035_100000042513 [0,1,0,1,0,0|2,0,0]=4 25851 B14R1.40 CCSCCOCCCC1OCCO1 7a_100009871617_100000757381 [0,1,0,1,0,0|2,0,0]=4 25852 B14R1.40 CCSCCSCCCC1CCCC1 62a_100000757381_100011713738 [0,1,0,1,0,0|2,0,0]=4 25853 B14R1.40 CCSCCSCCCC1CCCC1 62a_100011713738_100000757381 [0,1,0,1,0,0|2,0,0]=4 25854 B14R1.40 CCSCCSCCCC1OCCO1 62a_100000757381_100000042513 [0,1,0,1,0,0|2,0,0]=4 25855 B14R1.40 CNCCCCCOCC1CCCC1 34a_100000722520_100000740388 [0,1,0,1,0,0|2,0,0]=4 25856 B14R1.40 CNCCCCCOCC1CCOC1 34a_100000722520_100011261433 [0,1,0,1,0,0|2,0,0]=4 25857 B14R1.40 CNCCCCCOCC1OCCO1 34a_100000722520_100000755774 [0,1,0,1,0,0|2,0,0]=4 25858 B14R1.40 CNCCCOCCCC1CCCC1 34a_100000213112_100011713738 [0,1,0,1,0,0|2,0,0]=4 25859 B14R1.40 CNCCCOCCCC1OCCO1 34a_100000213112_100009861162 [0,1,0,1,0,0|2,0,0]=4 25860 B14R1.40 COCCCCCCNC1CCCC1 2230a_100000211070_100011998445 [0,1,0,1,0,0|1,0,0]=3 25861 B14R1.40 COCCCCCCNC1CCCC1 34a_100000211070_100011998445 [0,1,0,1,0,0|1,0,0]=3 25862 B14R1.40 COCCCCCCN[C@@H]1CCOC1 2230a_200015188469_100011998445 [0,1,0,1,0,0|2,0,0]=4 25863 B14R1.40 COCCCCCCN[C@H]1CCOC1 2230a_100015188467_100011998445 [0,1,0,1,0,0|2,0,0]=4 25864 B14R1.40 COCCCCCCN[C@H]1CCOC1 34a_100015188467_100011998445 [0,1,0,1,0,0|2,0,0]=4 25865 B14R1.40 COCCCCCCOC1CCCC1 34a_100000210269_100011998445 [0,1,0,1,0,0|1,0,0]=3 25866 B14R1.40 COCCCCCCOC1CCCC1 34a_200012092642_100000179811 [0,1,0,1,0,0|1,0,0]=3 25867 B14R1.40 COCCCCCCOC1CCCC1 7a_100000210269_100011998445 [0,1,0,1,0,0|1,0,0]=3 25868 B14R1.40 COCCCCCCOC1CCCC1 7a_200012092642_100000179811 [0,1,0,1,0,0|1,0,0]=3 25869 B14R1.40 COCCCCCCOC1CCCO1 34a_100000085407_100011998445 [0,1,0,1,0,0|1,0,0]=3 25870 B14R1.40 COCCCCCCOC1CCOC1 34a_200012092642_100000690089 [0,1,0,1,0,0|2,0,0]=4 25871 B14R1.40 COCCCCCCOC1CCOC1 7a_200012092642_100000731011 [0,1,0,1,0,0|2,0,0]=4 25872 B14R1.40 COCCCCCCOC1CCSC1 7a_100011232664_100011998445 [0,1,0,1,0,0|2,0,0]=4 25873 B14R1.40 COCCCCCCO[C@H]1CCOC1 34a_100000717292_100011998445 [0,1,0,1,0,0|2,0,0]=4 25874 B14R1.40 COCCCCCCSC1CCCC1 62a_100011217020_100011998445 [0,1,0,1,0,0|1,0,0]=3 25875 B14R1.40 COCCCCCCSC1CCCC1 62a_100011998445_100000179811 [0,1,0,1,0,0|1,0,0]=3 25876 B14R1.40 COCCCCCCSC1CCOC1 62a_100011998445_100000690089 [0,1,0,1,0,0|2,0,0]=4 25877 B14R1.40 COCCCCCNCC1CCCC1 2230a_100000747528_100000740388 [0,1,0,1,0,0|1,0,0]=3 25878 B14R1.40 COCCCCCNCC1CCCC1 269862a_100000747528_100000746403 [0,1,0,1,0,0|1,0,0]=3 25879 B14R1.40 COCCCCCNCC1CCCC1 34a_100000747528_100000740388 [0,1,0,1,0,0|1,0,0]=3 25880 B14R1.40 COCCCCCNCC1CCCO1 2230a_100000747528_100000203698 [0,1,0,1,0,0|1,0,0]=3 25881 B14R1.40 COCCCCCNCC1CCOC1 2230a_100000747528_100000702531 [0,1,0,1,0,0|2,0,0]=4 25882 B14R1.40 COCCCCCNCC1CCOC1 34a_100000747528_100011261433 [0,1,0,1,0,0|2,0,0]=4 25883 B14R1.40 COCCCCCNCC1OCCO1 2230a_100000747528_100000755774 [0,1,0,1,0,0|2,0,0]=4 25884 B14R1.40 COCCCCCNCC1OCCO1 34a_100000747528_100000755774 [0,1,0,1,0,0|2,0,0]=4 25885 B14R1.40 COCCCCNCCC1CCCC1 2230a_100000739158_100000730899 [0,1,0,1,0,0|1,0,0]=3 25886 B14R1.40 COCCCCNCCC1CCCC1 34a_100000739158_100000755781 [0,1,0,1,0,0|1,0,0]=3 25887 B14R1.40 COCCCCNCCC1OCCO1 2230a_100000034215_100000730899 [0,1,0,1,0,0|2,0,0]=4 25888 B14R1.40 COCCCCNCCC1OCCO1 34a_100000034215_100000755781 [0,1,0,1,0,0|2,0,0]=4 25889 B14R1.40 COCCCCOCCC1CCCC1 34a_100000740925_100000760354 [0,1,0,1,0,0|1,0,0]=3 25890 B14R1.40 COCCCCOCCC1CCCC1 34a_100000749090_100000755781 [0,1,0,1,0,0|1,0,0]=3 25891 B14R1.40 COCCCCOCCC1CCCC1 7a_100000749090_100000730899 [0,1,0,1,0,0|1,0,0]=3 25892 B14R1.40 COCCCCOCCC1CCNC1 34a_100016987287_100000755781 [0,1,0,1,0,0|2,0,0]=4 25893 B14R1.40 COCCCCOCCC1CCOC1 34a_100011879284_100000755781 [0,1,0,1,0,0|2,0,0]=4 25894 B14R1.40 COCCCCOCCC1OCCO1 34a_100000740925_100000740749 [0,1,0,1,0,0|2,0,0]=4 25895 B14R1.40 COCCCCSCCC1CCCC1 62a_100000730899_100000760354 [0,1,0,1,0,0|1,0,0]=3 25896 B14R1.40 COCCCCSCCC1CCCC1 62a_100000760354_100000730899 [0,1,0,1,0,0|1,0,0]=3 25897 B14R1.40 COCCCCSCCC1OCCO1 62a_100000730899_100000740749 [0,1,0,1,0,0|2,0,0]=4 25898 B14R1.40 COCCCCSCCN1CCCC1 62a_100000700749_100000730899 [0,1,0,1,0,0|2,0,0]=4 25899 B14R1.40 COCCCCSCCN1CCCC1 62a_100000730899_100000004467 [0,1,0,1,0,0|2,0,0]=4 25900 B14R1.40 COCCCNCCCC1CCCC1 2230a_100000736752_100000740836 [0,1,0,1,0,0|1,0,0]=3 25901 B14R1.40 COCCCNCCCC1CCCC1 34a_100000736752_100000740836 [0,1,0,1,0,0|1,0,0]=3 25902 B14R1.40 COCCCNCCCC1CCCC1 34a_100150723488_100011713738 [0,1,0,1,0,0|1,0,0]=3 25903 B14R1.40 COCCCNCCCC1OCCO1 34a_100150723488_100009861162 [0,1,0,1,0,0|2,0,0]=4 25904 B14R1.40 COCCCNCCCN1CCCC1 34a_100150723488_100016991639 [0,1,0,1,0,0|2,0,0]=4 25905 B14R1.40 COCCCNCCOC1CCCC1 34a_100000741755_100000740836 [0,1,0,1,0,0|2,0,0]=4 25906 B14R1.40 COCCCOCCCC1CCCC1 34a_100000740835_100011713738 [0,1,0,1,0,0|1,0,0]=3 25907 B14R1.40 COCCCOCCCC1CCCC1 34a_100011215328_100000740836 [0,1,0,1,0,0|1,0,0]=3 25908 B14R1.40 COCCCOCCCC1CCCC1 7a_100011215328_100000740836 [0,1,0,1,0,0|1,0,0]=3 25909 B14R1.40 COCCCOCCCC1OCCO1 34a_100000740835_100009861162 [0,1,0,1,0,0|2,0,0]=4 25910 B14R1.40 COCCCOCCCC1OCCO1 34a_100009871617_100000740836 [0,1,0,1,0,0|2,0,0]=4 25911 B14R1.40 COCCCOCCCC1OCCO1 7a_100009871617_100000740836 [0,1,0,1,0,0|2,0,0]=4 25912 B14R1.40 COCCCOCCCN1CCCC1 34a_100000740835_100016991639 [0,1,0,1,0,0|2,0,0]=4 25913 B14R1.40 COCCCOCCNC1CCCC1 34a_200000200444_100000740836 [0,1,0,1,0,0|2,0,0]=4 25914 B14R1.40 COCCCOCCOC1CCCC1 34a_100000738311_100000740836 [0,1,0,1,0,0|2,0,0]=4 25915 B14R1.40 COCCCOCCOC1CCCC1 7a_100000738311_100000740836 [0,1,0,1,0,0|2,0,0]=4 25916 B14R1.40 COCCCSCCCC1CCCC1 62a_100000709357_100011713738 [0,1,0,1,0,0|1,0,0]=3 25917 B14R1.40 COCCCSCCCC1CCCC1 62a_100011713738_100000709357 [0,1,0,1,0,0|1,0,0]=3 25918 B14R1.40 COCCCSCCCC1OCCO1 62a_100000709357_100000042513 [0,1,0,1,0,0|2,0,0]=4 25919 B14R1.40 COCCCSCCCN1CCCC1 62a_100000709357_100011445909 [0,1,0,1,0,0|2,0,0]=4 25920 B14R1.40 COCCCSCCCN1CCCC1 62a_100016991639_100000709357 [0,1,0,1,0,0|2,0,0]=4 25921 B14R1.40 COCCNCCCCC1OCCO1 2230a_100000209980_100000034956 [0,1,0,1,0,0|2,0,0]=4 25922 B14R1.40 COCCNCCCOC1CCCC1 34a_100000747560_100011201679 [0,1,0,1,0,0|2,0,0]=4 25923 B14R1.40 COCCOCCCCC1OCCO1 34a_100000210237_200009813554 [0,1,0,1,0,0|2,0,0]=4 25924 B14R1.40 COCCOCCCNC1CCCC1 2230a_100000206027_100000179811 [0,1,0,1,0,0|2,0,0]=4 25925 B14R1.40 COCCOCCCNC1CCCC1 2230a_100000211070_100011216529 [0,1,0,1,0,0|2,0,0]=4 25926 B14R1.40 COCCOCCCNC1CCCC1 270004a_100000206027_100000210133 [0,1,0,1,0,0|2,0,0]=4 25927 B14R1.40 COCCOCCCNC1CCCC1 34a_100000206027_100000179811 [0,1,0,1,0,0|2,0,0]=4 25928 B14R1.40 COCCOCCCNC1CCCC1 34a_100000211070_100011216529 [0,1,0,1,0,0|2,0,0]=4 25929 B14R1.40 COCCOCCCOC1CCCC1 34a_100000210269_100011216529 [0,1,0,1,0,0|2,0,0]=4 25930 B14R1.40 COCCOCCCOC1CCCC1 7a_100000210269_100011216529 [0,1,0,1,0,0|2,0,0]=4 25931 B14R1.40 COCCOCCCOC1CCCO1 34a_100000085407_100011216529 [0,1,0,1,0,0|2,0,0]=4 25932 B14R1.40 COCCOCCCSC1CCCC1 62a_100011216529_100000179811 [0,1,0,1,0,0|2,0,0]=4 25933 B14R1.40 COCCOCCCSC1CCCC1 62a_100011217020_100011216529 [0,1,0,1,0,0|2,0,0]=4 25934 B14R1.40 COCCOCCNCC1CCCC1 2230a_100000737975_100000695917 [0,1,0,1,0,0|2,0,0]=4 25935 B14R1.40 COCCOCCNCC1CCCC1 2230a_100000745349_100000740388 [0,1,0,1,0,0|2,0,0]=4 25936 B14R1.40 COCCOCCNCC1CCCC1 269862a_100000745349_100000746403 [0,1,0,1,0,0|2,0,0]=4 25937 B14R1.40 COCCOCCNCC1CCCC1 34a_100000737975_100000695917 [0,1,0,1,0,0|2,0,0]=4 25938 B14R1.40 COCCOCCNCC1CCCC1 34a_100000745349_100000740388 [0,1,0,1,0,0|2,0,0]=4 25939 B14R1.40 COCCOCCNCC1CCCO1 2230a_100000745349_100000203698 [0,1,0,1,0,0|2,0,0]=4 25940 B14R1.40 COCCOCCNC[C@@H]1CCCO1 2230a_100020590478_100000695917 [0,1,0,1,0,0|2,0,0]=4 25941 B14R1.40 COCCOCCNC[C@@H]1CCCO1 34a_100020590478_100000695917 [0,1,0,1,0,0|2,0,0]=4 25942 B14R1.40 COCCOCCOCC1CCCC1 34a_100000742336_100000695917 [0,1,0,1,0,0|2,0,0]=4 25943 B14R1.40 COCCOCCOCC1CCCC1 34a_100011215163_100000740388 [0,1,0,1,0,0|2,0,0]=4 25944 B14R1.40 COCCOCCOCC1CCCC1 7a_100000742336_100000695917 [0,1,0,1,0,0|2,0,0]=4 25945 B14R1.40 COCCOCCOCC1CCCC1 7a_100011215163_100000740388 [0,1,0,1,0,0|2,0,0]=4 25946 B14R1.40 COCCOCCOCC1CCCO1 34a_100000210270_100000695917 [0,1,0,1,0,0|2,0,0]=4 25947 B14R1.40 COCCOCCOCC1CCCO1 34a_200000723522_200000210301 [0,1,0,1,0,0|2,0,0]=4 25948 B14R1.40 COCCOCCOCC1CCCO1 7a_100000210270_100000695917 [0,1,0,1,0,0|2,0,0]=4 25949 B14R1.40 COCCOCCOCC1CCCO1 7a_100011215163_100000203698 [0,1,0,1,0,0|2,0,0]=4 25950 B14R1.40 COCCOCCOCC1CCCO1 7a_200000723522_200000210301 [0,1,0,1,0,0|2,0,0]=4 25951 B14R1.40 COCCOCCSCC1CCCC1 62a_100000695917_100000740388 [0,1,0,1,0,0|2,0,0]=4 25952 B14R1.40 COCCOCCSCC1CCCC1 62a_100000740388_100000695917 [0,1,0,1,0,0|2,0,0]=4 25953 B14R1.40 COCCOCCSCC1CCCO1 62a_100000203698_100000695917 [0,1,0,1,0,0|2,0,0]=4 25954 B14R1.40 COCCOCCSCC1CCCO1 62a_100000695917_100000203698 [0,1,0,1,0,0|2,0,0]=4 25955 B14R1.40 COCCOCNCCC1CCCC1 2230a_100000739158_100000231047 [0,1,0,1,0,0|2,0,0]=4 25956 B14R1.40 COCCOCSCCC1CCCC1 62a_100000231047_100000760354 [0,1,0,1,0,0|2,0,0]=4 25957 B14R1.40 COCCOCSCCC1CCCC1 62a_100000760354_100000231047 [0,1,0,1,0,0|2,0,0]=4 25958 B14R1.40 COCCSCCCCC1OCCO1 62a_100000233755_100000034956 [0,1,0,1,0,0|2,0,0]=4 25959 B14R1.40 CSCCCCOCCC1CCCC1 34a_100011217163_100000760354 [0,1,0,1,0,0|1,1,0]=4 25960 B14R1.40 CSCCCCOCCC1CCCC1 7a_100011217163_100000760354 [0,1,0,1,0,0|1,1,0]=4 25961 B14R1.40 CSCCCCOCCC1OCCO1 34a_100011217163_100000740749 [0,1,0,1,0,0|2,0,0]=4 25962 B14R1.40 CSCCCCOCCC1OCCO1 7a_100011217163_100000740749 [0,1,0,1,0,0|2,0,0]=4 25963 B14R1.40 CSCCCNCCCC1CCCC1 2230a_100000749238_100011713738 [0,1,0,1,0,0|1,1,0]=4 25964 B14R1.40 CSCCCNCCCC1OCCO1 2230a_100000749238_100000042513 [0,1,0,1,0,0|2,0,0]=4 25965 B14R1.40 CSCCCOCCCC1CCCC1 34a_100000690336_100011713738 [0,1,0,1,0,0|1,1,0]=4 25966 B14R1.40 CSCCCOCCCC1CCCC1 7a_100000690336_100011713738 [0,1,0,1,0,0|1,1,0]=4 25967 B14R1.40 CSCCCOCCCC1OCCO1 34a_100000690336_100009861162 [0,1,0,1,0,0|2,0,0]=4 25968 B14R1.40 CSCCCOCCCC1OCCO1 7a_100000690336_100000042513 [0,1,0,1,0,0|2,0,0]=4 25969 B14R1.40 CSCCNCCCCC1OCCO1 2230a_100020590264_100000034956 [0,1,0,1,0,0|2,0,0]=4 25970 B14R1.40 CSCCOCCCCC1OCCO1 34a_100000230434_200009813554 [0,1,0,1,0,0|2,0,0]=4 25971 B14R1.40 CSCCOCCCCC1OCCO1 7a_100000230434_100000034956 [0,1,0,1,0,0|2,0,0]=4 25972 B14R1.40 CSCCSCCCCC1OCCO1 62a_100000212216_100000034956 [0,1,0,1,0,0|2,0,0]=4 25973 B14R1.40 CSCOCCCCOC1CCCO1 34a_100011018183_100011218213 [0,1,0,1,0,0|2,0,0]=4 25974 B14R1.40 ClCCCCCCOCC1CCCC1 34a_100000766143_100000740388 [0,1,0,1,0,0|1,0,0]=3 25975 B14R1.40 ClCCCCCCOCC1CCCC1 7a_100000766143_100000740388 [0,1,0,1,0,0|1,0,0]=3 25976 B14R1.40 ClCCCCCCOCC1CCCO1 7a_100000766143_100000203698 [0,1,0,1,0,0|1,0,0]=3 25977 B14R1.40 ClCCCCCCOCC1CCOC1 34a_100000766143_100011261433 [0,1,0,1,0,0|2,0,0]=4 25978 B14R1.40 ClCCCCCCOCC1CCOC1 7a_100000766143_100000702531 [0,1,0,1,0,0|2,0,0]=4 25979 B14R1.40 ClCCCCCCOCC1OCCO1 34a_100000766143_100000755774 [0,1,0,1,0,0|2,0,0]=4 25980 B14R1.40 ClCCCCCCOCC1OCCO1 7a_100000766143_100000755774 [0,1,0,1,0,0|2,0,0]=4 25981 B14R1.40 ClCCCCCOCCC1CCCC1 34a_100000746330_100000760354 [0,1,0,1,0,0|1,0,0]=3 25982 B14R1.40 ClCCCCCOCCC1CCCC1 7a_100000746330_100000760354 [0,1,0,1,0,0|1,0,0]=3 25983 B14R1.40 ClCCCCCOCCC1OCCO1 34a_100000746330_100000740749 [0,1,0,1,0,0|2,0,0]=4 25984 B14R1.40 ClCCCCCOCCC1OCCO1 7a_100000746330_100000740749 [0,1,0,1,0,0|2,0,0]=4 25985 B14R1.40 ClCCCCCOCCN1CCCC1 7a_100000746330_100000004467 [0,1,0,1,0,0|2,0,0]=4 25986 B14R1.40 ClCCCCOCCCC1CCCC1 34a_100000210776_100011713738 [0,1,0,1,0,0|1,0,0]=3 25987 B14R1.40 ClCCCCOCCCC1CCCC1 7a_100000210776_100011713738 [0,1,0,1,0,0|1,0,0]=3 25988 B14R1.40 ClCCCCOCCCC1OCCO1 34a_100000210776_100009861162 [0,1,0,1,0,0|2,0,0]=4 25989 B14R1.40 ClCCCCOCCCC1OCCO1 7a_100000210776_100000042513 [0,1,0,1,0,0|2,0,0]=4 25990 B14R1.40 ClCCCCOCCCN1CCCC1 34a_100000210776_100016991639 [0,1,0,1,0,0|2,0,0]=4 25991 B14R1.40 ClCCCCOCCCN1CCCC1 7a_100000210776_100011445909 [0,1,0,1,0,0|2,0,0]=4 25992 B14R1.40 ClCCCOCCCCC1OCCO1 34a_100000230001_200009813554 [0,1,0,1,0,0|2,0,0]=4 25993 B14R1.40 ClCCOCCOCCC1CCCC1 34a_100011215305_100000760354 [0,1,0,1,0,0|2,0,0]=4 25994 B14R1.40 ClCCOCCOCCC1CCCC1 7a_100011215305_100000760354 [0,1,0,1,0,0|2,0,0]=4 25995 B14R1.40 FCCCCCCNCC1CCCC1 2230a_100000737975_100015922095 [0,1,0,1,0,0|1,0,0]=3 25996 B14R1.40 FCCCCCCNCC1CCCC1 34a_100000737975_100015922095 [0,1,0,1,0,0|1,0,0]=3 25997 B14R1.40 FCCCCCCNCC1CCOC1 2230a_100000737293_100015922095 [0,1,0,1,0,0|2,0,0]=4 25998 B14R1.40 FCCCCCCNCC1CCOC1 34a_100000737293_100015922095 [0,1,0,1,0,0|2,0,0]=4 25999 B14R1.40 FCCCCCCNCC1OCCO1 2230a_100000036311_100015922095 [0,1,0,1,0,0|2,0,0]=4 26000 B14R1.40 FCCCCCCNCC1OCCO1 34a_100000036311_100015922095 [0,1,0,1,0,0|2,0,0]=4 26001 B14R1.40 FCCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100015922095 [0,1,0,1,0,0|1,0,0]=3 26002 B14R1.40 FCCCCCCNC[C@@H]1CCCO1 34a_100020590478_100015922095 [0,1,0,1,0,0|1,0,0]=3 26003 B14R1.40 FCCCCCCOCC1CCCC1 34a_100000732779_100000740388 [0,1,0,1,0,0|1,0,0]=3 26004 B14R1.40 FCCCCCCOCC1CCCC1 34a_100000742336_100015922095 [0,1,0,1,0,0|1,0,0]=3 26005 B14R1.40 FCCCCCCOCC1CCCC1 7a_100000732779_100000740388 [0,1,0,1,0,0|1,0,0]=3 26006 B14R1.40 FCCCCCCOCC1CCCC1 7a_100000742336_100015922095 [0,1,0,1,0,0|1,0,0]=3 26007 B14R1.40 FCCCCCCOCC1CCCO1 34a_100000210270_100015922095 [0,1,0,1,0,0|1,0,0]=3 26008 B14R1.40 FCCCCCCOCC1CCCO1 7a_100000210270_100015922095 [0,1,0,1,0,0|1,0,0]=3 26009 B14R1.40 FCCCCCCOCC1CCCO1 7a_100000732779_100000203698 [0,1,0,1,0,0|1,0,0]=3 26010 B14R1.40 FCCCCCCOCC1CCNC1 34a_100000748654_100015922095 [0,1,0,1,0,0|2,0,0]=4 26011 B14R1.40 FCCCCCCOCC1CCOC1 34a_100000732779_100011261433 [0,1,0,1,0,0|2,0,0]=4 26012 B14R1.40 FCCCCCCOCC1CCOC1 34a_100000740260_100015922095 [0,1,0,1,0,0|2,0,0]=4 26013 B14R1.40 FCCCCCCOCC1CCOC1 7a_100000732779_100000702531 [0,1,0,1,0,0|2,0,0]=4 26014 B14R1.40 FCCCCCCOCC1COCO1 34a_100011216627_100015922095 [0,1,0,1,0,0|2,0,0]=4 26015 B14R1.40 FCCCCCCOCC1OCCO1 34a_100000087154_100015922095 [0,1,0,1,0,0|2,0,0]=4 26016 B14R1.40 FCCCCCCOCC1OCCO1 34a_100000732779_100000755774 [0,1,0,1,0,0|2,0,0]=4 26017 B14R1.40 FCCCCCCOCC1OCCO1 7a_100000732779_100000755774 [0,1,0,1,0,0|2,0,0]=4 26018 B14R1.40 FCCCCCCOC[C@H]1CCCN1 34a_100000745186_100015922095 [0,1,0,1,0,0|2,0,0]=4 26019 B14R1.40 FCCCCCCSCC1CCCC1 62a_100000740388_100015922095 [0,1,0,1,0,0|1,0,0]=3 26020 B14R1.40 FCCCCCCSCC1CCCC1 62a_100015922095_100000740388 [0,1,0,1,0,0|1,0,0]=3 26021 B14R1.40 FCCCCCCSCC1CCCO1 62a_100000203698_100015922095 [0,1,0,1,0,0|1,0,0]=3 26022 B14R1.40 FCCCCCCSCC1CCCO1 62a_100015922095_100000203698 [0,1,0,1,0,0|1,0,0]=3 26023 B14R1.40 FCCCCCCSCC1CCOC1 62a_100000702531_100015922095 [0,1,0,1,0,0|2,0,0]=4 26024 B14R1.40 FCCCCCCSCC1CCOC1 62a_100015922095_100000702531 [0,1,0,1,0,0|2,0,0]=4 26025 B14R1.40 FCCCCCCSCC1OCCO1 62a_100000755774_100015922095 [0,1,0,1,0,0|2,0,0]=4 26026 B14R1.40 FCCCCCCSCC1OCCO1 62a_100015922095_100000755774 [0,1,0,1,0,0|2,0,0]=4 26027 B14R1.40 FCCCCCNCCC1CCCC1 2230a_100000739158_100000729378 [0,1,0,1,0,0|1,0,0]=3 26028 B14R1.40 FCCCCCNCCC1CCCC1 34a_100000739158_100000729378 [0,1,0,1,0,0|1,0,0]=3 26029 B14R1.40 FCCCCCNCCC1OCCO1 2230a_100000034215_100000729378 [0,1,0,1,0,0|2,0,0]=4 26030 B14R1.40 FCCCCCNCCC1OCCO1 34a_100000034215_100000729378 [0,1,0,1,0,0|2,0,0]=4 26031 B14R1.40 FCCCCCOCCC1CCCC1 34a_100000749090_100000729378 [0,1,0,1,0,0|1,0,0]=3 26032 B14R1.40 FCCCCCOCCC1CCCC1 7a_100000749090_100000729378 [0,1,0,1,0,0|1,0,0]=3 26033 B14R1.40 FCCCCCOCCC1CCNC1 34a_100016987287_100000729378 [0,1,0,1,0,0|2,0,0]=4 26034 B14R1.40 FCCCCCOCCC1CCOC1 34a_100011879284_100000729378 [0,1,0,1,0,0|2,0,0]=4 26035 B14R1.40 FCCCCCSCCC1CCCC1 62a_100000729378_100000760354 [0,1,0,1,0,0|1,0,0]=3 26036 B14R1.40 FCCCCCSCCC1CCCC1 62a_100000760354_100000729378 [0,1,0,1,0,0|1,0,0]=3 26037 B14R1.40 FCCCCCSCCC1OCCO1 62a_100000729378_100000740749 [0,1,0,1,0,0|2,0,0]=4 26038 B14R1.40 FCCCCCSCCN1CCCC1 62a_100000700749_100000729378 [0,1,0,1,0,0|2,0,0]=4 26039 B14R1.40 FCCCCCSCCN1CCCC1 62a_100000729378_100000004467 [0,1,0,1,0,0|2,0,0]=4 26040 B14R1.40 FCCCCNCCCC1CCCC1 2230a_100000736752_100000729493 [0,1,0,1,0,0|1,0,0]=3 26041 B14R1.40 FCCCCNCCCC1CCCC1 34a_100000736752_100000729493 [0,1,0,1,0,0|1,0,0]=3 26042 B14R1.40 FCCCCNCCOC1CCCC1 34a_100000741755_100000729493 [0,1,0,1,0,0|2,0,0]=4 26043 B14R1.40 FCCCCOCCCC1CCCC1 34a_100011215328_100000729493 [0,1,0,1,0,0|1,0,0]=3 26044 B14R1.40 FCCCCOCCCC1CCCC1 34a_100011995726_100011713738 [0,1,0,1,0,0|1,0,0]=3 26045 B14R1.40 FCCCCOCCCC1CCCC1 7a_100011215328_100000729493 [0,1,0,1,0,0|1,0,0]=3 26046 B14R1.40 FCCCCOCCCC1CCCC1 7a_100011995726_100011713738 [0,1,0,1,0,0|1,0,0]=3 26047 B14R1.40 FCCCCOCCCC1OCCO1 34a_100009871617_100000729493 [0,1,0,1,0,0|2,0,0]=4 26048 B14R1.40 FCCCCOCCCC1OCCO1 34a_100011995726_100009861162 [0,1,0,1,0,0|2,0,0]=4 26049 B14R1.40 FCCCCOCCCC1OCCO1 7a_100009871617_100000729493 [0,1,0,1,0,0|2,0,0]=4 26050 B14R1.40 FCCCCOCCCC1OCCO1 7a_100011995726_100000042513 [0,1,0,1,0,0|2,0,0]=4 26051 B14R1.40 FCCCCOCCCN1CCCC1 34a_100011995726_100016991639 [0,1,0,1,0,0|2,0,0]=4 26052 B14R1.40 FCCCCOCCCN1CCCC1 7a_100011995726_100011445909 [0,1,0,1,0,0|2,0,0]=4 26053 B14R1.40 FCCCCOCCNC1CCCC1 34a_200000200444_100000729493 [0,1,0,1,0,0|2,0,0]=4 26054 B14R1.40 FCCCCOCCOC1CCCC1 34a_100000738311_100000729493 [0,1,0,1,0,0|2,0,0]=4 26055 B14R1.40 FCCCCOCCOC1CCCC1 7a_100000738311_100000729493 [0,1,0,1,0,0|2,0,0]=4 26056 B14R1.40 FCCCCSCCCC1CCCC1 62a_100000729493_100011713738 [0,1,0,1,0,0|1,0,0]=3 26057 B14R1.40 FCCCCSCCCC1CCCC1 62a_100011713738_100000729493 [0,1,0,1,0,0|1,0,0]=3 26058 B14R1.40 FCCCCSCCCC1OCCO1 62a_100000729493_100000042513 [0,1,0,1,0,0|2,0,0]=4 26059 B14R1.40 FCCCCSCCCN1CCCC1 62a_100000729493_100011445909 [0,1,0,1,0,0|2,0,0]=4 26060 B14R1.40 FCCCCSCCCN1CCCC1 62a_100016991639_100000729493 [0,1,0,1,0,0|2,0,0]=4 26061 B14R1.40 FCCCNCCCCC1OCCO1 2230a_100015189416_100000034956 [0,1,0,1,0,0|2,0,0]=4 26062 B14R1.40 FCCCNCCCCC1OCCO1 34a_100015189416_200009813554 [0,1,0,1,0,0|2,0,0]=4 26063 B14R1.40 FCCCNCCCOC1CCCC1 34a_100000747560_100011934791 [0,1,0,1,0,0|2,0,0]=4 26064 B14R1.40 FCCCOCCCCC1OCCO1 34a_100000759539_200009813554 [0,1,0,1,0,0|2,0,0]=4 26065 B14R1.40 FCCCSCCCCC1OCCO1 62a_100011934791_100000034956 [0,1,0,1,0,0|2,0,0]=4 26066 B14R1.40 FCCOCCCCOC1CCCO1 34a_100011018183_100011217306 [0,1,0,1,0,0|2,0,0]=4 26067 B14R1.40 FCCOCCCCOC1CCCO1 7a_100011018183_100011217306 [0,1,0,1,0,0|2,0,0]=4 26068 B14R1.40 FCCOCCOCCC1CCCC1 34a_200015357709_100000760354 [0,1,0,1,0,0|2,0,0]=4 26069 B14R1.40 FCCOCCOCCC1CCCC1 7a_200015357709_100000760354 [0,1,0,1,0,0|2,0,0]=4 26070 B14R1.40 ICCCCCOCCC1CCCC1 34a_200012148887_100000760354 [0,1,0,1,0,0|1,0,0]=3 26071 B14R1.40 ICCCCCOCCC1CCCC1 7a_200012148887_100000760354 [0,1,0,1,0,0|1,0,0]=3 26072 B14R1.40 ICCCCCOCCC1OCCO1 34a_200012148887_100000740749 [0,1,0,1,0,0|2,0,0]=4 26073 B14R1.40 ICCCCCOCCC1OCCO1 7a_200012148887_100000740749 [0,1,0,1,0,0|2,0,0]=4 26074 B14R1.40 ICCCCCOCCN1CCCC1 7a_200012148887_100000004467 [0,1,0,1,0,0|2,0,0]=4 26075 B14R1.40 ICCCCOCCCC1CCCC1 34a_200012148704_100011713738 [0,1,0,1,0,0|1,0,0]=3 26076 B14R1.40 ICCCCOCCCC1OCCO1 34a_200012148704_100009861162 [0,1,0,1,0,0|2,0,0]=4 26077 B14R1.40 ICCCCOCCCN1CCCC1 34a_200012148704_100016991639 [0,1,0,1,0,0|2,0,0]=4 26078 B14R1.40 ICCOCCOCCC1CCCC1 34a_100012149058_100000760354 [0,1,0,1,0,0|2,0,0]=4 26079 B14R1.40 ICCOCCOCCC1CCCC1 7a_100012149058_100000760354 [0,1,0,1,0,0|2,0,0]=4 26080 B14R1.40 N#CCCCCCCNC1CCCC1 2230a_100000211070_100009813337 [0,1,0,1,0,0|1,0,1]=4 26081 B14R1.40 N#CCCCCCCOC1CCCC1 7a_100000210269_100009813337 [0,1,0,1,0,0|1,0,1]=4 26082 B14R1.40 N#CCCCCCCSC1CCCC1 62a_100009813337_100000179811 [0,1,0,1,0,0|1,0,1]=4 26083 B14R1.40 N#CCCCCCCSC1CCCC1 62a_100011217020_100009813337 [0,1,0,1,0,0|1,0,1]=4 26084 B14R1.40 N#CCCCCCNCC1CCCC1 2230a_100000737975_100009813376 [0,1,0,1,0,0|1,0,1]=4 26085 B14R1.40 N#CCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100009813376 [0,1,0,1,0,0|1,0,1]=4 26086 B14R1.40 N#CCCCCCOCC1CCCC1 7a_100000742336_100009813376 [0,1,0,1,0,0|1,0,1]=4 26087 B14R1.40 N#CCCCCCOCC1CCCO1 7a_100000210270_100009813376 [0,1,0,1,0,0|1,0,1]=4 26088 B14R1.40 N#CCCCCCSCC1CCCC1 62a_100000740388_100009813376 [0,1,0,1,0,0|1,0,1]=4 26089 B14R1.40 N#CCCCCCSCC1CCCC1 62a_100009813376_100000740388 [0,1,0,1,0,0|1,0,1]=4 26090 B14R1.40 N#CCCCCCSCC1CCCO1 62a_100000203698_100009813376 [0,1,0,1,0,0|1,0,1]=4 26091 B14R1.40 N#CCCCCCSCC1CCCO1 62a_100009813376_100000203698 [0,1,0,1,0,0|1,0,1]=4 26092 B14R1.40 N#CCCCCNCCC1CCCC1 2230a_100000739158_100000211819 [0,1,0,1,0,0|1,0,1]=4 26093 B14R1.40 N#CCCCCOCCC1CCCC1 7a_100000749090_100000211819 [0,1,0,1,0,0|1,0,1]=4 26094 B14R1.40 N#CCCCCSCCC1CCCC1 62a_100000760354_100000211819 [0,1,0,1,0,0|1,0,1]=4 26095 B14R1.40 N#CCCCCSCCC1CCCC1 62a_100011219923_100000760354 [0,1,0,1,0,0|1,0,1]=4 26096 B14R1.40 N#CCCCNCCCC1CCCC1 2230a_100000736752_100000687738 [0,1,0,1,0,0|1,0,1]=4 26097 B14R1.40 N#CCCCOCCCC1CCCC1 7a_100011215328_100000687738 [0,1,0,1,0,0|1,0,1]=4 26098 B14R1.40 N#CCCCSCCCC1CCCC1 62a_100000687738_100011713738 [0,1,0,1,0,0|1,0,1]=4 26099 B14R1.40 N#CCCCSCCCC1CCCC1 62a_100011713738_100000687738 [0,1,0,1,0,0|1,0,1]=4 26100 B14R1.40 NCCCCCCCOC1CCCC1 34a_100011996573_100000179811 [0,1,0,1,0,0|1,0,0]=3 26101 B14R1.40 NCCCCCCCOC1CCOC1 34a_100011996573_100000690089 [0,1,0,1,0,0|2,0,0]=4 26102 B14R1.40 NCCCCCCOCC1CCCC1 34a_100000686447_100000740388 [0,1,0,1,0,0|1,0,0]=3 26103 B14R1.40 NCCCCCCOCC1CCOC1 34a_100000686447_100011261433 [0,1,0,1,0,0|2,0,0]=4 26104 B14R1.40 NCCCCCCOCC1OCCO1 34a_100000686447_100000755774 [0,1,0,1,0,0|2,0,0]=4 26105 B14R1.40 NCCCCCOCCC1CCCC1 34a_100000762737_100000760354 [0,1,0,1,0,0|1,0,0]=3 26106 B14R1.40 NCCCCCOCCC1OCCO1 34a_100000762737_100000740749 [0,1,0,1,0,0|2,0,0]=4 26107 B14R1.40 NCCCCOCCCC1CCCC1 34a_100000750430_100011713738 [0,1,0,1,0,0|1,0,0]=3 26108 B14R1.40 NCCCCOCCCC1OCCO1 34a_100000750430_100009861162 [0,1,0,1,0,0|2,0,0]=4 26109 B14R1.40 NCCCCOCCCN1CCCC1 34a_100000750430_100016991639 [0,1,0,1,0,0|2,0,0]=4 26110 B14R1.40 NCCCOCCCCC1OCCO1 34a_100000182051_200009813554 [0,1,0,1,0,0|2,0,0]=4 26111 B14R1.40 NCCCOCCCOC1CCCC1 34a_100011310245_100000179811 [0,1,0,1,0,0|2,0,0]=4 26112 B14R1.40 NCCOCCOCCC1CCCC1 34a_100000211614_100000760354 [0,1,0,1,0,0|2,0,0]=4 26113 B14R1.40 O=CCCCCCNCC1CCCC1 2230a_100000737975_100000139337 [0,1,0,1,0,0|0,0,2]=4 26114 B14R1.40 O=CCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000139337 [0,1,0,1,0,0|1,0,1]=4 26115 B14R1.40 O=CCCCCCOCC1CCCC1 7a_100000742336_100000139337 [0,1,0,1,0,0|0,0,2]=4 26116 B14R1.40 O=CCCCCCOCC1CCCO1 7a_100000210270_100000139337 [0,1,0,1,0,0|1,0,1]=4 26117 B14R1.40 O=CCCCCCSCC1CCCC1 62a_100000139337_100000740388 [0,1,0,1,0,0|0,0,2]=4 26118 B14R1.40 O=CCCCCCSCC1CCCC1 62a_100000740388_100000139337 [0,1,0,1,0,0|0,0,2]=4 26119 B14R1.40 O=CCCCCCSCC1CCCO1 62a_100000139337_100000203698 [0,1,0,1,0,0|1,0,1]=4 26120 B14R1.40 O=CCCCCCSCC1CCCO1 62a_100000203698_100000139337 [0,1,0,1,0,0|1,0,1]=4 26121 B14R1.40 O=CCCCCNCCC1CCCC1 2230a_100000739158_100000139335 [0,1,0,1,0,0|0,0,2]=4 26122 B14R1.40 O=CCCCCOCCC1CCCC1 7a_100000749090_100000139335 [0,1,0,1,0,0|0,0,2]=4 26123 B14R1.40 O=CCCCCSCCC1CCCC1 62a_100000139335_100000760354 [0,1,0,1,0,0|0,0,2]=4 26124 B14R1.40 O=CCCCCSCCC1CCCC1 62a_100000760354_100000139335 [0,1,0,1,0,0|0,0,2]=4 26125 B14R1.40 O=CCCCNCCCC1CCCC1 2230a_100000736752_200011292268 [0,1,0,1,0,0|0,0,2]=4 26126 B14R1.40 O=CCCCOCCCC1CCCC1 7a_100011215328_200011292268 [0,1,0,1,0,0|0,0,2]=4 26127 B14R1.40 O=CCCCSCCCC1CCCC1 62a_100011713738_200011292268 [0,1,0,1,0,0|0,0,2]=4 26128 B14R1.40 O=CCCCSCCCC1CCCC1 62a_200011292268_100011713738 [0,1,0,1,0,0|0,0,2]=4 26129 B14R1.40 OCC#CCNCCCC1CCCC1 2230a_100000736752_200000047223 [0,1,0,1,0,0|0,0,2]=4 26130 B14R1.40 OCC#CCNCCCC1CCCC1 34a_100000736752_200000047223 [0,1,0,1,0,0|0,0,2]=4 26131 B14R1.40 OCC#CCOCCCC1CCCC1 34a_100011215328_200000047223 [0,1,0,1,0,0|0,0,2]=4 26132 B14R1.40 OCC#CCOCCCC1CCCC1 7a_100011215328_200000047223 [0,1,0,1,0,0|0,0,2]=4 26133 B14R1.40 OCC#CCSCCCC1CCCC1 62a_100011713738_200000047223 [0,1,0,1,0,0|0,0,2]=4 26134 B14R1.40 OCC#CCSCCCC1CCCC1 62a_200000047223_100011713738 [0,1,0,1,0,0|0,0,2]=4 26135 B14R1.40 OCCCCCCCCN1CC=CC1 269982a_100015195280_100000033203 [0,1,0,1,0,0|0,0,2]=4 26136 B14R1.40 OCCCCCCCCN1CCCC1 2230a_100000188435_100000033203 [0,1,0,1,0,0|0,0,0]=2 26137 B14R1.40 OCCCCCCCCN1CCCC1 269982a_100000188435_100000033203 [0,1,0,1,0,0|0,0,0]=2 26138 B14R1.40 OCCCCCCCCN1CCSC1 2230a_100011215254_100000033203 [0,1,0,1,0,0|1,0,0]=3 26139 B14R1.40 OCCCCCCCCN1CCSC1 269982a_100011215254_100000033203 [0,1,0,1,0,0|1,0,0]=3 26140 B14R1.40 OCCCCCCCNC1CC=CC1 2230a_100015188752_100000760002 [0,1,0,1,0,0|0,0,2]=4 26141 B14R1.40 OCCCCCCCNC1CCCC1 2230a_100000211070_100000760002 [0,1,0,1,0,0|0,0,0]=2 26142 B14R1.40 OCCCCCCCNC1CCCC1 2230a_100011996573_100000179811 [0,1,0,1,0,0|0,0,0]=2 26143 B14R1.40 OCCCCCCCNC1CCCC1 270004a_100011996573_100000210133 [0,1,0,1,0,0|0,0,0]=2 26144 B14R1.40 OCCCCCCCNC1CCCC1 34a_100000211070_100000760002 [0,1,0,1,0,0|0,0,0]=2 26145 B14R1.40 OCCCCCCCNC1CCCC1 34a_100011996573_100000179811 [0,1,0,1,0,0|0,0,0]=2 26146 B14R1.40 OCCCCCCCNC1CCOC1 2230a_100011996573_100000731011 [0,1,0,1,0,0|1,0,0]=3 26147 B14R1.40 OCCCCCCCNC1CCOC1 270004a_100011996573_100000752484 [0,1,0,1,0,0|1,0,0]=3 26148 B14R1.40 OCCCCCCCNC1CCOC1 34a_100011996573_100000690089 [0,1,0,1,0,0|1,0,0]=3 26149 B14R1.40 OCCCCCCCNC1CCSC1 270004a_100011996573_100000212027 [0,1,0,1,0,0|1,0,0]=3 26150 B14R1.40 OCCCCCCCN[C@@H]1CCOC1 2230a_200015188469_100000760002 [0,1,0,1,0,0|1,0,0]=3 26151 B14R1.40 OCCCCCCCN[C@H]1CCOC1 2230a_100015188467_100000760002 [0,1,0,1,0,0|1,0,0]=3 26152 B14R1.40 OCCCCCCCN[C@H]1CCOC1 34a_100015188467_100000760002 [0,1,0,1,0,0|1,0,0]=3 26153 B14R1.40 OCCCCCCCOC1CCCC1 34a_100000210269_100000760002 [0,1,0,1,0,0|0,0,0]=2 26154 B14R1.40 OCCCCCCCOC1CCCC1 7a_100000210269_100000760002 [0,1,0,1,0,0|0,0,0]=2 26155 B14R1.40 OCCCCCCCOC1CCCO1 34a_100000085407_100000760002 [0,1,0,1,0,0|1,0,0]=3 26156 B14R1.40 OCCCCCCCOC1CCSC1 7a_100011232664_100000760002 [0,1,0,1,0,0|1,0,0]=3 26157 B14R1.40 OCCCCCCCO[C@H]1CCOC1 34a_100000717292_100000760002 [0,1,0,1,0,0|1,0,0]=3 26158 B14R1.40 OCCCCCCCSC1CCCC1 62a_100000760002_100000179811 [0,1,0,1,0,0|0,0,0]=2 26159 B14R1.40 OCCCCCCCSC1CCCC1 62a_100011217020_100000760002 [0,1,0,1,0,0|0,0,0]=2 26160 B14R1.40 OCCCCCCCSC1CCOC1 62a_100000760002_100000690089 [0,1,0,1,0,0|1,0,0]=3 26161 B14R1.40 OCCCCCCNCC1CCCC1 2230a_100000686447_100000740388 [0,1,0,1,0,0|0,0,0]=2 26162 B14R1.40 OCCCCCCNCC1CCCC1 2230a_100000737975_100000766143 [0,1,0,1,0,0|0,0,0]=2 26163 B14R1.40 OCCCCCCNCC1CCCC1 269862a_100000686447_100000746403 [0,1,0,1,0,0|0,0,0]=2 26164 B14R1.40 OCCCCCCNCC1CCCC1 34a_100000686447_100000740388 [0,1,0,1,0,0|0,0,0]=2 26165 B14R1.40 OCCCCCCNCC1CCCC1 34a_100000737975_100000766143 [0,1,0,1,0,0|0,0,0]=2 26166 B14R1.40 OCCCCCCNCC1CCCO1 2230a_100000686447_100000203698 [0,1,0,1,0,0|1,0,0]=3 26167 B14R1.40 OCCCCCCNCC1CCOC1 2230a_100000686447_100000702531 [0,1,0,1,0,0|1,0,0]=3 26168 B14R1.40 OCCCCCCNCC1CCOC1 2230a_100000737293_100000766143 [0,1,0,1,0,0|1,0,0]=3 26169 B14R1.40 OCCCCCCNCC1CCOC1 34a_100000686447_100011261433 [0,1,0,1,0,0|1,0,0]=3 26170 B14R1.40 OCCCCCCNCC1CCOC1 34a_100000737293_100000766143 [0,1,0,1,0,0|1,0,0]=3 26171 B14R1.40 OCCCCCCNCC1OCCO1 2230a_100000036311_100000766143 [0,1,0,1,0,0|2,0,0]=4 26172 B14R1.40 OCCCCCCNCC1OCCO1 2230a_100000686447_100000755774 [0,1,0,1,0,0|2,0,0]=4 26173 B14R1.40 OCCCCCCNCC1OCCO1 34a_100000036311_100000766143 [0,1,0,1,0,0|2,0,0]=4 26174 B14R1.40 OCCCCCCNCC1OCCO1 34a_100000686447_100000755774 [0,1,0,1,0,0|2,0,0]=4 26175 B14R1.40 OCCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000766143 [0,1,0,1,0,0|1,0,0]=3 26176 B14R1.40 OCCCCCCNC[C@@H]1CCCO1 34a_100020590478_100000766143 [0,1,0,1,0,0|1,0,0]=3 26177 B14R1.40 OCCCCCCOCC1CC=CC1 34a_100000688395_100000766143 [0,1,0,1,0,0|0,0,2]=4 26178 B14R1.40 OCCCCCCOCC1CCCC1 34a_100000742336_100000766143 [0,1,0,1,0,0|0,0,0]=2 26179 B14R1.40 OCCCCCCOCC1CCCC1 7a_100000742336_100000766143 [0,1,0,1,0,0|0,0,0]=2 26180 B14R1.40 OCCCCCCOCC1CCCO1 34a_100000210270_100000766143 [0,1,0,1,0,0|1,0,0]=3 26181 B14R1.40 OCCCCCCOCC1CCCO1 7a_100000210270_100000766143 [0,1,0,1,0,0|1,0,0]=3 26182 B14R1.40 OCCCCCCOCC1CCNC1 34a_100000748654_100000766143 [0,1,0,1,0,0|1,0,0]=3 26183 B14R1.40 OCCCCCCOCC1CCOC1 34a_100000740260_100000766143 [0,1,0,1,0,0|1,0,0]=3 26184 B14R1.40 OCCCCCCOCC1COCO1 34a_100011216627_100000766143 [0,1,0,1,0,0|2,0,0]=4 26185 B14R1.40 OCCCCCCOCC1OCCO1 34a_100000087154_100000766143 [0,1,0,1,0,0|2,0,0]=4 26186 B14R1.40 OCCCCCCOC[C@H]1CCCN1 34a_100000745186_100000766143 [0,1,0,1,0,0|1,0,0]=3 26187 B14R1.40 OCCCCCCSCC1CCCC1 62a_100000740388_100000766143 [0,1,0,1,0,0|0,0,0]=2 26188 B14R1.40 OCCCCCCSCC1CCCC1 62a_100000766143_100000740388 [0,1,0,1,0,0|0,0,0]=2 26189 B14R1.40 OCCCCCCSCC1CCCO1 62a_100000203698_100000766143 [0,1,0,1,0,0|1,0,0]=3 26190 B14R1.40 OCCCCCCSCC1CCCO1 62a_100000766143_100000203698 [0,1,0,1,0,0|1,0,0]=3 26191 B14R1.40 OCCCCCCSCC1CCOC1 62a_100000702531_100000766143 [0,1,0,1,0,0|1,0,0]=3 26192 B14R1.40 OCCCCCCSCC1CCOC1 62a_100000766143_100000702531 [0,1,0,1,0,0|1,0,0]=3 26193 B14R1.40 OCCCCCCSCC1OCCO1 62a_100000755774_100000766143 [0,1,0,1,0,0|2,0,0]=4 26194 B14R1.40 OCCCCCCSCC1OCCO1 62a_100000766143_100000755774 [0,1,0,1,0,0|2,0,0]=4 26195 B14R1.40 OCCCCCNCCC1CCCC1 2230a_100000739158_100000746330 [0,1,0,1,0,0|0,0,0]=2 26196 B14R1.40 OCCCCCNCCC1CCCC1 2230a_100000762737_100000760354 [0,1,0,1,0,0|0,0,0]=2 26197 B14R1.40 OCCCCCNCCC1CCCC1 34a_100000739158_100000746330 [0,1,0,1,0,0|0,0,0]=2 26198 B14R1.40 OCCCCCNCCC1CCCC1 34a_100000762737_100000760354 [0,1,0,1,0,0|0,0,0]=2 26199 B14R1.40 OCCCCCNCCC1OCCO1 2230a_100000034215_100000746330 [0,1,0,1,0,0|2,0,0]=4 26200 B14R1.40 OCCCCCNCCC1OCCO1 2230a_100000762737_100000740749 [0,1,0,1,0,0|2,0,0]=4 26201 B14R1.40 OCCCCCNCCC1OCCO1 34a_100000034215_100000746330 [0,1,0,1,0,0|2,0,0]=4 26202 B14R1.40 OCCCCCNCCC1OCCO1 34a_100000762737_100000740749 [0,1,0,1,0,0|2,0,0]=4 26203 B14R1.40 OCCCCCOCCC1CCCC1 34a_100000749090_100000746330 [0,1,0,1,0,0|0,0,0]=2 26204 B14R1.40 OCCCCCOCCC1CCCC1 7a_100000749090_100000746330 [0,1,0,1,0,0|0,0,0]=2 26205 B14R1.40 OCCCCCOCCC1CCNC1 34a_100016987287_100000746330 [0,1,0,1,0,0|1,0,0]=3 26206 B14R1.40 OCCCCCOCCC1CCOC1 34a_100011879284_100000746330 [0,1,0,1,0,0|1,0,0]=3 26207 B14R1.40 OCCCCCSCCC1CCCC1 62a_100000746330_100000760354 [0,1,0,1,0,0|0,0,0]=2 26208 B14R1.40 OCCCCCSCCC1CCCC1 62a_100000760354_100000746330 [0,1,0,1,0,0|0,0,0]=2 26209 B14R1.40 OCCCCCSCCC1OCCO1 62a_100000746330_100000740749 [0,1,0,1,0,0|2,0,0]=4 26210 B14R1.40 OCCCCCSCCN1CCCC1 62a_100000700749_100000746330 [0,1,0,1,0,0|1,0,0]=3 26211 B14R1.40 OCCCCCSCCN1CCCC1 62a_100000746330_100000004467 [0,1,0,1,0,0|1,0,0]=3 26212 B14R1.40 OCCCCNCCCC1CCCC1 2230a_100000736752_100000210776 [0,1,0,1,0,0|0,0,0]=2 26213 B14R1.40 OCCCCNCCCC1CCCC1 2230a_100000750430_100011713738 [0,1,0,1,0,0|0,0,0]=2 26214 B14R1.40 OCCCCNCCCC1CCCC1 34a_100000736752_100011216708 [0,1,0,1,0,0|0,0,0]=2 26215 B14R1.40 OCCCCNCCCC1CCCC1 34a_100000750430_100011713738 [0,1,0,1,0,0|0,0,0]=2 26216 B14R1.40 OCCCCNCCCC1OCCO1 2230a_100000750430_100000042513 [0,1,0,1,0,0|2,0,0]=4 26217 B14R1.40 OCCCCNCCCC1OCCO1 34a_100000750430_100009861162 [0,1,0,1,0,0|2,0,0]=4 26218 B14R1.40 OCCCCNCCCN1CCCC1 2230a_100000750430_100011445909 [0,1,0,1,0,0|1,0,0]=3 26219 B14R1.40 OCCCCNCCCN1CCCC1 34a_100000750430_100016991639 [0,1,0,1,0,0|1,0,0]=3 26220 B14R1.40 OCCCCNCCOC1CCCC1 34a_100000741755_100011216708 [0,1,0,1,0,0|1,0,0]=3 26221 B14R1.40 OCCCCOCCCC1CCCC1 34a_100011215328_100011216708 [0,1,0,1,0,0|0,0,0]=2 26222 B14R1.40 OCCCCOCCCC1CCCC1 7a_100011215328_100000210776 [0,1,0,1,0,0|0,0,0]=2 26223 B14R1.40 OCCCCOCCCC1OCCO1 34a_100009871617_100011216708 [0,1,0,1,0,0|2,0,0]=4 26224 B14R1.40 OCCCCOCCCC1OCCO1 7a_100009871617_100000210776 [0,1,0,1,0,0|2,0,0]=4 26225 B14R1.40 OCCCCOCCNC1CCCC1 34a_200000200444_100011216708 [0,1,0,1,0,0|1,0,0]=3 26226 B14R1.40 OCCCCOCCOC1CCCC1 34a_100000738311_100011216708 [0,1,0,1,0,0|1,0,0]=3 26227 B14R1.40 OCCCCOCCOC1CCCC1 7a_100000738311_100000210776 [0,1,0,1,0,0|1,0,0]=3 26228 B14R1.40 OCCCCSCCCC1CCCC1 62a_100000210776_100011713738 [0,1,0,1,0,0|0,0,0]=2 26229 B14R1.40 OCCCCSCCCC1CCCC1 62a_100011713738_100000210776 [0,1,0,1,0,0|0,0,0]=2 26230 B14R1.40 OCCCCSCCCC1OCCO1 62a_100000210776_100000042513 [0,1,0,1,0,0|2,0,0]=4 26231 B14R1.40 OCCCCSCCCN1CCCC1 62a_100000210776_100011445909 [0,1,0,1,0,0|1,0,0]=3 26232 B14R1.40 OCCCCSCCCN1CCCC1 62a_100016991639_100000210776 [0,1,0,1,0,0|1,0,0]=3 26233 B14R1.40 OCCCNCCCOC1CCCC1 34a_100000747560_100000230001 [0,1,0,1,0,0|1,0,0]=3 26234 B14R1.40 OCCCOCCCNC1CCCC1 2230a_100011310245_100000179811 [0,1,0,1,0,0|1,0,0]=3 26235 B14R1.40 OCCCOCCCNC1CCCC1 270004a_100011310245_100000210133 [0,1,0,1,0,0|1,0,0]=3 26236 B14R1.40 OCCCOCCCNC1CCCC1 34a_100011310245_100000179811 [0,1,0,1,0,0|1,0,0]=3 26237 B14R1.40 OCCCOCCCNC1CCOC1 2230a_100011310245_100000731011 [0,1,0,1,0,0|2,0,0]=4 26238 B14R1.40 OCCCOCCCNC1CCOC1 270004a_100011310245_100000752484 [0,1,0,1,0,0|2,0,0]=4 26239 B14R1.40 OCCCOCCCNC1CCOC1 34a_100011310245_100000690089 [0,1,0,1,0,0|2,0,0]=4 26240 B14R1.40 OCCCOCCCNC1CCSC1 270004a_100011310245_100000212027 [0,1,0,1,0,0|2,0,0]=4 26241 B14R1.40 OCCCSCCCCC1OCCO1 62a_100011215043_100000034956 [0,1,0,1,0,0|2,0,0]=4 26242 B14R1.40 OCCOCCCCOC1CCCO1 34a_100011018183_100000211926 [0,1,0,1,0,0|2,0,0]=4 26243 B14R1.40 OCCOCCCCOC1CCCO1 7a_100011018183_100000211926 [0,1,0,1,0,0|2,0,0]=4 26244 B14R1.40 OCCOCCNCCC1CCCC1 2230a_100000211614_100000760354 [0,1,0,1,0,0|1,0,0]=3 26245 B14R1.40 OCCOCCNCCC1CCCC1 2230a_100000739158_100011215305 [0,1,0,1,0,0|1,0,0]=3 26246 B14R1.40 OCCOCCNCCC1CCCC1 34a_100000211614_100000760354 [0,1,0,1,0,0|1,0,0]=3 26247 B14R1.40 OCCOCCNCCC1CCCC1 34a_100000739158_100000692535 [0,1,0,1,0,0|1,0,0]=3 26248 B14R1.40 OCCOCCOCCC1CCCC1 34a_100000749090_100000692535 [0,1,0,1,0,0|1,0,0]=3 26249 B14R1.40 OCCOCCOCCC1CCCC1 7a_100000749090_100011215305 [0,1,0,1,0,0|1,0,0]=3 26250 B14R1.40 OCCOCCOCCC1CCNC1 34a_100016987287_100000692535 [0,1,0,1,0,0|2,0,0]=4 26251 B14R1.40 OCCOCCOCCC1CCOC1 34a_100011879284_100000692535 [0,1,0,1,0,0|2,0,0]=4 26252 B14R1.40 OCCOCCOCCN1CCCC1 2230a_100000188435_100000032323 [0,1,0,1,0,0|2,0,0]=4 26253 B14R1.40 OCCOCCOCCN1CCCC1 269982a_100000188435_100000032323 [0,1,0,1,0,0|2,0,0]=4 26254 B14R1.40 OCCOCCSCCC1CCCC1 62a_100000760354_100011215305 [0,1,0,1,0,0|1,0,0]=3 26255 B14R1.40 OCCOCCSCCC1CCCC1 62a_100011215305_100000760354 [0,1,0,1,0,0|1,0,0]=3 26256 B14R1.40 OCCOCCSCCN1CCCC1 62a_100000700749_100011215305 [0,1,0,1,0,0|2,0,0]=4 26257 B14R1.40 OCCOCCSCCN1CCCC1 62a_100011215305_100000004467 [0,1,0,1,0,0|2,0,0]=4 26258 B14R1.40 OCCSCCNCCC1CCCC1 2230a_100011219999_100000760354 [0,1,0,1,0,0|1,0,0]=3 26259 B14R1.40 [13CH3]OCCOCCOCC1CCCO1 34a_200000723522_200025704644 [0,1,0,1,0,0|2,0,0]=4 26260 B14R1.40 [13CH3]OCCOCCOCC1CCCO1 7a_200000723522_200025704644 [0,1,0,1,0,0|2,0,0]=4 26261 B14R1.216 C#CCCCCCCN1CCC[C@@H]1C 2230a_100020605311_100012276617 [0,1,0,1,0,0|1,0,1]=4 26262 B14R1.216 C#CCCCCCCN1CCC[C@@H]1C 269982a_100020605311_100012276617 [0,1,0,1,0,0|1,0,1]=4 26263 B14R1.216 C#CCCCCCCN1CCC[C@H]1C 2230a_100015189458_100012276617 [0,1,0,1,0,0|1,0,1]=4 26264 B14R1.216 C#CCCCCCCN1CCC[C@H]1C 269982a_100015189458_100012276617 [0,1,0,1,0,0|1,0,1]=4 26265 B14R1.216 C#CCCCCCCN1CCC[C@H]1C 34a_100015189458_100012276617 [0,1,0,1,0,0|1,0,1]=4 26266 B14R1.216 C#CCCCCCOC1CCCC1C 34a_100011216460_100012094781 [0,1,0,1,0,0|1,0,1]=4 26267 B14R1.216 C#CCCCCCOC1CCCC1C 7a_100011216460_100012094781 [0,1,0,1,0,0|1,0,1]=4 26268 B14R1.216 C#CCCCCCS[C@@H]1CCC[C@H]1O 62a_100012094781_200016002552 [0,1,0,1,0,0|0,0,2]=4 26269 B14R1.216 C#CCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100012094781 [0,1,0,1,0,0|0,0,2]=4 26270 B14R1.216 C=CCCCCCCN1CCC[C@@H]1C 2230a_100020605311_100011215473 [0,1,0,1,0,0|1,0,1]=4 26271 B14R1.216 C=CCCCCCCN1CCC[C@@H]1C 269982a_100020605311_100011215473 [0,1,0,1,0,0|1,0,1]=4 26272 B14R1.216 C=CCCCCCCN1CCC[C@H]1C 2230a_100015189458_100011215473 [0,1,0,1,0,0|1,0,1]=4 26273 B14R1.216 C=CCCCCCCN1CCC[C@H]1C 269982a_100015189458_100011215473 [0,1,0,1,0,0|1,0,1]=4 26274 B14R1.216 C=CCCCCCCN1CCC[C@H]1C 34a_100015189458_100011215473 [0,1,0,1,0,0|1,0,1]=4 26275 B14R1.216 C=CCCCCCOC1CCCC1C 34a_100011216460_100000700193 [0,1,0,1,0,0|1,0,1]=4 26276 B14R1.216 C=CCCCCCOC1CCCC1C 7a_100011216460_100000700193 [0,1,0,1,0,0|1,0,1]=4 26277 B14R1.216 C=CCCCCCS[C@@H]1CCC[C@H]1O 62a_100000700193_200016002552 [0,1,0,1,0,0|0,0,2]=4 26278 B14R1.216 C=CCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000700193 [0,1,0,1,0,0|0,0,2]=4 26279 B14R1.216 CC1CCCC1NCCCCCCO 269862a_100000686447_100000752053 [0,1,0,1,0,0|0,0,0]=2 26280 B14R1.216 CC1CCCC1OCCCCCC#N 7a_100011216460_100009813376 [0,1,0,1,0,0|1,0,1]=4 26281 B14R1.216 CC1CCCC1OCCCCCC=O 7a_100011216460_100000139337 [0,1,0,1,0,0|0,0,2]=4 26282 B14R1.216 CC1CCCC1OCCCCCCF 34a_100011216460_100015922095 [0,1,0,1,0,0|1,0,0]=3 26283 B14R1.216 CC1CCCC1OCCCCCCF 7a_100011216460_100015922095 [0,1,0,1,0,0|1,0,0]=3 26284 B14R1.216 CC1CCCC1OCCCCCCO 34a_100011216460_100000766143 [0,1,0,1,0,0|0,0,0]=2 26285 B14R1.216 CC1CCCC1OCCCCCCO 7a_100011216460_100000766143 [0,1,0,1,0,0|0,0,0]=2 26286 B14R1.216 CC1OCCC1NCCCCCCO 270004a_100000686447_100000691750 [0,1,0,1,0,0|1,0,0]=3 26287 B14R1.216 CC1SCCN1CCCCCCCO 2230a_200011216479_100000760002 [0,1,0,1,0,0|1,0,0]=3 26288 B14R1.216 CC1SCCN1CCCCCCCO 269982a_200011216479_100000760002 [0,1,0,1,0,0|1,0,0]=3 26289 B14R1.216 CC1SCCN1CCCCCCCO 34a_200011216479_100000760002 [0,1,0,1,0,0|1,0,0]=3 26290 B14R1.216 CCCCCCCCN1CCC[C@@H]1C 2230a_100020605311_100000210759 [0,1,0,1,0,0|1,0,0]=3 26291 B14R1.216 CCCCCCCCN1CCC[C@@H]1C 269982a_100020605311_100000210759 [0,1,0,1,0,0|1,0,0]=3 26292 B14R1.216 CCCCCCCCN1CCC[C@H]1C 2230a_100015189458_100000210759 [0,1,0,1,0,0|1,0,0]=3 26293 B14R1.216 CCCCCCCCN1CCC[C@H]1C 269982a_100015189458_100000210759 [0,1,0,1,0,0|1,0,0]=3 26294 B14R1.216 CCCCCCCCN1CCC[C@H]1C 34a_100015189458_100000210759 [0,1,0,1,0,0|1,0,0]=3 26295 B14R1.216 CCCCCCCCN1CCSC1C 2230a_200011216479_100000210759 [0,1,0,1,0,0|2,0,0]=4 26296 B14R1.216 CCCCCCCCN1CCSC1C 269982a_200011216479_100000210759 [0,1,0,1,0,0|2,0,0]=4 26297 B14R1.216 CCCCCCCCN1CCSC1C 34a_200011216479_100000210759 [0,1,0,1,0,0|2,0,0]=4 26298 B14R1.216 CCCCCCCNC1CCCC1=O 2230a_100000229938_100000211823 [0,1,0,1,0,0|0,0,2]=4 26299 B14R1.216 CCCCCCCNC1CCCC1C 269862a_100000229938_100000752053 [0,1,0,1,0,0|1,0,0]=3 26300 B14R1.216 CCCCCCCNC1CCOC1C 270004a_100000229938_100000691750 [0,1,0,1,0,0|2,0,0]=4 26301 B14R1.216 CCCCCCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100000210681 [0,1,0,1,0,0|1,0,0]=3 26302 B14R1.216 CCCCCCCOC1CCCC1=O 34a_100000210272_100000709159 [0,1,0,1,0,0|0,0,2]=4 26303 B14R1.216 CCCCCCCOC1CCCC1=O 34a_200000719330_100000210614 [0,1,0,1,0,0|0,0,2]=4 26304 B14R1.216 CCCCCCCOC1CCCC1=O 7a_100000210272_100000211823 [0,1,0,1,0,0|0,0,2]=4 26305 B14R1.216 CCCCCCCOC1CCCC1C 34a_100011216460_100000210614 [0,1,0,1,0,0|1,0,0]=3 26306 B14R1.216 CCCCCCCOC1CCCC1C 7a_100011216460_100000210614 [0,1,0,1,0,0|1,0,0]=3 26307 B14R1.216 CCCCCCCOC1COCC1O 34a_100000210272_200000725654 [0,1,0,1,0,0|1,0,0]=3 26308 B14R1.216 CCCCCCCOC1COCC1O 7a_100000210272_200000725654 [0,1,0,1,0,0|1,0,0]=3 26309 B14R1.216 CCCCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000210614 [0,1,0,1,0,0|1,0,0]=3 26310 B14R1.216 CCCCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000210614 [0,1,0,1,0,0|1,0,0]=3 26311 B14R1.216 CCCCCCCO[C@H]1CNC[C@H]1C 34a_200015306588_100000210614 [0,1,0,1,0,0|2,0,0]=4 26312 B14R1.216 CCCCCCCO[C@H]1COC[C@@H]1N 34a_100015191717_100000210614 [0,1,0,1,0,0|2,0,0]=4 26313 B14R1.216 CCCCCCCSC1CCCC1=O 62a_100000210614_100000211823 [0,1,0,1,0,0|0,0,2]=4 26314 B14R1.216 CCCCCCCSC1CCCC1=O 62a_100000211823_100000210316 [0,1,0,1,0,0|0,0,2]=4 26315 B14R1.216 CCCCCCCSC1COCC1O 62a_100000210614_200000725654 [0,1,0,1,0,0|1,0,0]=3 26316 B14R1.216 CCCCCCCSC1COCC1O 62a_200000725654_100000210316 [0,1,0,1,0,0|1,0,0]=3 26317 B14R1.216 CCCCCCCS[C@@H]1CCC[C@H]1O 62a_100000210614_200016002552 [0,1,0,1,0,0|0,0,0]=2 26318 B14R1.216 CCCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000210316 [0,1,0,1,0,0|0,0,0]=2 26319 B14R1.216 CCCCCCOCC1CCCN1C 34a_100000743107_100000210314 [0,1,0,1,0,0|2,0,0]=4 26320 B14R1.216 CCCCCNCCC1CCCN1C 2230a_100000209983_100000005710 [0,1,0,1,0,0|2,0,0]=4 26321 B14R1.216 CCCCCOCCC1CCCN1C 34a_100000210253_100000005710 [0,1,0,1,0,0|2,0,0]=4 26322 B14R1.216 CCCCCOCCC1CCCN1C 34a_100011215177_100000718602 [0,1,0,1,0,0|2,0,0]=4 26323 B14R1.216 CCCCCOCCC1CCCN1C 7a_100000210253_100000005710 [0,1,0,1,0,0|2,0,0]=4 26324 B14R1.216 CCCCCOCCC1CCCN1C 7a_100011215177_100000210326 [0,1,0,1,0,0|2,0,0]=4 26325 B14R1.216 CCCCCSCCC1CCCN1C 62a_100000005710_100000210326 [0,1,0,1,0,0|2,0,0]=4 26326 B14R1.216 CCCCCSCCC1CCCN1C 62a_100000210326_100000005710 [0,1,0,1,0,0|2,0,0]=4 26327 B14R1.216 CCCCOCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100000743108 [0,1,0,1,0,0|2,0,0]=4 26328 B14R1.216 CCCCOCCOC1CCCC1C 34a_100011216460_100000743108 [0,1,0,1,0,0|2,0,0]=4 26329 B14R1.216 CCCCOCCOC1CCCC1C 7a_100011216460_100000743108 [0,1,0,1,0,0|2,0,0]=4 26330 B14R1.216 CCCCOCCOC1COCC1O 34a_100000210238_200000725654 [0,1,0,1,0,0|2,0,0]=4 26331 B14R1.216 CCCCOCCOC1COCC1O 7a_100000210238_200000725654 [0,1,0,1,0,0|2,0,0]=4 26332 B14R1.216 CCCCOCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000743108 [0,1,0,1,0,0|2,0,0]=4 26333 B14R1.216 CCCCOCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000743108 [0,1,0,1,0,0|2,0,0]=4 26334 B14R1.216 CCCCOCCSC1COCC1O 62a_100000743108_200000725654 [0,1,0,1,0,0|2,0,0]=4 26335 B14R1.216 CCCCOCCSC1COCC1O 62a_200000725654_100000743108 [0,1,0,1,0,0|2,0,0]=4 26336 B14R1.216 CCCCOCCS[C@@H]1CCC[C@H]1O 62a_100000743108_200016002552 [0,1,0,1,0,0|1,0,0]=3 26337 B14R1.216 CCCCOCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000743108 [0,1,0,1,0,0|1,0,0]=3 26338 B14R1.216 CCCCSCCNC1CCCC1C 269862a_100025743550_100000752053 [0,1,0,1,0,0|2,0,0]=4 26339 B14R1.216 CCCCSCCOC1COCC1O 34a_200000230436_200000725654 [0,1,0,1,0,0|2,0,0]=4 26340 B14R1.216 CCCCSCCOC1COCC1O 7a_200000230436_200000725654 [0,1,0,1,0,0|2,0,0]=4 26341 B14R1.216 CCCOCCCNC1CCCC1C 269862a_100011217757_100000752053 [0,1,0,1,0,0|2,0,0]=4 26342 B14R1.216 CCCOCCCNC1COCC1O 34a_100011217757_200000725654 [0,1,0,1,0,0|2,0,0]=4 26343 B14R1.216 CN1CCCC1CCNCCCCO 2230a_100000750430_100000005710 [0,1,0,1,0,0|1,0,0]=3 26344 B14R1.216 CN1CCCC1CCNCCCCO 34a_100000750430_100000005710 [0,1,0,1,0,0|1,0,0]=3 26345 B14R1.216 CN1CCCC1CCOCCCCBr 34a_100011216708_100000005710 [0,1,0,1,0,0|2,0,0]=4 26346 B14R1.216 CN1CCCC1CCOCCCCCl 34a_100000210776_100000005710 [0,1,0,1,0,0|2,0,0]=4 26347 B14R1.216 CN1CCCC1CCOCCCCCl 7a_100000210776_100000005710 [0,1,0,1,0,0|2,0,0]=4 26348 B14R1.216 CN1CCCC1CCOCCCCF 34a_100011215177_100000729493 [0,1,0,1,0,0|2,0,0]=4 26349 B14R1.216 CN1CCCC1CCOCCCCF 34a_100011995726_100000005710 [0,1,0,1,0,0|2,0,0]=4 26350 B14R1.216 CN1CCCC1CCOCCCCF 7a_100011215177_100000729493 [0,1,0,1,0,0|2,0,0]=4 26351 B14R1.216 CN1CCCC1CCOCCCCF 7a_100011995726_100000005710 [0,1,0,1,0,0|2,0,0]=4 26352 B14R1.216 CN1CCCC1CCOCCCCI 34a_200012148704_100000005710 [0,1,0,1,0,0|2,0,0]=4 26353 B14R1.216 CN1CCCC1CCOCCCCN 34a_100000750430_100000005710 [0,1,0,1,0,0|2,0,0]=4 26354 B14R1.216 CN1CCCC1CCOCCCCO 34a_100011215177_100011216708 [0,1,0,1,0,0|1,0,0]=3 26355 B14R1.216 CN1CCCC1CCOCCCCO 7a_100011215177_100000210776 [0,1,0,1,0,0|1,0,0]=3 26356 B14R1.216 CN1CCCC1CCSCCCCF 62a_100000005710_100000729493 [0,1,0,1,0,0|2,0,0]=4 26357 B14R1.216 CN1CCCC1CCSCCCCF 62a_100000729493_100000005710 [0,1,0,1,0,0|2,0,0]=4 26358 B14R1.216 CN1CCCC1CCSCCCCO 62a_100000005710_100000210776 [0,1,0,1,0,0|1,0,0]=3 26359 B14R1.216 CN1CCCC1CCSCCCCO 62a_100000210776_100000005710 [0,1,0,1,0,0|1,0,0]=3 26360 B14R1.216 CN1CCCC1COCCCCCF 34a_100000743107_100000729378 [0,1,0,1,0,0|2,0,0]=4 26361 B14R1.216 CN1CCCC1COCCCCCO 34a_100000743107_100000746330 [0,1,0,1,0,0|1,0,0]=3 26362 B14R1.216 CN1CCCC1COCCOCCO 34a_100000743107_100000692535 [0,1,0,1,0,0|2,0,0]=4 26363 B14R1.216 CNCCCCCOC1COCC1O 34a_100000722520_200000725654 [0,1,0,1,0,0|2,0,0]=4 26364 B14R1.216 COCCCCCCN1CCC[C@@H]1C 2230a_100020605311_100011998445 [0,1,0,1,0,0|1,0,0]=3 26365 B14R1.216 COCCCCCCN1CCC[C@@H]1C 269982a_100020605311_100011998445 [0,1,0,1,0,0|1,0,0]=3 26366 B14R1.216 COCCCCCCN1CCC[C@H]1C 2230a_100015189458_100011998445 [0,1,0,1,0,0|1,0,0]=3 26367 B14R1.216 COCCCCCCN1CCC[C@H]1C 269982a_100015189458_100011998445 [0,1,0,1,0,0|1,0,0]=3 26368 B14R1.216 COCCCCCCN1CCC[C@H]1C 34a_100015189458_100011998445 [0,1,0,1,0,0|1,0,0]=3 26369 B14R1.216 COCCCCCCN1CCSC1C 2230a_200011216479_100011998445 [0,1,0,1,0,0|2,0,0]=4 26370 B14R1.216 COCCCCCCN1CCSC1C 269982a_200011216479_100011998445 [0,1,0,1,0,0|2,0,0]=4 26371 B14R1.216 COCCCCCCN1CCSC1C 34a_200011216479_100011998445 [0,1,0,1,0,0|2,0,0]=4 26372 B14R1.216 COCCCCCNC1CCCC1C 269862a_100000747528_100000752053 [0,1,0,1,0,0|1,0,0]=3 26373 B14R1.216 COCCCCCNC1CCOC1C 270004a_100000747528_100000691750 [0,1,0,1,0,0|2,0,0]=4 26374 B14R1.216 COCCCCCNC1COCC1O 34a_100000747528_200000725654 [0,1,0,1,0,0|2,0,0]=4 26375 B14R1.216 COCCCCOCC1CCCN1C 34a_100000743107_100000755781 [0,1,0,1,0,0|2,0,0]=4 26376 B14R1.216 COCCCNCCC1CCCN1C 34a_100150723488_100000005710 [0,1,0,1,0,0|2,0,0]=4 26377 B14R1.216 COCCCOCCC1CCCN1C 34a_100000740835_100000005710 [0,1,0,1,0,0|2,0,0]=4 26378 B14R1.216 COCCCOCCC1CCCN1C 34a_100011215177_100000740836 [0,1,0,1,0,0|2,0,0]=4 26379 B14R1.216 COCCCOCCC1CCCN1C 7a_100011215177_100000740836 [0,1,0,1,0,0|2,0,0]=4 26380 B14R1.216 COCCCSCCC1CCCN1C 62a_100000005710_100000709357 [0,1,0,1,0,0|2,0,0]=4 26381 B14R1.216 COCCCSCCC1CCCN1C 62a_100000709357_100000005710 [0,1,0,1,0,0|2,0,0]=4 26382 B14R1.216 COCCOCCCN1CCC[C@@H]1C 2230a_100020605311_100011216529 [0,1,0,1,0,0|2,0,0]=4 26383 B14R1.216 COCCOCCCN1CCC[C@@H]1C 269982a_100020605311_100011216529 [0,1,0,1,0,0|2,0,0]=4 26384 B14R1.216 COCCOCCCN1CCC[C@H]1C 2230a_100015189458_100011216529 [0,1,0,1,0,0|2,0,0]=4 26385 B14R1.216 COCCOCCCN1CCC[C@H]1C 269982a_100015189458_100011216529 [0,1,0,1,0,0|2,0,0]=4 26386 B14R1.216 COCCOCCCN1CCC[C@H]1C 34a_100015189458_100011216529 [0,1,0,1,0,0|2,0,0]=4 26387 B14R1.216 COCCOCCNC1CCCC1C 269862a_100000745349_100000752053 [0,1,0,1,0,0|2,0,0]=4 26388 B14R1.216 COCCOCCOC1CCCC1C 34a_100011216460_100000695917 [0,1,0,1,0,0|2,0,0]=4 26389 B14R1.216 COCCOCCOC1CCCC1C 7a_100011216460_100000695917 [0,1,0,1,0,0|2,0,0]=4 26390 B14R1.216 COCCOCCS[C@@H]1CCC[C@H]1O 62a_100000695917_200016002552 [0,1,0,1,0,0|2,0,0]=4 26391 B14R1.216 COCCOCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000695917 [0,1,0,1,0,0|2,0,0]=4 26392 B14R1.216 C[C@@H]1CCCN1CCCCCCC#N 2230a_100015189458_100009813337 [0,1,0,1,0,0|1,0,1]=4 26393 B14R1.216 C[C@@H]1CCCN1CCCCCCC#N 269982a_100015189458_100009813337 [0,1,0,1,0,0|1,0,1]=4 26394 B14R1.216 C[C@@H]1CCCN1CCCCCCCO 2230a_100015189458_100000760002 [0,1,0,1,0,0|0,0,0]=2 26395 B14R1.216 C[C@@H]1CCCN1CCCCCCCO 269982a_100015189458_100000760002 [0,1,0,1,0,0|0,0,0]=2 26396 B14R1.216 C[C@@H]1CCCN1CCCCCCCO 34a_100015189458_100000760002 [0,1,0,1,0,0|0,0,0]=2 26397 B14R1.216 C[C@@H]1CNC[C@@H]1OCCCCCCF 34a_200015306588_100015922095 [0,1,0,1,0,0|2,0,0]=4 26398 B14R1.216 C[C@@H]1CNC[C@@H]1OCCCCCCO 34a_200015306588_100000766143 [0,1,0,1,0,0|1,0,0]=3 26399 B14R1.216 C[C@H]1CCCN1CCCCCCC#N 2230a_100020605311_100009813337 [0,1,0,1,0,0|1,0,1]=4 26400 B14R1.216 C[C@H]1CCCN1CCCCCCC#N 269982a_100020605311_100009813337 [0,1,0,1,0,0|1,0,1]=4 26401 B14R1.216 C[C@H]1CCCN1CCCCCCCO 2230a_100020605311_100000760002 [0,1,0,1,0,0|0,0,0]=2 26402 B14R1.216 C[C@H]1CCCN1CCCCCCCO 269982a_100020605311_100000760002 [0,1,0,1,0,0|0,0,0]=2 26403 B14R1.216 FCCCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100015922095 [0,1,0,1,0,0|2,0,0]=4 26404 B14R1.216 N#CCCCCCS[C@@H]1CCC[C@H]1O 62a_100009813376_200016002552 [0,1,0,1,0,0|1,0,1]=4 26405 B14R1.216 N#CCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100009813376 [0,1,0,1,0,0|1,0,1]=4 26406 B14R1.216 NCCCCCCOC1COCC1O 34a_100000686447_200000725654 [0,1,0,1,0,0|2,0,0]=4 26407 B14R1.216 N[C@H]1CCC[C@@H]1OCCCCCCF 34a_100000748460_100015922095 [0,1,0,1,0,0|2,0,0]=4 26408 B14R1.216 N[C@H]1CCC[C@@H]1OCCCCCCO 34a_100000748460_100000766143 [0,1,0,1,0,0|1,0,0]=3 26409 B14R1.216 N[C@H]1COC[C@@H]1OCCCCCCO 34a_100015191717_100000766143 [0,1,0,1,0,0|2,0,0]=4 26410 B14R1.216 O=C1CCCC1NCCCCCCO 2230a_100000686447_100000211823 [0,1,0,1,0,0|1,0,1]=4 26411 B14R1.216 O=C1CCCC1NCCCCCCO 34a_100000686447_100000709159 [0,1,0,1,0,0|1,0,1]=4 26412 B14R1.216 O=C1CCCC1OCCCCCCO 34a_200000719330_100000766143 [0,1,0,1,0,0|1,0,1]=4 26413 B14R1.216 O=C1CCCC1SCCCCCCO 62a_100000211823_100000766143 [0,1,0,1,0,0|1,0,1]=4 26414 B14R1.216 O=C1CCCC1SCCCCCCO 62a_100000766143_100000211823 [0,1,0,1,0,0|1,0,1]=4 26415 B14R1.216 O=CCCCCCS[C@@H]1CCC[C@H]1O 62a_100000139337_200016002552 [0,1,0,1,0,0|1,0,1]=4 26416 B14R1.216 O=CCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000139337 [0,1,0,1,0,0|1,0,1]=4 26417 B14R1.216 OC1COCC1OCCCCCCBr 34a_100011215345_200000725654 [0,1,0,1,0,0|2,0,0]=4 26418 B14R1.216 OC1COCC1OCCCCCCBr 7a_100011215345_200000725654 [0,1,0,1,0,0|2,0,0]=4 26419 B14R1.216 OC1COCC1OCCCCCCCl 34a_100000766143_200000725654 [0,1,0,1,0,0|2,0,0]=4 26420 B14R1.216 OC1COCC1OCCCCCCCl 7a_100000766143_200000725654 [0,1,0,1,0,0|2,0,0]=4 26421 B14R1.216 OC1COCC1OCCCCCCF 34a_100000732779_200000725654 [0,1,0,1,0,0|2,0,0]=4 26422 B14R1.216 OC1COCC1OCCCCCCF 7a_100000732779_200000725654 [0,1,0,1,0,0|2,0,0]=4 26423 B14R1.216 OC1COCC1SCCCCCCF 62a_100015922095_200000725654 [0,1,0,1,0,0|2,0,0]=4 26424 B14R1.216 OC1COCC1SCCCCCCF 62a_200000725654_100015922095 [0,1,0,1,0,0|2,0,0]=4 26425 B14R1.216 OCCCCCCNC1COCC1O 34a_100000686447_200000725654 [0,1,0,1,0,0|2,0,0]=4 26426 B14R1.216 OCCCCCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100000766143 [0,1,0,1,0,0|2,0,0]=4 26427 B14R1.216 OCCCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000766143 [0,1,0,1,0,0|1,0,0]=3 26428 B14R1.216 OCCCCCCSC1COCC1O 62a_100000766143_200000725654 [0,1,0,1,0,0|2,0,0]=4 26429 B14R1.216 OCCCCCCSC1COCC1O 62a_200000725654_100000766143 [0,1,0,1,0,0|2,0,0]=4 26430 B14R1.216 OCCCCCCS[C@@H]1CCC[C@H]1O 62a_100000766143_200016002552 [0,1,0,1,0,0|1,0,0]=3 26431 B14R1.216 OCCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000766143 [0,1,0,1,0,0|1,0,0]=3 26432 B14R1.216 O[C@@H]1CCC[C@H]1SCCCCCCF 62a_100015922095_200016002552 [0,1,0,1,0,0|1,0,0]=3 26433 B14R1.216 O[C@@H]1CCC[C@H]1SCCCCCCF 62a_200016002552_100015922095 [0,1,0,1,0,0|1,0,0]=3 26434 B14R1.216 O[C@H]1COC[C@@H]1NCCCCCCF 2230a_100015191717_100015922095 [0,1,0,1,0,0|2,0,0]=4 26435 B14R1.219 CCCC1CCC(C1)NCCCCO 270004a_100000750430_200012087856 [0,1,0,1,0,0|1,0,0]=3 26436 B14R1.219 CCCCCCN1CCC(C1)CCO 2230a_100016987287_100000210314 [0,1,0,1,0,0|1,0,0]=3 26437 B14R1.219 CCCCCCN1CCC(C1)CCO 269982a_100016987287_100000210757 [0,1,0,1,0,0|1,0,0]=3 26438 B14R1.219 CCCCCCN1CCC(C1)CCO 34a_100016987287_100000210314 [0,1,0,1,0,0|1,0,0]=3 26439 B14R1.219 CCCCCNC1CCC(C1)CCC 270004a_100000209983_200012087856 [0,1,0,1,0,0|2,0,0]=4 26440 B14R1.219 CCCCOCN1CCC(C1)CCO 2230a_100016987287_100011995733 [0,1,0,1,0,0|2,0,0]=4 26441 B14R1.219 CCCCOCN1CCC(C1)CCO 269982a_100016987287_100011995733 [0,1,0,1,0,0|2,0,0]=4 26442 B14R1.219 CCCCOCN1CCC(C1)CCO 34a_100016987287_100011995733 [0,1,0,1,0,0|2,0,0]=4 26443 B14R1.219 CCCOCCN1CCC(C1)CCO 2230a_100016987287_100011215938 [0,1,0,1,0,0|2,0,0]=4 26444 B14R1.219 CCCOCCN1CCC(C1)CCO 269982a_100016987287_100011215938 [0,1,0,1,0,0|2,0,0]=4 26445 B14R1.219 CCCOCCN1CCC(C1)CCO 34a_100016987287_100011215938 [0,1,0,1,0,0|2,0,0]=4 26446 B14R1.219 CCOCCCN1CCC(C1)CCO 2230a_100016987287_100012232248 [0,1,0,1,0,0|2,0,0]=4 26447 B14R1.219 CCOCCCN1CCC(C1)CCO 269982a_100016987287_100012232248 [0,1,0,1,0,0|2,0,0]=4 26448 B14R1.219 CCOCCCN1CCC(C1)CCO 34a_100016987287_100012232248 [0,1,0,1,0,0|2,0,0]=4 26449 B14R1.219 CCO[C@H]1CCN(C1)CCCCCO 2230a_100011787710_100000746330 [0,1,0,1,0,0|2,0,0]=4 26450 B14R1.219 CCO[C@H]1CCN(C1)CCCCCO 269982a_100011787710_100000746330 [0,1,0,1,0,0|2,0,0]=4 26451 B14R1.219 CCO[C@H]1CCN(C1)CCCCCO 34a_100011787710_100000746330 [0,1,0,1,0,0|2,0,0]=4 26452 B14R1.219 COCC1CCN(C1)CCCCCO 2230a_100025706693_100000746330 [0,1,0,1,0,0|2,0,0]=4 26453 B14R1.219 COCC1CCN(C1)CCCCCO 269982a_100025706693_100000746330 [0,1,0,1,0,0|2,0,0]=4 26454 B14R1.219 COCC1CCN(C1)CCCCCO 34a_100025706693_100000746330 [0,1,0,1,0,0|2,0,0]=4 26455 B14R1.219 COCCCCN1CCC(C1)CCO 2230a_100016987287_100000730899 [0,1,0,1,0,0|2,0,0]=4 26456 B14R1.219 COCCCCN1CCC(C1)CCO 269982a_100016987287_100000730899 [0,1,0,1,0,0|2,0,0]=4 26457 B14R1.219 COCCCCN1CCC(C1)CCO 34a_100016987287_100000755781 [0,1,0,1,0,0|2,0,0]=4 26458 B14R1.219 OCCC1CCN(C1)CCCCCF 2230a_100016987287_100000729378 [0,1,0,1,0,0|2,0,0]=4 26459 B14R1.219 OCCC1CCN(C1)CCCCCF 269982a_100016987287_100000729378 [0,1,0,1,0,0|2,0,0]=4 26460 B14R1.219 OCCC1CCN(C1)CCCCCF 34a_100016987287_100000729378 [0,1,0,1,0,0|2,0,0]=4 26461 B14R1.219 OCCCCCN1CCC(C1)CCO 2230a_100016987287_100000746330 [0,1,0,1,0,0|2,0,0]=4 26462 B14R1.219 OCCCCCN1CCC(C1)CCO 269982a_100016987287_100000746330 [0,1,0,1,0,0|2,0,0]=4 26463 B14R1.219 OCCCCCN1CCC(C1)CCO 34a_100016987287_100000746330 [0,1,0,1,0,0|2,0,0]=4 26464 B14R1.263 CC(CCO)N1CCCCC1CCO 2230a_100000211664_100009893172 [0,1,0,1,0,0|2,0,0]=4 26465 B14R1.263 CC(CCO)N1CCCCC1CCO 269982a_100000211664_100009893172 [0,1,0,1,0,0|2,0,0]=4 26466 B14R1.263 CC(CCO)N1CCCCC1CCO 34a_100000211664_100009893172 [0,1,0,1,0,0|2,0,0]=4 26467 B14R1.263 CCCC(=O)N1CCCCC1CCO 240690a_100000211664_100000211992 [0,1,0,1,0,0|1,0,1]=4 26468 B14R1.263 CCCC(C)N1CCCCC1CCC 2230a_100000701414_100000766640 [0,1,0,1,0,0|2,0,0]=4 26469 B14R1.263 CCCC(C)N1CCCCC1CCC 269982a_100000701414_100000766640 [0,1,0,1,0,0|2,0,0]=4 26470 B14R1.263 CCCC(C)N1CCCCC1CCC 270004a_100000701414_100000211909 [0,1,0,1,0,0|2,0,0]=4 26471 B14R1.263 CCCC(C)N1CCCCC1CCC 34a_100000701414_100000766640 [0,1,0,1,0,0|2,0,0]=4 26472 B14R1.263 CCCC(C)N1CCCCC1CCO 2230a_100000211664_100000766640 [0,1,0,1,0,0|1,0,0]=3 26473 B14R1.263 CCCC(C)N1CCCCC1CCO 269982a_100000211664_100000766640 [0,1,0,1,0,0|1,0,0]=3 26474 B14R1.263 CCCC(C)N1CCCCC1CCO 270004a_100000211664_100000211909 [0,1,0,1,0,0|1,0,0]=3 26475 B14R1.263 CCCC(C)N1CCCCC1CCO 34a_100000211664_100000766640 [0,1,0,1,0,0|1,0,0]=3 26476 B14R1.263 CCCC1CCCCC1N(C)CCC 270004a_100000747261_100011218038 [0,1,0,1,0,0|2,0,0]=4 26477 B14R1.263 CCCC1CCCCC1N(C)CCO 270004a_100000210263_100011218038 [0,1,0,1,0,0|1,0,0]=3 26478 B14R1.263 CCCC1CCCCN1C(=O)CCO 240690a_100000701414_100011216618 [0,1,0,1,0,0|1,0,1]=4 26479 B14R1.263 CCCC1CCCCN1C(C)CCO 2230a_100000701414_100009893172 [0,1,0,1,0,0|1,0,0]=3 26480 B14R1.263 CCCC1CCCCN1C(C)CCO 269982a_100000701414_100009893172 [0,1,0,1,0,0|1,0,0]=3 26481 B14R1.263 CCCC1CCCCN1C(C)CCO 34a_100000701414_100009893172 [0,1,0,1,0,0|1,0,0]=3 26482 B14R1.263 CCCC1COCCN1C(C)CCO 2230a_102495339903_100009893172 [0,1,0,1,0,0|2,0,0]=4 26483 B14R1.263 CCCC1COCCN1C(C)CCO 269982a_102495339903_100009893172 [0,1,0,1,0,0|2,0,0]=4 26484 B14R1.263 CCCC1COCCN1C(C)CCO 34a_102495339903_100009893172 [0,1,0,1,0,0|2,0,0]=4 26485 B14R1.263 CCCN1CCCCC1C(=O)CCO 1458a_100000743559_100000211926 [0,1,0,1,0,0|1,0,1]=4 26486 B14R1.263 CCOC1CCCCC1N(C)CCO 270004a_100000210263_200000031474 [0,1,0,1,0,0|2,0,0]=4 26487 B14R1.263 COCC(C)N1CCCCC1CCO 2230a_100000211664_100000765312 [0,1,0,1,0,0|2,0,0]=4 26488 B14R1.263 COCC(C)N1CCCCC1CCO 269982a_100000211664_100000765312 [0,1,0,1,0,0|2,0,0]=4 26489 B14R1.263 COCC(C)N1CCCCC1CCO 270004a_100000211664_100000749346 [0,1,0,1,0,0|2,0,0]=4 26490 B14R1.263 COCC(C)N1CCCCC1CCO 34a_100000211664_100000765312 [0,1,0,1,0,0|2,0,0]=4 26491 B14R1.263 COCC1CCCCN1C(C)CCO 2230a_100015184032_100009893172 [0,1,0,1,0,0|2,0,0]=4 26492 B14R1.263 COCC1CCCCN1C(C)CCO 269982a_100015184032_100009893172 [0,1,0,1,0,0|2,0,0]=4 26493 B14R1.263 COCC1CCCCN1C(C)CCO 34a_100015184032_100009893172 [0,1,0,1,0,0|2,0,0]=4 26494 B14R1.263 CSCC(C)N1CCCCC1CCO 270004a_100000211664_100011216314 [0,1,0,1,0,0|2,0,0]=4 26495 B14R1.273 CCCC(C)NC1CCCC1CCC 269862a_100000741246_100000723119 [0,1,0,1,0,0|2,0,0]=4 26496 B14R1.273 CCCC(C)NC1CCCC1CCC 270004a_100000741246_100000723119 [0,1,0,1,0,0|2,0,0]=4 26497 B14R1.273 CCCC1CCCC1N[C@H](C)CCO 269862a_100000706166_100000723119 [0,1,0,1,0,0|1,0,0]=3 26498 B14R1.273 CCCC1CCCC1N[C@H](C)CCO 270004a_100000706166_100000723119 [0,1,0,1,0,0|1,0,0]=3 26499 B14R1.520 CC(CCBr)OCCC1CCCCC1 34a_100012276601_100011209188 [0,1,0,1,0,0|2,0,0]=4 26500 B14R1.520 CC(CCN)COCC1CCCCC1 34a_106354213184_100000211423 [0,1,0,1,0,0|2,0,0]=4 26501 B14R1.520 CC(CCN)COCC1CCCCO1 34a_106354213184_100000211543 [0,1,0,1,0,0|2,0,0]=4 26502 B14R1.520 CC(CCO)NCCC1CCCCC1 2230a_100000738074_100009893172 [0,1,0,1,0,0|1,0,0]=3 26503 B14R1.520 CC(CCO)NCCC1CCCCC1 34a_100000738074_100009893172 [0,1,0,1,0,0|1,0,0]=3 26504 B14R1.520 CC(CCO)NCCC1CCCCO1 2230a_100015183643_100009893172 [0,1,0,1,0,0|2,0,0]=4 26505 B14R1.520 CC(CCO)NCCC1CCCCO1 34a_100015183643_100009893172 [0,1,0,1,0,0|2,0,0]=4 26506 B14R1.520 CC(CCO)NCCC1CCOCC1 2230a_100000755988_100009893172 [0,1,0,1,0,0|2,0,0]=4 26507 B14R1.520 CC(CCO)NCCC1CCOCC1 34a_100000755988_100009893172 [0,1,0,1,0,0|2,0,0]=4 26508 B14R1.520 CC(CCO)OCCC1CCCCC1 34a_100011217863_100009893172 [0,1,0,1,0,0|1,0,0]=3 26509 B14R1.520 CC(CCO)OCCC1CCCCC1 7a_100011217863_100009893172 [0,1,0,1,0,0|1,0,0]=3 26510 B14R1.520 CC(CCO)OCCC1CCCCN1 34a_100000211664_100009893172 [0,1,0,1,0,0|2,0,0]=4 26511 B14R1.520 CC(CCO)OCCC1CCCNC1 34a_100000752241_100009893172 [0,1,0,1,0,0|2,0,0]=4 26512 B14R1.520 CC(CCO)OCCC1CCNCC1 34a_100015190746_100009893172 [0,1,0,1,0,0|2,0,0]=4 26513 B14R1.520 CC(CCO)OCCC1CCOCC1 34a_100011933979_100009893172 [0,1,0,1,0,0|2,0,0]=4 26514 B14R1.520 CC(CCO)OCCC1CCOCC1 7a_100011933979_100009893172 [0,1,0,1,0,0|2,0,0]=4 26515 B14R1.520 CC(CCO)SCCC1CCCCC1 62a_100009893172_100012355289 [0,1,0,1,0,0|1,0,0]=3 26516 B14R1.520 CC(CCO)SCCC1CCCCC1 62a_100012355289_100009893172 [0,1,0,1,0,0|1,0,0]=3 26517 B14R1.520 CC(CCO)SCCC1CCOCC1 62a_100009893172_100011934994 [0,1,0,1,0,0|2,0,0]=4 26518 B14R1.520 CC(CCO)SCCC1CCOCC1 62a_100011934994_100009893172 [0,1,0,1,0,0|2,0,0]=4 26519 B14R1.520 CC(CCO)SCCN1CCCCC1 62a_100000739454_100009893172 [0,1,0,1,0,0|2,0,0]=4 26520 B14R1.520 CC(CCO)SCCN1CCCCC1 62a_100009893172_100000739454 [0,1,0,1,0,0|2,0,0]=4 26521 B14R1.520 CC(CCO)SCOC1CCCCC1 62a_100009893172_100011935260 [0,1,0,1,0,0|2,0,0]=4 26522 B14R1.520 CC(CCO)SCOC1CCCCC1 62a_100011935260_100009893172 [0,1,0,1,0,0|2,0,0]=4 26523 B14R1.520 CCCC(=O)CCCC1CCCCC1 1458a_100000211478_100000210303 [0,1,0,1,0,0|1,0,1]=4 26524 B14R1.520 CCCC(=O)CCCC1CCCCC1 1458a_100000211992_100011713725 [0,1,0,1,0,0|1,0,1]=4 26525 B14R1.520 CCCC(=O)CCOC1CCCCO1 1458a_100000211992_100000744793 [0,1,0,1,0,0|1,0,1]=4 26526 B14R1.520 CCCC(=O)CNCC1CCCCO1 2230a_100000174945_100000747444 [0,1,0,1,0,0|1,0,1]=4 26527 B14R1.520 CCCC(=O)COCC1CCCCO1 1458a_100011223378_100000210303 [0,1,0,1,0,0|1,0,1]=4 26528 B14R1.520 CCCC(=O)COCC1CCCCO1 7a_100000211370_100000747444 [0,1,0,1,0,0|1,0,1]=4 26529 B14R1.520 CCCC(=O)CSCC1CCCCO1 62a_100000211543_100000747444 [0,1,0,1,0,0|1,0,1]=4 26530 B14R1.520 CCCC(=O)CSCC1CCCCO1 62a_100000747444_100000211543 [0,1,0,1,0,0|1,0,1]=4 26531 B14R1.520 CCCC(=O)NCCC1CCCCO1 11a_100015183643_100000211992 [0,1,0,1,0,0|1,0,1]=4 26532 B14R1.520 CCCC(=O)NCCC1CCCCO1 1626a_100015183643_100000211992 [0,1,0,1,0,0|1,0,1]=4 26533 B14R1.520 CCCC(=O)NCCC1CCCCO1 240690a_100015183643_100000211992 [0,1,0,1,0,0|1,0,1]=4 26534 B14R1.520 CCCC(=O)NCCC1CCCCO1 527a_100015183643_100000211992 [0,1,0,1,0,0|1,0,1]=4 26535 B14R1.520 CCCC(C)CCOC1CCCCC1 34a_100011217855_100000210327 [0,1,0,1,0,0|2,0,0]=4 26536 B14R1.520 CCCC(C)CCOC1CCCCC1 7a_100011217855_100000210327 [0,1,0,1,0,0|2,0,0]=4 26537 B14R1.520 CCCC(C)CNCC1CCCCC1 2230a_100000210473_100011216630 [0,1,0,1,0,0|2,0,0]=4 26538 B14R1.520 CCCC(C)CNCC1CCCCC1 270004a_100000210473_100000243154 [0,1,0,1,0,0|2,0,0]=4 26539 B14R1.520 CCCC(C)CNCC1CCCCC1 34a_100000210473_100011216630 [0,1,0,1,0,0|2,0,0]=4 26540 B14R1.520 CCCC(C)CNCC1CCCCO1 2230a_100000174945_100011216630 [0,1,0,1,0,0|1,0,0]=3 26541 B14R1.520 CCCC(C)CNCC1CCCCO1 270004a_100000174945_100000243154 [0,1,0,1,0,0|1,0,0]=3 26542 B14R1.520 CCCC(C)CNCC1CCCCO1 34a_100000174945_100011216630 [0,1,0,1,0,0|1,0,0]=3 26543 B14R1.520 CCCC(C)CNC[C@H]1COCCO1 2230a_100010981119_100011216630 [0,1,0,1,0,0|2,0,0]=4 26544 B14R1.520 CCCC(C)CNC[C@H]1COCCO1 270004a_100010981119_100000243154 [0,1,0,1,0,0|2,0,0]=4 26545 B14R1.520 CCCC(C)CNC[C@H]1COCCO1 34a_100010981119_100011216630 [0,1,0,1,0,0|2,0,0]=4 26546 B14R1.520 CCCC(C)COCC1CCCCC1 34a_100000212181_100011216630 [0,1,0,1,0,0|2,0,0]=4 26547 B14R1.520 CCCC(C)COCC1CCCCC1 34a_100000688023_100000211423 [0,1,0,1,0,0|2,0,0]=4 26548 B14R1.520 CCCC(C)COCC1CCCCC1 7a_100000212181_100011216630 [0,1,0,1,0,0|2,0,0]=4 26549 B14R1.520 CCCC(C)COCC1CCCCC1 7a_100000688023_100000211423 [0,1,0,1,0,0|2,0,0]=4 26550 B14R1.520 CCCC(C)COCC1CCCCN1 34a_100000210821_100011216630 [0,1,0,1,0,0|2,0,0]=4 26551 B14R1.520 CCCC(C)COCC1CCCCO1 34a_100000211370_100011216630 [0,1,0,1,0,0|1,0,0]=3 26552 B14R1.520 CCCC(C)COCC1CCCCO1 34a_100000688023_100000211543 [0,1,0,1,0,0|1,0,0]=3 26553 B14R1.520 CCCC(C)COCC1CCCCO1 7a_100000211370_100011216630 [0,1,0,1,0,0|1,0,0]=3 26554 B14R1.520 CCCC(C)COCC1CCCCO1 7a_100000688023_100000211543 [0,1,0,1,0,0|1,0,0]=3 26555 B14R1.520 CCCC(C)COC[C@@H]1CNCCO1 34a_100015189573_100011216630 [0,1,0,1,0,0|2,0,0]=4 26556 B14R1.520 CCCC(C)COC[C@H]1COCCO1 34a_100009875890_100011216630 [0,1,0,1,0,0|2,0,0]=4 26557 B14R1.520 CCCC(C)CSCC1CCCCC1 62a_100000211423_100011216630 [0,1,0,1,0,0|2,0,0]=4 26558 B14R1.520 CCCC(C)CSCC1CCCCC1 62a_100011216630_100000211423 [0,1,0,1,0,0|2,0,0]=4 26559 B14R1.520 CCCC(C)CSCC1CCCCO1 62a_100000211543_100011216630 [0,1,0,1,0,0|1,0,0]=3 26560 B14R1.520 CCCC(C)CSCC1CCCCO1 62a_100011216630_100000211543 [0,1,0,1,0,0|1,0,0]=3 26561 B14R1.520 CCCC(C)NCCC1CCCCC1 2230a_100000738074_100000766640 [0,1,0,1,0,0|2,0,0]=4 26562 B14R1.520 CCCC(C)NCCC1CCCCC1 2230a_100000741246_100012355289 [0,1,0,1,0,0|2,0,0]=4 26563 B14R1.520 CCCC(C)NCCC1CCCCC1 270004a_100000738074_100000211909 [0,1,0,1,0,0|2,0,0]=4 26564 B14R1.520 CCCC(C)NCCC1CCCCC1 270004a_100000741246_100011713444 [0,1,0,1,0,0|2,0,0]=4 26565 B14R1.520 CCCC(C)NCCC1CCCCC1 34a_100000738074_100000766640 [0,1,0,1,0,0|2,0,0]=4 26566 B14R1.520 CCCC(C)NCCC1CCCCO1 2230a_100015183643_100000766640 [0,1,0,1,0,0|1,0,0]=3 26567 B14R1.520 CCCC(C)NCCC1CCCCO1 270004a_100015183643_100000211909 [0,1,0,1,0,0|1,0,0]=3 26568 B14R1.520 CCCC(C)NCCC1CCCCO1 34a_100015183643_100000766640 [0,1,0,1,0,0|1,0,0]=3 26569 B14R1.520 CCCC(C)NCCC1OCCCO1 2230a_100000741246_100000764188 [0,1,0,1,0,0|2,0,0]=4 26570 B14R1.520 CCCC(C)OCCC1CCCCC1 34a_100000764384_100011209188 [0,1,0,1,0,0|2,0,0]=4 26571 B14R1.520 CCCC(C)OCCC1CCCCC1 34a_100011217863_100000766640 [0,1,0,1,0,0|2,0,0]=4 26572 B14R1.520 CCCC(C)OCCC1CCCCC1 7a_100000764384_100011273959 [0,1,0,1,0,0|2,0,0]=4 26573 B14R1.520 CCCC(C)OCCC1CCCCC1 7a_100011217863_100000766640 [0,1,0,1,0,0|2,0,0]=4 26574 B14R1.520 CCCC(C)OCCC1CCCCN1 34a_100000211664_100000766640 [0,1,0,1,0,0|2,0,0]=4 26575 B14R1.520 CCCC(C)OCCC1OCCCO1 34a_100000764384_100000764188 [0,1,0,1,0,0|2,0,0]=4 26576 B14R1.520 CCCC(C)OCCC1OCCCO1 7a_100000764384_100000764188 [0,1,0,1,0,0|2,0,0]=4 26577 B14R1.520 CCCC(C)SCCC1CCCCC1 62a_100000766640_100012355289 [0,1,0,1,0,0|2,0,0]=4 26578 B14R1.520 CCCC(C)SCCC1CCCCC1 62a_100012355289_100000766640 [0,1,0,1,0,0|2,0,0]=4 26579 B14R1.520 CCCC(C)SCCC1OCCCO1 62a_100000764188_100000766640 [0,1,0,1,0,0|2,0,0]=4 26580 B14R1.520 CCCC(C)SCCC1OCCCO1 62a_100000766640_100000764188 [0,1,0,1,0,0|2,0,0]=4 26581 B14R1.520 CCCN(C)CCCC1CCCCC1 2230a_100000747261_100011713725 [0,1,0,1,0,0|2,0,0]=4 26582 B14R1.520 CCCN(C)CCCC1CCCCC1 269982a_100000747261_100011713725 [0,1,0,1,0,0|2,0,0]=4 26583 B14R1.520 CCCN(C)CCOC1CCCCO1 2230a_100000747261_100000744793 [0,1,0,1,0,0|2,0,0]=4 26584 B14R1.520 CCCN(C)CCOC1CCCCO1 269982a_100000747261_100000744793 [0,1,0,1,0,0|2,0,0]=4 26585 B14R1.520 CCC[C@H](N)CCOC1CCCCC1 34a_100015193777_100000210327 [0,1,0,1,0,0|2,0,0]=4 26586 B14R1.520 CCC[C@H](N)COCC1CCCCC1 34a_100000732646_100000211423 [0,1,0,1,0,0|2,0,0]=4 26587 B14R1.520 CCC[C@H](N)COCC1CCCCO1 34a_100000732646_100000211543 [0,1,0,1,0,0|1,0,0]=3 26588 B14R1.520 CN(CCO)CCCC1CCCCC1 2230a_100000210263_100011713725 [0,1,0,1,0,0|1,0,0]=3 26589 B14R1.520 CN(CCO)CCCC1CCCCC1 269982a_100000210263_100011713725 [0,1,0,1,0,0|1,0,0]=3 26590 B14R1.520 CN(CCO)CCCN1CCCCC1 2230a_100000210263_100000690320 [0,1,0,1,0,0|2,0,0]=4 26591 B14R1.520 CN(CCO)CCCN1CCCCC1 269982a_100000210263_100000690320 [0,1,0,1,0,0|2,0,0]=4 26592 B14R1.520 CN(CCO)CCOC1CCCCC1 2230a_100000210263_100011211530 [0,1,0,1,0,0|2,0,0]=4 26593 B14R1.520 CN(CCO)CCOC1CCCCC1 269982a_100000210263_100011211530 [0,1,0,1,0,0|2,0,0]=4 26594 B14R1.520 COCC(C)NCCC1CCCCO1 2230a_100015183643_100000765312 [0,1,0,1,0,0|2,0,0]=4 26595 B14R1.520 COCC(C)NCCC1CCCCO1 270004a_100015183643_100000749346 [0,1,0,1,0,0|2,0,0]=4 26596 B14R1.520 COCC(C)NCCC1CCCCO1 34a_100015183643_100000765312 [0,1,0,1,0,0|2,0,0]=4 26597 B14R1.520 COCC(N)COCC1CCCCO1 34a_100000724102_100000211543 [0,1,0,1,0,0|2,0,0]=4 26598 B14R1.520 COCC(O)CNCC1CCCCO1 2230a_100000756049_100000211543 [0,1,0,1,0,0|2,0,0]=4 26599 B14R1.520 COCC(O)CNCC1CCCCO1 34a_100000174945_100011215053 [0,1,0,1,0,0|2,0,0]=4 26600 B14R1.520 COCC(O)CNCC1CCCCO1 34a_100000756049_100000211543 [0,1,0,1,0,0|2,0,0]=4 26601 B14R1.520 COCC(O)COCC1CCCCO1 34a_100000211370_100011215053 [0,1,0,1,0,0|2,0,0]=4 26602 B14R1.520 COCC(O)COCC1CCCCO1 7a_100000211370_100011215053 [0,1,0,1,0,0|2,0,0]=4 26603 B14R1.520 COCC(O)CSCC1CCCCO1 62a_100000211543_100011215053 [0,1,0,1,0,0|2,0,0]=4 26604 B14R1.520 COCC(O)CSCC1CCCCO1 62a_100011215053_100000211543 [0,1,0,1,0,0|2,0,0]=4 26605 B14R1.520 CSCC(C)NCCC1CCCCO1 270004a_100015183643_100011216314 [0,1,0,1,0,0|2,0,0]=4 26606 B14R1.520 C[C@H](CCO)NCCC1CCCCC1 2230a_100000706166_100012355289 [0,1,0,1,0,0|1,0,0]=3 26607 B14R1.520 C[C@H](CCO)NCCC1CCCCC1 270004a_100000706166_100011713444 [0,1,0,1,0,0|1,0,0]=3 26608 B14R1.520 C[C@H](CCO)NCCC1CCCCC1 34a_100000706166_100011209188 [0,1,0,1,0,0|1,0,0]=3 26609 B14R1.520 C[C@H](CCO)NCCC1CCOCC1 2230a_100000706166_100011934994 [0,1,0,1,0,0|2,0,0]=4 26610 B14R1.520 C[C@H](CCO)NCCC1CCOCC1 34a_100000706166_100011934994 [0,1,0,1,0,0|2,0,0]=4 26611 B14R1.520 C[C@H](CCO)NCCN1CCCCC1 2230a_100000706166_100000739454 [0,1,0,1,0,0|2,0,0]=4 26612 B14R1.520 C[C@H](CCO)NCCN1CCCCC1 34a_100000706166_100000739454 [0,1,0,1,0,0|2,0,0]=4 26613 B14R1.520 C[C@H](CCO)NCOC1CCCCC1 2230a_100000706166_100011935260 [0,1,0,1,0,0|2,0,0]=4 26614 B14R1.520 C[C@H](CCO)NCOC1CCCCC1 34a_100000706166_100011935260 [0,1,0,1,0,0|2,0,0]=4 26615 B14R1.520 O=C(CCF)CCCC1CCCCC1 1458a_100000211478_100011217306 [0,1,0,1,0,0|1,0,1]=4 26616 B14R1.520 O=C(CCO)CCCC1CCCCC1 1458a_100000211478_100000211926 [0,1,0,1,0,0|0,0,1]=3 26617 B14R1.520 O=C(CCO)CCCC1CCCCC1 1458a_100011216618_100011713725 [0,1,0,1,0,0|0,0,1]=3 26618 B14R1.520 O=C(CCO)CCCN1CCCCC1 1458a_100000742516_100000211926 [0,1,0,1,0,0|1,0,1]=4 26619 B14R1.520 O=C(CCO)CCCN1CCCCC1 1458a_100011216618_100000690320 [0,1,0,1,0,0|1,0,1]=4 26620 B14R1.520 O=C(CCO)CCOC1CCCCC1 1458a_100011216618_100011211530 [0,1,0,1,0,0|1,0,1]=4 26621 B14R1.520 O=C(CCO)NCCC1CCCCC1 240690a_100000738074_100011216618 [0,1,0,1,0,0|1,0,1]=4 26622 B14R1.598 CC(CCN)COC1CCCCC1O 34a_106354213184_100000038908 [0,1,0,1,0,0|2,0,0]=4 26623 B14R1.598 CC(CCO)NCC1CCCCC1O 34a_100011216029_100009893172 [0,1,0,1,0,0|2,0,0]=4 26624 B14R1.598 CC(CCO)NCC1CCCCN1C 34a_100011228421_100009893172 [0,1,0,1,0,0|2,0,0]=4 26625 B14R1.598 CC(CCO)OCC1CCCCN1C 34a_100000225079_100009893172 [0,1,0,1,0,0|2,0,0]=4 26626 B14R1.598 CC(CCO)SCC1CCCCN1C 62a_100009893172_100015185383 [0,1,0,1,0,0|2,0,0]=4 26627 B14R1.598 CC(CCO)SCC1CCCCN1C 62a_100015185383_100009893172 [0,1,0,1,0,0|2,0,0]=4 26628 B14R1.598 CC1CCCCC1OCC(=O)CCO 1458a_100011223357_100000211926 [0,1,0,1,0,0|1,0,1]=4 26629 B14R1.598 CC1CCCCN1CCN(C)CCO 2230a_200011233311_100000211926 [0,1,0,1,0,0|2,0,0]=4 26630 B14R1.598 CC1CCCCN1CCN(C)CCO 269982a_200011233311_100000211926 [0,1,0,1,0,0|2,0,0]=4 26631 B14R1.598 CCCC(=O)CSC1CCCCC1O 62a_100000038908_100000747444 [0,1,0,1,0,0|1,0,1]=4 26632 B14R1.598 CCCC(=O)CSC1CCCCC1O 62a_100000747444_100000038908 [0,1,0,1,0,0|1,0,1]=4 26633 B14R1.598 CCCC(=O)NCC1CCCCC1O 240690a_100011216029_100000211992 [0,1,0,1,0,0|1,0,1]=4 26634 B14R1.598 CCCC(=O)NCC1CCCCC1O 527a_100011216029_100000211992 [0,1,0,1,0,0|1,0,1]=4 26635 B14R1.598 CCCC(C)CNC1CCCCC1C 2230a_100000211402_100011216630 [0,1,0,1,0,0|2,0,0]=4 26636 B14R1.598 CCCC(C)CNC1CCCCC1C 270004a_100000211402_100000243154 [0,1,0,1,0,0|2,0,0]=4 26637 B14R1.598 CCCC(C)CNC1CCCCC1C 34a_100000211402_100011216630 [0,1,0,1,0,0|2,0,0]=4 26638 B14R1.598 CCCC(C)CN[C@@H]1CCCC[C@@H]1O 270004a_100015191688_100000243154 [0,1,0,1,0,0|1,0,0]=3 26639 B14R1.598 CCCC(C)CN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100011216630 [0,1,0,1,0,0|2,0,0]=4 26640 B14R1.598 CCCC(C)CN[C@@H]1CCCC[C@H]1F 270004a_100015195156_100000243154 [0,1,0,1,0,0|2,0,0]=4 26641 B14R1.598 CCCC(C)CN[C@@H]1CCCC[C@H]1F 34a_100015195156_100011216630 [0,1,0,1,0,0|2,0,0]=4 26642 B14R1.598 CCCC(C)CN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100011216630 [0,1,0,1,0,0|2,0,0]=4 26643 B14R1.598 CCCC(C)CN[C@@H]1CCOC[C@@H]1O 270004a_100016994285_100000243154 [0,1,0,1,0,0|2,0,0]=4 26644 B14R1.598 CCCC(C)CN[C@H]1COCC[C@@H]1O 2230a_100015739063_100011216630 [0,1,0,1,0,0|2,0,0]=4 26645 B14R1.598 CCCC(C)CN[C@H]1COCC[C@@H]1O 270004a_100015739063_100000243154 [0,1,0,1,0,0|2,0,0]=4 26646 B14R1.598 CCCC(C)COC1CCCCC1C 34a_100000211207_100011216630 [0,1,0,1,0,0|2,0,0]=4 26647 B14R1.598 CCCC(C)COC1CCCCC1C 7a_100000211207_100011216630 [0,1,0,1,0,0|2,0,0]=4 26648 B14R1.598 CCCC(C)COC1CCCCC1Cl 34a_100000038908_100011216630 [0,1,0,1,0,0|2,0,0]=4 26649 B14R1.598 CCCC(C)COC1CCCCC1Cl 7a_100000038908_100011216630 [0,1,0,1,0,0|2,0,0]=4 26650 B14R1.598 CCCC(C)COC1CCCCC1F 34a_100000688023_100015423560 [0,1,0,1,0,0|2,0,0]=4 26651 B14R1.598 CCCC(C)COC1CCCCC1O 34a_100000688023_100000038908 [0,1,0,1,0,0|1,0,0]=3 26652 B14R1.598 CCCC(C)CO[C@@H]1CCCC[C@H]1F 34a_100009816020_100011216630 [0,1,0,1,0,0|2,0,0]=4 26653 B14R1.598 CCCC(C)CO[C@@H]1CCCC[C@H]1F 7a_100009816020_100011216630 [0,1,0,1,0,0|2,0,0]=4 26654 B14R1.598 CCCC(C)CO[C@H]1CCCC[C@H]1N 34a_100015191688_100011216630 [0,1,0,1,0,0|2,0,0]=4 26655 B14R1.598 CCCC(C)CSC1CCCCC1F 62a_100011216630_100015423560 [0,1,0,1,0,0|2,0,0]=4 26656 B14R1.598 CCCC(C)CSC1CCCCC1F 62a_100015423560_100011216630 [0,1,0,1,0,0|2,0,0]=4 26657 B14R1.598 CCCC(C)CSC1CCCCC1O 62a_100000038908_100011216630 [0,1,0,1,0,0|1,0,0]=3 26658 B14R1.598 CCCC(C)CSC1CCCCC1O 62a_100011216630_100000038908 [0,1,0,1,0,0|1,0,0]=3 26659 B14R1.598 CCCC(C)NCC1CCCCC1O 270004a_100011216029_100000211909 [0,1,0,1,0,0|1,0,0]=3 26660 B14R1.598 CCCC(C)NCC1CCCCC1O 34a_100011216029_100000766640 [0,1,0,1,0,0|1,0,0]=3 26661 B14R1.598 CCC[C@H](N)COC1CCCCC1F 34a_100000732646_100015423560 [0,1,0,1,0,0|2,0,0]=4 26662 B14R1.598 CCC[C@H](N)COC1CCCCC1O 34a_100000732646_100000038908 [0,1,0,1,0,0|1,0,0]=3 26663 B14R1.598 CN(CCO)CCC1CCCCN1C 2230a_100000210263_100000211948 [0,1,0,1,0,0|2,0,0]=4 26664 B14R1.598 CN(CCO)CCC1CCCCN1C 269982a_100000210263_100000211948 [0,1,0,1,0,0|2,0,0]=4 26665 B14R1.598 CN1CCCCC1CCC(=O)CCO 1458a_100000718493_100000211926 [0,1,0,1,0,0|1,0,1]=4 26666 B14R1.598 CN1CCCCC1CCC(=O)CCO 1458a_100011216618_100000211948 [0,1,0,1,0,0|1,0,1]=4 26667 B14R1.598 COCC(C)NCC1CCCCC1O 270004a_100011216029_100000749346 [0,1,0,1,0,0|2,0,0]=4 26668 B14R1.598 COCC(C)NCC1CCCCC1O 34a_100011216029_100000765312 [0,1,0,1,0,0|2,0,0]=4 26669 B14R1.598 COCC(N)COC1CCCCC1O 34a_100000724102_100000038908 [0,1,0,1,0,0|2,0,0]=4 26670 B14R1.598 COCC(O)CNC1CCCCC1O 34a_100000756049_100000038908 [0,1,0,1,0,0|2,0,0]=4 26671 B14R1.598 COCC(O)CSC1CCCCC1O 62a_100000038908_100011215053 [0,1,0,1,0,0|2,0,0]=4 26672 B14R1.598 COCC(O)CSC1CCCCC1O 62a_100011215053_100000038908 [0,1,0,1,0,0|2,0,0]=4 26673 B14R1.598 CSCC(C)NCC1CCCCC1O 270004a_100011216029_100011216314 [0,1,0,1,0,0|2,0,0]=4 26674 B14R1.598 C[C@H](CCO)NCC1CCCCN1C 34a_100000706166_100015186950 [0,1,0,1,0,0|2,0,0]=4 26675 B14R1.609 CC(CCBr)OCCCC1CCCC1 34a_100012276601_100011713738 [0,1,0,1,0,0|2,0,0]=4 26676 B14R1.609 CC(CCN)COCCC1CCCC1 34a_106354213184_100000760354 [0,1,0,1,0,0|2,0,0]=4 26677 B14R1.609 CC(CCO)NCCCC1CCCC1 2230a_100000736752_100009893172 [0,1,0,1,0,0|1,0,0]=3 26678 B14R1.609 CC(CCO)NCCCC1CCCC1 34a_100000736752_100009893172 [0,1,0,1,0,0|1,0,0]=3 26679 B14R1.609 CC(CCO)NCCOC1CCCC1 34a_100000741755_100009893172 [0,1,0,1,0,0|2,0,0]=4 26680 B14R1.609 CC(CCO)OCCCC1CCCC1 34a_100011215328_100009893172 [0,1,0,1,0,0|1,0,0]=3 26681 B14R1.609 CC(CCO)OCCCC1CCCC1 7a_100011215328_100009893172 [0,1,0,1,0,0|1,0,0]=3 26682 B14R1.609 CC(CCO)OCCNC1CCCC1 34a_200000200444_100009893172 [0,1,0,1,0,0|2,0,0]=4 26683 B14R1.609 CC(CCO)OCCOC1CCCC1 34a_100000738311_100009893172 [0,1,0,1,0,0|2,0,0]=4 26684 B14R1.609 CC(CCO)OCCOC1CCCC1 7a_100000738311_100009893172 [0,1,0,1,0,0|2,0,0]=4 26685 B14R1.609 CC(CCO)SCCCC1CCCC1 62a_100009893172_100011713738 [0,1,0,1,0,0|1,0,0]=3 26686 B14R1.609 CC(CCO)SCCCC1CCCC1 62a_100011713738_100009893172 [0,1,0,1,0,0|1,0,0]=3 26687 B14R1.609 CC(CCO)SCCCN1CCCC1 62a_100009893172_100011445909 [0,1,0,1,0,0|2,0,0]=4 26688 B14R1.609 CC(CCO)SCCCN1CCCC1 62a_100016991639_100009893172 [0,1,0,1,0,0|2,0,0]=4 26689 B14R1.609 CCCC(=O)CCCCC1OCCO1 1458a_100000211992_100000034956 [0,1,0,1,0,0|1,0,1]=4 26690 B14R1.609 CCCC(C)CCCOC1CCCC1 34a_100011713154_100000179811 [0,1,0,1,0,0|2,0,0]=4 26691 B14R1.609 CCCC(C)CCCOC1CCCC1 7a_100011713154_100000179811 [0,1,0,1,0,0|2,0,0]=4 26692 B14R1.609 CCCC(C)CCOCC1CCCC1 34a_100011217855_100000740388 [0,1,0,1,0,0|2,0,0]=4 26693 B14R1.609 CCCC(C)CCOCC1CCCC1 7a_100011217855_100000740388 [0,1,0,1,0,0|2,0,0]=4 26694 B14R1.609 CCCC(C)CCOCC1CCCO1 7a_100011217855_100000203698 [0,1,0,1,0,0|1,0,0]=3 26695 B14R1.609 CCCC(C)CCOCC1OCCO1 34a_100011217855_100000755774 [0,1,0,1,0,0|2,0,0]=4 26696 B14R1.609 CCCC(C)CCOCC1OCCO1 7a_100011217855_100000755774 [0,1,0,1,0,0|2,0,0]=4 26697 B14R1.609 CCCC(C)CNCCC1CCCC1 2230a_100000739158_100011216630 [0,1,0,1,0,0|2,0,0]=4 26698 B14R1.609 CCCC(C)CNCCC1CCCC1 270004a_100000739158_100000243154 [0,1,0,1,0,0|2,0,0]=4 26699 B14R1.609 CCCC(C)CNCCC1CCCC1 34a_100000739158_100011216630 [0,1,0,1,0,0|2,0,0]=4 26700 B14R1.609 CCCC(C)CNCCC1OCCO1 2230a_100000034215_100011216630 [0,1,0,1,0,0|2,0,0]=4 26701 B14R1.609 CCCC(C)CNCCC1OCCO1 270004a_100000034215_100000243154 [0,1,0,1,0,0|2,0,0]=4 26702 B14R1.609 CCCC(C)CNCCC1OCCO1 34a_100000034215_100011216630 [0,1,0,1,0,0|2,0,0]=4 26703 B14R1.609 CCCC(C)COCCC1CCCC1 34a_100000688023_100000760354 [0,1,0,1,0,0|2,0,0]=4 26704 B14R1.609 CCCC(C)COCCC1CCCC1 34a_100000749090_100011216630 [0,1,0,1,0,0|2,0,0]=4 26705 B14R1.609 CCCC(C)COCCC1CCCC1 7a_100000688023_100000760354 [0,1,0,1,0,0|2,0,0]=4 26706 B14R1.609 CCCC(C)COCCC1CCCC1 7a_100000749090_100011216630 [0,1,0,1,0,0|2,0,0]=4 26707 B14R1.609 CCCC(C)COCCC1OCCO1 34a_100000688023_100000740749 [0,1,0,1,0,0|2,0,0]=4 26708 B14R1.609 CCCC(C)COCCC1OCCO1 7a_100000688023_100000740749 [0,1,0,1,0,0|2,0,0]=4 26709 B14R1.609 CCCC(C)CSCCC1CCCC1 62a_100000760354_100011216630 [0,1,0,1,0,0|2,0,0]=4 26710 B14R1.609 CCCC(C)CSCCC1CCCC1 62a_100011216630_100000760354 [0,1,0,1,0,0|2,0,0]=4 26711 B14R1.609 CCCC(C)CSCCC1OCCO1 62a_100011216630_100000740749 [0,1,0,1,0,0|2,0,0]=4 26712 B14R1.609 CCCC(C)NCCCC1CCCC1 2230a_100000736752_100000766640 [0,1,0,1,0,0|2,0,0]=4 26713 B14R1.609 CCCC(C)NCCCC1CCCC1 2230a_100000741246_100011713738 [0,1,0,1,0,0|2,0,0]=4 26714 B14R1.609 CCCC(C)NCCCC1CCCC1 270004a_100000736752_100000211909 [0,1,0,1,0,0|2,0,0]=4 26715 B14R1.609 CCCC(C)NCCCC1CCCC1 34a_100000736752_100000766640 [0,1,0,1,0,0|2,0,0]=4 26716 B14R1.609 CCCC(C)NCCCC1OCCO1 2230a_100000741246_100000042513 [0,1,0,1,0,0|2,0,0]=4 26717 B14R1.609 CCCC(C)OCCCC1CCCC1 34a_100000764384_100011713738 [0,1,0,1,0,0|2,0,0]=4 26718 B14R1.609 CCCC(C)OCCCC1CCCC1 34a_100011215328_100000766640 [0,1,0,1,0,0|2,0,0]=4 26719 B14R1.609 CCCC(C)OCCCC1CCCC1 7a_100000764384_100011713738 [0,1,0,1,0,0|2,0,0]=4 26720 B14R1.609 CCCC(C)OCCCC1CCCC1 7a_100011215328_100000766640 [0,1,0,1,0,0|2,0,0]=4 26721 B14R1.609 CCCC(C)OCCCC1OCCO1 34a_100000764384_100009861162 [0,1,0,1,0,0|2,0,0]=4 26722 B14R1.609 CCCC(C)OCCCC1OCCO1 34a_100009871617_100000766640 [0,1,0,1,0,0|2,0,0]=4 26723 B14R1.609 CCCC(C)OCCCC1OCCO1 7a_100000764384_100000042513 [0,1,0,1,0,0|2,0,0]=4 26724 B14R1.609 CCCC(C)OCCCC1OCCO1 7a_100009871617_100000766640 [0,1,0,1,0,0|2,0,0]=4 26725 B14R1.609 CCCC(C)SCCCC1CCCC1 62a_100000766640_100011713738 [0,1,0,1,0,0|2,0,0]=4 26726 B14R1.609 CCCC(C)SCCCC1CCCC1 62a_100011713738_100000766640 [0,1,0,1,0,0|2,0,0]=4 26727 B14R1.609 CCCC(C)SCCCC1OCCO1 62a_100000766640_100000042513 [0,1,0,1,0,0|2,0,0]=4 26728 B14R1.609 CCCN(C)CCCCC1OCCO1 2230a_100000747261_100000034956 [0,1,0,1,0,0|2,0,0]=4 26729 B14R1.609 CCCN(C)CCCCC1OCCO1 269982a_100000747261_100000034956 [0,1,0,1,0,0|2,0,0]=4 26730 B14R1.609 CCC[C@H](N)CCOCC1CCCC1 34a_100015193777_100000740388 [0,1,0,1,0,0|2,0,0]=4 26731 B14R1.609 CCC[C@H](N)CCOCC1OCCO1 34a_100015193777_100000755774 [0,1,0,1,0,0|2,0,0]=4 26732 B14R1.609 CCC[C@H](N)COCCC1CCCC1 34a_100000732646_100000760354 [0,1,0,1,0,0|2,0,0]=4 26733 B14R1.609 CCC[C@H](N)COCCC1OCCO1 34a_100000732646_100000740749 [0,1,0,1,0,0|2,0,0]=4 26734 B14R1.609 C[C@H](CCO)NCCCC1CCCC1 2230a_100000706166_100011713738 [0,1,0,1,0,0|1,0,0]=3 26735 B14R1.609 C[C@H](CCO)NCCCC1CCCC1 34a_100000706166_100011713738 [0,1,0,1,0,0|1,0,0]=3 26736 B14R1.609 C[C@H](CCO)NCCCN1CCCC1 2230a_100000706166_100011445909 [0,1,0,1,0,0|2,0,0]=4 26737 B14R1.609 C[C@H](CCO)NCCCN1CCCC1 34a_100000706166_100016991639 [0,1,0,1,0,0|2,0,0]=4 26738 B14R1.609 O=C(CCO)NCCCC1CCCC1 240690a_100000736752_100011216618 [0,1,0,1,0,0|1,0,1]=4 26739 B14R1.612 CCCC(C)CCCOCC1CCC1 34a_100011713154_100000763275 [0,1,0,1,0,0|2,0,0]=4 26740 B14R1.612 CCCC(C)CCCOCC1CCC1 7a_100011713154_100000763275 [0,1,0,1,0,0|2,0,0]=4 26741 B14R1.612 CCCC(C)CCCOCC1CCO1 34a_100011713154_100000103362 [0,1,0,1,0,0|1,0,0]=3 26742 B14R1.612 CCCC(C)CCCOCC1CCO1 7a_100011713154_100000103362 [0,1,0,1,0,0|1,0,0]=3 26743 B14R1.635 CCCCC1CCCC1N(C)CCC 270004a_100000747261_100000750825 [0,1,0,1,0,0|2,0,0]=4 26744 B14R1.635 CCCCC1CCCC1N(C)CCO 270004a_100000210263_100000750825 [0,1,0,1,0,0|1,0,0]=3 26745 B14R1.767 C=C1CC(C1)CNCCCCCCO 2230a_100102567296_100000766143 [0,1,0,1,0,0|1,0,1]=4 26746 B14R1.767 C=C1CC(C1)CNCCCCCCO 34a_100102567296_100000766143 [0,1,0,1,0,0|1,0,1]=4 26747 B14R1.767 C=C1CC(C1)COCCCCCCO 34a_100011011225_100000766143 [0,1,0,1,0,0|1,0,1]=4 26748 B14R1.767 C=C1CC(C1)NCCCCCCCO 2230a_100132301982_100000760002 [0,1,0,1,0,0|1,0,1]=4 26749 B14R1.767 CC1CN(C1)CCCCCCCCO 2230a_100000702820_100000033203 [0,1,0,1,0,0|1,0,0]=3 26750 B14R1.767 CC1CN(C1)CCCCCCCCO 269982a_100000702820_100000033203 [0,1,0,1,0,0|1,0,0]=3 26751 B14R1.767 CC1CN(C1)CCCCCCCCO 34a_100000702820_100000033203 [0,1,0,1,0,0|1,0,0]=3 26752 B14R1.767 CCCCCCCCCN1CC(C1)C 2230a_100000702820_100011214924 [0,1,0,1,0,0|2,0,0]=4 26753 B14R1.767 CCCCCCCCCN1CC(C1)C 269982a_100000702820_100000210670 [0,1,0,1,0,0|2,0,0]=4 26754 B14R1.767 CCCCCCCCCN1CC(C1)C 34a_100000702820_100011214924 [0,1,0,1,0,0|2,0,0]=4 26755 B14R1.767 CCCCCCCCCN1CC(C1)F 2230a_100000690557_100011214924 [0,1,0,1,0,0|2,0,0]=4 26756 B14R1.767 CCCCCCCCCN1CC(C1)F 269982a_100000690557_100000210670 [0,1,0,1,0,0|2,0,0]=4 26757 B14R1.767 CCCCCCCCCN1CC(C1)F 34a_100000690557_100011214924 [0,1,0,1,0,0|2,0,0]=4 26758 B14R1.767 CCCCCCCCCN1CC(C1)O 269982a_100000749847_100000210670 [0,1,0,1,0,0|1,0,0]=3 26759 B14R1.767 CCCCCCCCNC1CC(C1)F 2230a_100016993743_100000210759 [0,1,0,1,0,0|2,0,0]=4 26760 B14R1.767 CCCCCCCCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100000210759 [0,1,0,1,0,0|1,0,0]=3 26761 B14R1.767 CCCCCCCNCC1CC(C1)O 2230a_100016992100_100000210681 [0,1,0,1,0,0|1,0,0]=3 26762 B14R1.767 CCCCCCCOCC1CC(C1)Cl 34a_100009874164_100000210614 [0,1,0,1,0,0|2,0,0]=4 26763 B14R1.767 CCCCOCCNCC1CC(C1)O 2230a_100016992100_100000743108 [0,1,0,1,0,0|2,0,0]=4 26764 B14R1.767 COCCCCCCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100011998445 [0,1,0,1,0,0|2,0,0]=4 26765 B14R1.767 FCCCCCCOCC1CC(C1)Cl 34a_100009874164_100015922095 [0,1,0,1,0,0|2,0,0]=4 26766 B14R1.767 O=C1CC(C1)CNCCCCCCO 2230a_100000686447_100009874392 [0,1,0,1,0,0|1,0,1]=4 26767 B14R1.767 O=C1CC(C1)COCCCCCCO 34a_100000101936_100000766143 [0,1,0,1,0,0|1,0,1]=4 26768 B14R1.767 O=C1CC(C1)CSCCCCCCO 62a_100000766143_100009874392 [0,1,0,1,0,0|1,0,1]=4 26769 B14R1.767 O=C1CC(C1)CSCCCCCCO 62a_100009874392_100000766143 [0,1,0,1,0,0|1,0,1]=4 26770 B14R1.767 O=C1CC(C1)SCCCCCCCO 62a_100009894365_100000760002 [0,1,0,1,0,0|1,0,1]=4 26771 B14R1.767 OC1CC(C1)CNCCCCCCF 2230a_100016992100_100015922095 [0,1,0,1,0,0|2,0,0]=4 26772 B14R1.767 OCCCCCCCCN1CC(C1)F 2230a_100000690557_100000033203 [0,1,0,1,0,0|1,0,0]=3 26773 B14R1.767 OCCCCCCCCN1CC(C1)F 269982a_100000690557_100000033203 [0,1,0,1,0,0|1,0,0]=3 26774 B14R1.767 OCCCCCCCCN1CC(C1)F 34a_100000690557_100000033203 [0,1,0,1,0,0|1,0,0]=3 26775 B14R1.767 OCCCCCCCCN1CC(C1)O 269982a_100000749847_100000033203 [0,1,0,1,0,0|1,0,0]=3 26776 B14R1.767 OCCCCCCCNC1CC(C1)F 2230a_100016993743_100000760002 [0,1,0,1,0,0|1,0,0]=3 26777 B14R1.767 OCCCCCCCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100000760002 [0,1,0,1,0,0|1,0,0]=3 26778 B14R1.767 OCCCCCCNCC1CC(C1)O 2230a_100016992100_100000766143 [0,1,0,1,0,0|1,0,0]=3 26779 B14R1.767 OCCCCCCOCC1CC(C1)Cl 34a_100009874164_100000766143 [0,1,0,1,0,0|1,0,0]=3 26780 B14R1.774 CC1CCC(C(C1)C)OCCCCF 34a_100011539931_100000729493 [0,1,0,1,0,0|2,0,0]=4 26781 B14R1.774 CC1CCC(C(C1)C)OCCCCF 7a_100011539931_100000729493 [0,1,0,1,0,0|2,0,0]=4 26782 B14R1.774 CC1CCC(C(C1)C)OCCCCO 34a_100011539931_100011216708 [0,1,0,1,0,0|1,0,0]=3 26783 B14R1.774 CC1CCC(C(C1)C)OCCCCO 7a_100011539931_100000210776 [0,1,0,1,0,0|1,0,0]=3 26784 B14R1.774 CCCCCOC1CCC(CC1C)C 34a_100011539931_100000718602 [0,1,0,1,0,0|2,0,0]=4 26785 B14R1.774 CCCCCOC1CCC(CC1C)C 7a_100011539931_100000210326 [0,1,0,1,0,0|2,0,0]=4 26786 B14R1.774 C[C@H]1CN(CCN1CCCCCO)C 2230a_100012002466_100000746330 [0,1,0,1,0,0|2,0,0]=4 26787 B14R1.774 C[C@H]1CN(CCN1CCCCCO)C 269982a_100012002466_100000746330 [0,1,0,1,0,0|2,0,0]=4 26788 B14R1.898 CCCC1CC(CCN1)NCCCO 270004a_100000182051_100016991347 [0,1,0,1,0,0|2,0,0]=4 26789 B14R1.898 CCCCCN1CCCC(C1)CCO 2230a_100000752241_100000210326 [0,1,0,1,0,0|1,0,0]=3 26790 B14R1.898 CCCCCN1CCCC(C1)CCO 269982a_100000752241_100000210215 [0,1,0,1,0,0|1,0,0]=3 26791 B14R1.898 CCCCCN1CCCC(C1)CCO 34a_100000752241_100000718602 [0,1,0,1,0,0|1,0,0]=3 26792 B14R1.898 CCCN1CCCC(C1)NCCCO 2230a_100011435248_100000230001 [0,1,0,1,0,0|2,0,0]=4 26793 B14R1.898 CCOC1CCCN(C1)CCCCO 2230a_100000745229_100000210776 [0,1,0,1,0,0|2,0,0]=4 26794 B14R1.898 CCOC1CCCN(C1)CCCCO 269982a_100000745229_100000210776 [0,1,0,1,0,0|2,0,0]=4 26795 B14R1.898 CCOC1CCCN(C1)CCCCO 34a_100000745229_100011216708 [0,1,0,1,0,0|2,0,0]=4 26796 B14R1.898 CCOCCN1CCCC(C1)CCO 2230a_100000752241_100011215890 [0,1,0,1,0,0|2,0,0]=4 26797 B14R1.898 CCOCCN1CCCC(C1)CCO 269982a_100000752241_100011215890 [0,1,0,1,0,0|2,0,0]=4 26798 B14R1.898 CCOCCN1CCCC(C1)CCO 34a_100000752241_100000210147 [0,1,0,1,0,0|2,0,0]=4 26799 B14R1.898 CCSCCN1CCCC(C1)CCO 2230a_100000752241_100000757381 [0,1,0,1,0,0|2,0,0]=4 26800 B14R1.898 CCSCCN1CCCC(C1)CCO 269982a_100000752241_100000757381 [0,1,0,1,0,0|2,0,0]=4 26801 B14R1.898 CCSCCN1CCCC(C1)CCO 34a_100000752241_100000757381 [0,1,0,1,0,0|2,0,0]=4 26802 B14R1.898 COCC1CCCN(C1)CCCCO 2230a_100000755410_100000210776 [0,1,0,1,0,0|2,0,0]=4 26803 B14R1.898 COCC1CCCN(C1)CCCCO 269982a_100000755410_100000210776 [0,1,0,1,0,0|2,0,0]=4 26804 B14R1.898 COCC1CCCN(C1)CCCCO 34a_100000755410_100011216708 [0,1,0,1,0,0|2,0,0]=4 26805 B14R1.898 COCCCC1CCCN(C1)CCO 2230a_200011934583_100000211926 [0,1,0,1,0,0|2,0,0]=4 26806 B14R1.898 COCCCC1CCCN(C1)CCO 269982a_200011934583_100000211926 [0,1,0,1,0,0|2,0,0]=4 26807 B14R1.898 COCCCC1CCCN(C1)CCO 34a_200011934583_100000211926 [0,1,0,1,0,0|2,0,0]=4 26808 B14R1.898 COCCCN1CCCC(C1)CCO 2230a_100000752241_100000740836 [0,1,0,1,0,0|2,0,0]=4 26809 B14R1.898 COCCCN1CCCC(C1)CCO 269982a_100000752241_100000740836 [0,1,0,1,0,0|2,0,0]=4 26810 B14R1.898 COCCCN1CCCC(C1)CCO 34a_100000752241_100000740836 [0,1,0,1,0,0|2,0,0]=4 26811 B14R1.898 OCCC1CCCN(C1)CCCCF 2230a_100000752241_100000729493 [0,1,0,1,0,0|2,0,0]=4 26812 B14R1.898 OCCC1CCCN(C1)CCCCF 269982a_100000752241_100000729493 [0,1,0,1,0,0|2,0,0]=4 26813 B14R1.898 OCCC1CCCN(C1)CCCCF 34a_100000752241_100000729493 [0,1,0,1,0,0|2,0,0]=4 26814 B14R1.898 OCCCCN1CCCC(C1)CCO 2230a_100000752241_100000210776 [0,1,0,1,0,0|2,0,0]=4 26815 B14R1.898 OCCCCN1CCCC(C1)CCO 269982a_100000752241_100000210776 [0,1,0,1,0,0|2,0,0]=4 26816 B14R1.898 OCCCCN1CCCC(C1)CCO 34a_100000752241_100011216708 [0,1,0,1,0,0|2,0,0]=4 26817 B14R1.947 CCN1CCCC1CNC(C)CCO 2230a_100000211693_100009893172 [0,1,0,1,0,0|2,0,0]=4 26818 B14R1.947 CCN1CCC[C@@H]1COC(C)CCO 34a_100011739246_100009893172 [0,1,0,1,0,0|2,0,0]=4 26819 B14R1.947 CCN1CCC[C@@H]1COC(C)CCO 7a_100011739246_100009893172 [0,1,0,1,0,0|2,0,0]=4 26820 B14R1.948 CC(CCO)OCCC1CCCN1C 34a_100011215177_100009893172 [0,1,0,1,0,0|2,0,0]=4 26821 B14R1.948 CC(CCO)OCCC1CCCN1C 7a_100011215177_100009893172 [0,1,0,1,0,0|2,0,0]=4 26822 B14R1.948 CC(CCO)SCCC1CCCN1C 62a_100000005710_100009893172 [0,1,0,1,0,0|2,0,0]=4 26823 B14R1.948 CC(CCO)SCCC1CCCN1C 62a_100009893172_100000005710 [0,1,0,1,0,0|2,0,0]=4 26824 B14R1.948 CCCC(C)CCOC1COCC1O 34a_100011217855_200000725654 [0,1,0,1,0,0|2,0,0]=4 26825 B14R1.948 CCCC(C)CCOC1COCC1O 7a_100011217855_200000725654 [0,1,0,1,0,0|2,0,0]=4 26826 B14R1.948 CCC[C@H](N)CCOC1COCC1O 34a_100015193777_200000725654 [0,1,0,1,0,0|2,0,0]=4 26827 B14R1.948 C[C@H](CCO)NCCC1CCCN1C 2230a_100000706166_100000005710 [0,1,0,1,0,0|2,0,0]=4 26828 B14R1.948 C[C@H](CCO)NCCC1CCCN1C 34a_100000706166_100000005710 [0,1,0,1,0,0|2,0,0]=4 26829 B14R1.955 CCCC(C)CCCOCCC1CC1 34a_100011713154_100000694398 [0,1,0,1,0,0|2,0,0]=4 26830 B14R1.955 CCCC(C)CCCOCCC1CC1 7a_100011713154_100000764125 [0,1,0,1,0,0|2,0,0]=4 26831 B14R1.955 CCCC(C)CCCOCCC1CO1 34a_100011713154_100000732470 [0,1,0,1,0,0|1,0,0]=3 26832 B14R1.955 CCCC(C)CCCOCCC1CO1 7a_100011713154_100000732470 [0,1,0,1,0,0|1,0,0]=3 26833 B14R1.955 CCCC(C)CCOCCCC1CO1 34a_100011217855_100000733510 [0,1,0,1,0,0|1,0,0]=3 26834 B14R1.955 CCCC(C)CCOCCCC1CO1 7a_100011217855_100000733510 [0,1,0,1,0,0|1,0,0]=3 26835 B14R1.955 CCC[C@H](N)CCOCCCC1CO1 34a_100015193777_100000733510 [0,1,0,1,0,0|1,0,0]=3 26836 B14R1.965 CC(CCO)OC1CCCCC1CN 34a_100011216029_100009893172 [0,1,0,1,0,0|2,0,0]=4 26837 B14R1.965 CCC1CCCCC1N[C@H](C)CCO 269862a_100000706166_100000757040 [0,1,0,1,0,0|1,0,0]=3 26838 B14R1.965 CCC1CCCCC1N[C@H](C)CCO 270004a_100000706166_100000757040 [0,1,0,1,0,0|1,0,0]=3 26839 B14R1.965 CCC1CCCCC1OC(C)CCO 34a_100000210738_100009893172 [0,1,0,1,0,0|1,0,0]=3 26840 B14R1.965 CCC1CCCCC1OC(C)CCO 7a_100000210738_100009893172 [0,1,0,1,0,0|1,0,0]=3 26841 B14R1.965 CCCC(=O)CN1CCCCC1CO 2230a_100000210821_100000747444 [0,1,0,1,0,0|1,0,1]=4 26842 B14R1.965 CCCC(=O)CN1CCCCC1CO 269982a_100000210821_100000747444 [0,1,0,1,0,0|1,0,1]=4 26843 B14R1.965 CCCC(C)CN1CCCCC1CC 2230a_100000210034_100011216630 [0,1,0,1,0,0|2,0,0]=4 26844 B14R1.965 CCCC(C)CN1CCCCC1CC 269982a_100000210034_100011216630 [0,1,0,1,0,0|2,0,0]=4 26845 B14R1.965 CCCC(C)CN1CCCCC1CC 270004a_100000210034_100000243154 [0,1,0,1,0,0|2,0,0]=4 26846 B14R1.965 CCCC(C)CN1CCCCC1CC 34a_100000210034_100011216630 [0,1,0,1,0,0|2,0,0]=4 26847 B14R1.965 CCCC(C)CN1CCCCC1CO 2230a_100000210821_100011216630 [0,1,0,1,0,0|1,0,0]=3 26848 B14R1.965 CCCC(C)CN1CCCCC1CO 269982a_100000210821_100011216630 [0,1,0,1,0,0|1,0,0]=3 26849 B14R1.965 CCCC(C)CN1CCCCC1CO 34a_100000210821_100011216630 [0,1,0,1,0,0|1,0,0]=3 26850 B14R1.965 CCCC(C)CN1CCOC[C@H]1CO 2230a_100000717676_100011216630 [0,1,0,1,0,0|2,0,0]=4 26851 B14R1.965 CCCC(C)CN1CCOC[C@H]1CO 269982a_100000717676_100011216630 [0,1,0,1,0,0|2,0,0]=4 26852 B14R1.965 CCCC(C)CN1CCOC[C@H]1CO 270004a_100000717676_100000243154 [0,1,0,1,0,0|2,0,0]=4 26853 B14R1.965 CCCC(C)CN1CCOC[C@H]1CO 34a_100000717676_100011216630 [0,1,0,1,0,0|2,0,0]=4 26854 B14R1.965 CCCC(C)NC1CCCCC1CC 269862a_100000741246_100000757040 [0,1,0,1,0,0|2,0,0]=4 26855 B14R1.965 CCCC(C)NC1CCCCC1CC 270004a_100000741246_100000757040 [0,1,0,1,0,0|2,0,0]=4 26856 B14R1.965 CCCC(C)NC1CCCCC1CO 270004a_100000741246_100009861125 [0,1,0,1,0,0|1,0,0]=3 26857 B14R1.965 CCCC(C)NC1CCOCC1CO 2230a_214813039666_100000766640 [0,1,0,1,0,0|2,0,0]=4 26858 B14R1.965 CCCC(C)NC1CCOCC1CO 270004a_214813039666_100000211909 [0,1,0,1,0,0|2,0,0]=4 26859 B14R1.965 CCCC(C)NC1CCOCC1CO 34a_214813039666_100000766640 [0,1,0,1,0,0|2,0,0]=4 26860 B14R1.965 CCCC(C)OC1CCCCC1CC 34a_100000210738_100000766640 [0,1,0,1,0,0|2,0,0]=4 26861 B14R1.965 CCCC(C)OC1CCCCC1CC 7a_100000210738_100000766640 [0,1,0,1,0,0|2,0,0]=4 26862 B14R1.965 CCCC(C)OC1CCCCC1CN 34a_100011216029_100000766640 [0,1,0,1,0,0|2,0,0]=4 26863 B14R1.965 CN[C@@H]1CCCC[C@H]1OC(C)CCO 34a_100000708425_100009893172 [0,1,0,1,0,0|2,0,0]=4 26864 B14R1.965 COC1CCCCC1NC(C)CCO 34a_100011208099_100009893172 [0,1,0,1,0,0|2,0,0]=4 26865 B14R1.965 COC1CCCCC1N[C@H](C)CCO 270004a_100000706166_100000740605 [0,1,0,1,0,0|2,0,0]=4 26866 B14R1.965 COCC(O)CN1CCCCC1CO 34a_100000210821_100011215053 [0,1,0,1,0,0|2,0,0]=4 26867 B14R1.965 COC[C@@H](C)NC1CCCCC1CO 270004a_100000764878_100009861125 [0,1,0,1,0,0|2,0,0]=4 26868 B14R1.965 CO[C@H]1CCCC[C@@H]1OC(C)CCO 34a_200009815850_100009893172 [0,1,0,1,0,0|2,0,0]=4 26869 B14R1.965 CO[C@H]1CCCC[C@@H]1OC(C)CCO 7a_200009815850_100009893172 [0,1,0,1,0,0|2,0,0]=4 26870 B14R1.965 C[C@H](CCO)NC1CCCCC1CO 270004a_100000706166_100009861125 [0,1,0,1,0,0|2,0,0]=4 26871 B14R1.1253 CC1CCCN(CC1)CCCCCF 2230a_100025706717_100000729378 [0,1,0,1,0,0|2,0,0]=4 26872 B14R1.1253 CC1CCCN(CC1)CCCCCF 269982a_100025706717_100000729378 [0,1,0,1,0,0|2,0,0]=4 26873 B14R1.1253 CC1CCCN(CC1)CCCCCF 34a_100025706717_100000729378 [0,1,0,1,0,0|2,0,0]=4 26874 B14R1.1253 CC1CCCN(CC1)CCCCCO 2230a_100025706717_100000746330 [0,1,0,1,0,0|1,0,0]=3 26875 B14R1.1253 CC1CCCN(CC1)CCCCCO 269982a_100025706717_100000746330 [0,1,0,1,0,0|1,0,0]=3 26876 B14R1.1253 CC1CCCN(CC1)CCCCCO 34a_100025706717_100000746330 [0,1,0,1,0,0|1,0,0]=3 26877 B14R1.1253 CC1CCCN(CC1)CCOCCO 2230a_100025706717_100011215305 [0,1,0,1,0,0|2,0,0]=4 26878 B14R1.1253 CC1CCCN(CC1)CCOCCO 269982a_100025706717_100011215305 [0,1,0,1,0,0|2,0,0]=4 26879 B14R1.1253 CC1CCCN(CC1)CCOCCO 34a_100025706717_100000692535 [0,1,0,1,0,0|2,0,0]=4 26880 B14R1.1253 CCCCCCN1CCCC(CC1)C 2230a_100025706717_100000210314 [0,1,0,1,0,0|2,0,0]=4 26881 B14R1.1253 CCCCCCN1CCCC(CC1)C 269982a_100025706717_100000210757 [0,1,0,1,0,0|2,0,0]=4 26882 B14R1.1253 CCCCCCN1CCCC(CC1)C 34a_100025706717_100000210314 [0,1,0,1,0,0|2,0,0]=4 26883 B14R1.1253 CCCCCCN1CCCC(CC1)O 2230a_100015186869_100000210314 [0,1,0,1,0,0|2,0,0]=4 26884 B14R1.1253 CCCCCCN1CCCC(CC1)O 269982a_100015186869_100000210757 [0,1,0,1,0,0|2,0,0]=4 26885 B14R1.1253 CN1CCCN(CC1)CCCCCO 2230a_100000211313_100000746330 [0,1,0,1,0,0|2,0,0]=4 26886 B14R1.1253 CN1CCCN(CC1)CCCCCO 269982a_100000211313_100000746330 [0,1,0,1,0,0|2,0,0]=4 26887 B14R1.1253 OC1CCCN(CC1)CCCCCF 2230a_100015186869_100000729378 [0,1,0,1,0,0|2,0,0]=4 26888 B14R1.1253 OC1CCCN(CC1)CCCCCF 269982a_100015186869_100000729378 [0,1,0,1,0,0|2,0,0]=4 26889 B14R1.1253 OCCCCCN1CCCC(CC1)O 2230a_100015186869_100000746330 [0,1,0,1,0,0|1,0,0]=3 26890 B14R1.1253 OCCCCCN1CCCC(CC1)O 269982a_100015186869_100000746330 [0,1,0,1,0,0|1,0,0]=3 26891 B14R1.1253 OCCOCCN1CCCC(CC1)O 2230a_100015186869_100011215305 [0,1,0,1,0,0|2,0,0]=4 26892 B14R1.1253 OCCOCCN1CCCC(CC1)O 269982a_100015186869_100011215305 [0,1,0,1,0,0|2,0,0]=4 26893 B14R1.2357 CCOC1CN(C1)CCCCCCO 269982a_100000732654_100000766143 [0,1,0,1,0,0|2,0,0]=4 26894 B14R1.2357 CCOC1CN(C1)CCCCCCO 34a_100000732654_100000766143 [0,1,0,1,0,0|2,0,0]=4 26895 B14R1.2357 COCC1CC(C1)NCCCCCO 2230a_100012180050_100000746330 [0,1,0,1,0,0|2,0,0]=4 26896 B14R1.2357 COCC1CC(C1)NCCCCCO 270004a_100000762737_100010371266 [0,1,0,1,0,0|2,0,0]=4 26897 B14R1.2357 COCC1CN(C1)CCCCCCO 2230a_100016993750_100000766143 [0,1,0,1,0,0|2,0,0]=4 26898 B14R1.2357 COCC1CN(C1)CCCCCCO 269982a_100016993750_100000766143 [0,1,0,1,0,0|2,0,0]=4 26899 B14R1.2357 COCC1CN(C1)CCCCCCO 34a_100016993750_100000766143 [0,1,0,1,0,0|2,0,0]=4 26900 B14R1.6816 CC(NCCCCCCCO)C1CC1 2230a_100000700016_100000760002 [0,1,0,1,0,0|1,0,0]=3 26901 B14R1.6816 CC(NCCCCCCCO)C1CC1 269862a_100011996573_100000210639 [0,1,0,1,0,0|1,0,0]=3 26902 B14R1.6816 CC(NCCCCCCCO)C1CC1 34a_100000700016_100000760002 [0,1,0,1,0,0|1,0,0]=3 26903 B14R1.6816 CC(NCCCCCCCO)C1CO1 270004a_100011996573_100000031964 [0,1,0,1,0,0|2,0,0]=4 26904 B14R1.6816 CC(NCCCOCCCO)C1CC1 269862a_100011310245_100000210639 [0,1,0,1,0,0|2,0,0]=4 26905 B14R1.6816 CC(OCCCCCCCO)C1CC1 34a_100000744524_100000760002 [0,1,0,1,0,0|1,0,0]=3 26906 B14R1.6816 CC(OCCCCCCCO)C1CC1 7a_100000744524_100000760002 [0,1,0,1,0,0|1,0,0]=3 26907 B14R1.6816 CCCCCCCCCC(=O)C1CC1 1458a_100000210395_100000210670 [0,1,0,1,0,0|1,0,1]=4 26908 B14R1.6816 CCCCCCCCCC(=O)C1CO1 1458a_100000701028_100000210670 [0,1,0,1,0,0|0,0,1]=3 26909 B14R1.6816 CCCCCCCCCN(C)C1CC1 2230a_100000226674_100011214924 [0,1,0,1,0,0|2,0,0]=4 26910 B14R1.6816 CCCCCCCCCN(C)C1CC1 269982a_100000226674_100000210670 [0,1,0,1,0,0|2,0,0]=4 26911 B14R1.6816 CCCCCCCCCN(C)C1CC1 269982a_100000232482_100000211595 [0,1,0,1,0,0|2,0,0]=4 26912 B14R1.6816 CCCCCCCCNC(=O)C1CO1 11a_100000229939_100000701028 [0,1,0,1,0,0|1,0,1]=4 26913 B14R1.6816 CCCCCCCCNC(=O)C1CO1 1626a_100000229939_100000701028 [0,1,0,1,0,0|1,0,1]=4 26914 B14R1.6816 CCCCCCCCNC(=O)C1CO1 240690a_100000229939_100000701028 [0,1,0,1,0,0|1,0,1]=4 26915 B14R1.6816 CCCCCCCCNC(=O)C1CO1 527a_100000229939_100000701028 [0,1,0,1,0,0|1,0,1]=4 26916 B14R1.6816 CCCCCCCCNC(C)C1CC1 2230a_100000700016_100000210759 [0,1,0,1,0,0|2,0,0]=4 26917 B14R1.6816 CCCCCCCCNC(C)C1CC1 269862a_100000229939_100000210639 [0,1,0,1,0,0|2,0,0]=4 26918 B14R1.6816 CCCCCCCCNC(C)C1CC1 34a_100000700016_100000210759 [0,1,0,1,0,0|2,0,0]=4 26919 B14R1.6816 CCCCCCCCNC(C)C1CO1 270004a_100000229939_100000031964 [0,1,0,1,0,0|1,0,0]=3 26920 B14R1.6816 CCCCCCCCOC(C)C1CC1 34a_100000744524_100000210759 [0,1,0,1,0,0|2,0,0]=4 26921 B14R1.6816 CCCCCCCCOC(C)C1CC1 7a_100000744524_100000210759 [0,1,0,1,0,0|2,0,0]=4 26922 B14R1.6816 CCCCCCCNCC(O)C1CC1 2230a_100000751198_100000210681 [0,1,0,1,0,0|2,0,0]=4 26923 B14R1.6816 CCCCCCCNCC(O)C1CC1 34a_100000751198_100000210614 [0,1,0,1,0,0|2,0,0]=4 26924 B14R1.6816 CCCCCCCOC[C@H](N)C1CC1 34a_100020623730_100000210614 [0,1,0,1,0,0|2,0,0]=4 26925 B14R1.6816 CCCCOCCCNC(C)C1CO1 270004a_200000211371_100000031964 [0,1,0,1,0,0|2,0,0]=4 26926 B14R1.6816 CN(CCCCCCCCO)C1CC1 2230a_100000226674_100000033203 [0,1,0,1,0,0|1,0,0]=3 26927 B14R1.6816 CN(CCCCCCCCO)C1CC1 269982a_100000226674_100000033203 [0,1,0,1,0,0|1,0,0]=3 26928 B14R1.6816 N[C@@H](COCCCCCCF)C1CC1 34a_100020623730_100015922095 [0,1,0,1,0,0|2,0,0]=4 26929 B14R1.6816 N[C@@H](COCCCCCCO)C1CC1 34a_100020623730_100000766143 [0,1,0,1,0,0|1,0,0]=3 26930 B14R1.6816 O=C(CCCCCCCCO)C1CC1 1458a_100000210395_100000033203 [0,1,0,1,0,0|0,0,1]=3 26931 B14R1.6816 O=C(CCCCCCCCO)C1CO1 1458a_100000701028_100000033203 [0,1,0,1,0,0|1,0,1]=4 26932 B14R1.6816 O=C(CNCCCCCCO)C1CC1 2230a_100000686447_100000746382 [0,1,0,1,0,0|1,0,1]=4 26933 B14R1.6816 O=C(CNCCCCCCO)C1CC1 34a_100000686447_100000746382 [0,1,0,1,0,0|1,0,1]=4 26934 B14R1.6816 O=C(COCCCCCCO)C1CC1 34a_100000686663_100000766143 [0,1,0,1,0,0|1,0,1]=4 26935 B14R1.6816 O=C(CSCCCCCCO)C1CC1 62a_100000746382_100000766143 [0,1,0,1,0,0|1,0,1]=4 26936 B14R1.6816 O=C(CSCCCCCCO)C1CC1 62a_100000766143_100000746382 [0,1,0,1,0,0|1,0,1]=4 26937 B14R1.6816 O=C(NCCCCCCCO)C1CC1 240690a_100011996573_100000210395 [0,1,0,1,0,0|1,0,1]=4 26938 B14R1.6816 OC(CNCCCCCCF)C1CC1 2230a_100000751198_100015922095 [0,1,0,1,0,0|2,0,0]=4 26939 B14R1.6816 OC(CNCCCCCCF)C1CC1 34a_100000751198_100015922095 [0,1,0,1,0,0|2,0,0]=4 26940 B14R1.6816 OCCCCCCNCC(O)C1CC1 2230a_100000751198_100000766143 [0,1,0,1,0,0|1,0,0]=3 26941 B14R1.6816 OCCCCCCNCC(O)C1CC1 34a_100000751198_100000766143 [0,1,0,1,0,0|1,0,0]=3 26942 B14R1.7119 CC(CCO)N1CCCCCCCC1 2230a_100000039187_100009893172 [0,1,0,1,0,0|1,0,0]=3 26943 B14R1.7119 CC(CCO)N1CCCCCCCC1 269982a_100000039187_100009893172 [0,1,0,1,0,0|1,0,0]=3 26944 B14R1.7119 CC(CCO)N1CCCCCCCC1 34a_100000039187_100009893172 [0,1,0,1,0,0|1,0,0]=3 26945 B14R1.7119 CCCC(C)N1CCCCCCCC1 2230a_100000039187_100000766640 [0,1,0,1,0,0|2,0,0]=4 26946 B14R1.7119 CCCC(C)N1CCCCCCCC1 269982a_100000039187_100000766640 [0,1,0,1,0,0|2,0,0]=4 26947 B14R1.7119 CCCC(C)N1CCCCCCCC1 270004a_100000039187_100000211909 [0,1,0,1,0,0|2,0,0]=4 26948 B14R1.7119 CCCC(C)N1CCCCCCCC1 34a_100000039187_100000766640 [0,1,0,1,0,0|2,0,0]=4 26949 B14R1.7119 CCCN(C)C1CCCCCCCC1 270004a_100000747261_100000038600 [0,1,0,1,0,0|2,0,0]=4 26950 B14R1.7119 CN(CCO)C1CCCCCCCC1 270004a_100000210263_100000038600 [0,1,0,1,0,0|1,0,0]=3 26951 B14R1.7119 O=C(CCO)N1CCCCCCCC1 240690a_100000039187_100011216618 [0,1,0,1,0,0|1,0,1]=4 26952 B14R1.7146 CC(CCBr)OCC1CCCCCC1 34a_100012276601_200000696569 [0,1,0,1,0,0|2,0,0]=4 26953 B14R1.7146 CC(CCN)COC1CCCCCC1 34a_106354213184_100011217769 [0,1,0,1,0,0|2,0,0]=4 26954 B14R1.7146 CC(CCO)NCC1CCCCCC1 2230a_100015204231_100009893172 [0,1,0,1,0,0|1,0,0]=3 26955 B14R1.7146 CC(CCO)NCC1CCCCCC1 34a_100015204231_100009893172 [0,1,0,1,0,0|1,0,0]=3 26956 B14R1.7146 CC(CCO)OCC1CCCCCC1 34a_100000699130_100009893172 [0,1,0,1,0,0|1,0,0]=3 26957 B14R1.7146 CC(CCO)OCC1CCCCCC1 7a_100000699130_100009893172 [0,1,0,1,0,0|1,0,0]=3 26958 B14R1.7146 CC(CCO)SCC1CCCCCC1 62a_100009893172_200000696569 [0,1,0,1,0,0|1,0,0]=3 26959 B14R1.7146 CC(CCO)SCC1CCCCCC1 62a_200000696569_100009893172 [0,1,0,1,0,0|1,0,0]=3 26960 B14R1.7146 CCCC(C)CNC1CCCCCC1 2230a_100000210984_100011216630 [0,1,0,1,0,0|2,0,0]=4 26961 B14R1.7146 CCCC(C)CNC1CCCCCC1 270004a_100000210984_100000243154 [0,1,0,1,0,0|2,0,0]=4 26962 B14R1.7146 CCCC(C)CNC1CCCCCC1 34a_100000210984_100011216630 [0,1,0,1,0,0|2,0,0]=4 26963 B14R1.7146 CCCC(C)COC1CCCCCC1 34a_100000210887_100011216630 [0,1,0,1,0,0|2,0,0]=4 26964 B14R1.7146 CCCC(C)COC1CCCCCC1 34a_100000688023_100011217769 [0,1,0,1,0,0|2,0,0]=4 26965 B14R1.7146 CCCC(C)COC1CCCCCC1 7a_100000210887_100011216630 [0,1,0,1,0,0|2,0,0]=4 26966 B14R1.7146 CCCC(C)CSC1CCCCCC1 62a_100011216630_100011217769 [0,1,0,1,0,0|2,0,0]=4 26967 B14R1.7146 CCCC(C)CSC1CCCCCC1 62a_100011217769_100011216630 [0,1,0,1,0,0|2,0,0]=4 26968 B14R1.7146 CCCC(C)NCC1CCCCCC1 2230a_100000741246_200000696569 [0,1,0,1,0,0|2,0,0]=4 26969 B14R1.7146 CCCC(C)NCC1CCCCCC1 2230a_100015204231_100000766640 [0,1,0,1,0,0|2,0,0]=4 26970 B14R1.7146 CCCC(C)NCC1CCCCCC1 269862a_100000741246_200000763224 [0,1,0,1,0,0|2,0,0]=4 26971 B14R1.7146 CCCC(C)NCC1CCCCCC1 270004a_100015204231_100000211909 [0,1,0,1,0,0|2,0,0]=4 26972 B14R1.7146 CCCC(C)NCC1CCCCCC1 34a_100015204231_100000766640 [0,1,0,1,0,0|2,0,0]=4 26973 B14R1.7146 CCCC(C)OCC1CCCCCC1 34a_100000699130_100000766640 [0,1,0,1,0,0|2,0,0]=4 26974 B14R1.7146 CCCC(C)OCC1CCCCCC1 34a_100000764384_200000696569 [0,1,0,1,0,0|2,0,0]=4 26975 B14R1.7146 CCCC(C)OCC1CCCCCC1 7a_100000699130_100000766640 [0,1,0,1,0,0|2,0,0]=4 26976 B14R1.7146 CCCC(C)OCC1CCCCCC1 7a_100000764384_200000696569 [0,1,0,1,0,0|2,0,0]=4 26977 B14R1.7146 CCCC(C)SCC1CCCCCC1 62a_100000766640_200000696569 [0,1,0,1,0,0|2,0,0]=4 26978 B14R1.7146 CCCC(C)SCC1CCCCCC1 62a_200000696569_100000766640 [0,1,0,1,0,0|2,0,0]=4 26979 B14R1.7146 CCC[C@H](N)COC1CCCCCC1 34a_100000732646_100011217769 [0,1,0,1,0,0|2,0,0]=4 26980 B14R1.7146 CN(CCO)CCN1CCCCCC1 269982a_100000210263_100000722644 [0,1,0,1,0,0|2,0,0]=4 26981 B14R1.7146 CN(CCO)CCN1CCCCCC1 269982a_106744473495_100000211926 [0,1,0,1,0,0|2,0,0]=4 26982 B14R1.7146 C[C@H](CCO)NCC1CCCCCC1 2230a_100000706166_200000696569 [0,1,0,1,0,0|1,0,0]=3 26983 B14R1.7146 C[C@H](CCO)NCC1CCCCCC1 269862a_100000706166_200000763224 [0,1,0,1,0,0|1,0,0]=3 26984 B14R1.7146 C[C@H](CCO)NCC1CCCCCC1 34a_100000706166_200000696569 [0,1,0,1,0,0|1,0,0]=3 26985 B14R1.7146 O=C(CCO)CCN1CCCCCC1 1458a_100000740320_100000211926 [0,1,0,1,0,0|1,0,1]=4 26986 B14R1.7146 O=C(CCO)CCN1CCCCCC1 1458a_100011216618_100000722644 [0,1,0,1,0,0|1,0,1]=4 26987 B14R1.7146 O=C(CCO)NCC1CCCCCC1 240690a_100015204231_100011216618 [0,1,0,1,0,0|1,0,1]=4 26988 B14R1.7343 CC(CCO)NC1CCCCCCC1 2230a_100000211152_100009893172 [0,1,0,1,0,0|1,0,0]=3 26989 B14R1.7343 CC(CCO)NC1CCCCCCC1 34a_100000211152_100009893172 [0,1,0,1,0,0|1,0,0]=3 26990 B14R1.7343 CC(CCO)OC1CCCCCCC1 34a_100000210054_100009893172 [0,1,0,1,0,0|1,0,0]=3 26991 B14R1.7343 CC(CCO)OC1CCCCCCC1 7a_100000210054_100009893172 [0,1,0,1,0,0|1,0,0]=3 26992 B14R1.7343 CCCC(C)CN1CCCCCCC1 2230a_100000211400_100011216630 [0,1,0,1,0,0|2,0,0]=4 26993 B14R1.7343 CCCC(C)CN1CCCCCCC1 269982a_100000211400_100011216630 [0,1,0,1,0,0|2,0,0]=4 26994 B14R1.7343 CCCC(C)CN1CCCCCCC1 270004a_100000211400_100000243154 [0,1,0,1,0,0|2,0,0]=4 26995 B14R1.7343 CCCC(C)CN1CCCCCCC1 34a_100000211400_100011216630 [0,1,0,1,0,0|2,0,0]=4 26996 B14R1.7343 CCCC(C)NC1CCCCCCC1 2230a_100000211152_100000766640 [0,1,0,1,0,0|2,0,0]=4 26997 B14R1.7343 CCCC(C)NC1CCCCCCC1 270004a_100000211152_100000211909 [0,1,0,1,0,0|2,0,0]=4 26998 B14R1.7343 CCCC(C)NC1CCCCCCC1 270004a_100000741246_100000210524 [0,1,0,1,0,0|2,0,0]=4 26999 B14R1.7343 CCCC(C)NC1CCCCCCC1 34a_100000211152_100000766640 [0,1,0,1,0,0|2,0,0]=4 27000 B14R1.7343 CCCC(C)OC1CCCCCCC1 34a_100000210054_100000766640 [0,1,0,1,0,0|2,0,0]=4 27001 B14R1.7343 CCCC(C)OC1CCCCCCC1 7a_100000210054_100000766640 [0,1,0,1,0,0|2,0,0]=4 27002 B14R1.7343 C[C@H](CCO)NC1CCCCCCC1 270004a_100000706166_100000210524 [0,1,0,1,0,0|1,0,0]=3 27003 B14R1.7343 O=C(CCO)NC1CCCCCCC1 240690a_100000211152_100011216618 [0,1,0,1,0,0|1,0,1]=4 27004 B14R1.9622 CC1(CCC1)CNCCCCCCF 2230a_100000706607_100015922095 [0,1,0,1,0,0|2,0,0]=4 27005 B14R1.9622 CC1(CCC1)CNCCCCCCO 2230a_100000686447_100000726658 [0,1,0,1,0,0|1,0,0]=3 27006 B14R1.9622 CC1(CCC1)CNCCCCCCO 2230a_100000706607_100000766143 [0,1,0,1,0,0|1,0,0]=3 27007 B14R1.9622 CC1(CCC1)CNCCCCCCO 34a_100000686447_100000726658 [0,1,0,1,0,0|1,0,0]=3 27008 B14R1.9622 CC1(CCC1)COCCCCCCBr 34a_100011215345_100000726658 [0,1,0,1,0,0|2,0,0]=4 27009 B14R1.9622 CC1(CCC1)COCCCCCCBr 7a_100011215345_100000726658 [0,1,0,1,0,0|2,0,0]=4 27010 B14R1.9622 CC1(CCC1)COCCCCCCCl 34a_100000766143_100000726658 [0,1,0,1,0,0|2,0,0]=4 27011 B14R1.9622 CC1(CCC1)COCCCCCCCl 7a_100000766143_100000726658 [0,1,0,1,0,0|2,0,0]=4 27012 B14R1.9622 CC1(CCC1)COCCCCCCF 34a_100000732779_100000726658 [0,1,0,1,0,0|2,0,0]=4 27013 B14R1.9622 CC1(CCC1)COCCCCCCF 7a_100000732779_100000726658 [0,1,0,1,0,0|2,0,0]=4 27014 B14R1.9622 CC1(CCC1)COCCCCCCN 34a_100000686447_100000726658 [0,1,0,1,0,0|2,0,0]=4 27015 B14R1.9622 CC1(CCC1)CSCCCCCCF 62a_100000726658_100015922095 [0,1,0,1,0,0|2,0,0]=4 27016 B14R1.9622 CC1(CCC1)CSCCCCCCF 62a_100015922095_100000726658 [0,1,0,1,0,0|2,0,0]=4 27017 B14R1.9622 CC1(CCC1)CSCCCCCCO 62a_100000726658_100000766143 [0,1,0,1,0,0|1,0,0]=3 27018 B14R1.9622 CC1(CCC1)CSCCCCCCO 62a_100000766143_100000726658 [0,1,0,1,0,0|1,0,0]=3 27019 B14R1.9622 CC1(CCC1)NCCCCCCCO 2230a_100000692455_100000760002 [0,1,0,1,0,0|1,0,0]=3 27020 B14R1.9622 CC1(CCC1)NCCCCCCCO 34a_100000692455_100000760002 [0,1,0,1,0,0|1,0,0]=3 27021 B14R1.9622 CC1(CCC1)OCCCCCCCO 34a_100000759064_100000760002 [0,1,0,1,0,0|1,0,0]=3 27022 B14R1.9622 CC1(CCC1)OCCCCCCCO 7a_100000759064_100000760002 [0,1,0,1,0,0|1,0,0]=3 27023 B14R1.9622 CC1(COC1)CNCCCCCCO 2230a_100000686447_100000066812 [0,1,0,1,0,0|2,0,0]=4 27024 B14R1.9622 CC1(COC1)CNCCCCCCO 2230a_100020631278_100000766143 [0,1,0,1,0,0|2,0,0]=4 27025 B14R1.9622 CC1(COC1)CNCCCCCCO 269862a_100000686447_100000050806 [0,1,0,1,0,0|2,0,0]=4 27026 B14R1.9622 CC1(COC1)CNCCCCCCO 34a_100000686447_100009817586 [0,1,0,1,0,0|2,0,0]=4 27027 B14R1.9622 CC1(COC1)CSCCCCCCO 62a_100000766143_100009817586 [0,1,0,1,0,0|2,0,0]=4 27028 B14R1.9622 CC1(COC1)CSCCCCCCO 62a_100009817586_100000766143 [0,1,0,1,0,0|2,0,0]=4 27029 B14R1.9622 CC1(COC1)NCCCCCCCO 2230a_100000732644_100000760002 [0,1,0,1,0,0|2,0,0]=4 27030 B14R1.9622 CC1(CSC1)COCCCCCCO 34a_100000732658_100000766143 [0,1,0,1,0,0|2,0,0]=4 27031 B14R1.9622 CC1(CSC1)COCCCCCCO 7a_100000732658_100000766143 [0,1,0,1,0,0|2,0,0]=4 27032 B14R1.9622 CC1(CSC1)OCCCCCCCO 7a_100016018533_100000760002 [0,1,0,1,0,0|2,0,0]=4 27033 B14R1.9622 CCCCCCCCNC1(CCC1)C 2230a_100000692455_100000210759 [0,1,0,1,0,0|2,0,0]=4 27034 B14R1.9622 CCCCCCCCNC1(CCC1)C 34a_100000692455_100000210759 [0,1,0,1,0,0|2,0,0]=4 27035 B14R1.9622 CCCCCCCCOC1(CCC1)C 34a_100000759064_100000210759 [0,1,0,1,0,0|2,0,0]=4 27036 B14R1.9622 CCCCCCCCOC1(CCC1)C 7a_100000759064_100000210759 [0,1,0,1,0,0|2,0,0]=4 27037 B14R1.9622 CCCCCCCNCC1(CCC1)C 2230a_100000229938_100000726658 [0,1,0,1,0,0|2,0,0]=4 27038 B14R1.9622 CCCCCCCNCC1(CCC1)C 2230a_100000706607_100000210681 [0,1,0,1,0,0|2,0,0]=4 27039 B14R1.9622 CCCCCCCNCC1(CCC1)O 2230a_100000752638_100000210681 [0,1,0,1,0,0|2,0,0]=4 27040 B14R1.9622 CCCCCCCOCC1(CCC1)C 34a_100000210272_100000726658 [0,1,0,1,0,0|2,0,0]=4 27041 B14R1.9622 CCCCCCCOCC1(CCC1)C 7a_100000210272_100000726658 [0,1,0,1,0,0|2,0,0]=4 27042 B14R1.9622 CCCCCCCSCC1(CCC1)C 62a_100000210614_100000726658 [0,1,0,1,0,0|2,0,0]=4 27043 B14R1.9622 CCCCCCCSCC1(CCC1)C 62a_100000726658_100000210316 [0,1,0,1,0,0|2,0,0]=4 27044 B14R1.9622 OC1(CCC1)CNCCCCCCF 2230a_100000752638_100015922095 [0,1,0,1,0,0|2,0,0]=4 27045 B14R1.9622 OCCCCCCNCC1(CCC1)O 2230a_100000752638_100000766143 [0,1,0,1,0,0|1,0,0]=3 27046 B14R1.9622 OCCCCCCNCC1(COC1)O 2230a_100010264505_100000766143 [0,1,0,1,0,0|2,0,0]=4 27047 B14R1.16994 CC1CN(CCCN1CCCCO)C 269982a_100011935175_100000210776 [0,1,0,1,0,0|2,0,0]=4 27048 B14R1.96 CC(=O)CCCN1CCCCC1CO 269982a_100000210821_100011215641 [0,1,0,1,0,0|1,0,1]=4 27049 B14R1.96 CC(=O)CCCN1CCCCC1CO 34a_100000210821_100000685027 [0,1,0,1,0,0|1,0,1]=4 27050 B14R1.96 CC(C)CCCN1CCCCC1CO 2230a_100000210821_100011214892 [0,1,0,1,0,0|1,0,0]=3 27051 B14R1.96 CC(C)CCCN1CCCCC1CO 269982a_100000210821_100011214892 [0,1,0,1,0,0|1,0,0]=3 27052 B14R1.96 CC(C)CCCN1CCCCC1CO 34a_100000210821_100011214892 [0,1,0,1,0,0|1,0,0]=3 27053 B14R1.96 CC(C)CCCN1CCOC[C@H]1CO 2230a_100000717676_100011214892 [0,1,0,1,0,0|2,0,0]=4 27054 B14R1.96 CC(C)CCCN1CCOC[C@H]1CO 269982a_100000717676_100011214892 [0,1,0,1,0,0|2,0,0]=4 27055 B14R1.96 CC(C)CCCN1CCOC[C@H]1CO 34a_100000717676_100011214892 [0,1,0,1,0,0|2,0,0]=4 27056 B14R1.96 CC(C)CCNC1CCCCC1CO 270004a_100000210545_100009861125 [0,1,0,1,0,0|1,0,0]=3 27057 B14R1.96 CC(C)CCNC1CCOCC1CO 2230a_214813039666_100000210312 [0,1,0,1,0,0|2,0,0]=4 27058 B14R1.96 CC(C)CCNC1CCOCC1CO 269862a_214813039666_100000185833 [0,1,0,1,0,0|2,0,0]=4 27059 B14R1.96 CC(C)CCNC1CCOCC1CO 34a_214813039666_100000210312 [0,1,0,1,0,0|2,0,0]=4 27060 B14R1.96 CC(C)CCOC1CCCCC1CN 34a_100011216029_100000210312 [0,1,0,1,0,0|2,0,0]=4 27061 B14R1.96 CC(C)NCCN1CCCCC1CO 2230a_100011473795_100000210206 [0,1,0,1,0,0|2,0,0]=4 27062 B14R1.96 CC(C)NCCN1CCCCC1CO 34a_100011473795_100000210206 [0,1,0,1,0,0|2,0,0]=4 27063 B14R1.96 CC(C)OCCN1CCCCC1CO 2230a_100000210821_100000211751 [0,1,0,1,0,0|2,0,0]=4 27064 B14R1.96 CC(C)OCCN1CCCCC1CO 269982a_100000210821_100000211751 [0,1,0,1,0,0|2,0,0]=4 27065 B14R1.96 CC(C)OCCN1CCCCC1CO 34a_100000210821_100000211751 [0,1,0,1,0,0|2,0,0]=4 27066 B14R1.96 CC(C)SCCN1CCCCC1CO 2230a_100000210821_100000730970 [0,1,0,1,0,0|2,0,0]=4 27067 B14R1.96 CC(C)SCCN1CCCCC1CO 269982a_100000210821_100000730970 [0,1,0,1,0,0|2,0,0]=4 27068 B14R1.96 CC(C)SCCN1CCCCC1CO 34a_100000210821_100000730970 [0,1,0,1,0,0|2,0,0]=4 27069 B14R1.96 CC(O)CCCN1CCCCC1CO 2230a_100000210821_200000718107 [0,1,0,1,0,0|1,0,0]=3 27070 B14R1.96 CC(O)CCCN1CCCCC1CO 269982a_100000210821_200000718107 [0,1,0,1,0,0|1,0,0]=3 27071 B14R1.96 CC(O)CCCN1CCCCC1CO 34a_100000210821_200000718107 [0,1,0,1,0,0|1,0,0]=3 27072 B14R1.96 CC(O)CCCN1CCOC[C@H]1CO 2230a_100000717676_200000718107 [0,1,0,1,0,0|2,0,0]=4 27073 B14R1.96 CC(O)CCCN1CCOC[C@H]1CO 269982a_100000717676_200000718107 [0,1,0,1,0,0|2,0,0]=4 27074 B14R1.96 CC(O)CCCN1CCOC[C@H]1CO 34a_100000717676_200000718107 [0,1,0,1,0,0|2,0,0]=4 27075 B14R1.96 CC(O)CCNC1CCCCC1CO 270004a_200000755665_100009861125 [0,1,0,1,0,0|1,0,0]=3 27076 B14R1.96 CC(O)CCNC1CCOCC1CO 2230a_214813039666_100012276601 [0,1,0,1,0,0|2,0,0]=4 27077 B14R1.96 CC(O)CCNC1CCOCC1CO 34a_214813039666_100012276601 [0,1,0,1,0,0|2,0,0]=4 27078 B14R1.96 CC(O)CCOC1CCCCC1CN 34a_100011216029_100012276601 [0,1,0,1,0,0|2,0,0]=4 27079 B14R1.96 CCC1CCCCC1NCCC(C)C 269862a_100000210545_100000757040 [0,1,0,1,0,0|2,0,0]=4 27080 B14R1.96 CCC1CCCCC1NCCC(C)C 270004a_100000210545_100000757040 [0,1,0,1,0,0|2,0,0]=4 27081 B14R1.96 CCC1CCCCC1NCCC(C)O 269862a_200000755665_100000757040 [0,1,0,1,0,0|1,0,0]=3 27082 B14R1.96 CCC1CCCCC1NCCC(C)O 270004a_200000755665_100000757040 [0,1,0,1,0,0|1,0,0]=3 27083 B14R1.96 CCC1CCCCC1OCCC(C)C 34a_100000210738_100000210312 [0,1,0,1,0,0|2,0,0]=4 27084 B14R1.96 CCC1CCCCC1OCCC(C)C 7a_100000210738_100000210626 [0,1,0,1,0,0|2,0,0]=4 27085 B14R1.96 CCC1CCCCC1OCCC(C)O 34a_100000210738_100012276601 [0,1,0,1,0,0|1,0,0]=3 27086 B14R1.96 CCC1CCCCC1OCCC(C)O 7a_100000210738_100012276601 [0,1,0,1,0,0|1,0,0]=3 27087 B14R1.96 CCC1CCCCN1CCCC(C)C 2230a_100000210034_100011214892 [0,1,0,1,0,0|2,0,0]=4 27088 B14R1.96 CCC1CCCCN1CCCC(C)C 269982a_100000210034_100011214892 [0,1,0,1,0,0|2,0,0]=4 27089 B14R1.96 CCC1CCCCN1CCCC(C)C 34a_100000210034_100011214892 [0,1,0,1,0,0|2,0,0]=4 27090 B14R1.96 CCC1CCCCN1CCCC(C)O 2230a_100000210034_200000718107 [0,1,0,1,0,0|1,0,0]=3 27091 B14R1.96 CCC1CCCCN1CCCC(C)O 269982a_100000210034_200000718107 [0,1,0,1,0,0|1,0,0]=3 27092 B14R1.96 CCC1CCCCN1CCCC(C)O 34a_100000210034_200000718107 [0,1,0,1,0,0|1,0,0]=3 27093 B14R1.96 CCN1CCCCC1CNCC(C)O 2230a_100000754393_100011218427 [0,1,0,1,0,0|2,0,0]=4 27094 B14R1.96 CCN1CCCCC1CNCC(C)O 34a_100000754393_100011218427 [0,1,0,1,0,0|2,0,0]=4 27095 B14R1.96 CCN1CCCCC1CNC[C@@H](C)O 2230a_100000754393_100009817552 [0,1,0,1,0,0|2,0,0]=4 27096 B14R1.96 CCN1CCCCC1CNC[C@@H](C)O 34a_100000754393_100009817552 [0,1,0,1,0,0|2,0,0]=4 27097 B14R1.96 CCN1CCCCC1COCC(C)O 34a_100000225091_100011218427 [0,1,0,1,0,0|2,0,0]=4 27098 B14R1.96 CCN1CCCCC1COCC(C)O 7a_100000225091_100011218427 [0,1,0,1,0,0|2,0,0]=4 27099 B14R1.96 CCN1CCCCC1COC[C@@H](C)O 34a_100000225091_100009817552 [0,1,0,1,0,0|2,0,0]=4 27100 B14R1.96 CCN1CCCCC1COC[C@@H](C)O 7a_100000225091_100009817552 [0,1,0,1,0,0|2,0,0]=4 27101 B14R1.96 CC[C@H]1COCCN1CCCC(C)O 2230a_100016988097_200000718107 [0,1,0,1,0,0|2,0,0]=4 27102 B14R1.96 CC[C@H]1COCCN1CCCC(C)O 269982a_100016988097_200000718107 [0,1,0,1,0,0|2,0,0]=4 27103 B14R1.96 CC[C@H]1COCCN1CCCC(C)O 34a_100016988097_200000718107 [0,1,0,1,0,0|2,0,0]=4 27104 B14R1.96 CN(C)CCCN1CCCCC1CO 269982a_100000210821_100000757444 [0,1,0,1,0,0|2,0,0]=4 27105 B14R1.96 CN(C)CCNC1CCCCC1CO 270004a_100000210585_100009861125 [0,1,0,1,0,0|2,0,0]=4 27106 B14R1.96 CN[C@@H]1CCCC[C@H]1OCCC(C)O 34a_100000708425_100012276601 [0,1,0,1,0,0|2,0,0]=4 27107 B14R1.96 COC1CCCCC1NCCC(C)O 270004a_200000755665_100000740605 [0,1,0,1,0,0|2,0,0]=4 27108 B14R1.96 COC1CCCCC1NCCC(C)O 34a_100011208099_100012276601 [0,1,0,1,0,0|2,0,0]=4 27109 B14R1.96 CO[C@H]1CCCC[C@@H]1OCCC(C)O 34a_200009815850_100012276601 [0,1,0,1,0,0|2,0,0]=4 27110 B14R1.96 CO[C@H]1CCCC[C@@H]1OCCC(C)O 7a_200009815850_100012276601 [0,1,0,1,0,0|2,0,0]=4 27111 B14R1.108 CC(=O)CCCCN1CCC[C@@H]1CO 269982a_100000745186_100000735457 [0,1,0,1,0,0|1,0,1]=4 27112 B14R1.108 CC(=O)CCCCN1CCC[C@@H]1CO 34a_100000745186_100009817362 [0,1,0,1,0,0|1,0,1]=4 27113 B14R1.108 CC(C)CCCCN1CCC[C@@H]1CO 2230a_100000745186_100011216152 [0,1,0,1,0,0|1,0,0]=3 27114 B14R1.108 CC(C)CCCCN1CCC[C@@H]1CO 269982a_100000745186_100011216152 [0,1,0,1,0,0|1,0,0]=3 27115 B14R1.108 CC(C)CCCCN1CCC[C@@H]1CO 34a_100000745186_100011216152 [0,1,0,1,0,0|1,0,0]=3 27116 B14R1.108 CCC1CCCC1NCCCC(C)C 269862a_200000737386_100000749056 [0,1,0,1,0,0|2,0,0]=4 27117 B14R1.108 CCC1CCCC1NCCCC(C)C 270004a_200000737386_100000749056 [0,1,0,1,0,0|2,0,0]=4 27118 B14R1.108 CCC1CCCN1CCCCB(O)O 2230a_100000754278_200009817182 [0,1,0,1,0,0|2,0,0]=4 27119 B14R1.108 CCC1CCCN1CCCCB(O)O 269982a_100000754278_200009817182 [0,1,0,1,0,0|2,0,0]=4 27120 B14R1.108 CCC1CCCN1CCCCB(O)O 34a_100000754278_200009817182 [0,1,0,1,0,0|2,0,0]=4 27121 B14R1.108 CCC1CCCN1CCCCC(C)C 2230a_100000754278_100011216152 [0,1,0,1,0,0|2,0,0]=4 27122 B14R1.108 CCC1CCCN1CCCCC(C)C 269982a_100000754278_100011216152 [0,1,0,1,0,0|2,0,0]=4 27123 B14R1.108 CCC1CCCN1CCCCC(C)C 34a_100000754278_100011216152 [0,1,0,1,0,0|2,0,0]=4 27124 B14R1.108 CCN1CCCC1CNCCC(C)O 2230a_100000211693_100012276601 [0,1,0,1,0,0|2,0,0]=4 27125 B14R1.108 CCN1CCC[C@@H]1COCCC(C)O 34a_100011739246_100012276601 [0,1,0,1,0,0|2,0,0]=4 27126 B14R1.108 CCN1CCC[C@@H]1COCCC(C)O 7a_100011739246_100012276601 [0,1,0,1,0,0|2,0,0]=4 27127 B14R1.108 CN(C)CCCCN1CCC[C@@H]1CO 269982a_100000745186_100000690147 [0,1,0,1,0,0|2,0,0]=4 27128 B14R1.122 CC1CCC(C1)NCCCCCCO 270004a_100000686447_100011215218 [0,1,0,1,0,0|1,0,0]=3 27129 B14R1.122 CC1CCC(C1)OCCCCCCF 34a_100000698185_100015922095 [0,1,0,1,0,0|2,0,0]=4 27130 B14R1.122 CC1CCC(C1)OCCCCCCO 34a_100000698185_100000766143 [0,1,0,1,0,0|1,0,0]=3 27131 B14R1.122 CCCCCCCCN1CCC(C1)O 2230a_100011215560_100000210759 [0,1,0,1,0,0|1,0,0]=3 27132 B14R1.122 CCCCCCCCN1CCC(C1)O 269982a_100011215560_100000210759 [0,1,0,1,0,0|1,0,0]=3 27133 B14R1.122 CCCCCCCCN1CC[C@@H](C1)F 2230a_100015203821_100000210759 [0,1,0,1,0,0|2,0,0]=4 27134 B14R1.122 CCCCCCCCN1CC[C@@H](C1)F 269982a_100015203821_100000210759 [0,1,0,1,0,0|2,0,0]=4 27135 B14R1.122 CCCCCCCCN1CC[C@@H](C1)F 34a_100015203821_100000210759 [0,1,0,1,0,0|2,0,0]=4 27136 B14R1.122 CCCCCCCCN1CC[C@H](C1)C 2230a_100016987628_100000210759 [0,1,0,1,0,0|2,0,0]=4 27137 B14R1.122 CCCCCCCCN1CC[C@H](C1)C 269982a_100016987628_100000210759 [0,1,0,1,0,0|2,0,0]=4 27138 B14R1.122 CCCCCCCCN1CC[C@H](C1)C 34a_100016987628_100000210759 [0,1,0,1,0,0|2,0,0]=4 27139 B14R1.122 CCCCCCCNC1CCC(C1)C 270004a_100000229938_100011215218 [0,1,0,1,0,0|2,0,0]=4 27140 B14R1.122 CCCCCCCNC1CCC(C1)O 270004a_100000229938_100012614533 [0,1,0,1,0,0|1,0,0]=3 27141 B14R1.122 CCCCCCCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100000210681 [0,1,0,1,0,0|1,0,0]=3 27142 B14R1.122 CCCCCCCOC1CCC(C1)C 34a_100000698185_100000210614 [0,1,0,1,0,0|2,0,0]=4 27143 B14R1.122 CCCCCCOC[C@@H]1C[C@@H](CN1)F 34a_100015204000_100000210314 [0,1,0,1,0,0|2,0,0]=4 27144 B14R1.122 CCCCOCCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100000743108 [0,1,0,1,0,0|2,0,0]=4 27145 B14R1.122 CCCCSCCNC1CCC(C1)O 270004a_100025743550_100012614533 [0,1,0,1,0,0|2,0,0]=4 27146 B14R1.122 CCCOCCCNC1CCC(C1)O 270004a_100011217757_100012614533 [0,1,0,1,0,0|2,0,0]=4 27147 B14R1.122 CN1CCC(C1)CNCCCCCO 34a_100000762737_200000690779 [0,1,0,1,0,0|2,0,0]=4 27148 B14R1.122 CN1CCC(C1)CSCCCCCO 62a_100000746330_200000690779 [0,1,0,1,0,0|2,0,0]=4 27149 B14R1.122 CN1CCC(C1)CSCCCCCO 62a_200000690779_100000746330 [0,1,0,1,0,0|2,0,0]=4 27150 B14R1.122 CN1CCC(C1)SCCCCCCO 62a_100000766143_200012183744 [0,1,0,1,0,0|2,0,0]=4 27151 B14R1.122 COCCCCCCN1CCC(C1)O 2230a_100011215560_100011998445 [0,1,0,1,0,0|2,0,0]=4 27152 B14R1.122 COCCCCCCN1CCC(C1)O 269982a_100011215560_100011998445 [0,1,0,1,0,0|2,0,0]=4 27153 B14R1.122 COCCCCCNC1CCC(C1)O 270004a_100000747528_100012614533 [0,1,0,1,0,0|2,0,0]=4 27154 B14R1.122 C[C@@H]1CCN(C1)CCCCCCCO 2230a_100016987628_100000760002 [0,1,0,1,0,0|1,0,0]=3 27155 B14R1.122 C[C@@H]1CCN(C1)CCCCCCCO 269982a_100016987628_100000760002 [0,1,0,1,0,0|1,0,0]=3 27156 B14R1.122 C[C@@H]1CCN(C1)CCCCCCCO 34a_100016987628_100000760002 [0,1,0,1,0,0|1,0,0]=3 27157 B14R1.122 O=C1CCC(C1)OCCCCCCO 34a_100012614533_100000766143 [0,1,0,1,0,0|1,0,1]=4 27158 B14R1.122 OCCCCCCCN1CCC(C1)O 2230a_100011215560_100000760002 [0,1,0,1,0,0|1,0,0]=3 27159 B14R1.122 OCCCCCCCN1CCC(C1)O 269982a_100011215560_100000760002 [0,1,0,1,0,0|1,0,0]=3 27160 B14R1.122 OCCCCCCCN1CC[C@@H](C1)F 2230a_100015203821_100000760002 [0,1,0,1,0,0|1,0,0]=3 27161 B14R1.122 OCCCCCCCN1CC[C@@H](C1)F 269982a_100015203821_100000760002 [0,1,0,1,0,0|1,0,0]=3 27162 B14R1.122 OCCCCCCCN1CC[C@@H](C1)F 34a_100015203821_100000760002 [0,1,0,1,0,0|1,0,0]=3 27163 B14R1.122 OCCCCCCNC1CCC(C1)O 270004a_100000686447_100012614533 [0,1,0,1,0,0|1,0,0]=3 27164 B14R1.122 OCCCCCCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100000766143 [0,1,0,1,0,0|1,0,0]=3 27165 B14R1.122 OCCCCCOC[C@@H]1C[C@@H](CN1)F 34a_100015204000_100000746330 [0,1,0,1,0,0|2,0,0]=4 27166 B14R1.122 O[C@@H]1CC[C@@H](C1)NCCCCCCF 2230a_100015195300_100015922095 [0,1,0,1,0,0|2,0,0]=4 27167 B14R1.159 C=C(C)CCNCC1CCCCC1O 34a_100011216029_100000730704 [0,1,0,1,0,0|1,0,1]=4 27168 B14R1.159 CC(=O)CCCOC1CCCCC1O 34a_100000759063_100000038908 [0,1,0,1,0,0|1,0,1]=4 27169 B14R1.159 CC(=O)CCCSC1CCCCC1O 62a_100000038908_100011215641 [0,1,0,1,0,0|1,0,1]=4 27170 B14R1.159 CC(=O)CCCSC1CCCCC1O 62a_100011215641_100000038908 [0,1,0,1,0,0|1,0,1]=4 27171 B14R1.159 CC(C)CCCCN1CCCCC1C 2230a_100000211376_100011216152 [0,1,0,1,0,0|2,0,0]=4 27172 B14R1.159 CC(C)CCCCN1CCCCC1C 269982a_100000211376_100011216152 [0,1,0,1,0,0|2,0,0]=4 27173 B14R1.159 CC(C)CCCCN1CCCCC1C 34a_100000211376_100011216152 [0,1,0,1,0,0|2,0,0]=4 27174 B14R1.159 CC(C)CCCNC1CCCCC1C 2230a_100000211402_100011214892 [0,1,0,1,0,0|2,0,0]=4 27175 B14R1.159 CC(C)CCCNC1CCCCC1C 269862a_200000737386_100000210921 [0,1,0,1,0,0|2,0,0]=4 27176 B14R1.159 CC(C)CCCNC1CCCCC1C 270004a_200000737386_100000210921 [0,1,0,1,0,0|2,0,0]=4 27177 B14R1.159 CC(C)CCCNC1CCCCC1C 34a_100000211402_100011214892 [0,1,0,1,0,0|2,0,0]=4 27178 B14R1.159 CC(C)CCCNC1CCCCC1F 34a_200000737386_100015423560 [0,1,0,1,0,0|2,0,0]=4 27179 B14R1.159 CC(C)CCCNC1CCCCC1O 34a_200000737386_100000038908 [0,1,0,1,0,0|1,0,0]=3 27180 B14R1.159 CC(C)CCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100011214892 [0,1,0,1,0,0|2,0,0]=4 27181 B14R1.159 CC(C)CCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100011214892 [0,1,0,1,0,0|2,0,0]=4 27182 B14R1.159 CC(C)CCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100011214892 [0,1,0,1,0,0|2,0,0]=4 27183 B14R1.159 CC(C)CCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100011214892 [0,1,0,1,0,0|2,0,0]=4 27184 B14R1.159 CC(C)CCCOC1CCCCC1C 34a_100000211207_100011214892 [0,1,0,1,0,0|2,0,0]=4 27185 B14R1.159 CC(C)CCCOC1CCCCC1C 7a_100000211207_100011214892 [0,1,0,1,0,0|2,0,0]=4 27186 B14R1.159 CC(C)CCCOC1CCCCC1Cl 34a_100000038908_100011214892 [0,1,0,1,0,0|2,0,0]=4 27187 B14R1.159 CC(C)CCCOC1CCCCC1Cl 7a_100000038908_100011214892 [0,1,0,1,0,0|2,0,0]=4 27188 B14R1.159 CC(C)CCCOC1CCCCC1F 34a_100000210774_100015423560 [0,1,0,1,0,0|2,0,0]=4 27189 B14R1.159 CC(C)CCCOC1CCCCC1O 34a_100000210774_100000038908 [0,1,0,1,0,0|1,0,0]=3 27190 B14R1.159 CC(C)CCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100011214892 [0,1,0,1,0,0|2,0,0]=4 27191 B14R1.159 CC(C)CCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100011214892 [0,1,0,1,0,0|2,0,0]=4 27192 B14R1.159 CC(C)CCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100011214892 [0,1,0,1,0,0|2,0,0]=4 27193 B14R1.159 CC(C)CCCSC1CCCCC1F 62a_100011214892_100015423560 [0,1,0,1,0,0|2,0,0]=4 27194 B14R1.159 CC(C)CCCSC1CCCCC1F 62a_100015423560_100011214892 [0,1,0,1,0,0|2,0,0]=4 27195 B14R1.159 CC(C)CCCSC1CCCCC1O 62a_100000038908_100011214892 [0,1,0,1,0,0|1,0,0]=3 27196 B14R1.159 CC(C)CCCSC1CCCCC1O 62a_100011214892_100000038908 [0,1,0,1,0,0|1,0,0]=3 27197 B14R1.159 CC(C)CCNCC1CCCCC1O 269862a_100011216029_100000185833 [0,1,0,1,0,0|1,0,0]=3 27198 B14R1.159 CC(C)CCNCC1CCCCC1O 34a_100011216029_100000210312 [0,1,0,1,0,0|1,0,0]=3 27199 B14R1.159 CC(C)NCCOC1CCCCC1O 34a_100000224655_100000038908 [0,1,0,1,0,0|2,0,0]=4 27200 B14R1.159 CC(C)OCCNC1CCCCC1O 34a_100000701111_100000038908 [0,1,0,1,0,0|2,0,0]=4 27201 B14R1.159 CC(C)OCCOC1CCCCC1O 34a_100000211219_100000038908 [0,1,0,1,0,0|2,0,0]=4 27202 B14R1.159 CC(C)OCCSC1CCCCC1O 62a_100000038908_100000211751 [0,1,0,1,0,0|2,0,0]=4 27203 B14R1.159 CC(C)OCCSC1CCCCC1O 62a_100000211751_100000038908 [0,1,0,1,0,0|2,0,0]=4 27204 B14R1.159 CC(C)OCNCC1CCCCC1O 34a_100011216029_100000709892 [0,1,0,1,0,0|2,0,0]=4 27205 B14R1.159 CC(C)SCCNC1CCCCC1O 34a_100000731138_100000038908 [0,1,0,1,0,0|2,0,0]=4 27206 B14R1.159 CC(C)SCCOC1CCCCC1O 34a_200011212901_100000038908 [0,1,0,1,0,0|2,0,0]=4 27207 B14R1.159 CC(C)SCCSC1CCCCC1O 62a_100000038908_100000730970 [0,1,0,1,0,0|2,0,0]=4 27208 B14R1.159 CC(C)SCCSC1CCCCC1O 62a_100000730970_100000038908 [0,1,0,1,0,0|2,0,0]=4 27209 B14R1.159 CC(O)CCCNC1CCCCC1C 2230a_100000211402_200000718107 [0,1,0,1,0,0|1,0,0]=3 27210 B14R1.159 CC(O)CCCNC1CCCCC1C 34a_100000211402_200000718107 [0,1,0,1,0,0|1,0,0]=3 27211 B14R1.159 CC(O)CCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_200000718107 [0,1,0,1,0,0|2,0,0]=4 27212 B14R1.159 CC(O)CCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_200000718107 [0,1,0,1,0,0|2,0,0]=4 27213 B14R1.159 CC(O)CCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_200000718107 [0,1,0,1,0,0|2,0,0]=4 27214 B14R1.159 CC(O)CCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_200000718107 [0,1,0,1,0,0|2,0,0]=4 27215 B14R1.159 CC(O)CCCOC1CCCCC1C 34a_100000211207_200000718107 [0,1,0,1,0,0|1,0,0]=3 27216 B14R1.159 CC(O)CCCOC1CCCCC1C 7a_100000211207_200000718107 [0,1,0,1,0,0|1,0,0]=3 27217 B14R1.159 CC(O)CCCOC1CCCCC1Cl 34a_100000038908_200000718107 [0,1,0,1,0,0|2,0,0]=4 27218 B14R1.159 CC(O)CCCOC1CCCCC1Cl 7a_100000038908_200000718107 [0,1,0,1,0,0|2,0,0]=4 27219 B14R1.159 CC(O)CCCOC1CCNCC1C 34a_100011998114_200000718107 [0,1,0,1,0,0|2,0,0]=4 27220 B14R1.159 CC(O)CCCOC1CNCCC1C 34a_100000696640_200000718107 [0,1,0,1,0,0|2,0,0]=4 27221 B14R1.159 CC(O)CCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_200000718107 [0,1,0,1,0,0|2,0,0]=4 27222 B14R1.159 CC(O)CCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_200000718107 [0,1,0,1,0,0|2,0,0]=4 27223 B14R1.159 CC(O)CCCO[C@H]1CCCC[C@H]1N 34a_100015191688_200000718107 [0,1,0,1,0,0|2,0,0]=4 27224 B14R1.159 CC(O)CCCSC1CCCCC1F 62a_100015423560_200000718107 [0,1,0,1,0,0|2,0,0]=4 27225 B14R1.159 CC(O)CCCSC1CCCCC1F 62a_200000718107_100015423560 [0,1,0,1,0,0|2,0,0]=4 27226 B14R1.159 CC(O)CCCSC1CCCCC1O 62a_100000038908_200000718107 [0,1,0,1,0,0|1,0,0]=3 27227 B14R1.159 CC(O)CCCSC1CCCCC1O 62a_200000718107_100000038908 [0,1,0,1,0,0|1,0,0]=3 27228 B14R1.159 CC(O)CCNCC1CCCCC1O 34a_100011216029_100012276601 [0,1,0,1,0,0|1,0,0]=3 27229 B14R1.159 CC(O)CCNCC1CCCCN1C 34a_100011228421_100012276601 [0,1,0,1,0,0|2,0,0]=4 27230 B14R1.159 CC(O)CCOCC1CCCCN1C 34a_100000225079_100012276601 [0,1,0,1,0,0|2,0,0]=4 27231 B14R1.159 CC(O)CCSCC1CCCCN1C 62a_100012276601_100015185383 [0,1,0,1,0,0|2,0,0]=4 27232 B14R1.159 CC(O)CCSCC1CCCCN1C 62a_100015185383_100012276601 [0,1,0,1,0,0|2,0,0]=4 27233 B14R1.159 CC(O)CNCCC1CCCCN1C 2230a_100000210904_100000211948 [0,1,0,1,0,0|2,0,0]=4 27234 B14R1.159 CC(O)CNCCC1CCCCN1C 34a_100000210904_100000211948 [0,1,0,1,0,0|2,0,0]=4 27235 B14R1.159 CC(O)CNCCN1CCCCC1C 2230a_100000739827_100011218427 [0,1,0,1,0,0|2,0,0]=4 27236 B14R1.159 CC(O)CNCCN1CCCCC1C 34a_100000739827_100011218427 [0,1,0,1,0,0|2,0,0]=4 27237 B14R1.159 CC(O)COCCN1CCCCC1C 34a_100011305533_100011218427 [0,1,0,1,0,0|2,0,0]=4 27238 B14R1.159 CC(O)CSCCC1CCCCN1C 62a_100000211948_100011218427 [0,1,0,1,0,0|2,0,0]=4 27239 B14R1.159 CC(O)CSCCC1CCCCN1C 62a_100011218427_100000211948 [0,1,0,1,0,0|2,0,0]=4 27240 B14R1.159 CC1CCCCN1CCCCB(O)O 2230a_100000211376_200009817182 [0,1,0,1,0,0|2,0,0]=4 27241 B14R1.159 CC1CCCCN1CCCCB(O)O 269982a_100000211376_200009817182 [0,1,0,1,0,0|2,0,0]=4 27242 B14R1.159 CC1CCCCN1CCCCB(O)O 34a_100000211376_200009817182 [0,1,0,1,0,0|2,0,0]=4 27243 B14R1.159 CC1CCCCN1CCNC[C@@H](C)O 2230a_100000739827_100009817552 [0,1,0,1,0,0|2,0,0]=4 27244 B14R1.159 CC1CCCCN1CCNC[C@@H](C)O 34a_100000739827_100009817552 [0,1,0,1,0,0|2,0,0]=4 27245 B14R1.159 CC1CCCCN1CCOC[C@@H](C)O 34a_100011305533_100009817552 [0,1,0,1,0,0|2,0,0]=4 27246 B14R1.159 CN(C)CCCSC1CCCCC1O 62a_100000038908_100000757444 [0,1,0,1,0,0|2,0,0]=4 27247 B14R1.159 C[C@@H](O)CSCCC1CCCCN1C 62a_100000211948_100009817552 [0,1,0,1,0,0|2,0,0]=4 27248 B14R1.159 C[C@@H](O)CSCCC1CCCCN1C 62a_100009817552_100000211948 [0,1,0,1,0,0|2,0,0]=4 27249 B14R1.168 CC(=O)CCCCS[C@@H]1CCC[C@H]1O 62a_100000735457_200016002552 [0,1,0,1,0,0|1,0,1]=4 27250 B14R1.168 CC(=O)CCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000735457 [0,1,0,1,0,0|1,0,1]=4 27251 B14R1.168 CC(C)CCCCCN1CCC[C@@H]1C 2230a_100020605311_100000210682 [0,1,0,1,0,0|2,0,0]=4 27252 B14R1.168 CC(C)CCCCCN1CCC[C@@H]1C 269982a_100020605311_100000210682 [0,1,0,1,0,0|2,0,0]=4 27253 B14R1.168 CC(C)CCCCCN1CCC[C@H]1C 2230a_100015189458_100000210682 [0,1,0,1,0,0|2,0,0]=4 27254 B14R1.168 CC(C)CCCCCN1CCC[C@H]1C 269982a_100015189458_100000210682 [0,1,0,1,0,0|2,0,0]=4 27255 B14R1.168 CC(C)CCCCCN1CCC[C@H]1C 34a_100015189458_100000210682 [0,1,0,1,0,0|2,0,0]=4 27256 B14R1.168 CC(C)CCCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100011216152 [0,1,0,1,0,0|2,0,0]=4 27257 B14R1.168 CC(C)CCCCOC1CCCC1C 34a_100011216460_100011216152 [0,1,0,1,0,0|2,0,0]=4 27258 B14R1.168 CC(C)CCCCOC1CCCC1C 7a_100011216460_100011216152 [0,1,0,1,0,0|2,0,0]=4 27259 B14R1.168 CC(C)CCCCOC1COCC1O 34a_100011214890_200000725654 [0,1,0,1,0,0|2,0,0]=4 27260 B14R1.168 CC(C)CCCCOC1COCC1O 7a_100011214890_200000725654 [0,1,0,1,0,0|2,0,0]=4 27261 B14R1.168 CC(C)CCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100011216152 [0,1,0,1,0,0|2,0,0]=4 27262 B14R1.168 CC(C)CCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100011216152 [0,1,0,1,0,0|2,0,0]=4 27263 B14R1.168 CC(C)CCCCSC1COCC1O 62a_100011216152_200000725654 [0,1,0,1,0,0|2,0,0]=4 27264 B14R1.168 CC(C)CCCCSC1COCC1O 62a_200000725654_100011216152 [0,1,0,1,0,0|2,0,0]=4 27265 B14R1.168 CC(C)CCCCS[C@@H]1CCC[C@H]1O 62a_100011216152_200016002552 [0,1,0,1,0,0|1,0,0]=3 27266 B14R1.168 CC(C)CCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100011216152 [0,1,0,1,0,0|1,0,0]=3 27267 B14R1.168 CC(O)CCCOCC1CCCN1C 34a_100000743107_200000718107 [0,1,0,1,0,0|2,0,0]=4 27268 B14R1.168 CC(O)CCNCCC1CCCN1C 2230a_200000755665_100000005710 [0,1,0,1,0,0|2,0,0]=4 27269 B14R1.168 CC(O)CCOCCC1CCCN1C 34a_100011215177_100012276601 [0,1,0,1,0,0|2,0,0]=4 27270 B14R1.168 CC(O)CCOCCC1CCCN1C 7a_100011215177_100012276601 [0,1,0,1,0,0|2,0,0]=4 27271 B14R1.168 CC(O)CCSCCC1CCCN1C 62a_100000005710_100012276601 [0,1,0,1,0,0|2,0,0]=4 27272 B14R1.168 CC(O)CCSCCC1CCCN1C 62a_100012276601_100000005710 [0,1,0,1,0,0|2,0,0]=4 27273 B14R1.168 CC1CCCC1OCCCCB(O)O 34a_100011216460_200009817182 [0,1,0,1,0,0|2,0,0]=4 27274 B14R1.168 CC1CCCC1OCCCCB(O)O 7a_100011216460_200009817182 [0,1,0,1,0,0|2,0,0]=4 27275 B14R1.168 CN(C)CCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000690147 [0,1,0,1,0,0|2,0,0]=4 27276 B14R1.168 C[C@@H]1CCCN1CCCCCB(O)O 2230a_100015189458_200009817188 [0,1,0,1,0,0|2,0,0]=4 27277 B14R1.168 C[C@@H]1CCCN1CCCCCB(O)O 269982a_100015189458_200009817188 [0,1,0,1,0,0|2,0,0]=4 27278 B14R1.168 C[C@@H]1CCCN1CCCCCB(O)O 34a_100015189458_200009817188 [0,1,0,1,0,0|2,0,0]=4 27279 B14R1.168 C[C@H]1CCCN1CCCCCB(O)O 2230a_100020605311_200009817188 [0,1,0,1,0,0|2,0,0]=4 27280 B14R1.168 C[C@H]1CCCN1CCCCCB(O)O 269982a_100020605311_200009817188 [0,1,0,1,0,0|2,0,0]=4 27281 B14R1.221 BrCCCCCCCCCOC1CC1 34a_100009813782_100000211595 [0,1,0,1,0,0|1,0,0]=3 27282 B14R1.221 BrCCCCCCCCOCC1CC1 34a_100009813846_100000742324 [0,1,0,1,0,0|1,0,0]=3 27283 B14R1.221 BrCCCCCCCCOCC1CC1 7a_100009813846_100000742324 [0,1,0,1,0,0|1,0,0]=3 27284 B14R1.221 BrCCCCCCCCOCC1CO1 34a_100009813846_102125554688 [0,1,0,1,0,0|1,0,0]=3 27285 B14R1.221 BrCCCCCCCCOCC1CO1 7a_100009813846_102125554688 [0,1,0,1,0,0|1,0,0]=3 27286 B14R1.221 BrCCCCCCCCOCC1CS1 7a_100009813846_100000031435 [0,1,0,1,0,0|1,1,0]=4 27287 B14R1.221 BrCCCCCCCCOC[C@@H]1CO1 7a_100009813846_100000745022 [0,1,0,1,0,0|1,0,0]=3 27288 B14R1.221 BrCCCCCCCOCCC1CC1 34a_100000760002_100000694398 [0,1,0,1,0,0|1,0,0]=3 27289 B14R1.221 BrCCCCCCCOCCC1CC1 7a_100000760002_100000764125 [0,1,0,1,0,0|1,0,0]=3 27290 B14R1.221 BrCCCCCCCOCCC1CO1 34a_100000760002_100000732470 [0,1,0,1,0,0|1,0,0]=3 27291 B14R1.221 BrCCCCCCCOCCC1CO1 7a_100000760002_100000732470 [0,1,0,1,0,0|1,0,0]=3 27292 B14R1.221 BrCCCCCCOCCCC1CO1 34a_100011215345_100000733510 [0,1,0,1,0,0|1,0,0]=3 27293 B14R1.221 BrCCCCCCOCCCC1CO1 7a_100011215345_100000733510 [0,1,0,1,0,0|1,0,0]=3 27294 B14R1.221 C#CCCCCCCCCOC1CC1 34a_100000065265_100000211595 [0,1,0,1,0,0|1,0,1]=4 27295 B14R1.221 C#CCCCCCCCNCC1CC1 2230a_100000735609_100153394163 [0,1,0,1,0,0|1,0,1]=4 27296 B14R1.221 C#CCCCCCCCNCC1CC1 34a_100000735609_100153394163 [0,1,0,1,0,0|1,0,1]=4 27297 B14R1.221 C#CCCCCCCCOCC1CC1 34a_100000054614_100000742324 [0,1,0,1,0,0|1,0,1]=4 27298 B14R1.221 C#CCCCCCCCOCC1CC1 34a_100000211283_100153394163 [0,1,0,1,0,0|1,0,1]=4 27299 B14R1.221 C#CCCCCCCCOCC1CC1 7a_100000054614_100000742324 [0,1,0,1,0,0|1,0,1]=4 27300 B14R1.221 C#CCCCCCCCOCC1CO1 34a_100000054614_102125554688 [0,1,0,1,0,0|0,0,2]=4 27301 B14R1.221 C#CCCCCCCCOCC1CO1 7a_100000054614_102125554688 [0,1,0,1,0,0|0,0,2]=4 27302 B14R1.221 C#CCCCCCCCOC[C@@H]1CO1 34a_100000757423_100153394163 [0,1,0,1,0,0|0,0,2]=4 27303 B14R1.221 C#CCCCCCCCOC[C@@H]1CO1 7a_100000054614_100000745022 [0,1,0,1,0,0|0,0,2]=4 27304 B14R1.221 C#CCCCCCCCSCC1CC1 62a_100000756562_100153394163 [0,1,0,1,0,0|1,0,1]=4 27305 B14R1.221 C#CCCCCCCCSCC1CC1 62a_100153394163_100000742324 [0,1,0,1,0,0|1,0,1]=4 27306 B14R1.221 C#CCCCCCCCSCC1CO1 62a_100153394163_102125554688 [0,1,0,1,0,0|0,0,2]=4 27307 B14R1.221 C#CCCCCCCCSCC1CO1 62a_102125554688_100153394163 [0,1,0,1,0,0|0,0,2]=4 27308 B14R1.221 C#CCCCCCCCSC[C@@H]1CO1 62a_100000745022_100153394163 [0,1,0,1,0,0|0,0,2]=4 27309 B14R1.221 C#CCCCCCCCSC[C@@H]1CO1 62a_100153394163_100000745022 [0,1,0,1,0,0|0,0,2]=4 27310 B14R1.221 C#CCCCCCCNCCC1CC1 34a_100000764129_100012276617 [0,1,0,1,0,0|1,0,1]=4 27311 B14R1.221 C#CCCCCCCOCCC1CC1 34a_100000754188_100012276617 [0,1,0,1,0,0|1,0,1]=4 27312 B14R1.221 C#CCCCCCCOCCC1CC1 34a_100011217361_100000694398 [0,1,0,1,0,0|1,0,1]=4 27313 B14R1.221 C#CCCCCCCOCCC1CC1 7a_100000754188_100012276617 [0,1,0,1,0,0|1,0,1]=4 27314 B14R1.221 C#CCCCCCCOCCC1CC1 7a_100011217361_100000764125 [0,1,0,1,0,0|1,0,1]=4 27315 B14R1.221 C#CCCCCCCOCCC1CO1 34a_100011217361_100000732470 [0,1,0,1,0,0|0,0,2]=4 27316 B14R1.221 C#CCCCCCCOCCC1CO1 7a_100011217361_100000732470 [0,1,0,1,0,0|0,0,2]=4 27317 B14R1.221 C#CCCCCCCOCC[C@@H]1CO1 34a_100009820653_100012276617 [0,1,0,1,0,0|0,0,2]=4 27318 B14R1.221 C#CCCCCCCSCCC1CC1 62a_100000764125_100012276617 [0,1,0,1,0,0|1,0,1]=4 27319 B14R1.221 C#CCCCCCCSCCC1CC1 62a_100012276617_100000764125 [0,1,0,1,0,0|1,0,1]=4 27320 B14R1.221 C#CCCCCCCSCCC1CO1 62a_100000732470_100012276617 [0,1,0,1,0,0|0,0,2]=4 27321 B14R1.221 C#CCCCCCCSCCC1CO1 62a_100012276617_100000732470 [0,1,0,1,0,0|0,0,2]=4 27322 B14R1.221 C#CCCCCCOCCCC1CO1 34a_100000766912_100000733510 [0,1,0,1,0,0|0,0,2]=4 27323 B14R1.221 C#CCCCCCOCCCC1CO1 7a_100000766912_100000733510 [0,1,0,1,0,0|0,0,2]=4 27324 B14R1.221 C#CCCCCCSCCCC1CO1 62a_100000733510_100012094781 [0,1,0,1,0,0|0,0,2]=4 27325 B14R1.221 C#CCCCCCSCCCC1CO1 62a_100012094781_100000733510 [0,1,0,1,0,0|0,0,2]=4 27326 B14R1.221 C=CCCCCCCCCNC1CC1 34a_100000212008_100011933949 [0,1,0,1,0,0|1,0,1]=4 27327 B14R1.221 C=CCCCCCCCCOC1CC1 34a_100011215194_100000211595 [0,1,0,1,0,0|1,0,1]=4 27328 B14R1.221 C=CCCCCCCCCSC1CC1 62a_100011933949_100000211595 [0,1,0,1,0,0|1,0,1]=4 27329 B14R1.221 C=CCCCCCCCNCC1CC1 2230a_100000735609_100012355270 [0,1,0,1,0,0|1,0,1]=4 27330 B14R1.221 C=CCCCCCCCNCC1CC1 34a_100000735609_100012355270 [0,1,0,1,0,0|1,0,1]=4 27331 B14R1.221 C=CCCCCCCCOCC1CC1 34a_100000211283_100012355270 [0,1,0,1,0,0|1,0,1]=4 27332 B14R1.221 C=CCCCCCCCOCC1CC1 34a_100000730831_100000742324 [0,1,0,1,0,0|1,0,1]=4 27333 B14R1.221 C=CCCCCCCCOCC1CC1 7a_100000730831_100000742324 [0,1,0,1,0,0|1,0,1]=4 27334 B14R1.221 C=CCCCCCCCOCC1CO1 34a_100000730831_102125554688 [0,1,0,1,0,0|0,0,2]=4 27335 B14R1.221 C=CCCCCCCCOCC1CO1 7a_100000730831_102125554688 [0,1,0,1,0,0|0,0,2]=4 27336 B14R1.221 C=CCCCCCCCOC[C@@H]1CO1 34a_100000757423_100012355270 [0,1,0,1,0,0|0,0,2]=4 27337 B14R1.221 C=CCCCCCCCOC[C@@H]1CO1 7a_100000730831_100000745022 [0,1,0,1,0,0|0,0,2]=4 27338 B14R1.221 C=CCCCCCCCSCC1CC1 62a_100000756562_100012355270 [0,1,0,1,0,0|1,0,1]=4 27339 B14R1.221 C=CCCCCCCCSCC1CC1 62a_100012355270_100000742324 [0,1,0,1,0,0|1,0,1]=4 27340 B14R1.221 C=CCCCCCCCSCC1CO1 62a_100012355270_102125554688 [0,1,0,1,0,0|0,0,2]=4 27341 B14R1.221 C=CCCCCCCCSCC1CO1 62a_102125554688_100012355270 [0,1,0,1,0,0|0,0,2]=4 27342 B14R1.221 C=CCCCCCCCSC[C@@H]1CO1 62a_100000745022_100012355270 [0,1,0,1,0,0|0,0,2]=4 27343 B14R1.221 C=CCCCCCCCSC[C@@H]1CO1 62a_100012355270_100000745022 [0,1,0,1,0,0|0,0,2]=4 27344 B14R1.221 C=CCCCCCCNCCC1CC1 34a_100000764129_100011215473 [0,1,0,1,0,0|1,0,1]=4 27345 B14R1.221 C=CCCCCCCOCCC1CC1 34a_100000754188_100011215473 [0,1,0,1,0,0|1,0,1]=4 27346 B14R1.221 C=CCCCCCCOCCC1CC1 34a_200011216477_100000694398 [0,1,0,1,0,0|1,0,1]=4 27347 B14R1.221 C=CCCCCCCOCCC1CC1 7a_100000754188_100011215473 [0,1,0,1,0,0|1,0,1]=4 27348 B14R1.221 C=CCCCCCCOCCC1CC1 7a_200011216477_100000764125 [0,1,0,1,0,0|1,0,1]=4 27349 B14R1.221 C=CCCCCCCOCCC1CO1 34a_200011216477_100000732470 [0,1,0,1,0,0|0,0,2]=4 27350 B14R1.221 C=CCCCCCCOCCC1CO1 7a_200011216477_100000732470 [0,1,0,1,0,0|0,0,2]=4 27351 B14R1.221 C=CCCCCCCOCC[C@@H]1CO1 34a_100009820653_100011215473 [0,1,0,1,0,0|0,0,2]=4 27352 B14R1.221 C=CCCCCCCSCCC1CC1 62a_100000764125_100011215473 [0,1,0,1,0,0|1,0,1]=4 27353 B14R1.221 C=CCCCCCCSCCC1CC1 62a_100011215473_100000764125 [0,1,0,1,0,0|1,0,1]=4 27354 B14R1.221 C=CCCCCCCSCCC1CO1 62a_100000732470_100011215473 [0,1,0,1,0,0|0,0,2]=4 27355 B14R1.221 C=CCCCCCCSCCC1CO1 62a_100011215473_100000732470 [0,1,0,1,0,0|0,0,2]=4 27356 B14R1.221 C=CCCCCCOCCCC1CO1 34a_100011216702_100000733510 [0,1,0,1,0,0|0,0,2]=4 27357 B14R1.221 C=CCCCCCOCCCC1CO1 7a_100011216702_100000733510 [0,1,0,1,0,0|0,0,2]=4 27358 B14R1.221 C=CCCCCCSCCCC1CO1 62a_100000700193_100000733510 [0,1,0,1,0,0|0,0,2]=4 27359 B14R1.221 C=CCCCCCSCCCC1CO1 62a_100000733510_100000700193 [0,1,0,1,0,0|0,0,2]=4 27360 B14R1.221 CC/C=C/CCCOCCCC1CO1 34a_100016287902_100000733510 [0,1,0,1,0,0|0,0,2]=4 27361 B14R1.221 CC/C=C/CCCOCCCC1CO1 7a_100016287902_100000733510 [0,1,0,1,0,0|0,0,2]=4 27362 B14R1.221 CC/C=C\CCCCCOCC1CO1 34a_100016268722_102125554688 [0,1,0,1,0,0|0,0,2]=4 27363 B14R1.221 CC/C=C\CCCCCOCC1CO1 7a_100016268722_102125554688 [0,1,0,1,0,0|0,0,2]=4 27364 B14R1.221 CC/C=C\CCCCCOC[C@@H]1CO1 7a_100016268722_100000745022 [0,1,0,1,0,0|0,0,2]=4 27365 B14R1.221 CC/C=C\CCCCOCCC1CO1 34a_100016287862_100000732470 [0,1,0,1,0,0|0,0,2]=4 27366 B14R1.221 CC/C=C\CCCCOCCC1CO1 7a_100016287862_100000732470 [0,1,0,1,0,0|0,0,2]=4 27367 B14R1.221 CCCC#CCCOCCCC1CO1 34a_100000042726_100000733510 [0,1,0,1,0,0|0,0,2]=4 27368 B14R1.221 CCCC#CCCOCCCC1CO1 7a_100000042726_100000733510 [0,1,0,1,0,0|0,0,2]=4 27369 B14R1.221 CCCC/C=C/COCCCC1CO1 34a_200016272032_100000733510 [0,1,0,1,0,0|0,0,2]=4 27370 B14R1.221 CCCC/C=C/COCCCC1CO1 7a_200016272032_100000733510 [0,1,0,1,0,0|0,0,2]=4 27371 B14R1.221 CCCC/C=C\CCOCCC1CO1 34a_200016286491_100000732470 [0,1,0,1,0,0|0,0,2]=4 27372 B14R1.221 CCCC/C=C\CCOCCC1CO1 7a_200016286491_100000732470 [0,1,0,1,0,0|0,0,2]=4 27373 B14R1.221 CCCCC#CCCCOC[C@@H]1CO1 34a_100000757423_200000047210 [0,1,0,1,0,0|0,0,2]=4 27374 B14R1.221 CCCCC#CCCCSCC1CO1 62a_102125554688_200000047210 [0,1,0,1,0,0|0,0,2]=4 27375 B14R1.221 CCCCC#CCCCSCC1CO1 62a_200000047210_102125554688 [0,1,0,1,0,0|0,0,2]=4 27376 B14R1.221 CCCCC#CCCCSC[C@@H]1CO1 62a_100000745022_200000047210 [0,1,0,1,0,0|0,0,2]=4 27377 B14R1.221 CCCCC#CCCCSC[C@@H]1CO1 62a_200000047210_100000745022 [0,1,0,1,0,0|0,0,2]=4 27378 B14R1.221 CCCCC#CCCOCCC1CO1 34a_100000037610_100000732470 [0,1,0,1,0,0|0,0,2]=4 27379 B14R1.221 CCCCC#CCCOCCC1CO1 7a_100000037610_100000732470 [0,1,0,1,0,0|0,0,2]=4 27380 B14R1.221 CCCCC#CCOCCCC1CO1 34a_200000034558_100000733510 [0,1,0,1,0,0|0,0,2]=4 27381 B14R1.221 CCCCC#CCOCCCC1CO1 7a_200000034558_100000733510 [0,1,0,1,0,0|0,0,2]=4 27382 B14R1.221 CCCCC/C=C/COCCC1CO1 34a_100016258190_100000732470 [0,1,0,1,0,0|0,0,2]=4 27383 B14R1.221 CCCCC/C=C/COCCC1CO1 7a_100016258190_100000732470 [0,1,0,1,0,0|0,0,2]=4 27384 B14R1.221 CCCCC/C=C\CCOCC1CO1 34a_100016277358_102125554688 [0,1,0,1,0,0|0,0,2]=4 27385 B14R1.221 CCCCC/C=C\CCOCC1CO1 7a_100016277358_102125554688 [0,1,0,1,0,0|0,0,2]=4 27386 B14R1.221 CCCCC/C=C\CCOC[C@@H]1CO1 7a_100016277358_100000745022 [0,1,0,1,0,0|0,0,2]=4 27387 B14R1.221 CCCCCC#CCCOCC1CO1 34a_200000042877_102125554688 [0,1,0,1,0,0|0,0,2]=4 27388 B14R1.221 CCCCCC#CCCOCC1CO1 7a_200000042877_102125554688 [0,1,0,1,0,0|0,0,2]=4 27389 B14R1.221 CCCCCC#CCCOC[C@@H]1CO1 7a_200000042877_100000745022 [0,1,0,1,0,0|0,0,2]=4 27390 B14R1.221 CCCCCC#CCOCCC1CO1 34a_200000033628_100000732470 [0,1,0,1,0,0|0,0,2]=4 27391 B14R1.221 CCCCCC#CCOCCC1CO1 7a_200000033628_100000732470 [0,1,0,1,0,0|0,0,2]=4 27392 B14R1.221 CCCCCC#CCOCC[C@@H]1CO1 34a_100009820653_100009816472 [0,1,0,1,0,0|0,0,2]=4 27393 B14R1.221 CCCCCC#CCSCCC1CO1 62a_100000732470_100009816472 [0,1,0,1,0,0|0,0,2]=4 27394 B14R1.221 CCCCCC#CCSCCC1CO1 62a_100009816472_100000732470 [0,1,0,1,0,0|0,0,2]=4 27395 B14R1.221 CCCCCC/C=C/COCC1CO1 34a_200016276170_102125554688 [0,1,0,1,0,0|0,0,2]=4 27396 B14R1.221 CCCCCC/C=C/COCC1CO1 7a_200016276170_102125554688 [0,1,0,1,0,0|0,0,2]=4 27397 B14R1.221 CCCCCC/C=C/COC[C@@H]1CO1 7a_200016276170_100000745022 [0,1,0,1,0,0|0,0,2]=4 27398 B14R1.221 CCCCCCC#CCOCC1CO1 34a_200000037284_102125554688 [0,1,0,1,0,0|0,0,2]=4 27399 B14R1.221 CCCCCCC#CCOCC1CO1 7a_200000037284_102125554688 [0,1,0,1,0,0|0,0,2]=4 27400 B14R1.221 CCCCCCC#CCOC[C@@H]1CO1 7a_200000037284_100000745022 [0,1,0,1,0,0|0,0,2]=4 27401 B14R1.221 CCCCCCCCCCNC1CC1 34a_100000212008_100000210320 [0,1,0,1,0,0|1,0,0]=3 27402 B14R1.221 CCCCCCCCCCNC1CC1 34a_100000684558_100000211595 [0,1,0,1,0,0|1,0,0]=3 27403 B14R1.221 CCCCCCCCCCOC1CC1 34a_100000210711_100000211595 [0,1,0,1,0,0|1,0,0]=3 27404 B14R1.221 CCCCCCCCCNCC1CC1 2230a_100000212291_100000742324 [0,1,0,1,0,0|1,0,0]=3 27405 B14R1.221 CCCCCCCCCNCC1CC1 2230a_100000735609_100011214924 [0,1,0,1,0,0|1,0,0]=3 27406 B14R1.221 CCCCCCCCCNCC1CC1 269862a_100000212291_100000741477 [0,1,0,1,0,0|1,0,0]=3 27407 B14R1.221 CCCCCCCCCNCC1CC1 34a_100000212291_100000742324 [0,1,0,1,0,0|1,0,0]=3 27408 B14R1.221 CCCCCCCCCNCC1CC1 34a_100000735609_100011214924 [0,1,0,1,0,0|1,0,0]=3 27409 B14R1.221 CCCCCCCCCNCC1CO1 2230a_100000212291_100011216344 [0,1,0,1,0,0|0,0,0]=2 27410 B14R1.221 CCCCCCCCCNCC1CO1 34a_100000212291_102125554688 [0,1,0,1,0,0|0,0,0]=2 27411 B14R1.221 CCCCCCCCCOCC1CC1 34a_100000210712_100000742324 [0,1,0,1,0,0|1,0,0]=3 27412 B14R1.221 CCCCCCCCCOCC1CC1 34a_100000211283_100011214924 [0,1,0,1,0,0|1,0,0]=3 27413 B14R1.221 CCCCCCCCCOCC1CC1 7a_100000210712_100000742324 [0,1,0,1,0,0|1,0,0]=3 27414 B14R1.221 CCCCCCCCCOCC1CO1 34a_100000210712_102125554688 [0,1,0,1,0,0|0,0,0]=2 27415 B14R1.221 CCCCCCCCCOCC1CO1 7a_100000210712_102125554688 [0,1,0,1,0,0|0,0,0]=2 27416 B14R1.221 CCCCCCCCCOCC1CS1 7a_100000210712_100000031435 [0,1,0,1,0,0|0,1,0]=3 27417 B14R1.221 CCCCCCCCCOC[C@@H]1CO1 34a_100000757423_100011214924 [0,1,0,1,0,0|0,0,0]=2 27418 B14R1.221 CCCCCCCCCOC[C@@H]1CO1 7a_100000210712_100000745022 [0,1,0,1,0,0|0,0,0]=2 27419 B14R1.221 CCCCCCCCCSCC1CC1 62a_100000756562_100000210670 [0,1,0,1,0,0|1,0,0]=3 27420 B14R1.221 CCCCCCCCCSCC1CO1 62a_102125554688_100000210670 [0,1,0,1,0,0|0,0,0]=2 27421 B14R1.221 CCCCCCCCCSCC1CS1 62a_100000031435_100000210670 [0,1,0,1,0,0|0,1,0]=3 27422 B14R1.221 CCCCCCCCCSC[C@@H]1CO1 62a_100000745022_100000210670 [0,1,0,1,0,0|0,0,0]=2 27423 B14R1.221 CCCCCCCCNCCC1CC1 2230a_100000229939_100000694398 [0,1,0,1,0,0|1,0,0]=3 27424 B14R1.221 CCCCCCCCNCCC1CC1 34a_100000229939_100000694398 [0,1,0,1,0,0|1,0,0]=3 27425 B14R1.221 CCCCCCCCNCCC1CC1 34a_100000764129_100000210759 [0,1,0,1,0,0|1,0,0]=3 27426 B14R1.221 CCCCCCCCNCCC1CO1 2230a_100000229939_100000732470 [0,1,0,1,0,0|0,0,0]=2 27427 B14R1.221 CCCCCCCCNCCC1CO1 34a_100000229939_100000732470 [0,1,0,1,0,0|0,0,0]=2 27428 B14R1.221 CCCCCCCCOCCC1CC1 34a_100000210232_100000694398 [0,1,0,1,0,0|1,0,0]=3 27429 B14R1.221 CCCCCCCCOCCC1CC1 34a_100000754188_100000210759 [0,1,0,1,0,0|1,0,0]=3 27430 B14R1.221 CCCCCCCCOCCC1CC1 7a_100000210232_100000764125 [0,1,0,1,0,0|1,0,0]=3 27431 B14R1.221 CCCCCCCCOCCC1CC1 7a_100000754188_100000210759 [0,1,0,1,0,0|1,0,0]=3 27432 B14R1.221 CCCCCCCCOCCC1CO1 34a_100000210232_100000732470 [0,1,0,1,0,0|0,0,0]=2 27433 B14R1.221 CCCCCCCCOCCC1CO1 7a_100000210232_100000732470 [0,1,0,1,0,0|0,0,0]=2 27434 B14R1.221 CCCCCCCCOCC[C@@H]1CO1 34a_100009820653_100000210759 [0,1,0,1,0,0|0,0,0]=2 27435 B14R1.221 CCCCCCCCSCCC1CC1 62a_100000210759_100000764125 [0,1,0,1,0,0|1,0,0]=3 27436 B14R1.221 CCCCCCCCSCCC1CC1 62a_100000764125_100000210317 [0,1,0,1,0,0|1,0,0]=3 27437 B14R1.221 CCCCCCCCSCCC1CO1 62a_100000210759_100000732470 [0,1,0,1,0,0|0,0,0]=2 27438 B14R1.221 CCCCCCCCSCCC1CO1 62a_100000732470_100000210317 [0,1,0,1,0,0|0,0,0]=2 27439 B14R1.221 CCCCCCCNCCCC1CO1 2230a_100000229938_100000733510 [0,1,0,1,0,0|0,0,0]=2 27440 B14R1.221 CCCCCCCOCCCC1CO1 34a_100000210272_100000733510 [0,1,0,1,0,0|0,0,0]=2 27441 B14R1.221 CCCCCCCOCCCC1CO1 7a_100000210272_100000733510 [0,1,0,1,0,0|0,0,0]=2 27442 B14R1.221 CCCCCCCOCCNC1CC1 34a_100000738766_100000210614 [0,1,0,1,0,0|2,0,0]=4 27443 B14R1.221 CCCCCCCSCCCC1CO1 62a_100000210614_100000733510 [0,1,0,1,0,0|0,0,0]=2 27444 B14R1.221 CCCCCCCSCCCC1CO1 62a_100000733510_100000210316 [0,1,0,1,0,0|0,0,0]=2 27445 B14R1.221 CCCCCCOCCOCC1CC1 34a_100000691444_100000742324 [0,1,0,1,0,0|2,0,0]=4 27446 B14R1.221 CCCCCCOCCOCC1CC1 7a_100000691444_100000742324 [0,1,0,1,0,0|2,0,0]=4 27447 B14R1.221 CCCCCCOCCOCC1CO1 34a_100000691444_102125554688 [0,1,0,1,0,0|1,0,0]=3 27448 B14R1.221 CCCCCCOCCOCC1CO1 7a_100000691444_102125554688 [0,1,0,1,0,0|1,0,0]=3 27449 B14R1.221 CCCCCCOCCOCC1CS1 7a_100000691444_100000031435 [0,1,0,1,0,0|1,1,0]=4 27450 B14R1.221 CCCCCCOCCOC[C@@H]1CO1 7a_100000691444_100000745022 [0,1,0,1,0,0|1,0,0]=3 27451 B14R1.221 CCCCCNCCOCCC1CC1 34a_100000224656_100000694398 [0,1,0,1,0,0|2,0,0]=4 27452 B14R1.221 CCCCCNCCOCCC1CO1 34a_100000224656_100000732470 [0,1,0,1,0,0|1,0,0]=3 27453 B14R1.221 CCCCCOCCOCCC1CC1 34a_100011215259_100000694398 [0,1,0,1,0,0|2,0,0]=4 27454 B14R1.221 CCCCCOCCOCCC1CC1 7a_100011215259_100000764125 [0,1,0,1,0,0|2,0,0]=4 27455 B14R1.221 CCCCCOCCOCCC1CO1 34a_100011215259_100000732470 [0,1,0,1,0,0|1,0,0]=3 27456 B14R1.221 CCCCCOCCOCCC1CO1 7a_100011215259_100000732470 [0,1,0,1,0,0|1,0,0]=3 27457 B14R1.221 CCCCNCCCCOCC1CC1 34a_200011216965_100000742324 [0,1,0,1,0,0|2,0,0]=4 27458 B14R1.221 CCCCNCCCCOCC1CO1 34a_200011216965_102125554688 [0,1,0,1,0,0|1,0,0]=3 27459 B14R1.221 CCCCOCCCCOCC1CC1 34a_200000760531_100000742324 [0,1,0,1,0,0|2,0,0]=4 27460 B14R1.221 CCCCOCCCCOCC1CC1 7a_200000760531_100000742324 [0,1,0,1,0,0|2,0,0]=4 27461 B14R1.221 CCCCOCCCCOCC1CO1 34a_100010889290_100000210210 [0,1,0,1,0,0|1,0,0]=3 27462 B14R1.221 CCCCOCCCCOCC1CO1 34a_200000760531_102125554688 [0,1,0,1,0,0|1,0,0]=3 27463 B14R1.221 CCCCOCCCCOCC1CO1 7a_100010889290_100000210211 [0,1,0,1,0,0|1,0,0]=3 27464 B14R1.221 CCCCOCCCCOCC1CO1 7a_200000760531_102125554688 [0,1,0,1,0,0|1,0,0]=3 27465 B14R1.221 CCCCOCCCCOCC1CS1 7a_200000760531_100000031435 [0,1,0,1,0,0|1,1,0]=4 27466 B14R1.221 CCCCOCCCCOC[C@@H]1CO1 7a_200000760531_100000745022 [0,1,0,1,0,0|1,0,0]=3 27467 B14R1.221 CCCCOCCCNCCC1CC1 2230a_200000211371_100000694398 [0,1,0,1,0,0|2,0,0]=4 27468 B14R1.221 CCCCOCCCNCCC1CC1 34a_200000211371_100000694398 [0,1,0,1,0,0|2,0,0]=4 27469 B14R1.221 CCCCOCCCNCCC1CO1 2230a_200000211371_100000732470 [0,1,0,1,0,0|1,0,0]=3 27470 B14R1.221 CCCCOCCCNCCC1CO1 34a_200000211371_100000732470 [0,1,0,1,0,0|1,0,0]=3 27471 B14R1.221 CCCCOCCCOCCC1CC1 34a_200011215613_100000694398 [0,1,0,1,0,0|2,0,0]=4 27472 B14R1.221 CCCCOCCCOCCC1CC1 7a_200011215613_100000764125 [0,1,0,1,0,0|2,0,0]=4 27473 B14R1.221 CCCCOCCCOCCC1CO1 34a_200011215613_100000732470 [0,1,0,1,0,0|1,0,0]=3 27474 B14R1.221 CCCCOCCCOCCC1CO1 7a_200011215613_100000732470 [0,1,0,1,0,0|1,0,0]=3 27475 B14R1.221 CCCCOCCOCCCC1CO1 34a_100000210238_100000733510 [0,1,0,1,0,0|1,0,0]=3 27476 B14R1.221 CCCCOCCOCCCC1CO1 7a_100000210238_100000733510 [0,1,0,1,0,0|1,0,0]=3 27477 B14R1.221 CCCCOCCSCCCC1CO1 62a_100000733510_100000743108 [0,1,0,1,0,0|1,0,0]=3 27478 B14R1.221 CCCCOCCSCCCC1CO1 62a_100000743108_100000733510 [0,1,0,1,0,0|1,0,0]=3 27479 B14R1.221 CCCCSCCNCCCC1CO1 2230a_100025743550_100000733510 [0,1,0,1,0,0|1,0,0]=3 27480 B14R1.221 CCCCSCCOCCCC1CO1 34a_200000230436_100000733510 [0,1,0,1,0,0|1,0,0]=3 27481 B14R1.221 CCCCSCCOCCCC1CO1 7a_200000230436_100000733510 [0,1,0,1,0,0|1,0,0]=3 27482 B14R1.221 CCCOCCCNCCCC1CO1 2230a_100011217757_100000733510 [0,1,0,1,0,0|1,0,0]=3 27483 B14R1.221 CCCOCCCNCCCC1CO1 34a_100011217757_100000733510 [0,1,0,1,0,0|1,0,0]=3 27484 B14R1.221 CCCOCCOCCNCC1CO1 2230a_200011904461_100011216344 [0,1,0,1,0,0|2,0,0]=4 27485 B14R1.221 CCCOCCOCCNCC1CO1 34a_200011904461_102125554688 [0,1,0,1,0,0|2,0,0]=4 27486 B14R1.221 CCOCCOCCNCCC1CO1 2230a_100102712874_100000732470 [0,1,0,1,0,0|2,0,0]=4 27487 B14R1.221 CCOCCOCCNCCC1CO1 34a_100102712874_100000732470 [0,1,0,1,0,0|2,0,0]=4 27488 B14R1.221 CCOCCOCCOCCC1CO1 34a_100000210240_100000732470 [0,1,0,1,0,0|2,0,0]=4 27489 B14R1.221 CCOCCOCCOCCC1CO1 7a_100000210240_100000732470 [0,1,0,1,0,0|2,0,0]=4 27490 B14R1.221 CCOCCOCCOCC[C@@H]1CO1 34a_100009820653_100011211534 [0,1,0,1,0,0|2,0,0]=4 27491 B14R1.221 CCOCCOCCSCCC1CO1 62a_100000732470_100011211534 [0,1,0,1,0,0|2,0,0]=4 27492 B14R1.221 CCOCCOCCSCCC1CO1 62a_100011211534_100000732470 [0,1,0,1,0,0|2,0,0]=4 27493 B14R1.221 CNCCCCCOCCCC1CO1 34a_100000722520_100000733510 [0,1,0,1,0,0|1,0,0]=3 27494 B14R1.221 CNCCOCCOCCCC1CO1 34a_100000228057_100000733510 [0,1,0,1,0,0|2,0,0]=4 27495 B14R1.221 COCCCCCCNCCC1CC1 34a_100000764129_100011998445 [0,1,0,1,0,0|1,0,0]=3 27496 B14R1.221 COCCCCCCOCCC1CC1 34a_100000754188_100011998445 [0,1,0,1,0,0|1,0,0]=3 27497 B14R1.221 COCCCCCCOCCC1CC1 34a_200012092642_100000694398 [0,1,0,1,0,0|1,0,0]=3 27498 B14R1.221 COCCCCCCOCCC1CC1 7a_100000754188_100011998445 [0,1,0,1,0,0|1,0,0]=3 27499 B14R1.221 COCCCCCCOCCC1CC1 7a_200012092642_100000764125 [0,1,0,1,0,0|1,0,0]=3 27500 B14R1.221 COCCCCCCOCCC1CO1 34a_200012092642_100000732470 [0,1,0,1,0,0|1,0,0]=3 27501 B14R1.221 COCCCCCCOCCC1CO1 7a_200012092642_100000732470 [0,1,0,1,0,0|1,0,0]=3 27502 B14R1.221 COCCCCCCOCC[C@@H]1CO1 34a_100009820653_100011998445 [0,1,0,1,0,0|1,0,0]=3 27503 B14R1.221 COCCCCCCSCCC1CC1 62a_100000764125_100011998445 [0,1,0,1,0,0|1,0,0]=3 27504 B14R1.221 COCCCCCCSCCC1CC1 62a_100011998445_100000764125 [0,1,0,1,0,0|1,0,0]=3 27505 B14R1.221 COCCCCCCSCCC1CO1 62a_100000732470_100011998445 [0,1,0,1,0,0|1,0,0]=3 27506 B14R1.221 COCCCCCCSCCC1CO1 62a_100011998445_100000732470 [0,1,0,1,0,0|1,0,0]=3 27507 B14R1.221 COCCCCCNCCCC1CO1 2230a_100000747528_100000733510 [0,1,0,1,0,0|1,0,0]=3 27508 B14R1.221 COCCCCCNCCCC1CO1 34a_100000747528_100000733510 [0,1,0,1,0,0|1,0,0]=3 27509 B14R1.221 COCCCOCCCOCC1CC1 34a_200011215475_100000742324 [0,1,0,1,0,0|2,0,0]=4 27510 B14R1.221 COCCCOCCCOCC1CC1 7a_200011215475_100000742324 [0,1,0,1,0,0|2,0,0]=4 27511 B14R1.221 COCCCOCCCOCC1CO1 34a_200011215475_102125554688 [0,1,0,1,0,0|2,0,0]=4 27512 B14R1.221 COCCCOCCCOCC1CO1 7a_200011215475_102125554688 [0,1,0,1,0,0|2,0,0]=4 27513 B14R1.221 COCCCOCCCOC[C@@H]1CO1 7a_200011215475_100000745022 [0,1,0,1,0,0|2,0,0]=4 27514 B14R1.221 COCCOCCCCOCC1CO1 34a_100010889290_100011201679 [0,1,0,1,0,0|2,0,0]=4 27515 B14R1.221 COCCOCCCCOCC1CO1 7a_100010889290_100000233755 [0,1,0,1,0,0|2,0,0]=4 27516 B14R1.221 COCCOCCCNCCC1CC1 2230a_100000206027_100000694398 [0,1,0,1,0,0|2,0,0]=4 27517 B14R1.221 COCCOCCCNCCC1CC1 34a_100000206027_100000694398 [0,1,0,1,0,0|2,0,0]=4 27518 B14R1.221 COCCOCCCNCCC1CC1 34a_100000764129_100011216529 [0,1,0,1,0,0|2,0,0]=4 27519 B14R1.221 COCCOCCCNCCC1CO1 2230a_100000206027_100000732470 [0,1,0,1,0,0|2,0,0]=4 27520 B14R1.221 COCCOCCCNCCC1CO1 34a_100000206027_100000732470 [0,1,0,1,0,0|2,0,0]=4 27521 B14R1.221 COCCOCCCOCCC1CC1 34a_100000754188_100011216529 [0,1,0,1,0,0|2,0,0]=4 27522 B14R1.221 COCCOCCCOCCC1CC1 7a_100000754188_100011216529 [0,1,0,1,0,0|2,0,0]=4 27523 B14R1.221 COCCOCCCOCC[C@@H]1CO1 34a_100009820653_100011216529 [0,1,0,1,0,0|2,0,0]=4 27524 B14R1.221 COCCOCCCSCCC1CC1 62a_100000764125_100011216529 [0,1,0,1,0,0|2,0,0]=4 27525 B14R1.221 COCCOCCCSCCC1CC1 62a_100011216529_100000764125 [0,1,0,1,0,0|2,0,0]=4 27526 B14R1.221 COCCOCCCSCCC1CO1 62a_100000732470_100011216529 [0,1,0,1,0,0|2,0,0]=4 27527 B14R1.221 COCCOCCCSCCC1CO1 62a_100011216529_100000732470 [0,1,0,1,0,0|2,0,0]=4 27528 B14R1.221 COCCOCCNCCCC1CO1 2230a_100000745349_100000733510 [0,1,0,1,0,0|2,0,0]=4 27529 B14R1.221 COCCOCCNCCCC1CO1 34a_100000745349_100000733510 [0,1,0,1,0,0|2,0,0]=4 27530 B14R1.221 COCCOCCOCCCC1CO1 34a_100011215163_100000733510 [0,1,0,1,0,0|2,0,0]=4 27531 B14R1.221 COCCOCCOCCCC1CO1 7a_100011215163_100000733510 [0,1,0,1,0,0|2,0,0]=4 27532 B14R1.221 COCCOCCSCCCC1CO1 62a_100000695917_100000733510 [0,1,0,1,0,0|2,0,0]=4 27533 B14R1.221 COCCOCCSCCCC1CO1 62a_100000733510_100000695917 [0,1,0,1,0,0|2,0,0]=4 27534 B14R1.221 CSCCOCCCCOCC1CO1 34a_100010889290_100000212216 [0,1,0,1,0,0|2,0,0]=4 27535 B14R1.221 CSCCOCCCCOCC1CO1 7a_100010889290_100000212216 [0,1,0,1,0,0|2,0,0]=4 27536 B14R1.221 ClCCCCCCCCCOC1CC1 34a_100009868337_100000211595 [0,1,0,1,0,0|1,0,0]=3 27537 B14R1.221 ClCCCCCCCCOCC1CC1 34a_100000033203_100000742324 [0,1,0,1,0,0|1,0,0]=3 27538 B14R1.221 ClCCCCCCCCOCC1CC1 7a_100000033203_100000742324 [0,1,0,1,0,0|1,0,0]=3 27539 B14R1.221 ClCCCCCCCCOCC1CO1 34a_100000033203_102125554688 [0,1,0,1,0,0|1,0,0]=3 27540 B14R1.221 ClCCCCCCCCOCC1CO1 7a_100000033203_102125554688 [0,1,0,1,0,0|1,0,0]=3 27541 B14R1.221 ClCCCCCCCCOCC1CS1 7a_100000033203_100000031435 [0,1,0,1,0,0|1,1,0]=4 27542 B14R1.221 ClCCCCCCCCOC[C@@H]1CO1 7a_100000033203_100000745022 [0,1,0,1,0,0|1,0,0]=3 27543 B14R1.221 ClCCCCCCOCCCC1CO1 34a_100000766143_100000733510 [0,1,0,1,0,0|1,0,0]=3 27544 B14R1.221 ClCCCCCCOCCCC1CO1 7a_100000766143_100000733510 [0,1,0,1,0,0|1,0,0]=3 27545 B14R1.221 FCCCCCCOCCCC1CO1 34a_100000732779_100000733510 [0,1,0,1,0,0|1,0,0]=3 27546 B14R1.221 FCCCCCCOCCCC1CO1 7a_100000732779_100000733510 [0,1,0,1,0,0|1,0,0]=3 27547 B14R1.221 FCCCCCCOCCNC1CC1 34a_100000738766_100015922095 [0,1,0,1,0,0|2,0,0]=4 27548 B14R1.221 FCCCCCCSCCCC1CO1 62a_100000733510_100015922095 [0,1,0,1,0,0|1,0,0]=3 27549 B14R1.221 FCCCCCCSCCCC1CO1 62a_100015922095_100000733510 [0,1,0,1,0,0|1,0,0]=3 27550 B14R1.221 FCCCOCCCCOCC1CO1 34a_100010889290_100011934791 [0,1,0,1,0,0|2,0,0]=4 27551 B14R1.221 FCCCOCCCCOCC1CO1 7a_100010889290_100011934791 [0,1,0,1,0,0|2,0,0]=4 27552 B14R1.221 N#CCCCCCCOCCC1CC1 7a_100000754188_100009813337 [0,1,0,1,0,0|1,0,1]=4 27553 B14R1.221 N#CCCCCCCSCCC1CC1 62a_100000764125_100009813337 [0,1,0,1,0,0|1,0,1]=4 27554 B14R1.221 N#CCCCCCCSCCC1CC1 62a_100009813337_100000764125 [0,1,0,1,0,0|1,0,1]=4 27555 B14R1.221 N#CCCCCCCSCCC1CO1 62a_100000732470_100009813337 [0,1,0,1,0,0|1,0,1]=4 27556 B14R1.221 N#CCCCCCCSCCC1CO1 62a_100009813337_100000732470 [0,1,0,1,0,0|1,0,1]=4 27557 B14R1.221 N#CCCCCCSCCCC1CO1 62a_100000733510_100009813376 [0,1,0,1,0,0|1,0,1]=4 27558 B14R1.221 N#CCCCCCSCCCC1CO1 62a_100009813376_100000733510 [0,1,0,1,0,0|1,0,1]=4 27559 B14R1.221 NCCCCCCCCCOC1CC1 34a_100000078944_100000211595 [0,1,0,1,0,0|1,0,0]=3 27560 B14R1.221 NCCCCCCCCOCC1CC1 34a_102515433106_100000742324 [0,1,0,1,0,0|1,0,0]=3 27561 B14R1.221 NCCCCCCCCOCC1CO1 34a_102515433106_102125554688 [0,1,0,1,0,0|1,0,0]=3 27562 B14R1.221 NCCCCCCCOCCC1CC1 34a_100011996573_100000694398 [0,1,0,1,0,0|1,0,0]=3 27563 B14R1.221 NCCCCCCCOCCC1CO1 34a_100011996573_100000732470 [0,1,0,1,0,0|1,0,0]=3 27564 B14R1.221 NCCCCCCOCCCC1CO1 34a_100000686447_100000733510 [0,1,0,1,0,0|1,0,0]=3 27565 B14R1.221 NCCCOCCCOCCC1CC1 34a_100011310245_100000694398 [0,1,0,1,0,0|2,0,0]=4 27566 B14R1.221 NCCCOCCCOCCC1CO1 34a_100011310245_100000732470 [0,1,0,1,0,0|2,0,0]=4 27567 B14R1.221 NCCNCCCCCOCC1CC1 34a_103619048469_100000742324 [0,1,0,1,0,0|2,0,0]=4 27568 B14R1.221 NCCNCCCCCOCC1CO1 34a_103619048469_102125554688 [0,1,0,1,0,0|2,0,0]=4 27569 B14R1.221 O=CCCCCCSCCCC1CO1 62a_100000139337_100000733510 [0,1,0,1,0,0|1,0,1]=4 27570 B14R1.221 O=CCCCCCSCCCC1CO1 62a_100000733510_100000139337 [0,1,0,1,0,0|1,0,1]=4 27571 B14R1.221 OCCCCCCCCCNC1CC1 34a_100000078944_100000211595 [0,1,0,1,0,0|0,0,0]=2 27572 B14R1.221 OCCCCCCCCCNC1CC1 34a_100000212008_100009813782 [0,1,0,1,0,0|0,0,0]=2 27573 B14R1.221 OCCCCCCCCCSC1CC1 62a_100009813782_100000211595 [0,1,0,1,0,0|0,0,0]=2 27574 B14R1.221 OCCCCCCCCNCC1CC1 2230a_100000735609_100000033203 [0,1,0,1,0,0|0,0,0]=2 27575 B14R1.221 OCCCCCCCCNCC1CC1 2230a_102515433106_100000742324 [0,1,0,1,0,0|0,0,0]=2 27576 B14R1.221 OCCCCCCCCNCC1CC1 269862a_102515433106_100000741477 [0,1,0,1,0,0|0,0,0]=2 27577 B14R1.221 OCCCCCCCCNCC1CC1 34a_100000735609_100000033203 [0,1,0,1,0,0|0,0,0]=2 27578 B14R1.221 OCCCCCCCCNCC1CC1 34a_102515433106_100000742324 [0,1,0,1,0,0|0,0,0]=2 27579 B14R1.221 OCCCCCCCCNCC1CO1 2230a_102515433106_100011216344 [0,1,0,1,0,0|1,0,0]=3 27580 B14R1.221 OCCCCCCCCNCC1CO1 34a_102515433106_102125554688 [0,1,0,1,0,0|1,0,0]=3 27581 B14R1.221 OCCCCCCCCOCC1CC1 34a_100000211283_100000033203 [0,1,0,1,0,0|0,0,0]=2 27582 B14R1.221 OCCCCCCCCOC[C@@H]1CO1 34a_100000757423_100000033203 [0,1,0,1,0,0|1,0,0]=3 27583 B14R1.221 OCCCCCCCCSCC1CC1 62a_100000033203_100000742324 [0,1,0,1,0,0|0,0,0]=2 27584 B14R1.221 OCCCCCCCCSCC1CC1 62a_100000756562_100000033203 [0,1,0,1,0,0|0,0,0]=2 27585 B14R1.221 OCCCCCCCCSCC1CO1 62a_100000033203_102125554688 [0,1,0,1,0,0|1,0,0]=3 27586 B14R1.221 OCCCCCCCCSCC1CO1 62a_102125554688_100000033203 [0,1,0,1,0,0|1,0,0]=3 27587 B14R1.221 OCCCCCCCCSCC1CS1 62a_100000031435_100000033203 [0,1,0,1,0,0|1,0,0]=3 27588 B14R1.221 OCCCCCCCCSCC1CS1 62a_100000033203_100000031435 [0,1,0,1,0,0|1,0,0]=3 27589 B14R1.221 OCCCCCCCCSC[C@@H]1CO1 62a_100000033203_100000745022 [0,1,0,1,0,0|1,0,0]=3 27590 B14R1.221 OCCCCCCCCSC[C@@H]1CO1 62a_100000745022_100000033203 [0,1,0,1,0,0|1,0,0]=3 27591 B14R1.221 OCCCCCCCNCCC1CC1 2230a_100011996573_100000694398 [0,1,0,1,0,0|0,0,0]=2 27592 B14R1.221 OCCCCCCCNCCC1CC1 34a_100000764129_100000760002 [0,1,0,1,0,0|0,0,0]=2 27593 B14R1.221 OCCCCCCCNCCC1CC1 34a_100011996573_100000694398 [0,1,0,1,0,0|0,0,0]=2 27594 B14R1.221 OCCCCCCCNCCC1CO1 2230a_100011996573_100000732470 [0,1,0,1,0,0|1,0,0]=3 27595 B14R1.221 OCCCCCCCNCCC1CO1 34a_100011996573_100000732470 [0,1,0,1,0,0|1,0,0]=3 27596 B14R1.221 OCCCCCCCOCCC1CC1 34a_100000754188_100000760002 [0,1,0,1,0,0|0,0,0]=2 27597 B14R1.221 OCCCCCCCOCCC1CC1 7a_100000754188_100000760002 [0,1,0,1,0,0|0,0,0]=2 27598 B14R1.221 OCCCCCCCOCC[C@@H]1CO1 34a_100009820653_100000760002 [0,1,0,1,0,0|1,0,0]=3 27599 B14R1.221 OCCCCCCCSCCC1CC1 62a_100000760002_100000764125 [0,1,0,1,0,0|0,0,0]=2 27600 B14R1.221 OCCCCCCCSCCC1CC1 62a_100000764125_100000760002 [0,1,0,1,0,0|0,0,0]=2 27601 B14R1.221 OCCCCCCCSCCC1CO1 62a_100000732470_100000760002 [0,1,0,1,0,0|1,0,0]=3 27602 B14R1.221 OCCCCCCCSCCC1CO1 62a_100000760002_100000732470 [0,1,0,1,0,0|1,0,0]=3 27603 B14R1.221 OCCCCCCNCC#CC1CC1 2230a_100000686447_100009895102 [0,1,0,1,0,0|0,0,2]=4 27604 B14R1.221 OCCCCCCNCC#CC1CC1 34a_100000686447_100009895102 [0,1,0,1,0,0|0,0,2]=4 27605 B14R1.221 OCCCCCCNCCCC1CO1 2230a_100000686447_100000733510 [0,1,0,1,0,0|1,0,0]=3 27606 B14R1.221 OCCCCCCNCCCC1CO1 34a_100000686447_100000733510 [0,1,0,1,0,0|1,0,0]=3 27607 B14R1.221 OCCCCCCOCC#CC1CC1 34a_100000083941_100000766143 [0,1,0,1,0,0|0,0,2]=4 27608 B14R1.221 OCCCCCCOCC#CC1CC1 7a_100000083941_100000766143 [0,1,0,1,0,0|0,0,2]=4 27609 B14R1.221 OCCCCCCOCCNC1CC1 34a_100000738766_100000766143 [0,1,0,1,0,0|1,0,0]=3 27610 B14R1.221 OCCCCCCSCC#CC1CC1 62a_100000766143_100009895102 [0,1,0,1,0,0|0,0,2]=4 27611 B14R1.221 OCCCCCCSCC#CC1CC1 62a_100009895102_100000766143 [0,1,0,1,0,0|0,0,2]=4 27612 B14R1.221 OCCCCCCSCCCC1CO1 62a_100000733510_100000766143 [0,1,0,1,0,0|1,0,0]=3 27613 B14R1.221 OCCCCCCSCCCC1CO1 62a_100000766143_100000733510 [0,1,0,1,0,0|1,0,0]=3 27614 B14R1.221 OCCCOCCCCOCC1CO1 34a_100010889290_100000230001 [0,1,0,1,0,0|2,0,0]=4 27615 B14R1.221 OCCCOCCCCOCC1CO1 7a_100010889290_100011215043 [0,1,0,1,0,0|2,0,0]=4 27616 B14R1.221 OCCCOCCCNCCC1CC1 2230a_100011310245_100000694398 [0,1,0,1,0,0|1,0,0]=3 27617 B14R1.221 OCCCOCCCNCCC1CC1 34a_100011310245_100000694398 [0,1,0,1,0,0|1,0,0]=3 27618 B14R1.221 OCCCOCCCNCCC1CO1 2230a_100011310245_100000732470 [0,1,0,1,0,0|2,0,0]=4 27619 B14R1.221 OCCCOCCCNCCC1CO1 34a_100011310245_100000732470 [0,1,0,1,0,0|2,0,0]=4 27620 B14R1.221 OCCOCCOCCCNC1CC1 34a_100011996194_100000211595 [0,1,0,1,0,0|2,0,0]=4 27621 B14R1.221 OCCOCCOCCNCC1CC1 2230a_100000735609_100000032323 [0,1,0,1,0,0|2,0,0]=4 27622 B14R1.221 OCCOCCOCCNCC1CC1 2230a_100011998139_100000742324 [0,1,0,1,0,0|2,0,0]=4 27623 B14R1.221 OCCOCCOCCNCC1CC1 269862a_100011998139_100000741477 [0,1,0,1,0,0|2,0,0]=4 27624 B14R1.221 OCCOCCOCCNCC1CC1 34a_100000735609_100000032323 [0,1,0,1,0,0|2,0,0]=4 27625 B14R1.221 OCCOCCOCCNCC1CC1 34a_100011998139_100000742324 [0,1,0,1,0,0|2,0,0]=4 27626 B14R1.221 OCCOCCOCCOCC1CC1 34a_100000211283_100000032323 [0,1,0,1,0,0|2,0,0]=4 27627 B14R1.221 OCCOCCOCCSCC1CC1 62a_100000032323_100000742324 [0,1,0,1,0,0|2,0,0]=4 27628 B14R1.221 OCCOCCOCCSCC1CC1 62a_100000756562_100000032323 [0,1,0,1,0,0|2,0,0]=4 27629 B14R1.231 CC1(CCCCC1NCCCCO)C 269862a_100000750430_100000031690 [0,1,0,1,0,0|1,0,0]=3 27630 B14R1.231 CC1(CNCCC1NCCCCO)C 269862a_100000750430_100015191249 [0,1,0,1,0,0|2,0,0]=4 27631 B14R1.231 CC1(CNCCC1OCCCCO)C 34a_100000709803_100011216708 [0,1,0,1,0,0|2,0,0]=4 27632 B14R1.231 CC1(COCCN1CCCCCO)C 2230a_100000724681_100000746330 [0,1,0,1,0,0|2,0,0]=4 27633 B14R1.231 CC1(COCCN1CCCCCO)C 269982a_100000724681_100000746330 [0,1,0,1,0,0|2,0,0]=4 27634 B14R1.231 CC1(COCCN1CCCCCO)C 34a_100000724681_100000746330 [0,1,0,1,0,0|2,0,0]=4 27635 B14R1.231 CCCCCNC1CCCCC1(C)C 269862a_100000209983_100000031690 [0,1,0,1,0,0|2,0,0]=4 27636 B14R1.231 CCCCCNC1CCCCC1(F)F 2230a_100000686509_100000210326 [0,1,0,1,0,0|2,0,0]=4 27637 B14R1.231 CCCCCNC1CCCCC1(F)F 34a_100000686509_100000718602 [0,1,0,1,0,0|2,0,0]=4 27638 B14R1.231 CCCCCOC1CCCCC1(F)F 34a_100000210253_200009832135 [0,1,0,1,0,0|2,0,0]=4 27639 B14R1.231 CCCCCSC1CCCCC1(F)F 62a_100000210326_200009832135 [0,1,0,1,0,0|2,0,0]=4 27640 B14R1.231 CCCCCSC1CCCCC1(F)F 62a_200009832135_100000210326 [0,1,0,1,0,0|2,0,0]=4 27641 B14R1.231 OCCCCNC1CCCCC1(F)F 2230a_100000686509_100000210776 [0,1,0,1,0,0|2,0,0]=4 27642 B14R1.231 OCCCCNC1CCCCC1(F)F 34a_100000686509_100011216708 [0,1,0,1,0,0|2,0,0]=4 27643 B14R1.231 OCCCCNC1CCCCC1(F)F 34a_100000750430_200009832135 [0,1,0,1,0,0|2,0,0]=4 27644 B14R1.231 OCCCCSC1CCCCC1(F)F 62a_100000210776_200009832135 [0,1,0,1,0,0|2,0,0]=4 27645 B14R1.231 OCCCCSC1CCCCC1(F)F 62a_200009832135_100000210776 [0,1,0,1,0,0|2,0,0]=4 27646 B14R1.233 CC(C)C1CCCN1CCCCCF 2230a_100000762757_100000729378 [0,1,0,1,0,0|2,0,0]=4 27647 B14R1.233 CC(C)C1CCCN1CCCCCF 269982a_100000762757_100000729378 [0,1,0,1,0,0|2,0,0]=4 27648 B14R1.233 CC(C)C1CCCN1CCCCCF 34a_100000762757_100000729378 [0,1,0,1,0,0|2,0,0]=4 27649 B14R1.233 CC(C)C1CCCN1CCCCCO 2230a_100000762757_100000746330 [0,1,0,1,0,0|1,0,0]=3 27650 B14R1.233 CC(C)C1CCCN1CCCCCO 269982a_100000762757_100000746330 [0,1,0,1,0,0|1,0,0]=3 27651 B14R1.233 CC(C)C1CCCN1CCCCCO 34a_100000762757_100000746330 [0,1,0,1,0,0|1,0,0]=3 27652 B14R1.233 CC(C)C1CCCN1CCOCCO 2230a_100000762757_100011215305 [0,1,0,1,0,0|2,0,0]=4 27653 B14R1.233 CC(C)C1CCCN1CCOCCO 269982a_100000762757_100011215305 [0,1,0,1,0,0|2,0,0]=4 27654 B14R1.233 CC(C)C1CCCN1CCOCCO 34a_100000762757_100000692535 [0,1,0,1,0,0|2,0,0]=4 27655 B14R1.233 CCCCCCC1CCCC1N(C)C 270004a_100102631434_100000189428 [0,1,0,1,0,0|2,0,0]=4 27656 B14R1.233 CCCCCCN1CCCC1C(C)C 2230a_100000762757_100000210314 [0,1,0,1,0,0|2,0,0]=4 27657 B14R1.233 CCCCCCN1CCCC1C(C)C 269982a_100000762757_100000210757 [0,1,0,1,0,0|2,0,0]=4 27658 B14R1.233 CCCCCCN1CCCC1C(C)C 34a_100000762757_100000210314 [0,1,0,1,0,0|2,0,0]=4 27659 B14R1.233 CCCCCCN1CCC[C@H]1C(=O)O 269956a_100000743916_100000210757 [0,1,0,1,0,0|1,0,1]=4 27660 B14R1.241 CC(C)CCCCCOCC1CC1C 34a_100000744939_100000210682 [0,1,0,1,0,0|2,0,0]=4 27661 B14R1.241 CC(C)CCCCCOCC1CC1C 7a_100000744939_100000210682 [0,1,0,1,0,0|2,0,0]=4 27662 B14R1.241 CC1CC1COCCCCCB(O)O 34a_100000744939_200009817188 [0,1,0,1,0,0|2,0,0]=4 27663 B14R1.241 CC1CC1COCCCCCB(O)O 7a_100000744939_200009817188 [0,1,0,1,0,0|2,0,0]=4 27664 B14R1.269 CC(C)CC1CCCCCN1CCF 2230a_100000759364_100011217306 [0,1,0,1,0,0|2,0,0]=4 27665 B14R1.269 CC(C)CC1CCCCCN1CCF 269982a_100000759364_100011217306 [0,1,0,1,0,0|2,0,0]=4 27666 B14R1.269 CC(C)CC1CCCCCN1CCF 34a_100000759364_100011217306 [0,1,0,1,0,0|2,0,0]=4 27667 B14R1.269 CC(C)CC1CCCCCN1CCO 2230a_100000759364_100000211926 [0,1,0,1,0,0|1,0,0]=3 27668 B14R1.269 CC(C)CC1CCCCCN1CCO 269982a_100000759364_100000211926 [0,1,0,1,0,0|1,0,0]=3 27669 B14R1.269 CC(C)CC1CCCCCN1CCO 34a_100000759364_100000211926 [0,1,0,1,0,0|1,0,0]=3 27670 B14R1.269 CCCN1CCCCCC1CC(C)C 2230a_100000759364_100000210303 [0,1,0,1,0,0|2,0,0]=4 27671 B14R1.269 CCCN1CCCCCC1CC(C)C 269982a_100000759364_100000210303 [0,1,0,1,0,0|2,0,0]=4 27672 B14R1.269 CCCN1CCCCCC1CC(C)C 34a_100000759364_100000210303 [0,1,0,1,0,0|2,0,0]=4 27673 B14R1.325 CC1CCN1CCCCCCB(O)O 269982a_100000755817_100009817187 [0,1,0,1,0,0|2,0,0]=4 27674 B14R1.325 CC1CCN1CCCCCCB(O)O 34a_100000755817_100009817187 [0,1,0,1,0,0|2,0,0]=4 27675 B14R1.422 C=C(C)CCNCCC1CCCCO1 2230a_100015183643_100000730704 [0,1,0,1,0,0|1,0,1]=4 27676 B14R1.422 C=C(C)CCNCCC1CCCCO1 34a_100015183643_100000730704 [0,1,0,1,0,0|1,0,1]=4 27677 B14R1.422 CC(=O)CCCCOC1CCCCO1 1458a_100000070787_100000031530 [0,1,0,1,0,0|1,0,1]=4 27678 B14R1.422 CC(=O)CCCCOC1CCCCO1 34a_100000033831_100009817362 [0,1,0,1,0,0|1,0,1]=4 27679 B14R1.422 CC(=O)CCCNCC1CCCCO1 34a_100000174945_100000685027 [0,1,0,1,0,0|1,0,1]=4 27680 B14R1.422 CC(=O)CCCOCC1CCCCO1 34a_100000211370_100000685027 [0,1,0,1,0,0|1,0,1]=4 27681 B14R1.422 CC(=O)CCCOCC1CCCCO1 34a_100000759063_100000211543 [0,1,0,1,0,0|1,0,1]=4 27682 B14R1.422 CC(=O)CCCOCC1CCCCO1 7a_100000211370_100011215641 [0,1,0,1,0,0|1,0,1]=4 27683 B14R1.422 CC(=O)CCCOCC1CCCCO1 7a_100000759063_100000211543 [0,1,0,1,0,0|1,0,1]=4 27684 B14R1.422 CC(=O)CCCSCC1CCCCO1 62a_100000211543_100011215641 [0,1,0,1,0,0|1,0,1]=4 27685 B14R1.422 CC(=O)CCCSCC1CCCCO1 62a_100011215641_100000211543 [0,1,0,1,0,0|1,0,1]=4 27686 B14R1.422 CC(Br)CCOCCC1CCCCC1 34a_100009893172_100011209188 [0,1,0,1,0,0|2,0,0]=4 27687 B14R1.422 CC(Br)CCOCCC1OCCCO1 34a_100009893172_100000764188 [0,1,0,1,0,0|2,0,0]=4 27688 B14R1.422 CC(Br)COCCCC1CCCCC1 34a_100012180447_100011713725 [0,1,0,1,0,0|2,0,0]=4 27689 B14R1.422 CC(Br)COCCOC1CCCCO1 34a_100012180447_100000744793 [0,1,0,1,0,0|2,0,0]=4 27690 B14R1.422 CC(C)CCCCNC1CCCCC1 2230a_100000182618_100011216152 [0,1,0,1,0,0|2,0,0]=4 27691 B14R1.422 CC(C)CCCCNC1CCCCC1 34a_100000182618_100011216152 [0,1,0,1,0,0|2,0,0]=4 27692 B14R1.422 CC(C)CCCCOC1CCCCC1 34a_100000210231_100011216152 [0,1,0,1,0,0|2,0,0]=4 27693 B14R1.422 CC(C)CCCCOC1CCCCC1 34a_100011214890_100000210327 [0,1,0,1,0,0|2,0,0]=4 27694 B14R1.422 CC(C)CCCCOC1CCCCC1 7a_100000210231_100011216152 [0,1,0,1,0,0|2,0,0]=4 27695 B14R1.422 CC(C)CCCCOC1CCCCC1 7a_100011214890_100000210327 [0,1,0,1,0,0|2,0,0]=4 27696 B14R1.422 CC(C)CCCCOC1CCCCO1 34a_100000033831_100011216152 [0,1,0,1,0,0|1,0,0]=3 27697 B14R1.422 CC(C)CCCCSC1CCCCC1 62a_100000210327_100011216152 [0,1,0,1,0,0|2,0,0]=4 27698 B14R1.422 CC(C)CCCCSC1CCCCC1 62a_100011216152_100000210327 [0,1,0,1,0,0|2,0,0]=4 27699 B14R1.422 CC(C)CCCNCC1CCCCC1 2230a_100000210473_100011214892 [0,1,0,1,0,0|2,0,0]=4 27700 B14R1.422 CC(C)CCCNCC1CCCCC1 2230a_200000737386_100000211423 [0,1,0,1,0,0|2,0,0]=4 27701 B14R1.422 CC(C)CCCNCC1CCCCC1 269862a_200000737386_100000211278 [0,1,0,1,0,0|2,0,0]=4 27702 B14R1.422 CC(C)CCCNCC1CCCCC1 34a_100000210473_100011214892 [0,1,0,1,0,0|2,0,0]=4 27703 B14R1.422 CC(C)CCCNCC1CCCCC1 34a_200000737386_100000211423 [0,1,0,1,0,0|2,0,0]=4 27704 B14R1.422 CC(C)CCCNCC1CCCCO1 2230a_100000174945_100011214892 [0,1,0,1,0,0|1,0,0]=3 27705 B14R1.422 CC(C)CCCNCC1CCCCO1 2230a_200000737386_100000211543 [0,1,0,1,0,0|1,0,0]=3 27706 B14R1.422 CC(C)CCCNCC1CCCCO1 34a_100000174945_100011214892 [0,1,0,1,0,0|1,0,0]=3 27707 B14R1.422 CC(C)CCCNCC1CCCCO1 34a_200000737386_100000211543 [0,1,0,1,0,0|1,0,0]=3 27708 B14R1.422 CC(C)CCCNC[C@H]1COCCO1 2230a_100010981119_100011214892 [0,1,0,1,0,0|2,0,0]=4 27709 B14R1.422 CC(C)CCCNC[C@H]1COCCO1 34a_100010981119_100011214892 [0,1,0,1,0,0|2,0,0]=4 27710 B14R1.422 CC(C)CCCOCC1CCCCC1 34a_100000210774_100000211423 [0,1,0,1,0,0|2,0,0]=4 27711 B14R1.422 CC(C)CCCOCC1CCCCC1 34a_100000212181_100011214892 [0,1,0,1,0,0|2,0,0]=4 27712 B14R1.422 CC(C)CCCOCC1CCCCC1 7a_100000210774_100000211423 [0,1,0,1,0,0|2,0,0]=4 27713 B14R1.422 CC(C)CCCOCC1CCCCC1 7a_100000212181_100011214892 [0,1,0,1,0,0|2,0,0]=4 27714 B14R1.422 CC(C)CCCOCC1CCCCN1 34a_100000210821_100011214892 [0,1,0,1,0,0|2,0,0]=4 27715 B14R1.422 CC(C)CCCOCC1CCCCO1 34a_100000210774_100000211543 [0,1,0,1,0,0|1,0,0]=3 27716 B14R1.422 CC(C)CCCOCC1CCCCO1 34a_100000211370_100011214892 [0,1,0,1,0,0|1,0,0]=3 27717 B14R1.422 CC(C)CCCOCC1CCCCO1 7a_100000210774_100000211543 [0,1,0,1,0,0|1,0,0]=3 27718 B14R1.422 CC(C)CCCOCC1CCCCO1 7a_100000211370_100011214892 [0,1,0,1,0,0|1,0,0]=3 27719 B14R1.422 CC(C)CCCOC[C@@H]1CNCCO1 34a_100015189573_100011214892 [0,1,0,1,0,0|2,0,0]=4 27720 B14R1.422 CC(C)CCCOC[C@H]1COCCO1 34a_100009875890_100011214892 [0,1,0,1,0,0|2,0,0]=4 27721 B14R1.422 CC(C)CCCSCC1CCCCC1 62a_100000211423_100011214892 [0,1,0,1,0,0|2,0,0]=4 27722 B14R1.422 CC(C)CCCSCC1CCCCC1 62a_100011214892_100000211423 [0,1,0,1,0,0|2,0,0]=4 27723 B14R1.422 CC(C)CCCSCC1CCCCO1 62a_100000211543_100011214892 [0,1,0,1,0,0|1,0,0]=3 27724 B14R1.422 CC(C)CCCSCC1CCCCO1 62a_100011214892_100000211543 [0,1,0,1,0,0|1,0,0]=3 27725 B14R1.422 CC(C)CCNCCC1CCCCC1 2230a_100000738074_100000210312 [0,1,0,1,0,0|2,0,0]=4 27726 B14R1.422 CC(C)CCNCCC1CCCCC1 269862a_100000738074_100000185833 [0,1,0,1,0,0|2,0,0]=4 27727 B14R1.422 CC(C)CCNCCC1CCCCC1 270004a_100000210545_100011713444 [0,1,0,1,0,0|2,0,0]=4 27728 B14R1.422 CC(C)CCNCCC1CCCCC1 34a_100000738074_100000210312 [0,1,0,1,0,0|2,0,0]=4 27729 B14R1.422 CC(C)CCNCCC1CCCCO1 2230a_100015183643_100000210312 [0,1,0,1,0,0|1,0,0]=3 27730 B14R1.422 CC(C)CCNCCC1CCCCO1 269862a_100015183643_100000185833 [0,1,0,1,0,0|1,0,0]=3 27731 B14R1.422 CC(C)CCNCCC1CCCCO1 34a_100015183643_100000210312 [0,1,0,1,0,0|1,0,0]=3 27732 B14R1.422 CC(C)CCOCCC1CCCCC1 34a_100000210254_100011209188 [0,1,0,1,0,0|2,0,0]=4 27733 B14R1.422 CC(C)CCOCCC1CCCCC1 34a_100011217863_100000210312 [0,1,0,1,0,0|2,0,0]=4 27734 B14R1.422 CC(C)CCOCCC1CCCCC1 7a_100000210254_100011273959 [0,1,0,1,0,0|2,0,0]=4 27735 B14R1.422 CC(C)CCOCCC1CCCCC1 7a_100011217863_100000210626 [0,1,0,1,0,0|2,0,0]=4 27736 B14R1.422 CC(C)CCOCCC1CCCCN1 34a_100000211664_100000210312 [0,1,0,1,0,0|2,0,0]=4 27737 B14R1.422 CC(C)CCOCCC1OCCCO1 34a_100000210254_100000764188 [0,1,0,1,0,0|2,0,0]=4 27738 B14R1.422 CC(C)CCOCCC1OCCCO1 7a_100000210254_100000764188 [0,1,0,1,0,0|2,0,0]=4 27739 B14R1.422 CC(C)CCSCCC1CCCCC1 62a_100000210312_100012355289 [0,1,0,1,0,0|2,0,0]=4 27740 B14R1.422 CC(C)CCSCCC1CCCCC1 62a_100012355289_100000210312 [0,1,0,1,0,0|2,0,0]=4 27741 B14R1.422 CC(C)CCSCCC1OCCCO1 62a_100000210312_100000764188 [0,1,0,1,0,0|2,0,0]=4 27742 B14R1.422 CC(C)CCSCCC1OCCCO1 62a_100000764188_100000210312 [0,1,0,1,0,0|2,0,0]=4 27743 B14R1.422 CC(C)CNCCCC1CCCCC1 2230a_100000210953_100011713725 [0,1,0,1,0,0|2,0,0]=4 27744 B14R1.422 CC(C)CNCCCC1CCCCC1 2230a_100011211642_100000210760 [0,1,0,1,0,0|2,0,0]=4 27745 B14R1.422 CC(C)CNCCCC1CCCCC1 270004a_100011211642_100000210432 [0,1,0,1,0,0|2,0,0]=4 27746 B14R1.422 CC(C)CNCCCC1CCCCC1 34a_100000210953_100011713725 [0,1,0,1,0,0|2,0,0]=4 27747 B14R1.422 CC(C)CNCCCC1CCCCC1 34a_100011211642_100000210624 [0,1,0,1,0,0|2,0,0]=4 27748 B14R1.422 CC(C)CNCCOC1CCCCO1 2230a_100000210953_100000744793 [0,1,0,1,0,0|2,0,0]=4 27749 B14R1.422 CC(C)CNCCOC1CCCCO1 34a_100000210953_100000744793 [0,1,0,1,0,0|2,0,0]=4 27750 B14R1.422 CC(C)COCCCC1CCCCC1 34a_100000198086_100000210624 [0,1,0,1,0,0|2,0,0]=4 27751 B14R1.422 CC(C)COCCCC1CCCCC1 34a_100000210257_100011713725 [0,1,0,1,0,0|2,0,0]=4 27752 B14R1.422 CC(C)COCCCC1CCCCC1 7a_100000198086_100000210760 [0,1,0,1,0,0|2,0,0]=4 27753 B14R1.422 CC(C)COCCCC1CCCCN1 34a_100011934581_100000210624 [0,1,0,1,0,0|2,0,0]=4 27754 B14R1.422 CC(C)COCCOC1CCCCO1 34a_100000034223_100000210624 [0,1,0,1,0,0|2,0,0]=4 27755 B14R1.422 CC(C)COCCOC1CCCCO1 34a_100000210257_100000744793 [0,1,0,1,0,0|2,0,0]=4 27756 B14R1.422 CC(C)COCCOC1CCCCO1 7a_100000034223_100000210760 [0,1,0,1,0,0|2,0,0]=4 27757 B14R1.422 CC(C)CSCCCC1CCCCC1 62a_100000210624_100011713725 [0,1,0,1,0,0|2,0,0]=4 27758 B14R1.422 CC(C)CSCCCC1CCCCC1 62a_100011713725_100000210760 [0,1,0,1,0,0|2,0,0]=4 27759 B14R1.422 CC(C)CSCCOC1CCCCO1 62a_100000210624_100000744793 [0,1,0,1,0,0|2,0,0]=4 27760 B14R1.422 CC(C)CSCCOC1CCCCO1 62a_100000744793_100000210760 [0,1,0,1,0,0|2,0,0]=4 27761 B14R1.422 CC(C)NCCCOC1CCCCO1 2230a_100138425928_100000700653 [0,1,0,1,0,0|2,0,0]=4 27762 B14R1.422 CC(C)NCCCOC1CCCCO1 34a_100138425928_100000700653 [0,1,0,1,0,0|2,0,0]=4 27763 B14R1.422 CC(C)NCCOCC1CCCCO1 34a_100000224655_100000211543 [0,1,0,1,0,0|2,0,0]=4 27764 B14R1.422 CC(C)OCCCCC1CCCCC1 34a_100011215267_100000210206 [0,1,0,1,0,0|2,0,0]=4 27765 B14R1.422 CC(C)OCCCCC1CCCCC1 7a_100011215267_100000210206 [0,1,0,1,0,0|2,0,0]=4 27766 B14R1.422 CC(C)OCCCOC1CCCCO1 34a_100000212225_100000700653 [0,1,0,1,0,0|2,0,0]=4 27767 B14R1.422 CC(C)OCCNCC1CCCCO1 2230a_100000174945_100000211751 [0,1,0,1,0,0|2,0,0]=4 27768 B14R1.422 CC(C)OCCNCC1CCCCO1 2230a_100000701111_100000211543 [0,1,0,1,0,0|2,0,0]=4 27769 B14R1.422 CC(C)OCCNCC1CCCCO1 34a_100000174945_100000211751 [0,1,0,1,0,0|2,0,0]=4 27770 B14R1.422 CC(C)OCCNCC1CCCCO1 34a_100000701111_100000211543 [0,1,0,1,0,0|2,0,0]=4 27771 B14R1.422 CC(C)OCCOCC1CCCCO1 34a_100000211219_100000211543 [0,1,0,1,0,0|2,0,0]=4 27772 B14R1.422 CC(C)OCCOCC1CCCCO1 34a_100000211370_100000211751 [0,1,0,1,0,0|2,0,0]=4 27773 B14R1.422 CC(C)OCCOCC1CCCCO1 7a_100000211219_100000211543 [0,1,0,1,0,0|2,0,0]=4 27774 B14R1.422 CC(C)OCCOCC1CCCCO1 7a_100000211370_100000211751 [0,1,0,1,0,0|2,0,0]=4 27775 B14R1.422 CC(C)OCCSCC1CCCCO1 62a_100000211543_100000211751 [0,1,0,1,0,0|2,0,0]=4 27776 B14R1.422 CC(C)OCCSCC1CCCCO1 62a_100000211751_100000211543 [0,1,0,1,0,0|2,0,0]=4 27777 B14R1.422 CC(C)OCNCCC1CCCCO1 2230a_100015183643_100000709892 [0,1,0,1,0,0|2,0,0]=4 27778 B14R1.422 CC(C)OCNCCC1CCCCO1 34a_100015183643_100000709892 [0,1,0,1,0,0|2,0,0]=4 27779 B14R1.422 CC(C)SCCCOC1CCCCO1 62a_100000210206_100000700653 [0,1,0,1,0,0|2,0,0]=4 27780 B14R1.422 CC(C)SCCCOC1CCCCO1 62a_100000700653_100000210206 [0,1,0,1,0,0|2,0,0]=4 27781 B14R1.422 CC(C)SCCNCC1CCCCO1 2230a_100000174945_100000730970 [0,1,0,1,0,0|2,0,0]=4 27782 B14R1.422 CC(C)SCCNCC1CCCCO1 2230a_100000731138_100000211543 [0,1,0,1,0,0|2,0,0]=4 27783 B14R1.422 CC(C)SCCNCC1CCCCO1 34a_100000174945_100000730970 [0,1,0,1,0,0|2,0,0]=4 27784 B14R1.422 CC(C)SCCNCC1CCCCO1 34a_100000731138_100000211543 [0,1,0,1,0,0|2,0,0]=4 27785 B14R1.422 CC(C)SCCOCC1CCCCO1 34a_100000211370_100000730970 [0,1,0,1,0,0|2,0,0]=4 27786 B14R1.422 CC(C)SCCOCC1CCCCO1 34a_200011212901_100000211543 [0,1,0,1,0,0|2,0,0]=4 27787 B14R1.422 CC(C)SCCOCC1CCCCO1 7a_100000211370_100000730970 [0,1,0,1,0,0|2,0,0]=4 27788 B14R1.422 CC(C)SCCOCC1CCCCO1 7a_200011212901_100000211543 [0,1,0,1,0,0|2,0,0]=4 27789 B14R1.422 CC(C)SCCSCC1CCCCO1 62a_100000211543_100000730970 [0,1,0,1,0,0|2,0,0]=4 27790 B14R1.422 CC(C)SCCSCC1CCCCO1 62a_100000730970_100000211543 [0,1,0,1,0,0|2,0,0]=4 27791 B14R1.422 CC(F)COCCCC1CCCCC1 34a_100015925927_100011713725 [0,1,0,1,0,0|2,0,0]=4 27792 B14R1.422 CC(F)COCCOC1CCCCO1 34a_100015925927_100000744793 [0,1,0,1,0,0|2,0,0]=4 27793 B14R1.422 CC(O)CCCNCC1CCCCC1 2230a_100000210473_200000718107 [0,1,0,1,0,0|1,0,0]=3 27794 B14R1.422 CC(O)CCCNCC1CCCCC1 34a_100000210473_200000718107 [0,1,0,1,0,0|1,0,0]=3 27795 B14R1.422 CC(O)CCCNCC1CCCCO1 2230a_100000174945_200000718107 [0,1,0,1,0,0|1,0,0]=3 27796 B14R1.422 CC(O)CCCNCC1CCCCO1 34a_100000174945_200000718107 [0,1,0,1,0,0|1,0,0]=3 27797 B14R1.422 CC(O)CCCNCC1CCCOC1 2230a_100000720124_200000718107 [0,1,0,1,0,0|2,0,0]=4 27798 B14R1.422 CC(O)CCCNCC1CCCOC1 34a_100000720124_200000718107 [0,1,0,1,0,0|2,0,0]=4 27799 B14R1.422 CC(O)CCCNCC1CCOCC1 2230a_100000746373_200000718107 [0,1,0,1,0,0|2,0,0]=4 27800 B14R1.422 CC(O)CCCNCC1CCOCC1 34a_100000746373_200000718107 [0,1,0,1,0,0|2,0,0]=4 27801 B14R1.422 CC(O)CCCNCC1CCSCC1 2230a_100015188806_200000718107 [0,1,0,1,0,0|2,0,0]=4 27802 B14R1.422 CC(O)CCCNCC1CCSCC1 34a_100015188806_200000718107 [0,1,0,1,0,0|2,0,0]=4 27803 B14R1.422 CC(O)CCCNC[C@H]1COCCO1 2230a_100010981119_200000718107 [0,1,0,1,0,0|2,0,0]=4 27804 B14R1.422 CC(O)CCCNC[C@H]1COCCO1 34a_100010981119_200000718107 [0,1,0,1,0,0|2,0,0]=4 27805 B14R1.422 CC(O)CCCOCC1CCCCC1 34a_100000212181_200000718107 [0,1,0,1,0,0|1,0,0]=3 27806 B14R1.422 CC(O)CCCOCC1CCCCC1 7a_100000212181_200000718107 [0,1,0,1,0,0|1,0,0]=3 27807 B14R1.422 CC(O)CCCOCC1CCCCN1 34a_100000210821_200000718107 [0,1,0,1,0,0|2,0,0]=4 27808 B14R1.422 CC(O)CCCOCC1CCCCO1 34a_100000211370_200000718107 [0,1,0,1,0,0|1,0,0]=3 27809 B14R1.422 CC(O)CCCOCC1CCCCO1 7a_100000211370_200000718107 [0,1,0,1,0,0|1,0,0]=3 27810 B14R1.422 CC(O)CCCOCC1CCCNC1 34a_100000211344_200000718107 [0,1,0,1,0,0|2,0,0]=4 27811 B14R1.422 CC(O)CCCOCC1CCCOC1 34a_100000741520_200000718107 [0,1,0,1,0,0|2,0,0]=4 27812 B14R1.422 CC(O)CCCOCC1CCNCC1 34a_100000738675_200000718107 [0,1,0,1,0,0|2,0,0]=4 27813 B14R1.422 CC(O)CCCOCC1CCOCC1 34a_100000749013_200000718107 [0,1,0,1,0,0|2,0,0]=4 27814 B14R1.422 CC(O)CCCOCC1CCSCC1 34a_100000070558_200000718107 [0,1,0,1,0,0|2,0,0]=4 27815 B14R1.422 CC(O)CCCOCC1CCSCC1 7a_100000070558_200000718107 [0,1,0,1,0,0|2,0,0]=4 27816 B14R1.422 CC(O)CCCOC[C@@H]1CNCCO1 34a_100015189573_200000718107 [0,1,0,1,0,0|2,0,0]=4 27817 B14R1.422 CC(O)CCCOC[C@H]1COCCO1 34a_100009875890_200000718107 [0,1,0,1,0,0|2,0,0]=4 27818 B14R1.422 CC(O)CCCSCC1CCCCC1 62a_100000211423_200000718107 [0,1,0,1,0,0|1,0,0]=3 27819 B14R1.422 CC(O)CCCSCC1CCCCC1 62a_200000718107_100000211423 [0,1,0,1,0,0|1,0,0]=3 27820 B14R1.422 CC(O)CCCSCC1CCCCO1 62a_100000211543_200000718107 [0,1,0,1,0,0|1,0,0]=3 27821 B14R1.422 CC(O)CCCSCC1CCCCO1 62a_200000718107_100000211543 [0,1,0,1,0,0|1,0,0]=3 27822 B14R1.422 CC(O)CCCSCC1CCCOC1 62a_100000741521_200000718107 [0,1,0,1,0,0|2,0,0]=4 27823 B14R1.422 CC(O)CCCSCC1CCCOC1 62a_200000718107_100000741521 [0,1,0,1,0,0|2,0,0]=4 27824 B14R1.422 CC(O)CCCSCC1CCOCC1 62a_100000754603_200000718107 [0,1,0,1,0,0|2,0,0]=4 27825 B14R1.422 CC(O)CCCSCC1CCOCC1 62a_200000718107_100000749018 [0,1,0,1,0,0|2,0,0]=4 27826 B14R1.422 CC(O)CCNCCC1CCCCC1 2230a_100000738074_100012276601 [0,1,0,1,0,0|1,0,0]=3 27827 B14R1.422 CC(O)CCNCCC1CCCCC1 2230a_200000755665_100012355289 [0,1,0,1,0,0|1,0,0]=3 27828 B14R1.422 CC(O)CCNCCC1CCCCC1 270004a_200000755665_100011713444 [0,1,0,1,0,0|1,0,0]=3 27829 B14R1.422 CC(O)CCNCCC1CCCCC1 34a_100000738074_100012276601 [0,1,0,1,0,0|1,0,0]=3 27830 B14R1.422 CC(O)CCNCCC1CCCCO1 2230a_100015183643_100012276601 [0,1,0,1,0,0|1,0,0]=3 27831 B14R1.422 CC(O)CCNCCC1CCCCO1 34a_100015183643_100012276601 [0,1,0,1,0,0|1,0,0]=3 27832 B14R1.422 CC(O)CCNCCC1CCOCC1 2230a_100000755988_100012276601 [0,1,0,1,0,0|2,0,0]=4 27833 B14R1.422 CC(O)CCNCCC1CCOCC1 2230a_200000755665_100011934994 [0,1,0,1,0,0|2,0,0]=4 27834 B14R1.422 CC(O)CCNCCC1CCOCC1 34a_100000755988_100012276601 [0,1,0,1,0,0|2,0,0]=4 27835 B14R1.422 CC(O)CCNCCC1OCCCO1 2230a_200000755665_100000764188 [0,1,0,1,0,0|2,0,0]=4 27836 B14R1.422 CC(O)CCNCCN1CCCCC1 2230a_200000755665_100000739454 [0,1,0,1,0,0|2,0,0]=4 27837 B14R1.422 CC(O)CCNCOC1CCCCC1 2230a_200000755665_100011935260 [0,1,0,1,0,0|2,0,0]=4 27838 B14R1.422 CC(O)CCOCCC1CCCCC1 34a_100011217863_100012276601 [0,1,0,1,0,0|1,0,0]=3 27839 B14R1.422 CC(O)CCOCCC1CCCCC1 7a_100011217863_100012276601 [0,1,0,1,0,0|1,0,0]=3 27840 B14R1.422 CC(O)CCOCCC1CCCCN1 34a_100000211664_100012276601 [0,1,0,1,0,0|2,0,0]=4 27841 B14R1.422 CC(O)CCOCCC1CCCNC1 34a_100000752241_100012276601 [0,1,0,1,0,0|2,0,0]=4 27842 B14R1.422 CC(O)CCOCCC1CCNCC1 34a_100015190746_100012276601 [0,1,0,1,0,0|2,0,0]=4 27843 B14R1.422 CC(O)CCOCCC1CCOCC1 34a_100011933979_100012276601 [0,1,0,1,0,0|2,0,0]=4 27844 B14R1.422 CC(O)CCOCCC1CCOCC1 7a_100011933979_100012276601 [0,1,0,1,0,0|2,0,0]=4 27845 B14R1.422 CC(O)CCSCCC1CCCCC1 62a_100012276601_100012355289 [0,1,0,1,0,0|1,0,0]=3 27846 B14R1.422 CC(O)CCSCCC1CCCCC1 62a_100012355289_100012276601 [0,1,0,1,0,0|1,0,0]=3 27847 B14R1.422 CC(O)CCSCCC1CCOCC1 62a_100011934994_100012276601 [0,1,0,1,0,0|2,0,0]=4 27848 B14R1.422 CC(O)CCSCCC1CCOCC1 62a_100012276601_100011934994 [0,1,0,1,0,0|2,0,0]=4 27849 B14R1.422 CC(O)CCSCCC1OCCCO1 62a_100000764188_100012276601 [0,1,0,1,0,0|2,0,0]=4 27850 B14R1.422 CC(O)CCSCCC1OCCCO1 62a_100012276601_100000764188 [0,1,0,1,0,0|2,0,0]=4 27851 B14R1.422 CC(O)CCSCCN1CCCCC1 62a_100000739454_100012276601 [0,1,0,1,0,0|2,0,0]=4 27852 B14R1.422 CC(O)CCSCCN1CCCCC1 62a_100012276601_100000739454 [0,1,0,1,0,0|2,0,0]=4 27853 B14R1.422 CC(O)CCSCOC1CCCCC1 62a_100011935260_100012276601 [0,1,0,1,0,0|2,0,0]=4 27854 B14R1.422 CC(O)CCSCOC1CCCCC1 62a_100012276601_100011935260 [0,1,0,1,0,0|2,0,0]=4 27855 B14R1.422 CC(O)CNCCCC1CCCCC1 2230a_100000210904_100011713725 [0,1,0,1,0,0|1,0,0]=3 27856 B14R1.422 CC(O)CNCCCC1CCCCC1 2230a_100011211642_100011218427 [0,1,0,1,0,0|1,0,0]=3 27857 B14R1.422 CC(O)CNCCCC1CCCCC1 34a_100000210904_100011713725 [0,1,0,1,0,0|1,0,0]=3 27858 B14R1.422 CC(O)CNCCCC1CCCCC1 34a_100011211642_100011218427 [0,1,0,1,0,0|1,0,0]=3 27859 B14R1.422 CC(O)CNCCCN1CCCCC1 2230a_100000210904_100000690320 [0,1,0,1,0,0|2,0,0]=4 27860 B14R1.422 CC(O)CNCCCN1CCCCC1 34a_100000210904_100000690320 [0,1,0,1,0,0|2,0,0]=4 27861 B14R1.422 CC(O)CNCCOC1CCCCC1 2230a_100000210904_100011211530 [0,1,0,1,0,0|2,0,0]=4 27862 B14R1.422 CC(O)CNCCOC1CCCCC1 34a_100000210904_100011211530 [0,1,0,1,0,0|2,0,0]=4 27863 B14R1.422 CC(O)CNCCOC1CCCCC1 34a_100015206981_100011218427 [0,1,0,1,0,0|2,0,0]=4 27864 B14R1.422 CC(O)CNCCOC1CCCCO1 2230a_100000210904_100000744793 [0,1,0,1,0,0|2,0,0]=4 27865 B14R1.422 CC(O)CNCCOC1CCCCO1 34a_100000210904_100000744793 [0,1,0,1,0,0|2,0,0]=4 27866 B14R1.422 CC(O)COCCCC1CCCCC1 34a_100000198086_100011218427 [0,1,0,1,0,0|1,0,0]=3 27867 B14R1.422 CC(O)COCCCC1CCCCC1 7a_100000198086_100011218427 [0,1,0,1,0,0|1,0,0]=3 27868 B14R1.422 CC(O)COCCCC1CCCCN1 34a_100011934581_100011218427 [0,1,0,1,0,0|2,0,0]=4 27869 B14R1.422 CC(O)COCCCC1CCCNC1 34a_100150707839_100011218427 [0,1,0,1,0,0|2,0,0]=4 27870 B14R1.422 CC(O)COCCCC1CCNCC1 34a_100016988962_100011218427 [0,1,0,1,0,0|2,0,0]=4 27871 B14R1.422 CC(O)COCCCN1CCCCC1 34a_100000212458_100011218427 [0,1,0,1,0,0|2,0,0]=4 27872 B14R1.422 CC(O)COCCNC1CCCCC1 34a_100000200466_100011218427 [0,1,0,1,0,0|2,0,0]=4 27873 B14R1.422 CC(O)COCCOC1CCCCC1 34a_100011249652_100011218427 [0,1,0,1,0,0|2,0,0]=4 27874 B14R1.422 CC(O)COCCOC1CCCCC1 7a_100011249652_100011218427 [0,1,0,1,0,0|2,0,0]=4 27875 B14R1.422 CC(O)COCCOC1CCCCO1 34a_100000034223_100011218427 [0,1,0,1,0,0|2,0,0]=4 27876 B14R1.422 CC(O)COCCOC1CCCCO1 7a_100000034223_100011218427 [0,1,0,1,0,0|2,0,0]=4 27877 B14R1.422 CC(O)CSCCCC1CCCCC1 62a_100011218427_100011713725 [0,1,0,1,0,0|1,0,0]=3 27878 B14R1.422 CC(O)CSCCCC1CCCCC1 62a_100011713725_100011218427 [0,1,0,1,0,0|1,0,0]=3 27879 B14R1.422 CC(O)CSCCCN1CCCCC1 62a_100011218427_100000007876 [0,1,0,1,0,0|2,0,0]=4 27880 B14R1.422 CC(O)CSCCCN1CCCCC1 62a_100132302099_100011218427 [0,1,0,1,0,0|2,0,0]=4 27881 B14R1.422 CC(O)CSCCOC1CCCCC1 62a_100011211530_100011218427 [0,1,0,1,0,0|2,0,0]=4 27882 B14R1.422 CC(O)CSCCOC1CCCCC1 62a_100011218427_100011211530 [0,1,0,1,0,0|2,0,0]=4 27883 B14R1.422 CC(O)CSCCOC1CCCCO1 62a_100000744793_100011218427 [0,1,0,1,0,0|2,0,0]=4 27884 B14R1.422 CC(O)CSCCOC1CCCCO1 62a_100011218427_100000744793 [0,1,0,1,0,0|2,0,0]=4 27885 B14R1.422 CN(C)CCCCOC1CCCCO1 2230a_100102631434_100000031530 [0,1,0,1,0,0|2,0,0]=4 27886 B14R1.422 CN(C)CCCCOC1CCCCO1 269982a_100102631434_100000031530 [0,1,0,1,0,0|2,0,0]=4 27887 B14R1.422 CN(C)CCCOCC1CCCCO1 7a_100000211370_100000757444 [0,1,0,1,0,0|2,0,0]=4 27888 B14R1.422 CN(C)CCCSCC1CCCCO1 62a_100000211543_100000757444 [0,1,0,1,0,0|2,0,0]=4 27889 B14R1.422 CS(=O)CCCNCC1CCCCO1 2230a_200000753449_100000211543 [0,1,0,1,0,0|2,0,0]=4 27890 B14R1.422 C[C@@H](Cl)COCCCC1CCCCC1 34a_100016084084_100011713725 [0,1,0,1,0,0|2,0,0]=4 27891 B14R1.422 C[C@@H](Cl)COCCOC1CCCCO1 34a_100016084084_100000744793 [0,1,0,1,0,0|2,0,0]=4 27892 B14R1.422 C[C@@H](N)CCOCCC1CCCCC1 34a_100000706166_100011209188 [0,1,0,1,0,0|2,0,0]=4 27893 B14R1.422 C[C@@H](N)CCOCCC1OCCCO1 34a_100000706166_100000764188 [0,1,0,1,0,0|2,0,0]=4 27894 B14R1.422 C[C@@H](N)COCCCC1CCCCC1 34a_100000737577_100011713725 [0,1,0,1,0,0|2,0,0]=4 27895 B14R1.422 C[C@@H](N)COCCOC1CCCCO1 34a_100000737577_100000744793 [0,1,0,1,0,0|2,0,0]=4 27896 B14R1.422 C[C@@H](O)CNCCCC1CCCCC1 2230a_100011211642_100009817552 [0,1,0,1,0,0|1,0,0]=3 27897 B14R1.422 C[C@@H](O)CNCCCC1CCCCC1 34a_100011211642_100009817552 [0,1,0,1,0,0|1,0,0]=3 27898 B14R1.422 C[C@@H](O)CNCCOC1CCCCC1 34a_100015206981_100009817552 [0,1,0,1,0,0|2,0,0]=4 27899 B14R1.422 C[C@@H](O)COCCCC1CCCCC1 34a_100000198086_100009817552 [0,1,0,1,0,0|1,0,0]=3 27900 B14R1.422 C[C@@H](O)COCCCC1CCCCC1 7a_100000198086_100009817552 [0,1,0,1,0,0|1,0,0]=3 27901 B14R1.422 C[C@@H](O)COCCCC1CCCCN1 34a_100011934581_100009817552 [0,1,0,1,0,0|2,0,0]=4 27902 B14R1.422 C[C@@H](O)COCCCC1CCCNC1 34a_100150707839_100009817552 [0,1,0,1,0,0|2,0,0]=4 27903 B14R1.422 C[C@@H](O)COCCCC1CCNCC1 34a_100016988962_100009817552 [0,1,0,1,0,0|2,0,0]=4 27904 B14R1.422 C[C@@H](O)COCCCN1CCCCC1 34a_100000212458_100009817552 [0,1,0,1,0,0|2,0,0]=4 27905 B14R1.422 C[C@@H](O)COCCNC1CCCCC1 34a_100000200466_100009817552 [0,1,0,1,0,0|2,0,0]=4 27906 B14R1.422 C[C@@H](O)COCCOC1CCCCC1 34a_100011249652_100009817552 [0,1,0,1,0,0|2,0,0]=4 27907 B14R1.422 C[C@@H](O)COCCOC1CCCCC1 7a_100011249652_100009817552 [0,1,0,1,0,0|2,0,0]=4 27908 B14R1.422 C[C@@H](O)COCCOC1CCCCO1 34a_100000034223_100009817552 [0,1,0,1,0,0|2,0,0]=4 27909 B14R1.422 C[C@@H](O)COCCOC1CCCCO1 7a_100000034223_100009817552 [0,1,0,1,0,0|2,0,0]=4 27910 B14R1.422 C[C@@H](O)CSCCCC1CCCCC1 62a_100009817552_100011713725 [0,1,0,1,0,0|1,0,0]=3 27911 B14R1.422 C[C@@H](O)CSCCCC1CCCCC1 62a_100011713725_100009817552 [0,1,0,1,0,0|1,0,0]=3 27912 B14R1.422 C[C@@H](O)CSCCCN1CCCCC1 62a_100009817552_100000007876 [0,1,0,1,0,0|2,0,0]=4 27913 B14R1.422 C[C@@H](O)CSCCCN1CCCCC1 62a_100132302099_100009817552 [0,1,0,1,0,0|2,0,0]=4 27914 B14R1.422 C[C@@H](O)CSCCOC1CCCCC1 62a_100009817552_100011211530 [0,1,0,1,0,0|2,0,0]=4 27915 B14R1.422 C[C@@H](O)CSCCOC1CCCCC1 62a_100011211530_100009817552 [0,1,0,1,0,0|2,0,0]=4 27916 B14R1.422 C[C@@H](O)CSCCOC1CCCCO1 62a_100000744793_100009817552 [0,1,0,1,0,0|2,0,0]=4 27917 B14R1.422 C[C@@H](O)CSCCOC1CCCCO1 62a_100009817552_100000744793 [0,1,0,1,0,0|2,0,0]=4 27918 B14R1.422 FC(F)CCOCCC1CCCCC1 34a_100103093639_100011209188 [0,1,0,1,0,0|2,0,0]=4 27919 B14R1.422 FC(F)CNCCCC1CCCCC1 2230a_100011211642_100011934356 [0,1,0,1,0,0|2,0,0]=4 27920 B14R1.422 FC(F)CNCCCC1CCCCC1 34a_100000765723_100011713725 [0,1,0,1,0,0|2,0,0]=4 27921 B14R1.422 FC(F)CNCCCC1CCCCC1 34a_100011211642_100011934356 [0,1,0,1,0,0|2,0,0]=4 27922 B14R1.422 FC(F)COCCCC1CCCCC1 34a_100000198086_100011934356 [0,1,0,1,0,0|2,0,0]=4 27923 B14R1.422 FC(F)COCCCC1CCCCC1 34a_100000743014_100011713725 [0,1,0,1,0,0|2,0,0]=4 27924 B14R1.422 FC(F)COCCCC1CCCCC1 7a_100000198086_100011934356 [0,1,0,1,0,0|2,0,0]=4 27925 B14R1.422 FC(F)CSCCCC1CCCCC1 62a_100011713725_100011934356 [0,1,0,1,0,0|2,0,0]=4 27926 B14R1.422 FC(F)CSCCCC1CCCCC1 62a_100011934356_100011713725 [0,1,0,1,0,0|2,0,0]=4 27927 B14R1.422 O=C(O)CNCCCC1CCCCC1 269956a_100016091260_100011713725 [0,1,0,1,0,0|1,0,1]=4 27928 B14R1.422 OB(O)CCCCNC1CCCCC1 2230a_100000182618_200009817182 [0,1,0,1,0,0|2,0,0]=4 27929 B14R1.422 OB(O)CCCCNC1CCCCC1 34a_100000182618_200009817182 [0,1,0,1,0,0|2,0,0]=4 27930 B14R1.422 OB(O)CCCCOC1CCCCC1 34a_100000210231_200009817182 [0,1,0,1,0,0|2,0,0]=4 27931 B14R1.422 OB(O)CCCCOC1CCCCC1 7a_100000210231_200009817182 [0,1,0,1,0,0|2,0,0]=4 27932 B14R1.422 OB(O)CCCCSC1CCCCC1 62a_100000210327_200009817182 [0,1,0,1,0,0|2,0,0]=4 27933 B14R1.422 OB(O)CCCCSC1CCCCC1 62a_200009817182_100000210327 [0,1,0,1,0,0|2,0,0]=4 27934 B14R1.427 CC(=O)CCCCNC[C@@H]1CCCO1 34a_100020590478_100009817362 [0,1,0,1,0,0|1,0,1]=4 27935 B14R1.427 CC(=O)CCCCOCC1CCCO1 34a_100000210270_100009817362 [0,1,0,1,0,0|1,0,1]=4 27936 B14R1.427 CC(=O)CCCCOCC1CCCO1 7a_100000210270_100000735457 [0,1,0,1,0,0|1,0,1]=4 27937 B14R1.427 CC(=O)CCCCSCC1CCCO1 62a_100000203698_100000735457 [0,1,0,1,0,0|1,0,1]=4 27938 B14R1.427 CC(=O)CCCCSCC1CCCO1 62a_100000735457_100000203698 [0,1,0,1,0,0|1,0,1]=4 27939 B14R1.427 CC(Br)CCOCCCC1CCCC1 34a_100009893172_100011713738 [0,1,0,1,0,0|2,0,0]=4 27940 B14R1.427 CC(Br)CCOCCCC1OCCO1 34a_100009893172_100009861162 [0,1,0,1,0,0|2,0,0]=4 27941 B14R1.427 CC(Br)COCCCCC1OCCO1 34a_100012180447_200009813554 [0,1,0,1,0,0|2,0,0]=4 27942 B14R1.427 CC(C)CCCCCNC1CCCC1 2230a_100000211070_100000210682 [0,1,0,1,0,0|2,0,0]=4 27943 B14R1.427 CC(C)CCCCCNC1CCCC1 2230a_100011290863_100000179811 [0,1,0,1,0,0|2,0,0]=4 27944 B14R1.427 CC(C)CCCCCNC1CCCC1 270004a_100011290863_100000210133 [0,1,0,1,0,0|2,0,0]=4 27945 B14R1.427 CC(C)CCCCCNC1CCCC1 34a_100000211070_100000210682 [0,1,0,1,0,0|2,0,0]=4 27946 B14R1.427 CC(C)CCCCCNC1CCCC1 34a_100011290863_100000179811 [0,1,0,1,0,0|2,0,0]=4 27947 B14R1.427 CC(C)CCCCCOC1CCCC1 34a_100000210269_100000210682 [0,1,0,1,0,0|2,0,0]=4 27948 B14R1.427 CC(C)CCCCCOC1CCCC1 34a_100011995859_100000179811 [0,1,0,1,0,0|2,0,0]=4 27949 B14R1.427 CC(C)CCCCCOC1CCCC1 7a_100000210269_100000210682 [0,1,0,1,0,0|2,0,0]=4 27950 B14R1.427 CC(C)CCCCCOC1CCCC1 7a_100011995859_100000179811 [0,1,0,1,0,0|2,0,0]=4 27951 B14R1.427 CC(C)CCCCCOC1CCCO1 34a_100000085407_100000210682 [0,1,0,1,0,0|1,0,0]=3 27952 B14R1.427 CC(C)CCCCCSC1CCCC1 62a_100000210682_100000179811 [0,1,0,1,0,0|2,0,0]=4 27953 B14R1.427 CC(C)CCCCCSC1CCCC1 62a_100011217020_100000210682 [0,1,0,1,0,0|2,0,0]=4 27954 B14R1.427 CC(C)CCCCNCC1CCCC1 2230a_100000737975_100011216152 [0,1,0,1,0,0|2,0,0]=4 27955 B14R1.427 CC(C)CCCCNCC1CCCC1 34a_100000737975_100011216152 [0,1,0,1,0,0|2,0,0]=4 27956 B14R1.427 CC(C)CCCCNCC1OCCO1 2230a_100000036311_100011216152 [0,1,0,1,0,0|2,0,0]=4 27957 B14R1.427 CC(C)CCCCNCC1OCCO1 34a_100000036311_100011216152 [0,1,0,1,0,0|2,0,0]=4 27958 B14R1.427 CC(C)CCCCNC[C@@H]1CCCO1 2230a_100020590478_100011216152 [0,1,0,1,0,0|1,0,0]=3 27959 B14R1.427 CC(C)CCCCNC[C@@H]1CCCO1 34a_100020590478_100011216152 [0,1,0,1,0,0|1,0,0]=3 27960 B14R1.427 CC(C)CCCCOCC1CCCC1 34a_100000742336_100011216152 [0,1,0,1,0,0|2,0,0]=4 27961 B14R1.427 CC(C)CCCCOCC1CCCC1 34a_100011214890_100000740388 [0,1,0,1,0,0|2,0,0]=4 27962 B14R1.427 CC(C)CCCCOCC1CCCC1 7a_100000742336_100011216152 [0,1,0,1,0,0|2,0,0]=4 27963 B14R1.427 CC(C)CCCCOCC1CCCC1 7a_100011214890_100000740388 [0,1,0,1,0,0|2,0,0]=4 27964 B14R1.427 CC(C)CCCCOCC1CCCO1 34a_100000210270_100011216152 [0,1,0,1,0,0|1,0,0]=3 27965 B14R1.427 CC(C)CCCCOCC1CCCO1 7a_100000210270_100011216152 [0,1,0,1,0,0|1,0,0]=3 27966 B14R1.427 CC(C)CCCCOCC1CCCO1 7a_100011214890_100000203698 [0,1,0,1,0,0|1,0,0]=3 27967 B14R1.427 CC(C)CCCCOCC1COCO1 34a_100011216627_100011216152 [0,1,0,1,0,0|2,0,0]=4 27968 B14R1.427 CC(C)CCCCOCC1OCCO1 34a_100000087154_100011216152 [0,1,0,1,0,0|2,0,0]=4 27969 B14R1.427 CC(C)CCCCOCC1OCCO1 34a_100011214890_100000755774 [0,1,0,1,0,0|2,0,0]=4 27970 B14R1.427 CC(C)CCCCOCC1OCCO1 7a_100011214890_100000755774 [0,1,0,1,0,0|2,0,0]=4 27971 B14R1.427 CC(C)CCCCOC[C@H]1CCCN1 34a_100000745186_100011216152 [0,1,0,1,0,0|2,0,0]=4 27972 B14R1.427 CC(C)CCCCSCC1CCCC1 62a_100000740388_100011216152 [0,1,0,1,0,0|2,0,0]=4 27973 B14R1.427 CC(C)CCCCSCC1CCCC1 62a_100011216152_100000740388 [0,1,0,1,0,0|2,0,0]=4 27974 B14R1.427 CC(C)CCCCSCC1CCCO1 62a_100000203698_100011216152 [0,1,0,1,0,0|1,0,0]=3 27975 B14R1.427 CC(C)CCCCSCC1CCCO1 62a_100011216152_100000203698 [0,1,0,1,0,0|1,0,0]=3 27976 B14R1.427 CC(C)CCCCSCC1OCCO1 62a_100000755774_100011216152 [0,1,0,1,0,0|2,0,0]=4 27977 B14R1.427 CC(C)CCCCSCC1OCCO1 62a_100011216152_100000755774 [0,1,0,1,0,0|2,0,0]=4 27978 B14R1.427 CC(C)CCCNCCC1CCCC1 2230a_100000739158_100011214892 [0,1,0,1,0,0|2,0,0]=4 27979 B14R1.427 CC(C)CCCNCCC1CCCC1 2230a_200000737386_100000760354 [0,1,0,1,0,0|2,0,0]=4 27980 B14R1.427 CC(C)CCCNCCC1CCCC1 34a_100000739158_100011214892 [0,1,0,1,0,0|2,0,0]=4 27981 B14R1.427 CC(C)CCCNCCC1CCCC1 34a_200000737386_100000760354 [0,1,0,1,0,0|2,0,0]=4 27982 B14R1.427 CC(C)CCCNCCC1OCCO1 2230a_100000034215_100011214892 [0,1,0,1,0,0|2,0,0]=4 27983 B14R1.427 CC(C)CCCNCCC1OCCO1 2230a_200000737386_100000740749 [0,1,0,1,0,0|2,0,0]=4 27984 B14R1.427 CC(C)CCCNCCC1OCCO1 34a_100000034215_100011214892 [0,1,0,1,0,0|2,0,0]=4 27985 B14R1.427 CC(C)CCCNCCC1OCCO1 34a_200000737386_100000740749 [0,1,0,1,0,0|2,0,0]=4 27986 B14R1.427 CC(C)CCCOCCC1CCCC1 34a_100000210774_100000760354 [0,1,0,1,0,0|2,0,0]=4 27987 B14R1.427 CC(C)CCCOCCC1CCCC1 34a_100000749090_100011214892 [0,1,0,1,0,0|2,0,0]=4 27988 B14R1.427 CC(C)CCCOCCC1CCCC1 7a_100000210774_100000760354 [0,1,0,1,0,0|2,0,0]=4 27989 B14R1.427 CC(C)CCCOCCC1CCCC1 7a_100000749090_100011214892 [0,1,0,1,0,0|2,0,0]=4 27990 B14R1.427 CC(C)CCCOCCC1OCCO1 34a_100000210774_100000740749 [0,1,0,1,0,0|2,0,0]=4 27991 B14R1.427 CC(C)CCCOCCC1OCCO1 7a_100000210774_100000740749 [0,1,0,1,0,0|2,0,0]=4 27992 B14R1.427 CC(C)CCCSCCC1CCCC1 62a_100000760354_100011214892 [0,1,0,1,0,0|2,0,0]=4 27993 B14R1.427 CC(C)CCCSCCC1CCCC1 62a_100011214892_100000760354 [0,1,0,1,0,0|2,0,0]=4 27994 B14R1.427 CC(C)CCCSCCC1OCCO1 62a_100011214892_100000740749 [0,1,0,1,0,0|2,0,0]=4 27995 B14R1.427 CC(C)CCNCCCC1CCCC1 2230a_100000736752_100000210312 [0,1,0,1,0,0|2,0,0]=4 27996 B14R1.427 CC(C)CCNCCCC1CCCC1 269862a_100000736752_100000185833 [0,1,0,1,0,0|2,0,0]=4 27997 B14R1.427 CC(C)CCNCCCC1CCCC1 34a_100000736752_100000210312 [0,1,0,1,0,0|2,0,0]=4 27998 B14R1.427 CC(C)CCOCCCC1CCCC1 34a_100000210254_100011713738 [0,1,0,1,0,0|2,0,0]=4 27999 B14R1.427 CC(C)CCOCCCC1CCCC1 34a_100011215328_100000210312 [0,1,0,1,0,0|2,0,0]=4 28000 B14R1.427 CC(C)CCOCCCC1CCCC1 7a_100000210254_100011713738 [0,1,0,1,0,0|2,0,0]=4 28001 B14R1.427 CC(C)CCOCCCC1CCCC1 7a_100011215328_100000210626 [0,1,0,1,0,0|2,0,0]=4 28002 B14R1.427 CC(C)CCOCCCC1OCCO1 34a_100000210254_100009861162 [0,1,0,1,0,0|2,0,0]=4 28003 B14R1.427 CC(C)CCOCCCC1OCCO1 34a_100009871617_100000210312 [0,1,0,1,0,0|2,0,0]=4 28004 B14R1.427 CC(C)CCOCCCC1OCCO1 7a_100000210254_100000042513 [0,1,0,1,0,0|2,0,0]=4 28005 B14R1.427 CC(C)CCOCCCC1OCCO1 7a_100009871617_100000210626 [0,1,0,1,0,0|2,0,0]=4 28006 B14R1.427 CC(C)CCSCCCC1CCCC1 62a_100000210312_100011713738 [0,1,0,1,0,0|2,0,0]=4 28007 B14R1.427 CC(C)CCSCCCC1CCCC1 62a_100011713738_100000210312 [0,1,0,1,0,0|2,0,0]=4 28008 B14R1.427 CC(C)CCSCCCC1OCCO1 62a_100000210312_100000042513 [0,1,0,1,0,0|2,0,0]=4 28009 B14R1.427 CC(C)CNCCCCC1OCCO1 2230a_100000210953_100000034956 [0,1,0,1,0,0|2,0,0]=4 28010 B14R1.427 CC(C)CNCCCCC1OCCO1 34a_100000210953_200009813554 [0,1,0,1,0,0|2,0,0]=4 28011 B14R1.427 CC(C)COCCCCC1OCCO1 34a_100000210257_200009813554 [0,1,0,1,0,0|2,0,0]=4 28012 B14R1.427 CC(C)COCCOCC1CCCO1 7a_100000703358_100000203698 [0,1,0,1,0,0|2,0,0]=4 28013 B14R1.427 CC(C)CSCCCCC1OCCO1 62a_100000210624_100000034956 [0,1,0,1,0,0|2,0,0]=4 28014 B14R1.427 CC(C)CSCCOCC1CCCO1 7a_200000230437_100000203698 [0,1,0,1,0,0|2,0,0]=4 28015 B14R1.427 CC(C)OCCCCOC1CCCO1 34a_100011018183_100000210206 [0,1,0,1,0,0|2,0,0]=4 28016 B14R1.427 CC(C)OCCCCOC1CCCO1 7a_100011018183_100000210206 [0,1,0,1,0,0|2,0,0]=4 28017 B14R1.427 CC(C)OCCCNCC1CCCO1 2230a_100000737246_100000203698 [0,1,0,1,0,0|2,0,0]=4 28018 B14R1.427 CC(F)COCCCCC1OCCO1 34a_100015925927_200009813554 [0,1,0,1,0,0|2,0,0]=4 28019 B14R1.427 CC(O)CCCNCCC1CCCC1 2230a_100000739158_200000718107 [0,1,0,1,0,0|1,0,0]=3 28020 B14R1.427 CC(O)CCCNCCC1CCCC1 34a_100000739158_200000718107 [0,1,0,1,0,0|1,0,0]=3 28021 B14R1.427 CC(O)CCCNCCC1OCCO1 2230a_100000034215_200000718107 [0,1,0,1,0,0|2,0,0]=4 28022 B14R1.427 CC(O)CCCNCCC1OCCO1 34a_100000034215_200000718107 [0,1,0,1,0,0|2,0,0]=4 28023 B14R1.427 CC(O)CCCOCCC1CCCC1 34a_100000749090_200000718107 [0,1,0,1,0,0|1,0,0]=3 28024 B14R1.427 CC(O)CCCOCCC1CCCC1 7a_100000749090_200000718107 [0,1,0,1,0,0|1,0,0]=3 28025 B14R1.427 CC(O)CCCOCCC1CCNC1 34a_100016987287_200000718107 [0,1,0,1,0,0|2,0,0]=4 28026 B14R1.427 CC(O)CCCOCCC1CCOC1 34a_100011879284_200000718107 [0,1,0,1,0,0|2,0,0]=4 28027 B14R1.427 CC(O)CCCSCCC1CCCC1 62a_100000760354_200000718107 [0,1,0,1,0,0|1,0,0]=3 28028 B14R1.427 CC(O)CCCSCCC1CCCC1 62a_200000718107_100000760354 [0,1,0,1,0,0|1,0,0]=3 28029 B14R1.427 CC(O)CCCSCCC1OCCO1 62a_200000718107_100000740749 [0,1,0,1,0,0|2,0,0]=4 28030 B14R1.427 CC(O)CCCSCCN1CCCC1 62a_100000700749_200000718107 [0,1,0,1,0,0|2,0,0]=4 28031 B14R1.427 CC(O)CCCSCCN1CCCC1 62a_200000718107_100000004467 [0,1,0,1,0,0|2,0,0]=4 28032 B14R1.427 CC(O)CCNCCCC1CCCC1 2230a_100000736752_100012276601 [0,1,0,1,0,0|1,0,0]=3 28033 B14R1.427 CC(O)CCNCCCC1CCCC1 2230a_200000755665_100011713738 [0,1,0,1,0,0|1,0,0]=3 28034 B14R1.427 CC(O)CCNCCCC1CCCC1 34a_100000736752_100012276601 [0,1,0,1,0,0|1,0,0]=3 28035 B14R1.427 CC(O)CCNCCCC1OCCO1 2230a_200000755665_100000042513 [0,1,0,1,0,0|2,0,0]=4 28036 B14R1.427 CC(O)CCNCCCN1CCCC1 2230a_200000755665_100011445909 [0,1,0,1,0,0|2,0,0]=4 28037 B14R1.427 CC(O)CCNCCOC1CCCC1 34a_100000741755_100012276601 [0,1,0,1,0,0|2,0,0]=4 28038 B14R1.427 CC(O)CCOCCCC1CCCC1 34a_100011215328_100012276601 [0,1,0,1,0,0|1,0,0]=3 28039 B14R1.427 CC(O)CCOCCCC1CCCC1 7a_100011215328_100012276601 [0,1,0,1,0,0|1,0,0]=3 28040 B14R1.427 CC(O)CCOCCCC1OCCO1 34a_100009871617_100012276601 [0,1,0,1,0,0|2,0,0]=4 28041 B14R1.427 CC(O)CCOCCCC1OCCO1 7a_100009871617_100012276601 [0,1,0,1,0,0|2,0,0]=4 28042 B14R1.427 CC(O)CCOCCNC1CCCC1 34a_200000200444_100012276601 [0,1,0,1,0,0|2,0,0]=4 28043 B14R1.427 CC(O)CCOCCOC1CCCC1 34a_100000738311_100012276601 [0,1,0,1,0,0|2,0,0]=4 28044 B14R1.427 CC(O)CCOCCOC1CCCC1 7a_100000738311_100012276601 [0,1,0,1,0,0|2,0,0]=4 28045 B14R1.427 CC(O)CCSCCCC1CCCC1 62a_100011713738_100012276601 [0,1,0,1,0,0|1,0,0]=3 28046 B14R1.427 CC(O)CCSCCCC1CCCC1 62a_100012276601_100011713738 [0,1,0,1,0,0|1,0,0]=3 28047 B14R1.427 CC(O)CCSCCCC1OCCO1 62a_100012276601_100000042513 [0,1,0,1,0,0|2,0,0]=4 28048 B14R1.427 CC(O)CCSCCCN1CCCC1 62a_100012276601_100011445909 [0,1,0,1,0,0|2,0,0]=4 28049 B14R1.427 CC(O)CCSCCCN1CCCC1 62a_100016991639_100012276601 [0,1,0,1,0,0|2,0,0]=4 28050 B14R1.427 CC(O)CNCCCCC1OCCO1 2230a_100000210904_100000034956 [0,1,0,1,0,0|2,0,0]=4 28051 B14R1.427 CC(O)CNCCCCC1OCCO1 34a_100000210904_200009813554 [0,1,0,1,0,0|2,0,0]=4 28052 B14R1.427 CC(O)CNCCCOC1CCCC1 34a_100000747560_100011218427 [0,1,0,1,0,0|2,0,0]=4 28053 B14R1.427 CC(O)CSCCCCC1OCCO1 62a_100011218427_100000034956 [0,1,0,1,0,0|2,0,0]=4 28054 B14R1.427 CN(C)CCCCSCC1CCCO1 62a_100000203698_100000690147 [0,1,0,1,0,0|2,0,0]=4 28055 B14R1.427 C[C@@H](Cl)COCCCCC1OCCO1 34a_100016084084_200009813554 [0,1,0,1,0,0|2,0,0]=4 28056 B14R1.427 C[C@@H](N)CCOCCCC1CCCC1 34a_100000706166_100011713738 [0,1,0,1,0,0|2,0,0]=4 28057 B14R1.427 C[C@@H](N)CCOCCCC1OCCO1 34a_100000706166_100009861162 [0,1,0,1,0,0|2,0,0]=4 28058 B14R1.427 C[C@@H](N)COCCCCC1OCCO1 34a_100000737577_200009813554 [0,1,0,1,0,0|2,0,0]=4 28059 B14R1.427 C[C@@H](O)CNCCCOC1CCCC1 34a_100000747560_100009817552 [0,1,0,1,0,0|2,0,0]=4 28060 B14R1.427 C[C@@H](O)CSCCCCC1OCCO1 62a_100009817552_100000034956 [0,1,0,1,0,0|2,0,0]=4 28061 B14R1.427 FC(F)CCOCCCC1CCCC1 34a_100103093639_100011713738 [0,1,0,1,0,0|2,0,0]=4 28062 B14R1.427 OB(O)CCCCCCN1CCCC1 2230a_100000188435_100009817187 [0,1,0,1,0,0|2,0,0]=4 28063 B14R1.427 OB(O)CCCCCCN1CCCC1 269982a_100000188435_100009817187 [0,1,0,1,0,0|2,0,0]=4 28064 B14R1.427 OB(O)CCCCCNC1CCCC1 2230a_100000211070_200009817188 [0,1,0,1,0,0|2,0,0]=4 28065 B14R1.427 OB(O)CCCCCNC1CCCC1 34a_100000211070_200009817188 [0,1,0,1,0,0|2,0,0]=4 28066 B14R1.427 OB(O)CCCCCOC1CCCC1 34a_100000210269_200009817188 [0,1,0,1,0,0|2,0,0]=4 28067 B14R1.427 OB(O)CCCCCOC1CCCC1 7a_100000210269_200009817188 [0,1,0,1,0,0|2,0,0]=4 28068 B14R1.427 OB(O)CCCCCSC1CCCC1 62a_100011217020_200009817188 [0,1,0,1,0,0|2,0,0]=4 28069 B14R1.427 OB(O)CCCCCSC1CCCC1 62a_200009817188_100000179811 [0,1,0,1,0,0|2,0,0]=4 28070 B14R1.427 OB(O)CCCCNCC1CCCC1 2230a_100000737975_200009817182 [0,1,0,1,0,0|2,0,0]=4 28071 B14R1.427 OB(O)CCCCNCC1CCCC1 34a_100000737975_200009817182 [0,1,0,1,0,0|2,0,0]=4 28072 B14R1.427 OB(O)CCCCOCC1CCCC1 34a_100000742336_200009817182 [0,1,0,1,0,0|2,0,0]=4 28073 B14R1.427 OB(O)CCCCOCC1CCCC1 7a_100000742336_200009817182 [0,1,0,1,0,0|2,0,0]=4 28074 B14R1.427 OB(O)CCCCSCC1CCCC1 62a_100000740388_200009817182 [0,1,0,1,0,0|2,0,0]=4 28075 B14R1.427 OB(O)CCCCSCC1CCCC1 62a_200009817182_100000740388 [0,1,0,1,0,0|2,0,0]=4 28076 B14R1.482 C=C(C)CCN1CCCCC1CCO 2230a_100000211664_100000730704 [0,1,0,1,0,0|1,0,1]=4 28077 B14R1.482 C=C(C)CCN1CCCCC1CCO 269982a_100000211664_100000730704 [0,1,0,1,0,0|1,0,1]=4 28078 B14R1.482 C=C(C)CCN1CCCCC1CCO 34a_100000211664_100000730704 [0,1,0,1,0,0|1,0,1]=4 28079 B14R1.482 CC(=O)CCN1CCCCC1CCO 269982a_100000211664_100000053229 [0,1,0,1,0,0|1,0,1]=4 28080 B14R1.482 CC(C)CCN1CCCCC1CCO 2230a_100000211664_100000210312 [0,1,0,1,0,0|1,0,0]=3 28081 B14R1.482 CC(C)CCN1CCCCC1CCO 269982a_100000211664_100000210312 [0,1,0,1,0,0|1,0,0]=3 28082 B14R1.482 CC(C)CCN1CCCCC1CCO 34a_100000211664_100000210312 [0,1,0,1,0,0|1,0,0]=3 28083 B14R1.482 CC(C)OCN1CCCCC1CCO 2230a_100000211664_100000709892 [0,1,0,1,0,0|2,0,0]=4 28084 B14R1.482 CC(C)OCN1CCCCC1CCO 269982a_100000211664_100000709892 [0,1,0,1,0,0|2,0,0]=4 28085 B14R1.482 CC(C)OCN1CCCCC1CCO 34a_100000211664_100000709892 [0,1,0,1,0,0|2,0,0]=4 28086 B14R1.482 CC(O)CCN1CCCCC1CCO 2230a_100000211664_100012276601 [0,1,0,1,0,0|1,0,0]=3 28087 B14R1.482 CC(O)CCN1CCCCC1CCO 269982a_100000211664_100012276601 [0,1,0,1,0,0|1,0,0]=3 28088 B14R1.482 CC(O)CCN1CCCCC1CCO 34a_100000211664_100012276601 [0,1,0,1,0,0|1,0,0]=3 28089 B14R1.482 CCCC1CCCCC1NCC(C)C 269862a_100000210953_100011218038 [0,1,0,1,0,0|2,0,0]=4 28090 B14R1.482 CCCC1CCCCC1NCC(C)C 270004a_100000210953_100011218038 [0,1,0,1,0,0|2,0,0]=4 28091 B14R1.482 CCCC1CCCCC1NCC(C)O 269862a_100000210904_100011218038 [0,1,0,1,0,0|1,0,0]=3 28092 B14R1.482 CCCC1CCCCC1NCC(C)O 270004a_100000210904_100011218038 [0,1,0,1,0,0|1,0,0]=3 28093 B14R1.482 CCCC1CCCCC1NCC(F)F 270004a_100000765723_100011218038 [0,1,0,1,0,0|2,0,0]=4 28094 B14R1.482 CCCC1CCCCC1OCC(C)C 34a_100011217265_100000210624 [0,1,0,1,0,0|2,0,0]=4 28095 B14R1.482 CCCC1CCCCC1OCC(C)C 7a_100011217265_100000210760 [0,1,0,1,0,0|2,0,0]=4 28096 B14R1.482 CCCC1CCCCC1OCC(C)O 34a_100011217265_100011218427 [0,1,0,1,0,0|1,0,0]=3 28097 B14R1.482 CCCC1CCCCC1OCC(C)O 7a_100011217265_100011218427 [0,1,0,1,0,0|1,0,0]=3 28098 B14R1.482 CCCC1CCCCC1OCC(F)F 34a_100011217265_100011934356 [0,1,0,1,0,0|2,0,0]=4 28099 B14R1.482 CCCC1CCCCC1OCC(F)F 7a_100011217265_100011934356 [0,1,0,1,0,0|2,0,0]=4 28100 B14R1.482 CCCC1CCCCC1OC[C@@H](C)O 34a_100011217265_100009817552 [0,1,0,1,0,0|1,0,0]=3 28101 B14R1.482 CCCC1CCCCC1OC[C@@H](C)O 7a_100011217265_100009817552 [0,1,0,1,0,0|1,0,0]=3 28102 B14R1.482 CCCC1CCCCN1CCC(C)C 2230a_100000701414_100000210312 [0,1,0,1,0,0|2,0,0]=4 28103 B14R1.482 CCCC1CCCCN1CCC(C)C 269982a_100000701414_100000210312 [0,1,0,1,0,0|2,0,0]=4 28104 B14R1.482 CCCC1CCCCN1CCC(C)C 34a_100000701414_100000210312 [0,1,0,1,0,0|2,0,0]=4 28105 B14R1.482 CCCC1CCCCN1CCC(C)O 2230a_100000701414_100012276601 [0,1,0,1,0,0|1,0,0]=3 28106 B14R1.482 CCCC1CCCCN1CCC(C)O 269982a_100000701414_100012276601 [0,1,0,1,0,0|1,0,0]=3 28107 B14R1.482 CCCC1CCCCN1CCC(C)O 34a_100000701414_100012276601 [0,1,0,1,0,0|1,0,0]=3 28108 B14R1.482 CCCC1COCCN1CCC(C)O 2230a_102495339903_100012276601 [0,1,0,1,0,0|2,0,0]=4 28109 B14R1.482 CCCC1COCCN1CCC(C)O 269982a_102495339903_100012276601 [0,1,0,1,0,0|2,0,0]=4 28110 B14R1.482 CCCC1COCCN1CCC(C)O 34a_102495339903_100012276601 [0,1,0,1,0,0|2,0,0]=4 28111 B14R1.482 CCCN1CCCCC1CCC(=O)O 269956a_100000694054_100000210207 [0,1,0,1,0,0|1,0,1]=4 28112 B14R1.482 CCOC1CCCCC1NCC(C)O 270004a_100000210904_200000031474 [0,1,0,1,0,0|2,0,0]=4 28113 B14R1.482 CN(C)CCC1CCCCN1CCO 269982a_100000243220_100000211926 [0,1,0,1,0,0|2,0,0]=4 28114 B14R1.482 CN(C)CCN1CCCCC1CCO 269982a_100000211664_100000755713 [0,1,0,1,0,0|2,0,0]=4 28115 B14R1.482 COCC1CCCCN1CCC(C)O 2230a_100015184032_100012276601 [0,1,0,1,0,0|2,0,0]=4 28116 B14R1.482 COCC1CCCCN1CCC(C)O 269982a_100015184032_100012276601 [0,1,0,1,0,0|2,0,0]=4 28117 B14R1.482 COCC1CCCCN1CCC(C)O 34a_100015184032_100012276601 [0,1,0,1,0,0|2,0,0]=4 28118 B14R1.498 CCCC1CCCC1NCCC(C)C 269862a_100000210545_100000723119 [0,1,0,1,0,0|2,0,0]=4 28119 B14R1.498 CCCC1CCCC1NCCC(C)C 270004a_100000210545_100000723119 [0,1,0,1,0,0|2,0,0]=4 28120 B14R1.498 CCCC1CCCC1NCCC(C)O 269862a_200000755665_100000723119 [0,1,0,1,0,0|1,0,0]=3 28121 B14R1.498 CCCC1CCCC1NCCC(C)O 270004a_200000755665_100000723119 [0,1,0,1,0,0|1,0,0]=3 28122 B14R1.498 CCCN1CCCC1COCC(C)O 34a_200000694710_100011218427 [0,1,0,1,0,0|2,0,0]=4 28123 B14R1.498 CCCN1CCCC1COCC(C)O 7a_200000694710_100011218427 [0,1,0,1,0,0|2,0,0]=4 28124 B14R1.498 CCCN1CCCC1COC[C@@H](C)O 34a_200000694710_100009817552 [0,1,0,1,0,0|2,0,0]=4 28125 B14R1.498 CCCN1CCCC1COC[C@@H](C)O 7a_200000694710_100009817552 [0,1,0,1,0,0|2,0,0]=4 28126 B14R1.498 COC[C@@H]1CCCN1CCCC(C)O 2230a_100020646714_200000718107 [0,1,0,1,0,0|2,0,0]=4 28127 B14R1.498 COC[C@@H]1CCCN1CCCC(C)O 269982a_100020646714_200000718107 [0,1,0,1,0,0|2,0,0]=4 28128 B14R1.498 COC[C@@H]1CCCN1CCCC(C)O 34a_100020646714_200000718107 [0,1,0,1,0,0|2,0,0]=4 28129 B14R1.651 CC(C)C1CCCCCN1CCCF 2230a_100000697956_100011934791 [0,1,0,1,0,0|2,0,0]=4 28130 B14R1.651 CC(C)C1CCCCCN1CCCF 269982a_100000697956_100011934791 [0,1,0,1,0,0|2,0,0]=4 28131 B14R1.651 CC(C)C1CCCCCN1CCCF 34a_100000697956_100011934791 [0,1,0,1,0,0|2,0,0]=4 28132 B14R1.651 CC(C)C1CCCCCN1CCCO 2230a_100000697956_100000230001 [0,1,0,1,0,0|1,0,0]=3 28133 B14R1.651 CC(C)C1CCCCCN1CCCO 269982a_100000697956_100011215043 [0,1,0,1,0,0|1,0,0]=3 28134 B14R1.651 CC(C)C1CCCCCN1CCCO 34a_100000697956_100000230001 [0,1,0,1,0,0|1,0,0]=3 28135 B14R1.651 CCCCN1CCCCCC1C(=O)O 269956a_100000758484_100000210211 [0,1,0,1,0,0|1,0,1]=4 28136 B14R1.651 CCCCN1CCCCCC1C(C)C 2230a_100000697956_100000210211 [0,1,0,1,0,0|2,0,0]=4 28137 B14R1.651 CCCCN1CCCCCC1C(C)C 269982a_100000697956_100000210211 [0,1,0,1,0,0|2,0,0]=4 28138 B14R1.651 CCCCN1CCCCCC1C(C)C 34a_100000697956_100000210210 [0,1,0,1,0,0|2,0,0]=4 28139 B14R1.786 C=C(C)CN1CCCCC1CCCO 2230a_100011934581_100000748629 [0,1,0,1,0,0|1,0,1]=4 28140 B14R1.786 C=C(C)CN1CCCCC1CCCO 269982a_100011934581_100000748629 [0,1,0,1,0,0|1,0,1]=4 28141 B14R1.786 C=C(C)CN1CCCCC1CCCO 34a_100011934581_100000748629 [0,1,0,1,0,0|1,0,1]=4 28142 B14R1.786 CC(C)CC1COCCN1CCCO 2230a_100000755734_100000230001 [0,1,0,1,0,0|2,0,0]=4 28143 B14R1.786 CC(C)CC1COCCN1CCCO 269982a_100000755734_100011215043 [0,1,0,1,0,0|2,0,0]=4 28144 B14R1.786 CC(C)CC1COCCN1CCCO 34a_100000755734_100000230001 [0,1,0,1,0,0|2,0,0]=4 28145 B14R1.786 CC(C)CN1CCCCC1CCCO 2230a_100011934581_100000210760 [0,1,0,1,0,0|1,0,0]=3 28146 B14R1.786 CC(C)CN1CCCCC1CCCO 269982a_100011934581_100000210624 [0,1,0,1,0,0|1,0,0]=3 28147 B14R1.786 CC(C)CN1CCCCC1CCCO 270004a_100011934581_100000210432 [0,1,0,1,0,0|1,0,0]=3 28148 B14R1.786 CC(C)CN1CCCCC1CCCO 34a_100011934581_100000210624 [0,1,0,1,0,0|1,0,0]=3 28149 B14R1.786 CC(C)NC1CCCCC1OCCO 34a_100000692356_100000211926 [0,1,0,1,0,0|2,0,0]=4 28150 B14R1.786 CC(O)CN1CCCCC1CCCO 2230a_100011934581_100011218427 [0,1,0,1,0,0|1,0,0]=3 28151 B14R1.786 CC(O)CN1CCCCC1CCCO 269982a_100011934581_100011218427 [0,1,0,1,0,0|1,0,0]=3 28152 B14R1.786 CC(O)CN1CCCCC1CCCO 34a_100011934581_100011218427 [0,1,0,1,0,0|1,0,0]=3 28153 B14R1.786 CN(C)CC1CCCCN1CCCO 2230a_100000746231_100000230001 [0,1,0,1,0,0|2,0,0]=4 28154 B14R1.786 CN(C)CC1CCCCN1CCCO 269982a_100000746231_100011215043 [0,1,0,1,0,0|2,0,0]=4 28155 B14R1.786 COCCC1CCCCN1CC(C)O 2230a_100015186528_100011218427 [0,1,0,1,0,0|2,0,0]=4 28156 B14R1.786 COCCC1CCCCN1CC(C)O 269982a_100015186528_100011218427 [0,1,0,1,0,0|2,0,0]=4 28157 B14R1.786 COCCC1CCCCN1CC(C)O 34a_100015186528_100011218427 [0,1,0,1,0,0|2,0,0]=4 28158 B14R1.786 COCCC1CCCCN1C[C@@H](C)O 2230a_100015186528_100009817552 [0,1,0,1,0,0|2,0,0]=4 28159 B14R1.786 COCCC1CCCCN1C[C@@H](C)O 269982a_100015186528_100009817552 [0,1,0,1,0,0|2,0,0]=4 28160 B14R1.786 COCCC1CCCCN1C[C@@H](C)O 34a_100015186528_100009817552 [0,1,0,1,0,0|2,0,0]=4 28161 B14R1.786 C[C@@H](O)CN1CCCCC1CCCO 2230a_100011934581_100009817552 [0,1,0,1,0,0|1,0,0]=3 28162 B14R1.786 C[C@@H](O)CN1CCCCC1CCCO 269982a_100011934581_100009817552 [0,1,0,1,0,0|1,0,0]=3 28163 B14R1.786 C[C@@H](O)CN1CCCCC1CCCO 34a_100011934581_100009817552 [0,1,0,1,0,0|1,0,0]=3 28164 B14R1.786 OCCCC1CCCCN1CC(F)F 2230a_100011934581_100011934356 [0,1,0,1,0,0|2,0,0]=4 28165 B14R1.786 OCCCC1CCCCN1CC(F)F 269982a_100011934581_100011934356 [0,1,0,1,0,0|2,0,0]=4 28166 B14R1.786 OCCCC1CCCCN1CC(F)F 34a_100011934581_100011934356 [0,1,0,1,0,0|2,0,0]=4 28167 B14R1.799 CCCCC1CCCC1NCC(C)C 269862a_100000210953_100000750825 [0,1,0,1,0,0|2,0,0]=4 28168 B14R1.799 CCCCC1CCCC1NCC(C)C 270004a_100000210953_100000750825 [0,1,0,1,0,0|2,0,0]=4 28169 B14R1.799 CCCCC1CCCC1NCC(C)O 269862a_100000210904_100000750825 [0,1,0,1,0,0|1,0,0]=3 28170 B14R1.799 CCCCC1CCCC1NCC(C)O 270004a_100000210904_100000750825 [0,1,0,1,0,0|1,0,0]=3 28171 B14R1.799 CCCCC1CCCC1NCC(F)F 270004a_100000765723_100000750825 [0,1,0,1,0,0|2,0,0]=4 28172 B14R1.890 C#CCCCCCCOCC1CC1C 34a_100000744939_100012276617 [0,1,0,1,0,0|1,0,1]=4 28173 B14R1.890 C#CCCCCCCOCC1CC1C 7a_100000744939_100012276617 [0,1,0,1,0,0|1,0,1]=4 28174 B14R1.890 C=CCCCCCCOCC1CC1C 34a_100000744939_100011215473 [0,1,0,1,0,0|1,0,1]=4 28175 B14R1.890 C=CCCCCCCOCC1CC1C 7a_100000744939_100011215473 [0,1,0,1,0,0|1,0,1]=4 28176 B14R1.890 CC1CC1COCCCCCCC#N 7a_100000744939_100009813337 [0,1,0,1,0,0|1,0,1]=4 28177 B14R1.890 CC1CC1COCCCCCCCO 34a_100000744939_100000760002 [0,1,0,1,0,0|0,0,0]=2 28178 B14R1.890 CC1CC1COCCCCCCCO 7a_100000744939_100000760002 [0,1,0,1,0,0|0,0,0]=2 28179 B14R1.890 CCCCCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100011214924 [0,1,0,1,0,0|1,0,0]=3 28180 B14R1.890 CCCCCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100011214924 [0,1,0,1,0,0|1,0,0]=3 28181 B14R1.890 CCCCCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100011214924 [0,1,0,1,0,0|1,0,0]=3 28182 B14R1.890 CCCCCCCCOCC1CC1C 34a_100000744939_100000210759 [0,1,0,1,0,0|1,0,0]=3 28183 B14R1.890 CCCCCCCCOCC1CC1C 7a_100000744939_100000210759 [0,1,0,1,0,0|1,0,0]=3 28184 B14R1.890 COCCCCCCOCC1CC1C 34a_100000744939_100011998445 [0,1,0,1,0,0|1,0,0]=3 28185 B14R1.890 COCCCCCCOCC1CC1C 7a_100000744939_100011998445 [0,1,0,1,0,0|1,0,0]=3 28186 B14R1.890 COCCOCCCOCC1CC1C 34a_100000744939_100011216529 [0,1,0,1,0,0|2,0,0]=4 28187 B14R1.890 COCCOCCCOCC1CC1C 7a_100000744939_100011216529 [0,1,0,1,0,0|2,0,0]=4 28188 B14R1.890 OCCCCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100000033203 [0,1,0,1,0,0|1,0,0]=3 28189 B14R1.890 OCCCCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100000033203 [0,1,0,1,0,0|1,0,0]=3 28190 B14R1.890 OCCCCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100000033203 [0,1,0,1,0,0|1,0,0]=3 28191 B14R1.903 CC(C)C1CCCCC1OCCCF 34a_100011709184_100011934791 [0,1,0,1,0,0|2,0,0]=4 28192 B14R1.903 CC(C)C1CCCCC1OCCCF 7a_100011709184_100011934791 [0,1,0,1,0,0|2,0,0]=4 28193 B14R1.903 CC(C)C1CCCCC1OCCCO 34a_100011709184_100000230001 [0,1,0,1,0,0|1,0,0]=3 28194 B14R1.903 CC(C)C1CCCCC1OCCCO 7a_100011709184_100011215043 [0,1,0,1,0,0|1,0,0]=3 28195 B14R1.903 CC(C)C1CCCCN1CCCCF 2230a_100000757267_100000729493 [0,1,0,1,0,0|2,0,0]=4 28196 B14R1.903 CC(C)C1CCCCN1CCCCF 269982a_100000757267_100000729493 [0,1,0,1,0,0|2,0,0]=4 28197 B14R1.903 CC(C)C1CCCCN1CCCCF 34a_100000757267_100000729493 [0,1,0,1,0,0|2,0,0]=4 28198 B14R1.903 CC(C)C1CCCCN1CCCCO 2230a_100000757267_100000210776 [0,1,0,1,0,0|1,0,0]=3 28199 B14R1.903 CC(C)C1CCCCN1CCCCO 269982a_100000757267_100000210776 [0,1,0,1,0,0|1,0,0]=3 28200 B14R1.903 CC(C)C1CCCCN1CCCCO 34a_100000757267_100011216708 [0,1,0,1,0,0|1,0,0]=3 28201 B14R1.903 CC(C)[C@H]1COCCN1CCCCO 2230a_100025712635_100000210776 [0,1,0,1,0,0|2,0,0]=4 28202 B14R1.903 CC(C)[C@H]1COCCN1CCCCO 269982a_100025712635_100000210776 [0,1,0,1,0,0|2,0,0]=4 28203 B14R1.903 CC(C)[C@H]1COCCN1CCCCO 34a_100025712635_100011216708 [0,1,0,1,0,0|2,0,0]=4 28204 B14R1.903 CCCCCN1CCCCC1C(C)C 2230a_100000757267_100000210326 [0,1,0,1,0,0|2,0,0]=4 28205 B14R1.903 CCCCCN1CCCCC1C(C)C 269982a_100000757267_100000210215 [0,1,0,1,0,0|2,0,0]=4 28206 B14R1.903 CCCCCN1CCCCC1C(C)C 34a_100000757267_100000718602 [0,1,0,1,0,0|2,0,0]=4 28207 B14R1.903 CCCCCN1CCCC[C@@H]1C(=O)O 269956a_100000763471_100000210326 [0,1,0,1,0,0|1,0,1]=4 28208 B14R1.903 CCCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100000210211 [0,1,0,1,0,0|1,0,1]=4 28209 B14R1.903 CCCCOC1CCCCC1C(C)C 34a_100011709184_100000210210 [0,1,0,1,0,0|2,0,0]=4 28210 B14R1.903 CCCCOC1CCCCC1C(C)C 7a_100011709184_100000210211 [0,1,0,1,0,0|2,0,0]=4 28211 B14R1.910 CC(C)CC1CCCN1CCCCF 2230a_100000748429_100000729493 [0,1,0,1,0,0|2,0,0]=4 28212 B14R1.910 CC(C)CC1CCCN1CCCCF 269982a_100000748429_100000729493 [0,1,0,1,0,0|2,0,0]=4 28213 B14R1.910 CC(C)CC1CCCN1CCCCF 34a_100000748429_100000729493 [0,1,0,1,0,0|2,0,0]=4 28214 B14R1.910 CC(C)CC1CCCN1CCCCO 2230a_100000748429_100000210776 [0,1,0,1,0,0|1,0,0]=3 28215 B14R1.910 CC(C)CC1CCCN1CCCCO 269982a_100000748429_100000210776 [0,1,0,1,0,0|1,0,0]=3 28216 B14R1.910 CC(C)CC1CCCN1CCCCO 34a_100000748429_100011216708 [0,1,0,1,0,0|1,0,0]=3 28217 B14R1.910 CCCCCN1CCCC1CC(C)C 2230a_100000748429_100000210326 [0,1,0,1,0,0|2,0,0]=4 28218 B14R1.910 CCCCCN1CCCC1CC(C)C 269982a_100000748429_100000210215 [0,1,0,1,0,0|2,0,0]=4 28219 B14R1.910 CCCCCN1CCCC1CC(C)C 34a_100000748429_100000718602 [0,1,0,1,0,0|2,0,0]=4 28220 B14R1.910 CN(C)C[C@H]1CCCN1CCCCO 269982a_200020645772_100000210776 [0,1,0,1,0,0|2,0,0]=4 28221 B14R1.1252 CCCCCCN1CCCCC(C1)O 2230a_100025706797_100000210314 [0,1,0,1,0,0|1,0,0]=3 28222 B14R1.1252 CCCCCCN1CCCCC(C1)O 269982a_100025706797_100000210757 [0,1,0,1,0,0|1,0,0]=3 28223 B14R1.1252 CCCCCCN1CCOC[C@@H](C1)O 2230a_100016073750_100000210314 [0,1,0,1,0,0|2,0,0]=4 28224 B14R1.1252 CCCCCCN1CCOC[C@@H](C1)O 269982a_100016073750_100000210757 [0,1,0,1,0,0|2,0,0]=4 28225 B14R1.1252 CCCCOCN1CCCCC(C1)O 2230a_100025706797_100011995733 [0,1,0,1,0,0|2,0,0]=4 28226 B14R1.1252 CCCCOCN1CCCCC(C1)O 269982a_100025706797_100011995733 [0,1,0,1,0,0|2,0,0]=4 28227 B14R1.1252 CCCOCCN1CCCCC(C1)O 2230a_100025706797_100011215938 [0,1,0,1,0,0|2,0,0]=4 28228 B14R1.1252 CCCOCCN1CCCCC(C1)O 269982a_100025706797_100011215938 [0,1,0,1,0,0|2,0,0]=4 28229 B14R1.1252 CCOCCCN1CCCCC(C1)O 2230a_100025706797_100012232248 [0,1,0,1,0,0|2,0,0]=4 28230 B14R1.1252 CCOCCCN1CCCCC(C1)O 269982a_100025706797_100012232248 [0,1,0,1,0,0|2,0,0]=4 28231 B14R1.1252 COCCCCN1CCCCC(C1)O 2230a_100025706797_100000730899 [0,1,0,1,0,0|2,0,0]=4 28232 B14R1.1252 COCCCCN1CCCCC(C1)O 269982a_100025706797_100000730899 [0,1,0,1,0,0|2,0,0]=4 28233 B14R1.1252 OC1CCCCN(C1)CCCCCF 2230a_100025706797_100000729378 [0,1,0,1,0,0|2,0,0]=4 28234 B14R1.1252 OC1CCCCN(C1)CCCCCF 269982a_100025706797_100000729378 [0,1,0,1,0,0|2,0,0]=4 28235 B14R1.1252 OCCCCCN1CCCCC(C1)O 2230a_100025706797_100000746330 [0,1,0,1,0,0|1,0,0]=3 28236 B14R1.1252 OCCCCCN1CCCCC(C1)O 269982a_100025706797_100000746330 [0,1,0,1,0,0|1,0,0]=3 28237 B14R1.1252 OCCCCCN1CCOC[C@@H](C1)O 2230a_100016073750_100000746330 [0,1,0,1,0,0|2,0,0]=4 28238 B14R1.1252 OCCCCCN1CCOC[C@@H](C1)O 269982a_100016073750_100000746330 [0,1,0,1,0,0|2,0,0]=4 28239 B14R1.1252 OCCOCCN1CCCCC(C1)O 2230a_100025706797_100011215305 [0,1,0,1,0,0|2,0,0]=4 28240 B14R1.1252 OCCOCCN1CCCCC(C1)O 269982a_100025706797_100011215305 [0,1,0,1,0,0|2,0,0]=4 28241 B14R1.1275 CC1(CC1COCCCCCCF)C 34a_100000728257_100015922095 [0,1,0,1,0,0|2,0,0]=4 28242 B14R1.1275 CC1(CC1COCCCCCCF)C 7a_100000728257_100015922095 [0,1,0,1,0,0|2,0,0]=4 28243 B14R1.1275 CC1(CC1COCCCCCCO)C 34a_100000728257_100000766143 [0,1,0,1,0,0|1,0,0]=3 28244 B14R1.1275 CC1(CC1COCCCCCCO)C 7a_100000728257_100000766143 [0,1,0,1,0,0|1,0,0]=3 28245 B14R1.1275 CC1(OC1COCCCCCCO)C 34a_200010283642_100000766143 [0,1,0,1,0,0|2,0,0]=4 28246 B14R1.1275 CC1(OC1COCCCCCCO)C 7a_200010283642_100000766143 [0,1,0,1,0,0|2,0,0]=4 28247 B14R1.1275 CCCCCCCCNC1CC1(F)F 2230a_100020610826_100000210759 [0,1,0,1,0,0|2,0,0]=4 28248 B14R1.1275 CCCCCCCCNC1CC1(F)F 34a_100020610826_100000210759 [0,1,0,1,0,0|2,0,0]=4 28249 B14R1.1275 CCCCCCCNCC1CC1(F)F 2230a_100000229938_100009817841 [0,1,0,1,0,0|2,0,0]=4 28250 B14R1.1275 CCCCCCCOCC1CC1(C)C 34a_100000728257_100000210614 [0,1,0,1,0,0|2,0,0]=4 28251 B14R1.1275 CCCCCCCOCC1CC1(C)C 7a_100000728257_100000210614 [0,1,0,1,0,0|2,0,0]=4 28252 B14R1.1275 CCCCCCCOCC1CC1(F)F 34a_100000056500_100000210614 [0,1,0,1,0,0|2,0,0]=4 28253 B14R1.1275 CCCCCCCOCC1CC1(F)F 34a_100000210272_100009817841 [0,1,0,1,0,0|2,0,0]=4 28254 B14R1.1275 CCCCCCCOCC1CC1(F)F 7a_100000056500_100000210614 [0,1,0,1,0,0|2,0,0]=4 28255 B14R1.1275 CCCCCCCOCC1CC1(F)F 7a_100000210272_100009817841 [0,1,0,1,0,0|2,0,0]=4 28256 B14R1.1275 CCCCCCCSCC1CC1(F)F 62a_100000210614_100009817841 [0,1,0,1,0,0|2,0,0]=4 28257 B14R1.1275 CCCCCCCSCC1CC1(F)F 62a_100009817841_100000210316 [0,1,0,1,0,0|2,0,0]=4 28258 B14R1.1275 CCCCCCOCCC1CC1(F)F 34a_100009864177_100000210314 [0,1,0,1,0,0|2,0,0]=4 28259 B14R1.1275 CCCCCCOCCC1CC1(F)F 7a_100009864177_100000210314 [0,1,0,1,0,0|2,0,0]=4 28260 B14R1.1275 OCCCCCCCNC1CC1(F)F 2230a_100020610826_100000760002 [0,1,0,1,0,0|2,0,0]=4 28261 B14R1.1275 OCCCCCCCNC1CC1(F)F 34a_100020610826_100000760002 [0,1,0,1,0,0|2,0,0]=4 28262 B14R1.1275 OCCCCCCNCC1CC1(F)F 2230a_100000686447_100009817841 [0,1,0,1,0,0|2,0,0]=4 28263 B14R1.1275 OCCCCCCNCC1CC1(F)F 34a_100000686447_100009817841 [0,1,0,1,0,0|2,0,0]=4 28264 B14R1.1275 OCCCCCCOCC1CC1(F)F 34a_100000056500_100000766143 [0,1,0,1,0,0|2,0,0]=4 28265 B14R1.1275 OCCCCCCOCC1CC1(F)F 7a_100000056500_100000766143 [0,1,0,1,0,0|2,0,0]=4 28266 B14R1.1275 OCCCCCCSCC1CC1(F)F 62a_100000766143_100009817841 [0,1,0,1,0,0|2,0,0]=4 28267 B14R1.1275 OCCCCCCSCC1CC1(F)F 62a_100009817841_100000766143 [0,1,0,1,0,0|2,0,0]=4 28268 B14R1.1275 OCCCCCOCCC1CC1(F)F 34a_100009864177_100000746330 [0,1,0,1,0,0|2,0,0]=4 28269 B14R1.1275 OCCCCCOCCC1CC1(F)F 7a_100009864177_100000746330 [0,1,0,1,0,0|2,0,0]=4 28270 B14R1.1454 CC(C)CCCN1CCCCCCC1 2230a_100000211400_100011214892 [0,1,0,1,0,0|2,0,0]=4 28271 B14R1.1454 CC(C)CCCN1CCCCCCC1 269982a_100000211400_100011214892 [0,1,0,1,0,0|2,0,0]=4 28272 B14R1.1454 CC(C)CCCN1CCCCCCC1 34a_100000211400_100011214892 [0,1,0,1,0,0|2,0,0]=4 28273 B14R1.1454 CC(C)CCNC1CCCCCCC1 2230a_100000211152_100000210312 [0,1,0,1,0,0|2,0,0]=4 28274 B14R1.1454 CC(C)CCNC1CCCCCCC1 269862a_100000211152_100000185833 [0,1,0,1,0,0|2,0,0]=4 28275 B14R1.1454 CC(C)CCNC1CCCCCCC1 270004a_100000210545_100000210524 [0,1,0,1,0,0|2,0,0]=4 28276 B14R1.1454 CC(C)CCNC1CCCCCCC1 34a_100000211152_100000210312 [0,1,0,1,0,0|2,0,0]=4 28277 B14R1.1454 CC(C)CCOC1CCCCCCC1 34a_100000210054_100000210312 [0,1,0,1,0,0|2,0,0]=4 28278 B14R1.1454 CC(C)CCOC1CCCCCCC1 7a_100000210054_100000210626 [0,1,0,1,0,0|2,0,0]=4 28279 B14R1.1454 CC(C)COCC1CCCCCCC1 34a_100011216312_100000210624 [0,1,0,1,0,0|2,0,0]=4 28280 B14R1.1454 CC(C)COCC1CCCCCCC1 7a_100011216312_100000210760 [0,1,0,1,0,0|2,0,0]=4 28281 B14R1.1454 CC(C)NCCC1CCCCCCC1 2230a_100011532352_100000210206 [0,1,0,1,0,0|2,0,0]=4 28282 B14R1.1454 CC(C)NCCC1CCCCCCC1 34a_100011532352_100000210206 [0,1,0,1,0,0|2,0,0]=4 28283 B14R1.1454 CC(O)CCCN1CCCCCCC1 2230a_100000211400_200000718107 [0,1,0,1,0,0|1,0,0]=3 28284 B14R1.1454 CC(O)CCCN1CCCCCCC1 269982a_100000211400_200000718107 [0,1,0,1,0,0|1,0,0]=3 28285 B14R1.1454 CC(O)CCCN1CCCCCCC1 34a_100000211400_200000718107 [0,1,0,1,0,0|1,0,0]=3 28286 B14R1.1454 CC(O)CCNC1CCCCCCC1 2230a_100000211152_100012276601 [0,1,0,1,0,0|1,0,0]=3 28287 B14R1.1454 CC(O)CCNC1CCCCCCC1 270004a_200000755665_100000210524 [0,1,0,1,0,0|1,0,0]=3 28288 B14R1.1454 CC(O)CCNC1CCCCCCC1 34a_100000211152_100012276601 [0,1,0,1,0,0|1,0,0]=3 28289 B14R1.1454 CC(O)CCOC1CCCCCCC1 34a_100000210054_100012276601 [0,1,0,1,0,0|1,0,0]=3 28290 B14R1.1454 CC(O)CCOC1CCCCCCC1 7a_100000210054_100012276601 [0,1,0,1,0,0|1,0,0]=3 28291 B14R1.1454 CC(O)COCC1CCCCCCC1 34a_100011216312_100011218427 [0,1,0,1,0,0|1,0,0]=3 28292 B14R1.1454 CC(O)COCC1CCCCCCC1 7a_100011216312_100011218427 [0,1,0,1,0,0|1,0,0]=3 28293 B14R1.1454 C[C@@H](O)COCC1CCCCCCC1 34a_100011216312_100009817552 [0,1,0,1,0,0|1,0,0]=3 28294 B14R1.1454 C[C@@H](O)COCC1CCCCCCC1 7a_100011216312_100009817552 [0,1,0,1,0,0|1,0,0]=3 28295 B14R1.1454 FC(F)COCC1CCCCCCC1 34a_100011216312_100011934356 [0,1,0,1,0,0|2,0,0]=4 28296 B14R1.1454 FC(F)COCC1CCCCCCC1 7a_100011216312_100011934356 [0,1,0,1,0,0|2,0,0]=4 28297 B14R1.3129 CC1(CCCC1NCCCCCO)C 269862a_100000762737_100000065263 [0,1,0,1,0,0|1,0,0]=3 28298 B14R1.3129 CC1(CCCC1NCCOCCO)C 269862a_100000211614_100000065263 [0,1,0,1,0,0|2,0,0]=4 28299 B14R1.3129 CC1(CCCC1NCCSCCO)C 269862a_100011219999_100000065263 [0,1,0,1,0,0|2,0,0]=4 28300 B14R1.3129 CC1(CCCC1OCCCCCF)C 34a_100000726220_100000729378 [0,1,0,1,0,0|2,0,0]=4 28301 B14R1.3129 CC1(CCCC1OCCCCCF)C 7a_100000726220_100000729378 [0,1,0,1,0,0|2,0,0]=4 28302 B14R1.3129 CC1(CCCC1OCCCCCO)C 34a_100000726220_100000746330 [0,1,0,1,0,0|1,0,0]=3 28303 B14R1.3129 CC1(CCCC1OCCCCCO)C 7a_100000726220_100000746330 [0,1,0,1,0,0|1,0,0]=3 28304 B14R1.3129 CC1(CCCC1OCCOCCO)C 34a_100000726220_100000692535 [0,1,0,1,0,0|2,0,0]=4 28305 B14R1.3129 CC1(CCCC1OCCOCCO)C 7a_100000726220_100011215305 [0,1,0,1,0,0|2,0,0]=4 28306 B14R1.3129 CC1(CCCN1CCCCCCF)C 2230a_100000761399_100015922095 [0,1,0,1,0,0|2,0,0]=4 28307 B14R1.3129 CC1(CCCN1CCCCCCF)C 269982a_100000761399_100015922095 [0,1,0,1,0,0|2,0,0]=4 28308 B14R1.3129 CC1(CCCN1CCCCCCF)C 34a_100000761399_100015922095 [0,1,0,1,0,0|2,0,0]=4 28309 B14R1.3129 CC1(CCCN1CCCCCCO)C 2230a_100000761399_100000766143 [0,1,0,1,0,0|1,0,0]=3 28310 B14R1.3129 CC1(CCCN1CCCCCCO)C 269982a_100000761399_100000766143 [0,1,0,1,0,0|1,0,0]=3 28311 B14R1.3129 CC1(CCCN1CCCCCCO)C 34a_100000761399_100000766143 [0,1,0,1,0,0|1,0,0]=3 28312 B14R1.3129 CC1(CCCN1CCNCCCO)C 2230a_100015204988_100000230001 [0,1,0,1,0,0|2,0,0]=4 28313 B14R1.3129 CC1(COCN1CCCCCCO)C 2230a_100000043020_100000766143 [0,1,0,1,0,0|2,0,0]=4 28314 B14R1.3129 CC1(COCN1CCCCCCO)C 269982a_100000043020_100000766143 [0,1,0,1,0,0|2,0,0]=4 28315 B14R1.3129 CC1(SCCN1CCCCCCO)C 2230a_100011217261_100000766143 [0,1,0,1,0,0|2,0,0]=4 28316 B14R1.3129 CC1(SCCN1CCCCCCO)C 269982a_100011217261_100000766143 [0,1,0,1,0,0|2,0,0]=4 28317 B14R1.3129 CC1(SCCN1CCCCCCO)C 34a_100011217261_100000766143 [0,1,0,1,0,0|2,0,0]=4 28318 B14R1.3129 CCCCCCCN1CCCC1(C)C 2230a_100000761399_100000210681 [0,1,0,1,0,0|2,0,0]=4 28319 B14R1.3129 CCCCCCCN1CCCC1(C)C 269982a_100000761399_100000210681 [0,1,0,1,0,0|2,0,0]=4 28320 B14R1.3129 CCCCCCCN1CCCC1(C)C 34a_100000761399_100000210614 [0,1,0,1,0,0|2,0,0]=4 28321 B14R1.3129 CCCCCCNC1CCCC1(C)C 269862a_100000210581_100000065263 [0,1,0,1,0,0|2,0,0]=4 28322 B14R1.3129 CCCCCCNC1CCCC1(F)F 2230a_100000767123_100000210314 [0,1,0,1,0,0|2,0,0]=4 28323 B14R1.3129 CCCCCCNC1CCCC1(F)F 34a_100000767123_100000210314 [0,1,0,1,0,0|2,0,0]=4 28324 B14R1.3129 CCCCCCN[C@@H]1CCC[C@@]1(C)O 2230a_100015977457_100000210314 [0,1,0,1,0,0|1,0,0]=3 28325 B14R1.3129 CCCCCCN[C@@H]1CCC[C@@]1(C)O 34a_100015977457_100000210314 [0,1,0,1,0,0|1,0,0]=3 28326 B14R1.3129 CCCCCCOC1CCCC1(C)C 34a_100000726220_100000210314 [0,1,0,1,0,0|2,0,0]=4 28327 B14R1.3129 CCCCCCOC1CCCC1(C)C 7a_100000726220_100000210314 [0,1,0,1,0,0|2,0,0]=4 28328 B14R1.3129 CCCCCCOC1CCCC1(F)F 34a_100000210259_100119073726 [0,1,0,1,0,0|2,0,0]=4 28329 B14R1.3129 CCCCCCSC1CCCC1(F)F 62a_100000210314_100119073726 [0,1,0,1,0,0|2,0,0]=4 28330 B14R1.3129 CCCCCCSC1CCCC1(F)F 62a_100119073726_100000210757 [0,1,0,1,0,0|2,0,0]=4 28331 B14R1.3129 CCCCOCN[C@@H]1CCC[C@@]1(C)O 2230a_100015977457_100011995733 [0,1,0,1,0,0|2,0,0]=4 28332 B14R1.3129 CCCCOCN[C@@H]1CCC[C@@]1(C)O 34a_100015977457_100011995733 [0,1,0,1,0,0|2,0,0]=4 28333 B14R1.3129 CCCOCCN[C@@H]1CCC[C@@]1(C)O 2230a_100015977457_100011215938 [0,1,0,1,0,0|2,0,0]=4 28334 B14R1.3129 CCCOCCN[C@@H]1CCC[C@@]1(C)O 34a_100015977457_100011215938 [0,1,0,1,0,0|2,0,0]=4 28335 B14R1.3129 CCOCCCN[C@@H]1CCC[C@@]1(C)O 2230a_100015977457_100012232248 [0,1,0,1,0,0|2,0,0]=4 28336 B14R1.3129 CCOCCCN[C@@H]1CCC[C@@]1(C)O 34a_100015977457_100012232248 [0,1,0,1,0,0|2,0,0]=4 28337 B14R1.3129 COCCCCN[C@@H]1CCC[C@@]1(C)O 2230a_100015977457_100000730899 [0,1,0,1,0,0|2,0,0]=4 28338 B14R1.3129 COCCCCN[C@@H]1CCC[C@@]1(C)O 34a_100015977457_100000755781 [0,1,0,1,0,0|2,0,0]=4 28339 B14R1.3129 C[C@]1(CCC[C@H]1NCCCCCF)O 2230a_100015977457_100000729378 [0,1,0,1,0,0|2,0,0]=4 28340 B14R1.3129 C[C@]1(CCC[C@H]1NCCCCCF)O 34a_100015977457_100000729378 [0,1,0,1,0,0|2,0,0]=4 28341 B14R1.3129 C[C@]1(CCC[C@H]1NCCCCCO)O 2230a_100015977457_100000746330 [0,1,0,1,0,0|1,0,0]=3 28342 B14R1.3129 C[C@]1(CCC[C@H]1NCCCCCO)O 34a_100015977457_100000746330 [0,1,0,1,0,0|1,0,0]=3 28343 B14R1.3129 C[C@]1(CCC[C@H]1NCCOCCO)O 2230a_100015977457_100011215305 [0,1,0,1,0,0|2,0,0]=4 28344 B14R1.3129 C[C@]1(CCC[C@H]1NCCOCCO)O 34a_100015977457_100000692535 [0,1,0,1,0,0|2,0,0]=4 28345 B14R1.3129 OCCCCCNC1CCCC1(F)F 2230a_100000767123_100000746330 [0,1,0,1,0,0|2,0,0]=4 28346 B14R1.3129 OCCCCCNC1CCCC1(F)F 34a_100000762737_100119073726 [0,1,0,1,0,0|2,0,0]=4 28347 B14R1.3129 OCCCCCNC1CCCC1(F)F 34a_100000767123_100000746330 [0,1,0,1,0,0|2,0,0]=4 28348 B14R1.3129 OCCCCCSC1CCCC1(F)F 62a_100000746330_100119073726 [0,1,0,1,0,0|2,0,0]=4 28349 B14R1.3129 OCCCCCSC1CCCC1(F)F 62a_100119073726_100000746330 [0,1,0,1,0,0|2,0,0]=4 28350 B14R1.3447 CCCCCCCN1CCC1C(=O)O 269956a_100000021838_100000210614 [0,1,0,1,0,0|1,0,1]=4 28351 B14R1.4521 CC(C)CCCCCCNC1CCC1 270004a_100000211014_100000241760 [0,1,0,1,0,0|2,0,0]=4 28352 B14R1.4521 CC(C)CCCCCCNC1CCC1 34a_100000211014_100000749161 [0,1,0,1,0,0|2,0,0]=4 28353 B14R1.4521 CC(C)CCCCCNCC1CCC1 2230a_100000738700_100000210682 [0,1,0,1,0,0|2,0,0]=4 28354 B14R1.4521 CC(C)CCCCCNCC1CCC1 2230a_100011290863_100000763275 [0,1,0,1,0,0|2,0,0]=4 28355 B14R1.4521 CC(C)CCCCCNCC1CCC1 269862a_100011290863_100000753134 [0,1,0,1,0,0|2,0,0]=4 28356 B14R1.4521 CC(C)CCCCCNCC1CCC1 34a_100000738700_100000210682 [0,1,0,1,0,0|2,0,0]=4 28357 B14R1.4521 CC(C)CCCCCNCC1CCC1 34a_100011290863_100000763275 [0,1,0,1,0,0|2,0,0]=4 28358 B14R1.4521 CC(C)CCCCCNCC1CCO1 2230a_100011290863_100000103362 [0,1,0,1,0,0|1,0,0]=3 28359 B14R1.4521 CC(C)CCCCCNCC1CCO1 34a_100011290863_100000103362 [0,1,0,1,0,0|1,0,0]=3 28360 B14R1.4521 CC(C)CCCCCNC[C@@H]1CCO1 2230a_100020831831_100000210682 [0,1,0,1,0,0|1,0,0]=3 28361 B14R1.4521 CC(C)CCCCCNC[C@@H]1CCO1 34a_100020831831_100000210682 [0,1,0,1,0,0|1,0,0]=3 28362 B14R1.4521 CC(C)CCCCCOCC1CCC1 34a_100000760304_100000210682 [0,1,0,1,0,0|2,0,0]=4 28363 B14R1.4521 CC(C)CCCCCOCC1CCC1 34a_100011995859_100000763275 [0,1,0,1,0,0|2,0,0]=4 28364 B14R1.4521 CC(C)CCCCCOCC1CCC1 7a_100011995859_100000763275 [0,1,0,1,0,0|2,0,0]=4 28365 B14R1.4521 CC(C)CCCCCOCC1CCO1 34a_100000039022_100000210682 [0,1,0,1,0,0|1,0,0]=3 28366 B14R1.4521 CC(C)CCCCCOCC1CCO1 34a_100011995859_100000103362 [0,1,0,1,0,0|1,0,0]=3 28367 B14R1.4521 CC(C)CCCCCOCC1CCO1 7a_100011995859_100000103362 [0,1,0,1,0,0|1,0,0]=3 28368 B14R1.4521 CC(C)CCCCCSCC1CCC1 62a_100000210682_100000763275 [0,1,0,1,0,0|2,0,0]=4 28369 B14R1.4521 CC(C)CCCCCSCC1CCC1 62a_100000763275_100000210682 [0,1,0,1,0,0|2,0,0]=4 28370 B14R1.4521 CC(C)CCCCCSCC1CCO1 62a_100000103362_100000210682 [0,1,0,1,0,0|1,0,0]=3 28371 B14R1.4521 CC(C)CCCCCSCC1CCO1 62a_100000210682_100000103362 [0,1,0,1,0,0|1,0,0]=3 28372 B14R1.4521 CC(C)COCCCNCC1CCO1 2230a_100000205972_100000103362 [0,1,0,1,0,0|2,0,0]=4 28373 B14R1.4521 CC(C)COCCCNCC1CCO1 34a_100000205972_100000103362 [0,1,0,1,0,0|2,0,0]=4 28374 B14R1.4521 CC(C)NCCCCOCC1CCO1 34a_100011521146_100000103362 [0,1,0,1,0,0|2,0,0]=4 28375 B14R1.4521 OB(O)CCCCCCNC1CCC1 2230a_100000749019_100009817187 [0,1,0,1,0,0|2,0,0]=4 28376 B14R1.4521 OB(O)CCCCCCNC1CCC1 34a_100000749019_100009817187 [0,1,0,1,0,0|2,0,0]=4 28377 B14R1.4521 OB(O)CCCCCCOC1CCC1 34a_100000748187_100009817187 [0,1,0,1,0,0|2,0,0]=4 28378 B14R1.4521 OB(O)CCCCCCSC1CCC1 62a_100009817187_100000749161 [0,1,0,1,0,0|2,0,0]=4 28379 B14R1.4521 OB(O)CCCCCNCC1CCC1 2230a_100000738700_200009817188 [0,1,0,1,0,0|2,0,0]=4 28380 B14R1.4521 OB(O)CCCCCNCC1CCC1 34a_100000738700_200009817188 [0,1,0,1,0,0|2,0,0]=4 28381 B14R1.4521 OB(O)CCCCCOCC1CCC1 34a_100000760304_200009817188 [0,1,0,1,0,0|2,0,0]=4 28382 B14R1.4521 OB(O)CCCCCSCC1CCC1 62a_100000763275_200009817188 [0,1,0,1,0,0|2,0,0]=4 28383 B14R1.4521 OB(O)CCCCCSCC1CCC1 62a_200009817188_100000763275 [0,1,0,1,0,0|2,0,0]=4 28384 B14R1.5254 CCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000210202 [0,1,0,1,0,0|1,0,1]=4 28385 B14R1.6335 CC(C)CCN1CCCCCCCC1 2230a_100000039187_100000210312 [0,1,0,1,0,0|2,0,0]=4 28386 B14R1.6335 CC(C)CCN1CCCCCCCC1 269982a_100000039187_100000210312 [0,1,0,1,0,0|2,0,0]=4 28387 B14R1.6335 CC(C)CCN1CCCCCCCC1 34a_100000039187_100000210312 [0,1,0,1,0,0|2,0,0]=4 28388 B14R1.6335 CC(C)CNC1CCCCCCCC1 270004a_100000210953_100000038600 [0,1,0,1,0,0|2,0,0]=4 28389 B14R1.6335 CC(O)CCN1CCCCCCCC1 2230a_100000039187_100012276601 [0,1,0,1,0,0|1,0,0]=3 28390 B14R1.6335 CC(O)CCN1CCCCCCCC1 269982a_100000039187_100012276601 [0,1,0,1,0,0|1,0,0]=3 28391 B14R1.6335 CC(O)CCN1CCCCCCCC1 34a_100000039187_100012276601 [0,1,0,1,0,0|1,0,0]=3 28392 B14R1.6335 CC(O)CNC1CCCCCCCC1 270004a_100000210904_100000038600 [0,1,0,1,0,0|1,0,0]=3 28393 B14R1.6335 FC(F)CNC1CCCCCCCC1 270004a_100000765723_100000038600 [0,1,0,1,0,0|2,0,0]=4 28394 B14R1.6343 CC(Br)CCOCC1CCCCCC1 34a_100009893172_200000696569 [0,1,0,1,0,0|2,0,0]=4 28395 B14R1.6343 CC(C)CCCCN1CCCCCC1 2230a_100000185865_100011216152 [0,1,0,1,0,0|2,0,0]=4 28396 B14R1.6343 CC(C)CCCCN1CCCCCC1 269982a_100000185865_100011216152 [0,1,0,1,0,0|2,0,0]=4 28397 B14R1.6343 CC(C)CCCCN1CCCCCC1 34a_100000185865_100011216152 [0,1,0,1,0,0|2,0,0]=4 28398 B14R1.6343 CC(C)CCCNC1CCCCCC1 2230a_100000210984_100011214892 [0,1,0,1,0,0|2,0,0]=4 28399 B14R1.6343 CC(C)CCCNC1CCCCCC1 270004a_200000737386_100000210131 [0,1,0,1,0,0|2,0,0]=4 28400 B14R1.6343 CC(C)CCCNC1CCCCCC1 34a_100000210984_100011214892 [0,1,0,1,0,0|2,0,0]=4 28401 B14R1.6343 CC(C)CCCNC1CCCCCC1 34a_200000737386_100011217769 [0,1,0,1,0,0|2,0,0]=4 28402 B14R1.6343 CC(C)CCCOC1CCCCCC1 34a_100000210774_100011217769 [0,1,0,1,0,0|2,0,0]=4 28403 B14R1.6343 CC(C)CCCOC1CCCCCC1 34a_100000210887_100011214892 [0,1,0,1,0,0|2,0,0]=4 28404 B14R1.6343 CC(C)CCCOC1CCCCCC1 7a_100000210887_100011214892 [0,1,0,1,0,0|2,0,0]=4 28405 B14R1.6343 CC(C)CCCSC1CCCCCC1 62a_100011214892_100011217769 [0,1,0,1,0,0|2,0,0]=4 28406 B14R1.6343 CC(C)CCCSC1CCCCCC1 62a_100011217769_100011214892 [0,1,0,1,0,0|2,0,0]=4 28407 B14R1.6343 CC(C)CCNCC1CCCCCC1 2230a_100015204231_100000210312 [0,1,0,1,0,0|2,0,0]=4 28408 B14R1.6343 CC(C)CCNCC1CCCCCC1 269862a_100000210545_200000763224 [0,1,0,1,0,0|2,0,0]=4 28409 B14R1.6343 CC(C)CCNCC1CCCCCC1 269862a_100015204231_100000185833 [0,1,0,1,0,0|2,0,0]=4 28410 B14R1.6343 CC(C)CCNCC1CCCCCC1 34a_100015204231_100000210312 [0,1,0,1,0,0|2,0,0]=4 28411 B14R1.6343 CC(C)CCOCC1CCCCCC1 34a_100000210254_200000696569 [0,1,0,1,0,0|2,0,0]=4 28412 B14R1.6343 CC(C)CCOCC1CCCCCC1 34a_100000699130_100000210312 [0,1,0,1,0,0|2,0,0]=4 28413 B14R1.6343 CC(C)CCOCC1CCCCCC1 7a_100000210254_200000696569 [0,1,0,1,0,0|2,0,0]=4 28414 B14R1.6343 CC(C)CCOCC1CCCCCC1 7a_100000699130_100000210626 [0,1,0,1,0,0|2,0,0]=4 28415 B14R1.6343 CC(C)CCSCC1CCCCCC1 62a_100000210312_200000696569 [0,1,0,1,0,0|2,0,0]=4 28416 B14R1.6343 CC(C)CCSCC1CCCCCC1 62a_200000696569_100000210312 [0,1,0,1,0,0|2,0,0]=4 28417 B14R1.6343 CC(C)CNCCC1CCCCCC1 2230a_100011532351_100000210760 [0,1,0,1,0,0|2,0,0]=4 28418 B14R1.6343 CC(C)CNCCC1CCCCCC1 270004a_100011532351_100000210432 [0,1,0,1,0,0|2,0,0]=4 28419 B14R1.6343 CC(C)CNCCC1CCCCCC1 34a_100011532351_100000210624 [0,1,0,1,0,0|2,0,0]=4 28420 B14R1.6343 CC(O)CCCNC1CCCCCC1 2230a_100000210984_200000718107 [0,1,0,1,0,0|1,0,0]=3 28421 B14R1.6343 CC(O)CCCNC1CCCCCC1 34a_100000210984_200000718107 [0,1,0,1,0,0|1,0,0]=3 28422 B14R1.6343 CC(O)CCCOC1CCCCCC1 34a_100000210887_200000718107 [0,1,0,1,0,0|1,0,0]=3 28423 B14R1.6343 CC(O)CCCOC1CCCCCC1 7a_100000210887_200000718107 [0,1,0,1,0,0|1,0,0]=3 28424 B14R1.6343 CC(O)CCCSC1CCCCCC1 62a_100011217769_200000718107 [0,1,0,1,0,0|1,0,0]=3 28425 B14R1.6343 CC(O)CCCSC1CCCCCC1 62a_200000718107_100011217769 [0,1,0,1,0,0|1,0,0]=3 28426 B14R1.6343 CC(O)CCNCC1CCCCCC1 2230a_100015204231_100012276601 [0,1,0,1,0,0|1,0,0]=3 28427 B14R1.6343 CC(O)CCNCC1CCCCCC1 2230a_200000755665_200000696569 [0,1,0,1,0,0|1,0,0]=3 28428 B14R1.6343 CC(O)CCNCC1CCCCCC1 269862a_200000755665_200000763224 [0,1,0,1,0,0|1,0,0]=3 28429 B14R1.6343 CC(O)CCNCC1CCCCCC1 34a_100015204231_100012276601 [0,1,0,1,0,0|1,0,0]=3 28430 B14R1.6343 CC(O)CCOCC1CCCCCC1 34a_100000699130_100012276601 [0,1,0,1,0,0|1,0,0]=3 28431 B14R1.6343 CC(O)CCOCC1CCCCCC1 7a_100000699130_100012276601 [0,1,0,1,0,0|1,0,0]=3 28432 B14R1.6343 CC(O)CCSCC1CCCCCC1 62a_100012276601_200000696569 [0,1,0,1,0,0|1,0,0]=3 28433 B14R1.6343 CC(O)CCSCC1CCCCCC1 62a_200000696569_100012276601 [0,1,0,1,0,0|1,0,0]=3 28434 B14R1.6343 CC(O)CNCCC1CCCCCC1 2230a_100011532351_100011218427 [0,1,0,1,0,0|1,0,0]=3 28435 B14R1.6343 CC(O)CNCCC1CCCCCC1 34a_100011532351_100011218427 [0,1,0,1,0,0|1,0,0]=3 28436 B14R1.6343 CC(O)COCCN1CCCCCC1 34a_100000238007_100011218427 [0,1,0,1,0,0|2,0,0]=4 28437 B14R1.6343 CC(O)CSCCN1CCCCCC1 62a_100000722644_100011218427 [0,1,0,1,0,0|2,0,0]=4 28438 B14R1.6343 CC(O)CSCCN1CCCCCC1 62a_100011218427_100000722644 [0,1,0,1,0,0|2,0,0]=4 28439 B14R1.6343 C[C@@H](N)CCOCC1CCCCCC1 34a_100000706166_200000696569 [0,1,0,1,0,0|2,0,0]=4 28440 B14R1.6343 C[C@@H](O)CNCCC1CCCCCC1 2230a_100011532351_100009817552 [0,1,0,1,0,0|1,0,0]=3 28441 B14R1.6343 C[C@@H](O)CNCCC1CCCCCC1 34a_100011532351_100009817552 [0,1,0,1,0,0|1,0,0]=3 28442 B14R1.6343 C[C@@H](O)COCCN1CCCCCC1 34a_100000238007_100009817552 [0,1,0,1,0,0|2,0,0]=4 28443 B14R1.6343 C[C@@H](O)CSCCN1CCCCCC1 62a_100000722644_100009817552 [0,1,0,1,0,0|2,0,0]=4 28444 B14R1.6343 C[C@@H](O)CSCCN1CCCCCC1 62a_100009817552_100000722644 [0,1,0,1,0,0|2,0,0]=4 28445 B14R1.6343 FC(F)CCOCC1CCCCCC1 34a_100103093639_200000696569 [0,1,0,1,0,0|2,0,0]=4 28446 B14R1.6343 FC(F)CNCCC1CCCCCC1 2230a_100011532351_100011934356 [0,1,0,1,0,0|2,0,0]=4 28447 B14R1.6343 FC(F)CNCCC1CCCCCC1 34a_100011532351_100011934356 [0,1,0,1,0,0|2,0,0]=4 28448 B14R1.6343 OB(O)CCCCN1CCCCCC1 2230a_100000185865_200009817182 [0,1,0,1,0,0|2,0,0]=4 28449 B14R1.6343 OB(O)CCCCN1CCCCCC1 269982a_100000185865_200009817182 [0,1,0,1,0,0|2,0,0]=4 28450 B14R1.6343 OB(O)CCCCN1CCCCCC1 34a_100000185865_200009817182 [0,1,0,1,0,0|2,0,0]=4 28451 B14R1.6388 CC(=O)CCCCSCCCC1CO1 62a_100000733510_100000735457 [0,1,0,1,0,0|1,0,1]=4 28452 B14R1.6388 CC(=O)CCCCSCCCC1CO1 62a_100000735457_100000733510 [0,1,0,1,0,0|1,0,1]=4 28453 B14R1.6388 CC(C)CCCCCCCOC1CC1 34a_200000210741_100000211595 [0,1,0,1,0,0|2,0,0]=4 28454 B14R1.6388 CC(C)CCCCCCNCC1CC1 2230a_100000211014_100000742324 [0,1,0,1,0,0|2,0,0]=4 28455 B14R1.6388 CC(C)CCCCCCNCC1CC1 269862a_100000211014_100000741477 [0,1,0,1,0,0|2,0,0]=4 28456 B14R1.6388 CC(C)CCCCCCNCC1CC1 34a_100000211014_100000742324 [0,1,0,1,0,0|2,0,0]=4 28457 B14R1.6388 CC(C)CCCCCCNCC1CO1 2230a_100000211014_100011216344 [0,1,0,1,0,0|1,0,0]=3 28458 B14R1.6388 CC(C)CCCCCCNCC1CO1 34a_100000211014_102125554688 [0,1,0,1,0,0|1,0,0]=3 28459 B14R1.6388 CC(C)CCCCCNCCC1CC1 2230a_100011290863_100000694398 [0,1,0,1,0,0|2,0,0]=4 28460 B14R1.6388 CC(C)CCCCCNCCC1CC1 34a_100000764129_100000210682 [0,1,0,1,0,0|2,0,0]=4 28461 B14R1.6388 CC(C)CCCCCNCCC1CC1 34a_100011290863_100000694398 [0,1,0,1,0,0|2,0,0]=4 28462 B14R1.6388 CC(C)CCCCCNCCC1CO1 2230a_100011290863_100000732470 [0,1,0,1,0,0|1,0,0]=3 28463 B14R1.6388 CC(C)CCCCCNCCC1CO1 34a_100011290863_100000732470 [0,1,0,1,0,0|1,0,0]=3 28464 B14R1.6388 CC(C)CCCCCOCCC1CC1 34a_100000754188_100000210682 [0,1,0,1,0,0|2,0,0]=4 28465 B14R1.6388 CC(C)CCCCCOCCC1CC1 34a_100011995859_100000694398 [0,1,0,1,0,0|2,0,0]=4 28466 B14R1.6388 CC(C)CCCCCOCCC1CC1 7a_100000754188_100000210682 [0,1,0,1,0,0|2,0,0]=4 28467 B14R1.6388 CC(C)CCCCCOCCC1CC1 7a_100011995859_100000764125 [0,1,0,1,0,0|2,0,0]=4 28468 B14R1.6388 CC(C)CCCCCOCCC1CO1 34a_100011995859_100000732470 [0,1,0,1,0,0|1,0,0]=3 28469 B14R1.6388 CC(C)CCCCCOCCC1CO1 7a_100011995859_100000732470 [0,1,0,1,0,0|1,0,0]=3 28470 B14R1.6388 CC(C)CCCCCOCC[C@@H]1CO1 34a_100009820653_100000210682 [0,1,0,1,0,0|1,0,0]=3 28471 B14R1.6388 CC(C)CCCCCSCCC1CC1 62a_100000210682_100000764125 [0,1,0,1,0,0|2,0,0]=4 28472 B14R1.6388 CC(C)CCCCCSCCC1CC1 62a_100000764125_100000210682 [0,1,0,1,0,0|2,0,0]=4 28473 B14R1.6388 CC(C)CCCCCSCCC1CO1 62a_100000210682_100000732470 [0,1,0,1,0,0|1,0,0]=3 28474 B14R1.6388 CC(C)CCCCCSCCC1CO1 62a_100000732470_100000210682 [0,1,0,1,0,0|1,0,0]=3 28475 B14R1.6388 CC(C)CCCCOCCCC1CO1 34a_100011214890_100000733510 [0,1,0,1,0,0|1,0,0]=3 28476 B14R1.6388 CC(C)CCCCOCCCC1CO1 7a_100011214890_100000733510 [0,1,0,1,0,0|1,0,0]=3 28477 B14R1.6388 CC(C)CCCCSCCCC1CO1 62a_100000733510_100011216152 [0,1,0,1,0,0|1,0,0]=3 28478 B14R1.6388 CC(C)CCCCSCCCC1CO1 62a_100011216152_100000733510 [0,1,0,1,0,0|1,0,0]=3 28479 B14R1.6388 CC(C)CNCCOCCCC1CO1 34a_100015185251_100000733510 [0,1,0,1,0,0|2,0,0]=4 28480 B14R1.6388 CC(C)COCCCCOCC1CO1 34a_100010889290_100000210624 [0,1,0,1,0,0|2,0,0]=4 28481 B14R1.6388 CC(C)COCCCCOCC1CO1 7a_100010889290_100000210760 [0,1,0,1,0,0|2,0,0]=4 28482 B14R1.6388 CC(C)COCCCNCCC1CO1 2230a_100000205972_100000732470 [0,1,0,1,0,0|2,0,0]=4 28483 B14R1.6388 CC(C)COCCCNCCC1CO1 34a_100000205972_100000732470 [0,1,0,1,0,0|2,0,0]=4 28484 B14R1.6388 CC(C)COCCOCCCC1CO1 34a_100000703358_100000733510 [0,1,0,1,0,0|2,0,0]=4 28485 B14R1.6388 CC(C)COCCOCCCC1CO1 7a_100000703358_100000733510 [0,1,0,1,0,0|2,0,0]=4 28486 B14R1.6388 CC(C)CSCCOCCCC1CO1 34a_200000230437_100000733510 [0,1,0,1,0,0|2,0,0]=4 28487 B14R1.6388 CC(C)CSCCOCCCC1CO1 7a_200000230437_100000733510 [0,1,0,1,0,0|2,0,0]=4 28488 B14R1.6388 CC(C)NCCCCCOCC1CO1 34a_100011629493_102125554688 [0,1,0,1,0,0|2,0,0]=4 28489 B14R1.6388 CC(C)NCCCCOCCC1CO1 34a_100011521146_100000732470 [0,1,0,1,0,0|2,0,0]=4 28490 B14R1.6388 CC(C)NCCCOCCCC1CO1 34a_100000182298_100000733510 [0,1,0,1,0,0|2,0,0]=4 28491 B14R1.6388 CC(C)OCCCNCCCC1CO1 2230a_100000737246_100000733510 [0,1,0,1,0,0|2,0,0]=4 28492 B14R1.6388 CC(C)OCCCNCCCC1CO1 34a_100000737246_100000733510 [0,1,0,1,0,0|2,0,0]=4 28493 B14R1.6388 CC(O)COCCCCOCC1CO1 34a_100010889290_100011218427 [0,1,0,1,0,0|2,0,0]=4 28494 B14R1.6388 CC(O)COCCCCOCC1CO1 7a_100010889290_100011218427 [0,1,0,1,0,0|2,0,0]=4 28495 B14R1.6388 CN(C)CCCCSCCCC1CO1 62a_100000733510_100000690147 [0,1,0,1,0,0|2,0,0]=4 28496 B14R1.6388 C[C@@H](O)COCCCCOCC1CO1 34a_100010889290_100009817552 [0,1,0,1,0,0|2,0,0]=4 28497 B14R1.6388 C[C@@H](O)COCCCCOCC1CO1 7a_100010889290_100009817552 [0,1,0,1,0,0|2,0,0]=4 28498 B14R1.6388 OB(O)CCCCCCNCC1CC1 2230a_100000735609_100009817187 [0,1,0,1,0,0|2,0,0]=4 28499 B14R1.6388 OB(O)CCCCCCNCC1CC1 34a_100000735609_100009817187 [0,1,0,1,0,0|2,0,0]=4 28500 B14R1.6388 OB(O)CCCCCCOCC1CC1 34a_100000211283_100009817187 [0,1,0,1,0,0|2,0,0]=4 28501 B14R1.6388 OB(O)CCCCCCSCC1CC1 62a_100000756562_100009817187 [0,1,0,1,0,0|2,0,0]=4 28502 B14R1.6388 OB(O)CCCCCCSCC1CC1 62a_100009817187_100000742324 [0,1,0,1,0,0|2,0,0]=4 28503 B14R1.6388 OB(O)CCCCCNCCC1CC1 34a_100000764129_200009817188 [0,1,0,1,0,0|2,0,0]=4 28504 B14R1.6388 OB(O)CCCCCOCCC1CC1 34a_100000754188_200009817188 [0,1,0,1,0,0|2,0,0]=4 28505 B14R1.6388 OB(O)CCCCCOCCC1CC1 7a_100000754188_200009817188 [0,1,0,1,0,0|2,0,0]=4 28506 B14R1.6388 OB(O)CCCCCSCCC1CC1 62a_100000764125_200009817188 [0,1,0,1,0,0|2,0,0]=4 28507 B14R1.6388 OB(O)CCCCCSCCC1CC1 62a_200009817188_100000764125 [0,1,0,1,0,0|2,0,0]=4 28508 B14R1.123 BrCCCCCCOC1CCCCC1 34a_100011215345_100000210327 [0,1,0,1,0,0|1,0,0]=3 28509 B14R1.123 BrCCCCCCOC1CCCCC1 7a_100011215345_100000210327 [0,1,0,1,0,0|1,0,0]=3 28510 B14R1.123 BrCCCCCCOC1CCCOC1 34a_100011215345_100000693364 [0,1,0,1,0,0|2,0,0]=4 28511 B14R1.123 BrCCCCCCOC1CCCOC1 7a_100011215345_100000693364 [0,1,0,1,0,0|2,0,0]=4 28512 B14R1.123 BrCCCCCCOC1CCOCC1 7a_100011215345_100000686592 [0,1,0,1,0,0|2,0,0]=4 28513 B14R1.123 BrCCCCCCOC1CCSCC1 34a_100011215345_100000069128 [0,1,0,1,0,0|2,0,0]=4 28514 B14R1.123 BrCCCCCCOC1CCSCC1 7a_100011215345_100011500858 [0,1,0,1,0,0|2,0,0]=4 28515 B14R1.123 BrCCCCCOCC1CCCCC1 34a_100000746331_100000211423 [0,1,0,1,0,0|1,0,0]=3 28516 B14R1.123 BrCCCCCOCC1CCCCC1 7a_100000746331_100000211423 [0,1,0,1,0,0|1,0,0]=3 28517 B14R1.123 BrCCCCCOCC1CCCCO1 34a_100000746331_100000211543 [0,1,0,1,0,0|1,0,0]=3 28518 B14R1.123 BrCCCCCOCC1CCCCO1 7a_100000746331_100000211543 [0,1,0,1,0,0|1,0,0]=3 28519 B14R1.123 BrCCCCCOCC1CCCOC1 34a_100000746331_100000741521 [0,1,0,1,0,0|2,0,0]=4 28520 B14R1.123 BrCCCCCOCC1CCCOC1 7a_100000746331_100000741521 [0,1,0,1,0,0|2,0,0]=4 28521 B14R1.123 BrCCCCCOCC1CCOCC1 34a_100000746331_100000754603 [0,1,0,1,0,0|2,0,0]=4 28522 B14R1.123 BrCCCCCOCC1CCOCC1 7a_100000746331_100000754603 [0,1,0,1,0,0|2,0,0]=4 28523 B14R1.123 BrCCCCOCCC1CCCCC1 34a_100011216708_100011209188 [0,1,0,1,0,0|1,0,0]=3 28524 B14R1.123 BrCCCCOCCC1CCOCC1 34a_100011216708_100011934994 [0,1,0,1,0,0|2,0,0]=4 28525 B14R1.123 BrCCCCOCCC1OCCCO1 34a_100011216708_100000764188 [0,1,0,1,0,0|2,0,0]=4 28526 B14R1.123 BrCCCCOCCN1CCCCC1 34a_100011216708_100000739454 [0,1,0,1,0,0|2,0,0]=4 28527 B14R1.123 BrCCCCOCOC1CCCCC1 34a_100011216708_100011935260 [0,1,0,1,0,0|2,0,0]=4 28528 B14R1.123 BrCCCOCCCC1CCCCC1 34a_100011217188_100011713725 [0,1,0,1,0,0|1,0,0]=3 28529 B14R1.123 BrCCCOCCCN1CCCCC1 34a_100011217188_100000690320 [0,1,0,1,0,0|2,0,0]=4 28530 B14R1.123 BrCCCOCCOC1CCCCC1 34a_100011217188_100011211530 [0,1,0,1,0,0|2,0,0]=4 28531 B14R1.123 BrCCCOCCOC1CCCCO1 34a_100011217188_100000744793 [0,1,0,1,0,0|2,0,0]=4 28532 B14R1.123 BrCCOCCCOC1CCCCO1 34a_100000211926_100000700653 [0,1,0,1,0,0|2,0,0]=4 28533 B14R1.123 BrCCOCCOCC1CCCCC1 34a_100000692535_100000211423 [0,1,0,1,0,0|2,0,0]=4 28534 B14R1.123 BrCCOCCOCC1CCCCC1 7a_100000692535_100000211423 [0,1,0,1,0,0|2,0,0]=4 28535 B14R1.123 BrCCOCCOCC1CCCCO1 34a_100000692535_100000211543 [0,1,0,1,0,0|2,0,0]=4 28536 B14R1.123 BrCCOCCOCC1CCCCO1 7a_100000692535_100000211543 [0,1,0,1,0,0|2,0,0]=4 28537 B14R1.123 C#CCCCCCNC1CCCCC1 2230a_100000182618_100012094781 [0,1,0,1,0,0|1,0,1]=4 28538 B14R1.123 C#CCCCCCNC1CCCCC1 34a_100000182618_100012094781 [0,1,0,1,0,0|1,0,1]=4 28539 B14R1.123 C#CCCCCCOC1CCCCC1 34a_100000210231_100012094781 [0,1,0,1,0,0|1,0,1]=4 28540 B14R1.123 C#CCCCCCOC1CCCCC1 34a_100000766912_100000210327 [0,1,0,1,0,0|1,0,1]=4 28541 B14R1.123 C#CCCCCCOC1CCCCC1 7a_100000210231_100012094781 [0,1,0,1,0,0|1,0,1]=4 28542 B14R1.123 C#CCCCCCOC1CCCCC1 7a_100000766912_100000210327 [0,1,0,1,0,0|1,0,1]=4 28543 B14R1.123 C#CCCCCCOC1CCCCO1 34a_100000033831_100012094781 [0,1,0,1,0,0|0,0,2]=4 28544 B14R1.123 C#CCCCCCSC1CCCCC1 62a_100000210327_100012094781 [0,1,0,1,0,0|1,0,1]=4 28545 B14R1.123 C#CCCCCCSC1CCCCC1 62a_100012094781_100000210327 [0,1,0,1,0,0|1,0,1]=4 28546 B14R1.123 C#CCCCCNCC1CCCCC1 2230a_100000210473_100010269958 [0,1,0,1,0,0|1,0,1]=4 28547 B14R1.123 C#CCCCCNCC1CCCCC1 2230a_100000706060_100000211423 [0,1,0,1,0,0|1,0,1]=4 28548 B14R1.123 C#CCCCCNCC1CCCCC1 34a_100000210473_100010269958 [0,1,0,1,0,0|1,0,1]=4 28549 B14R1.123 C#CCCCCNCC1CCCCC1 34a_100000706060_100000211423 [0,1,0,1,0,0|1,0,1]=4 28550 B14R1.123 C#CCCCCNCC1CCCCO1 2230a_100000174945_100010269958 [0,1,0,1,0,0|0,0,2]=4 28551 B14R1.123 C#CCCCCNCC1CCCCO1 2230a_100000706060_100000211543 [0,1,0,1,0,0|0,0,2]=4 28552 B14R1.123 C#CCCCCNCC1CCCCO1 34a_100000174945_100010269958 [0,1,0,1,0,0|0,0,2]=4 28553 B14R1.123 C#CCCCCNCC1CCCCO1 34a_100000706060_100000211543 [0,1,0,1,0,0|0,0,2]=4 28554 B14R1.123 C#CCCCCOCC1CCCCC1 34a_100000212181_100010269958 [0,1,0,1,0,0|1,0,1]=4 28555 B14R1.123 C#CCCCCOCC1CCCCC1 34a_100000766709_100000211423 [0,1,0,1,0,0|1,0,1]=4 28556 B14R1.123 C#CCCCCOCC1CCCCC1 7a_100000212181_100010269958 [0,1,0,1,0,0|1,0,1]=4 28557 B14R1.123 C#CCCCCOCC1CCCCC1 7a_100000766709_100000211423 [0,1,0,1,0,0|1,0,1]=4 28558 B14R1.123 C#CCCCCOCC1CCCCO1 34a_100000211370_100010269958 [0,1,0,1,0,0|0,0,2]=4 28559 B14R1.123 C#CCCCCOCC1CCCCO1 34a_100000766709_100000211543 [0,1,0,1,0,0|0,0,2]=4 28560 B14R1.123 C#CCCCCOCC1CCCCO1 7a_100000211370_100010269958 [0,1,0,1,0,0|0,0,2]=4 28561 B14R1.123 C#CCCCCOCC1CCCCO1 7a_100000766709_100000211543 [0,1,0,1,0,0|0,0,2]=4 28562 B14R1.123 C#CCCCCSCC1CCCCC1 62a_100000211423_100010269958 [0,1,0,1,0,0|1,0,1]=4 28563 B14R1.123 C#CCCCCSCC1CCCCC1 62a_100010269958_100000211423 [0,1,0,1,0,0|1,0,1]=4 28564 B14R1.123 C#CCCCCSCC1CCCCO1 62a_100000211543_100010269958 [0,1,0,1,0,0|0,0,2]=4 28565 B14R1.123 C#CCCCCSCC1CCCCO1 62a_100010269958_100000211543 [0,1,0,1,0,0|0,0,2]=4 28566 B14R1.123 C#CCCCNCCC1CCCCC1 2230a_100000738074_100000731252 [0,1,0,1,0,0|1,0,1]=4 28567 B14R1.123 C#CCCCNCCC1CCCCC1 270004a_100000718082_100011713444 [0,1,0,1,0,0|1,0,1]=4 28568 B14R1.123 C#CCCCNCCC1CCCCC1 34a_100000718082_100011209188 [0,1,0,1,0,0|1,0,1]=4 28569 B14R1.123 C#CCCCNCCC1CCCCC1 34a_100000738074_100000695029 [0,1,0,1,0,0|1,0,1]=4 28570 B14R1.123 C#CCCCNCCC1CCCCO1 2230a_100015183643_100000731252 [0,1,0,1,0,0|0,0,2]=4 28571 B14R1.123 C#CCCCNCCC1CCCCO1 34a_100015183643_100000695029 [0,1,0,1,0,0|0,0,2]=4 28572 B14R1.123 C#CCCCOCCC1CCCCC1 34a_100000215630_100011209188 [0,1,0,1,0,0|1,0,1]=4 28573 B14R1.123 C#CCCCOCCC1CCCCC1 34a_100011217863_100000695029 [0,1,0,1,0,0|1,0,1]=4 28574 B14R1.123 C#CCCCOCCC1CCCCC1 7a_100000215630_100011273959 [0,1,0,1,0,0|1,0,1]=4 28575 B14R1.123 C#CCCCOCCC1CCCCC1 7a_100011217863_100011215417 [0,1,0,1,0,0|1,0,1]=4 28576 B14R1.123 C#CCCCSCCC1CCCCC1 62a_100011215417_100012355289 [0,1,0,1,0,0|1,0,1]=4 28577 B14R1.123 C#CCCCSCCC1CCCCC1 62a_100012355289_100011215417 [0,1,0,1,0,0|1,0,1]=4 28578 B14R1.123 C#CCCNCCCC1CCCCC1 2230a_100011211642_100000688953 [0,1,0,1,0,0|1,0,1]=4 28579 B14R1.123 C#CCCNCCCC1CCCCC1 34a_100000755551_100011713725 [0,1,0,1,0,0|1,0,1]=4 28580 B14R1.123 C#CCCNCCCC1CCCCC1 34a_100011211642_100000688953 [0,1,0,1,0,0|1,0,1]=4 28581 B14R1.123 C#CCCOCCCC1CCCCC1 34a_100000198086_100000688953 [0,1,0,1,0,0|1,0,1]=4 28582 B14R1.123 C#CCCOCCCC1CCCCC1 34a_100011215631_100011713725 [0,1,0,1,0,0|1,0,1]=4 28583 B14R1.123 C#CCCOCCCC1CCCCC1 7a_100000198086_100000688953 [0,1,0,1,0,0|1,0,1]=4 28584 B14R1.123 C#CCCSCCCC1CCCCC1 62a_100000688953_100011713725 [0,1,0,1,0,0|1,0,1]=4 28585 B14R1.123 C#CCCSCCCC1CCCCC1 62a_100011713725_100000688953 [0,1,0,1,0,0|1,0,1]=4 28586 B14R1.123 C#CCOCCCCC1CCCCC1 34a_100011215267_100000184674 [0,1,0,1,0,0|1,0,1]=4 28587 B14R1.123 C#CCOCCCCC1CCCCC1 7a_100011215267_100000038162 [0,1,0,1,0,0|1,0,1]=4 28588 B14R1.123 C=CCCCCCNC1CCCCC1 2230a_100000182618_100000700193 [0,1,0,1,0,0|1,0,1]=4 28589 B14R1.123 C=CCCCCCNC1CCCCC1 34a_100000182618_100000700193 [0,1,0,1,0,0|1,0,1]=4 28590 B14R1.123 C=CCCCCCOC1CCCCC1 34a_100000210231_100000700193 [0,1,0,1,0,0|1,0,1]=4 28591 B14R1.123 C=CCCCCCOC1CCCCC1 34a_100011216702_100000210327 [0,1,0,1,0,0|1,0,1]=4 28592 B14R1.123 C=CCCCCCOC1CCCCC1 7a_100000210231_100000700193 [0,1,0,1,0,0|1,0,1]=4 28593 B14R1.123 C=CCCCCCOC1CCCCC1 7a_100011216702_100000210327 [0,1,0,1,0,0|1,0,1]=4 28594 B14R1.123 C=CCCCCCOC1CCCCO1 34a_100000033831_100000700193 [0,1,0,1,0,0|0,0,2]=4 28595 B14R1.123 C=CCCCCCSC1CCCCC1 62a_100000210327_100000700193 [0,1,0,1,0,0|1,0,1]=4 28596 B14R1.123 C=CCCCCCSC1CCCCC1 62a_100000700193_100000210327 [0,1,0,1,0,0|1,0,1]=4 28597 B14R1.123 C=CCCCCNCC1CCCCC1 2230a_100000210473_100011215482 [0,1,0,1,0,0|1,0,1]=4 28598 B14R1.123 C=CCCCCNCC1CCCCC1 2230a_100000703577_100000211423 [0,1,0,1,0,0|1,0,1]=4 28599 B14R1.123 C=CCCCCNCC1CCCCC1 269862a_100000703577_100000211278 [0,1,0,1,0,0|1,0,1]=4 28600 B14R1.123 C=CCCCCNCC1CCCCC1 34a_100000210473_100011215482 [0,1,0,1,0,0|1,0,1]=4 28601 B14R1.123 C=CCCCCNCC1CCCCC1 34a_100000703577_100000211423 [0,1,0,1,0,0|1,0,1]=4 28602 B14R1.123 C=CCCCCNCC1CCCCO1 2230a_100000174945_100011215482 [0,1,0,1,0,0|0,0,2]=4 28603 B14R1.123 C=CCCCCNCC1CCCCO1 2230a_100000703577_100000211543 [0,1,0,1,0,0|0,0,2]=4 28604 B14R1.123 C=CCCCCNCC1CCCCO1 34a_100000174945_100011215482 [0,1,0,1,0,0|0,0,2]=4 28605 B14R1.123 C=CCCCCNCC1CCCCO1 34a_100000703577_100000211543 [0,1,0,1,0,0|0,0,2]=4 28606 B14R1.123 C=CCCCCOCC1CCCCC1 34a_100000212181_100011215482 [0,1,0,1,0,0|1,0,1]=4 28607 B14R1.123 C=CCCCCOCC1CCCCC1 34a_100000766645_100000211423 [0,1,0,1,0,0|1,0,1]=4 28608 B14R1.123 C=CCCCCOCC1CCCCC1 7a_100000212181_100011215482 [0,1,0,1,0,0|1,0,1]=4 28609 B14R1.123 C=CCCCCOCC1CCCCC1 7a_100000766645_100000211423 [0,1,0,1,0,0|1,0,1]=4 28610 B14R1.123 C=CCCCCOCC1CCCCO1 34a_100000211370_100011215482 [0,1,0,1,0,0|0,0,2]=4 28611 B14R1.123 C=CCCCCOCC1CCCCO1 34a_100000766645_100000211543 [0,1,0,1,0,0|0,0,2]=4 28612 B14R1.123 C=CCCCCOCC1CCCCO1 7a_100000211370_100011215482 [0,1,0,1,0,0|0,0,2]=4 28613 B14R1.123 C=CCCCCOCC1CCCCO1 7a_100000766645_100000211543 [0,1,0,1,0,0|0,0,2]=4 28614 B14R1.123 C=CCCCCSCC1CCCCC1 62a_100000211423_100011215482 [0,1,0,1,0,0|1,0,1]=4 28615 B14R1.123 C=CCCCCSCC1CCCCC1 62a_100011215482_100000211423 [0,1,0,1,0,0|1,0,1]=4 28616 B14R1.123 C=CCCCCSCC1CCCCO1 62a_100000211543_100011215482 [0,1,0,1,0,0|0,0,2]=4 28617 B14R1.123 C=CCCCCSCC1CCCCO1 62a_100011215482_100000211543 [0,1,0,1,0,0|0,0,2]=4 28618 B14R1.123 C=CCCCNCCC1CCCCC1 2230a_100000700776_100012355289 [0,1,0,1,0,0|1,0,1]=4 28619 B14R1.123 C=CCCCNCCC1CCCCC1 2230a_100000738074_100011713584 [0,1,0,1,0,0|1,0,1]=4 28620 B14R1.123 C=CCCCNCCC1CCCCC1 270004a_100000700776_100011713444 [0,1,0,1,0,0|1,0,1]=4 28621 B14R1.123 C=CCCCNCCC1CCCCC1 34a_100000700776_100011209188 [0,1,0,1,0,0|1,0,1]=4 28622 B14R1.123 C=CCCCNCCC1CCCCC1 34a_100000738074_100000757094 [0,1,0,1,0,0|1,0,1]=4 28623 B14R1.123 C=CCCCNCCC1CCCCO1 2230a_100015183643_100011713584 [0,1,0,1,0,0|0,0,2]=4 28624 B14R1.123 C=CCCCNCCC1CCCCO1 34a_100015183643_100000757094 [0,1,0,1,0,0|0,0,2]=4 28625 B14R1.123 C=CCCCOCCC1CCCCC1 34a_100000758997_100011209188 [0,1,0,1,0,0|1,0,1]=4 28626 B14R1.123 C=CCCCOCCC1CCCCC1 34a_100011217863_100000757094 [0,1,0,1,0,0|1,0,1]=4 28627 B14R1.123 C=CCCCOCCC1CCCCC1 7a_100000758997_100011273959 [0,1,0,1,0,0|1,0,1]=4 28628 B14R1.123 C=CCCCOCCC1CCCCC1 7a_100011217863_100000757094 [0,1,0,1,0,0|1,0,1]=4 28629 B14R1.123 C=CCCCSCCC1CCCCC1 62a_100011713584_100012355289 [0,1,0,1,0,0|1,0,1]=4 28630 B14R1.123 C=CCCCSCCC1CCCCC1 62a_100012355289_100000757094 [0,1,0,1,0,0|1,0,1]=4 28631 B14R1.123 C=CCCNCCCC1CCCCC1 2230a_100011211642_100000754431 [0,1,0,1,0,0|1,0,1]=4 28632 B14R1.123 C=CCCNCCCC1CCCCC1 2230a_100015191253_100011713725 [0,1,0,1,0,0|1,0,1]=4 28633 B14R1.123 C=CCCNCCCC1CCCCC1 34a_100011211642_100000754431 [0,1,0,1,0,0|1,0,1]=4 28634 B14R1.123 C=CCCOCCCC1CCCCC1 34a_100000198086_100000754431 [0,1,0,1,0,0|1,0,1]=4 28635 B14R1.123 C=CCCOCCCC1CCCCC1 34a_100011205117_100011713725 [0,1,0,1,0,0|1,0,1]=4 28636 B14R1.123 C=CCCOCCCC1CCCCC1 7a_100000198086_100000754431 [0,1,0,1,0,0|1,0,1]=4 28637 B14R1.123 C=CCCSCCCC1CCCCC1 62a_100000754431_100011713725 [0,1,0,1,0,0|1,0,1]=4 28638 B14R1.123 C=CCCSCCCC1CCCCC1 62a_100011713725_100000754431 [0,1,0,1,0,0|1,0,1]=4 28639 B14R1.123 C=CCOCCCCC1CCCCC1 34a_100011215267_100015514636 [0,1,0,1,0,0|1,0,1]=4 28640 B14R1.123 C=CCOCCCCC1CCCCC1 7a_100011215267_100015514636 [0,1,0,1,0,0|1,0,1]=4 28641 B14R1.123 CC/C=C\CCNCC1CCCCO1 2230a_100000174945_100015370543 [0,1,0,1,0,0|0,0,2]=4 28642 B14R1.123 CC/C=C\CCNCC1CCCCO1 34a_100000174945_100015370543 [0,1,0,1,0,0|0,0,2]=4 28643 B14R1.123 CC/C=C\CCOCC1CCCCO1 34a_100000211370_100015370543 [0,1,0,1,0,0|0,0,2]=4 28644 B14R1.123 CC/C=C\CCOCC1CCCCO1 34a_100016288707_100000211543 [0,1,0,1,0,0|0,0,2]=4 28645 B14R1.123 CC/C=C\CCOCC1CCCCO1 7a_100000211370_100015370543 [0,1,0,1,0,0|0,0,2]=4 28646 B14R1.123 CC/C=C\CCOCC1CCCCO1 7a_100016288707_100000211543 [0,1,0,1,0,0|0,0,2]=4 28647 B14R1.123 CC/C=C\CCSCC1CCCCO1 62a_100000211543_100015370543 [0,1,0,1,0,0|0,0,2]=4 28648 B14R1.123 CC/C=C\CCSCC1CCCCO1 62a_100015370543_100000211543 [0,1,0,1,0,0|0,0,2]=4 28649 B14R1.123 CC/C=C\CNCCC1CCCCO1 2230a_100015183643_100103147603 [0,1,0,1,0,0|0,0,2]=4 28650 B14R1.123 CC/C=C\CNCCC1CCCCO1 34a_100015183643_100103147603 [0,1,0,1,0,0|0,0,2]=4 28651 B14R1.123 CC=CCCCOCC1CCCCO1 34a_100020645299_100000211543 [0,1,0,1,0,0|0,0,2]=4 28652 B14R1.123 CCC#CCCOCC1CCCCO1 34a_100000036655_100000211543 [0,1,0,1,0,0|0,0,2]=4 28653 B14R1.123 CCC#CCCOCC1CCCCO1 7a_100000036655_100000211543 [0,1,0,1,0,0|0,0,2]=4 28654 B14R1.123 CCC#CCNCCC1CCCCO1 2230a_100015183643_100009813939 [0,1,0,1,0,0|0,0,2]=4 28655 B14R1.123 CCC#CCNCCC1CCCCO1 34a_100015183643_100009813939 [0,1,0,1,0,0|0,0,2]=4 28656 B14R1.123 CCC/C=C/COCC1CCCCO1 34a_100016278788_100000211543 [0,1,0,1,0,0|0,0,2]=4 28657 B14R1.123 CCC/C=C/COCC1CCCCO1 7a_100016278788_100000211543 [0,1,0,1,0,0|0,0,2]=4 28658 B14R1.123 CCCC#CCOCC1CCCCO1 34a_100000034806_100000211543 [0,1,0,1,0,0|0,0,2]=4 28659 B14R1.123 CCCC#CCOCC1CCCCO1 7a_100000034806_100000211543 [0,1,0,1,0,0|0,0,2]=4 28660 B14R1.123 CCCCCCCCN1CCCOC1 2230a_100000131196_100000210759 [0,1,0,1,0,0|1,0,0]=3 28661 B14R1.123 CCCCCCCCN1CCCOC1 269982a_100000131196_100000210759 [0,1,0,1,0,0|1,0,0]=3 28662 B14R1.123 CCCCCCCCN1CCCOC1 34a_100000131196_100000210759 [0,1,0,1,0,0|1,0,0]=3 28663 B14R1.123 CCCCCCCCN1CCOCC1 2230a_100015191051_100000210759 [0,1,0,1,0,0|2,0,0]=4 28664 B14R1.123 CCCCCCCCN1CCOCC1 269982a_100015191051_100000210759 [0,1,0,1,0,0|2,0,0]=4 28665 B14R1.123 CCCCCCCCN1CCOCC1 34a_100015191051_100000210759 [0,1,0,1,0,0|2,0,0]=4 28666 B14R1.123 CCCCCCCCN1CCSCC1 2230a_100000737611_100000210759 [0,1,0,1,0,0|2,0,0]=4 28667 B14R1.123 CCCCCCCCN1CCSCC1 269982a_100000737611_100000210759 [0,1,0,1,0,0|2,0,0]=4 28668 B14R1.123 CCCCCCCNC1C=CCCC1 2230a_100000229938_100000751183 [0,1,0,1,0,0|1,0,1]=4 28669 B14R1.123 CCCCCCCNC1CCCCC1 2230a_100000182618_100000210681 [0,1,0,1,0,0|1,0,0]=3 28670 B14R1.123 CCCCCCCNC1CCCCC1 270004a_100000229938_100000210434 [0,1,0,1,0,0|1,0,0]=3 28671 B14R1.123 CCCCCCCNC1CCCCC1 34a_100000182618_100000210614 [0,1,0,1,0,0|1,0,0]=3 28672 B14R1.123 CCCCCCCNC1CCCOC1 2230a_100000719290_100000210681 [0,1,0,1,0,0|1,0,0]=3 28673 B14R1.123 CCCCCCCNC1CCCOC1 270004a_100000229938_100000753404 [0,1,0,1,0,0|1,0,0]=3 28674 B14R1.123 CCCCCCCNC1CCCOC1 34a_100000719290_100000210614 [0,1,0,1,0,0|1,0,0]=3 28675 B14R1.123 CCCCCCCNC1CCCSC1 270004a_100000229938_100000057913 [0,1,0,1,0,0|1,1,0]=4 28676 B14R1.123 CCCCCCCNC1CCNCC1 270004a_100000229938_100015192401 [0,1,0,1,0,0|2,0,0]=4 28677 B14R1.123 CCCCCCCNC1CCOCC1 2230a_100000741149_100000210681 [0,1,0,1,0,0|2,0,0]=4 28678 B14R1.123 CCCCCCCNC1CCOCC1 270004a_100000229938_100011217826 [0,1,0,1,0,0|2,0,0]=4 28679 B14R1.123 CCCCCCCNC1CCOCC1 34a_100000741149_100000210614 [0,1,0,1,0,0|2,0,0]=4 28680 B14R1.123 CCCCCCCNC1CCSCC1 2230a_100000748639_100000210681 [0,1,0,1,0,0|2,0,0]=4 28681 B14R1.123 CCCCCCCNC1CCSCC1 270004a_100000229938_100000203788 [0,1,0,1,0,0|2,0,0]=4 28682 B14R1.123 CCCCCCCNC1CCSCC1 34a_100000748639_100000210614 [0,1,0,1,0,0|2,0,0]=4 28683 B14R1.123 CCCCCCCOC1C=CCCC1 34a_100011215024_100000210614 [0,1,0,1,0,0|1,0,1]=4 28684 B14R1.123 CCCCCCCOC1C=CCCC1 7a_100000210272_100000751183 [0,1,0,1,0,0|1,0,1]=4 28685 B14R1.123 CCCCCCCOC1CCCCC1 34a_100000210231_100000210614 [0,1,0,1,0,0|1,0,0]=3 28686 B14R1.123 CCCCCCCOC1CCCCC1 34a_100000210272_100000210327 [0,1,0,1,0,0|1,0,0]=3 28687 B14R1.123 CCCCCCCOC1CCCCC1 7a_100000210231_100000210614 [0,1,0,1,0,0|1,0,0]=3 28688 B14R1.123 CCCCCCCOC1CCCCC1 7a_100000210272_100000210327 [0,1,0,1,0,0|1,0,0]=3 28689 B14R1.123 CCCCCCCOC1CCCCO1 34a_100000033831_100000210614 [0,1,0,1,0,0|0,0,0]=2 28690 B14R1.123 CCCCCCCOC1CCCOC1 34a_100000210272_100000693364 [0,1,0,1,0,0|1,0,0]=3 28691 B14R1.123 CCCCCCCOC1CCCOC1 34a_100000754041_100000210614 [0,1,0,1,0,0|1,0,0]=3 28692 B14R1.123 CCCCCCCOC1CCCOC1 7a_100000210272_100000693364 [0,1,0,1,0,0|1,0,0]=3 28693 B14R1.123 CCCCCCCOC1CCCSC1 7a_100015962668_100000210614 [0,1,0,1,0,0|1,1,0]=4 28694 B14R1.123 CCCCCCCOC1CCOCC1 34a_100000744328_100000210614 [0,1,0,1,0,0|2,0,0]=4 28695 B14R1.123 CCCCCCCOC1CCOCC1 7a_100000210272_100000686592 [0,1,0,1,0,0|2,0,0]=4 28696 B14R1.123 CCCCCCCOC1CCSCC1 34a_100000210272_100000069128 [0,1,0,1,0,0|2,0,0]=4 28697 B14R1.123 CCCCCCCOC1CCSCC1 34a_100000731022_100000210614 [0,1,0,1,0,0|2,0,0]=4 28698 B14R1.123 CCCCCCCOC1CCSCC1 7a_100000210272_100011500858 [0,1,0,1,0,0|2,0,0]=4 28699 B14R1.123 CCCCCCCOC1CCSCC1 7a_100000731022_100000210614 [0,1,0,1,0,0|2,0,0]=4 28700 B14R1.123 CCCCCCCSC1C=CCCC1 62a_100000210614_100000751183 [0,1,0,1,0,0|1,0,1]=4 28701 B14R1.123 CCCCCCCSC1C=CCCC1 62a_100000751183_100000210316 [0,1,0,1,0,0|1,0,1]=4 28702 B14R1.123 CCCCCCCSC1CCCCC1 62a_100000210327_100000210316 [0,1,0,1,0,0|1,0,0]=3 28703 B14R1.123 CCCCCCCSC1CCCCC1 62a_100000210614_100000210327 [0,1,0,1,0,0|1,0,0]=3 28704 B14R1.123 CCCCCCCSC1CCCOC1 62a_100000210614_100000693364 [0,1,0,1,0,0|1,0,0]=3 28705 B14R1.123 CCCCCCCSC1CCOCC1 62a_100000210614_100011324220 [0,1,0,1,0,0|2,0,0]=4 28706 B14R1.123 CCCCCCCSC1CCSCC1 62a_100000210614_100000069128 [0,1,0,1,0,0|2,0,0]=4 28707 B14R1.123 CCCCCCNCC1CCCCC1 2230a_100000210473_100000210314 [0,1,0,1,0,0|1,0,0]=3 28708 B14R1.123 CCCCCCNCC1CCCCC1 2230a_100000210581_100000211423 [0,1,0,1,0,0|1,0,0]=3 28709 B14R1.123 CCCCCCNCC1CCCCC1 269862a_100000210581_100000211278 [0,1,0,1,0,0|1,0,0]=3 28710 B14R1.123 CCCCCCNCC1CCCCC1 34a_100000210473_100000210314 [0,1,0,1,0,0|1,0,0]=3 28711 B14R1.123 CCCCCCNCC1CCCCO1 2230a_100000174945_100000210314 [0,1,0,1,0,0|0,0,0]=2 28712 B14R1.123 CCCCCCNCC1CCCCO1 2230a_100000210581_100000211543 [0,1,0,1,0,0|0,0,0]=2 28713 B14R1.123 CCCCCCNCC1CCCCO1 34a_100000174945_100000210314 [0,1,0,1,0,0|0,0,0]=2 28714 B14R1.123 CCCCCCNCC1CCCOC1 2230a_100000210581_100000741521 [0,1,0,1,0,0|1,0,0]=3 28715 B14R1.123 CCCCCCNCC1CCCOC1 2230a_100000720124_100000210314 [0,1,0,1,0,0|1,0,0]=3 28716 B14R1.123 CCCCCCNCC1CCCOC1 34a_100000720124_100000210314 [0,1,0,1,0,0|1,0,0]=3 28717 B14R1.123 CCCCCCNCC1CCOCC1 2230a_100000210581_100000754603 [0,1,0,1,0,0|2,0,0]=4 28718 B14R1.123 CCCCCCNCC1CCOCC1 2230a_100000746373_100000210314 [0,1,0,1,0,0|2,0,0]=4 28719 B14R1.123 CCCCCCNCC1CCOCC1 269862a_100000210581_100000749017 [0,1,0,1,0,0|2,0,0]=4 28720 B14R1.123 CCCCCCNCC1CCOCC1 34a_100000746373_100000210314 [0,1,0,1,0,0|2,0,0]=4 28721 B14R1.123 CCCCCCNCC1CCSCC1 2230a_100015188806_100000210314 [0,1,0,1,0,0|2,0,0]=4 28722 B14R1.123 CCCCCCNCC1CCSCC1 269862a_100000210581_100000067145 [0,1,0,1,0,0|2,0,0]=4 28723 B14R1.123 CCCCCCNCC1CCSCC1 270004a_100000210581_100000067145 [0,1,0,1,0,0|2,0,0]=4 28724 B14R1.123 CCCCCCNCC1CCSCC1 34a_100015188806_100000210314 [0,1,0,1,0,0|2,0,0]=4 28725 B14R1.123 CCCCCCNC[C@H]1COCCO1 2230a_100010981119_100000210314 [0,1,0,1,0,0|1,0,0]=3 28726 B14R1.123 CCCCCCNC[C@H]1COCCO1 34a_100010981119_100000210314 [0,1,0,1,0,0|1,0,0]=3 28727 B14R1.123 CCCCCCOCC1CCC=CO1 34a_100011217868_100000210314 [0,1,0,1,0,0|0,0,2]=4 28728 B14R1.123 CCCCCCOCC1CCCCC1 34a_100000210259_100000211423 [0,1,0,1,0,0|1,0,0]=3 28729 B14R1.123 CCCCCCOCC1CCCCC1 34a_100000212181_100000210314 [0,1,0,1,0,0|1,0,0]=3 28730 B14R1.123 CCCCCCOCC1CCCCC1 7a_100000210259_100000211423 [0,1,0,1,0,0|1,0,0]=3 28731 B14R1.123 CCCCCCOCC1CCCCC1 7a_100000212181_100000210314 [0,1,0,1,0,0|1,0,0]=3 28732 B14R1.123 CCCCCCOCC1CCCCN1 34a_100000210821_100000210314 [0,1,0,1,0,0|1,0,0]=3 28733 B14R1.123 CCCCCCOCC1CCCCO1 34a_100000210259_100000211543 [0,1,0,1,0,0|0,0,0]=2 28734 B14R1.123 CCCCCCOCC1CCCCO1 34a_100000211370_100000210314 [0,1,0,1,0,0|0,0,0]=2 28735 B14R1.123 CCCCCCOCC1CCCCO1 7a_100000210259_100000211543 [0,1,0,1,0,0|0,0,0]=2 28736 B14R1.123 CCCCCCOCC1CCCCO1 7a_100000211370_100000210314 [0,1,0,1,0,0|0,0,0]=2 28737 B14R1.123 CCCCCCOCC1CCCNC1 34a_100000211344_100000210314 [0,1,0,1,0,0|2,0,0]=4 28738 B14R1.123 CCCCCCOCC1CCCOC1 34a_100000210259_100000741521 [0,1,0,1,0,0|1,0,0]=3 28739 B14R1.123 CCCCCCOCC1CCCOC1 34a_100000741520_100000210314 [0,1,0,1,0,0|1,0,0]=3 28740 B14R1.123 CCCCCCOCC1CCCOC1 7a_100000210259_100000741521 [0,1,0,1,0,0|1,0,0]=3 28741 B14R1.123 CCCCCCOCC1CCNCC1 34a_100000738675_100000210314 [0,1,0,1,0,0|2,0,0]=4 28742 B14R1.123 CCCCCCOCC1CCOCC1 34a_100000210259_100000754603 [0,1,0,1,0,0|2,0,0]=4 28743 B14R1.123 CCCCCCOCC1CCOCC1 34a_100000749013_100000210314 [0,1,0,1,0,0|2,0,0]=4 28744 B14R1.123 CCCCCCOCC1CCOCC1 7a_100000210259_100000754603 [0,1,0,1,0,0|2,0,0]=4 28745 B14R1.123 CCCCCCOCC1CCSCC1 34a_100000070558_100000210314 [0,1,0,1,0,0|2,0,0]=4 28746 B14R1.123 CCCCCCOCC1CCSCC1 7a_100000070558_100000210314 [0,1,0,1,0,0|2,0,0]=4 28747 B14R1.123 CCCCCCOC[C@@H]1CNCCO1 34a_100015189573_100000210314 [0,1,0,1,0,0|1,0,0]=3 28748 B14R1.123 CCCCCCOC[C@@H]1COCCN1 34a_100000717676_100000210314 [0,1,0,1,0,0|2,0,0]=4 28749 B14R1.123 CCCCCCOC[C@H]1COCCO1 34a_100009875890_100000210314 [0,1,0,1,0,0|1,0,0]=3 28750 B14R1.123 CCCCCCSCC1CCCCC1 62a_100000210314_100000211423 [0,1,0,1,0,0|1,0,0]=3 28751 B14R1.123 CCCCCCSCC1CCCCC1 62a_100000211423_100000210757 [0,1,0,1,0,0|1,0,0]=3 28752 B14R1.123 CCCCCCSCC1CCCCO1 62a_100000210314_100000211543 [0,1,0,1,0,0|0,0,0]=2 28753 B14R1.123 CCCCCCSCC1CCCCO1 62a_100000211543_100000210757 [0,1,0,1,0,0|0,0,0]=2 28754 B14R1.123 CCCCCCSCC1CCCOC1 62a_100000210314_100000741521 [0,1,0,1,0,0|1,0,0]=3 28755 B14R1.123 CCCCCCSCC1CCCOC1 62a_100000741521_100000210757 [0,1,0,1,0,0|1,0,0]=3 28756 B14R1.123 CCCCCCSCC1CCOCC1 62a_100000210314_100000749018 [0,1,0,1,0,0|2,0,0]=4 28757 B14R1.123 CCCCCCSCC1CCOCC1 62a_100000754603_100000210757 [0,1,0,1,0,0|2,0,0]=4 28758 B14R1.123 CCCCCNCCC1=CCCCC1 2230a_100000212019_100000210326 [0,1,0,1,0,0|1,0,1]=4 28759 B14R1.123 CCCCCNCCC1=CCCCC1 34a_100000212019_100000718602 [0,1,0,1,0,0|1,0,1]=4 28760 B14R1.123 CCCCCNCCC1CCCCC1 2230a_100000209983_100012355289 [0,1,0,1,0,0|1,0,0]=3 28761 B14R1.123 CCCCCNCCC1CCCCC1 2230a_100000738074_100000210326 [0,1,0,1,0,0|1,0,0]=3 28762 B14R1.123 CCCCCNCCC1CCCCC1 270004a_100000209983_100011713444 [0,1,0,1,0,0|1,0,0]=3 28763 B14R1.123 CCCCCNCCC1CCCCC1 34a_100000738074_100000718602 [0,1,0,1,0,0|1,0,0]=3 28764 B14R1.123 CCCCCNCCC1CCCCO1 2230a_100015183643_100000210326 [0,1,0,1,0,0|0,0,0]=2 28765 B14R1.123 CCCCCNCCC1CCCCO1 34a_100015183643_100000718602 [0,1,0,1,0,0|0,0,0]=2 28766 B14R1.123 CCCCCNCCC1CCOCC1 2230a_100000209983_100011934994 [0,1,0,1,0,0|2,0,0]=4 28767 B14R1.123 CCCCCNCCC1CCOCC1 2230a_100000755988_100000210326 [0,1,0,1,0,0|2,0,0]=4 28768 B14R1.123 CCCCCNCCC1CCOCC1 34a_100000755988_100000718602 [0,1,0,1,0,0|2,0,0]=4 28769 B14R1.123 CCCCCNCCC1OCCCO1 2230a_100000209983_100000764188 [0,1,0,1,0,0|1,0,0]=3 28770 B14R1.123 CCCCCNCCN1CCCCC1 2230a_100000209983_100000739454 [0,1,0,1,0,0|2,0,0]=4 28771 B14R1.123 CCCCCNCOC1CCCCC1 2230a_100000209983_100011935260 [0,1,0,1,0,0|2,0,0]=4 28772 B14R1.123 CCCCCOCCC1CCCCC1 34a_100000210253_100011209188 [0,1,0,1,0,0|1,0,0]=3 28773 B14R1.123 CCCCCOCCC1CCCCC1 34a_100011217863_100000718602 [0,1,0,1,0,0|1,0,0]=3 28774 B14R1.123 CCCCCOCCC1CCCCC1 7a_100000210253_100011273959 [0,1,0,1,0,0|1,0,0]=3 28775 B14R1.123 CCCCCOCCC1CCCCC1 7a_100011217863_100000210326 [0,1,0,1,0,0|1,0,0]=3 28776 B14R1.123 CCCCCOCCC1CCCCN1 34a_100000211664_100000718602 [0,1,0,1,0,0|1,0,0]=3 28777 B14R1.123 CCCCCOCCC1CCCNC1 34a_100000752241_100000718602 [0,1,0,1,0,0|2,0,0]=4 28778 B14R1.123 CCCCCOCCC1CCNCC1 34a_100015190746_100000718602 [0,1,0,1,0,0|2,0,0]=4 28779 B14R1.123 CCCCCOCCC1CCOCC1 34a_100000210253_100011934994 [0,1,0,1,0,0|2,0,0]=4 28780 B14R1.123 CCCCCOCCC1CCOCC1 34a_100011933979_100000718602 [0,1,0,1,0,0|2,0,0]=4 28781 B14R1.123 CCCCCOCCC1CCOCC1 7a_100000210253_100011934994 [0,1,0,1,0,0|2,0,0]=4 28782 B14R1.123 CCCCCOCCC1CCOCC1 7a_100011933979_100000210326 [0,1,0,1,0,0|2,0,0]=4 28783 B14R1.123 CCCCCOCCC1OCCCO1 34a_100000210253_100000764188 [0,1,0,1,0,0|1,0,0]=3 28784 B14R1.123 CCCCCOCCC1OCCCO1 7a_100000210253_100000764188 [0,1,0,1,0,0|1,0,0]=3 28785 B14R1.123 CCCCCOCCC1SCCCS1 34a_200011025297_100000718602 [0,1,0,1,0,0|1,1,0]=4 28786 B14R1.123 CCCCCOCCC1SCCCS1 7a_200011025297_100000210326 [0,1,0,1,0,0|1,1,0]=4 28787 B14R1.123 CCCCCOCCN1CCCCC1 34a_100000210253_100000739454 [0,1,0,1,0,0|2,0,0]=4 28788 B14R1.123 CCCCCOCCN1CCCCC1 7a_100000210253_100000739454 [0,1,0,1,0,0|2,0,0]=4 28789 B14R1.123 CCCCCOCC[C@@H]1CNCCN1 34a_100016989929_100000718602 [0,1,0,1,0,0|2,0,0]=4 28790 B14R1.123 CCCCCOCOC1CCCCC1 34a_100000210253_100011935260 [0,1,0,1,0,0|2,0,0]=4 28791 B14R1.123 CCCCCOCOC1CCCCC1 7a_100000210253_100011935260 [0,1,0,1,0,0|2,0,0]=4 28792 B14R1.123 CCCCCSCCC1CCCCC1 62a_100000210326_100012355289 [0,1,0,1,0,0|1,0,0]=3 28793 B14R1.123 CCCCCSCCC1CCCCC1 62a_100012355289_100000210326 [0,1,0,1,0,0|1,0,0]=3 28794 B14R1.123 CCCCCSCCC1CCOCC1 62a_100000210326_100011934994 [0,1,0,1,0,0|2,0,0]=4 28795 B14R1.123 CCCCCSCCC1CCOCC1 62a_100011934994_100000210326 [0,1,0,1,0,0|2,0,0]=4 28796 B14R1.123 CCCCCSCCC1OCCCO1 62a_100000210326_100000764188 [0,1,0,1,0,0|1,0,0]=3 28797 B14R1.123 CCCCCSCCC1OCCCO1 62a_100000764188_100000210326 [0,1,0,1,0,0|1,0,0]=3 28798 B14R1.123 CCCCCSCCN1CCCCC1 62a_100000210326_100000739454 [0,1,0,1,0,0|2,0,0]=4 28799 B14R1.123 CCCCCSCCN1CCCCC1 62a_100000739454_100000210326 [0,1,0,1,0,0|2,0,0]=4 28800 B14R1.123 CCCCCSCOC1CCCCC1 62a_100000210326_100011935260 [0,1,0,1,0,0|2,0,0]=4 28801 B14R1.123 CCCCCSCOC1CCCCC1 62a_100011935260_100000210326 [0,1,0,1,0,0|2,0,0]=4 28802 B14R1.123 CCCCNCCCC1CCCCC1 2230a_100000102301_100011713725 [0,1,0,1,0,0|1,0,0]=3 28803 B14R1.123 CCCCNCCCC1CCCCC1 2230a_100011211642_100000210211 [0,1,0,1,0,0|1,0,0]=3 28804 B14R1.123 CCCCNCCCC1CCCCC1 34a_100011211642_100000210210 [0,1,0,1,0,0|1,0,0]=3 28805 B14R1.123 CCCCNCCCC1CCCCC1 7a_106832991798_100011713725 [0,1,0,1,0,0|1,0,0]=3 28806 B14R1.123 CCCCNCCCN1CCCCC1 2230a_100000102301_100000690320 [0,1,0,1,0,0|2,0,0]=4 28807 B14R1.123 CCCCNCCCN1CCCCC1 7a_106832991798_100000007876 [0,1,0,1,0,0|2,0,0]=4 28808 B14R1.123 CCCCNCCOC1CCCCC1 2230a_100000102301_100011211530 [0,1,0,1,0,0|2,0,0]=4 28809 B14R1.123 CCCCNCCOC1CCCCC1 34a_100015206981_100000210210 [0,1,0,1,0,0|2,0,0]=4 28810 B14R1.123 CCCCNCCOC1CCCCC1 7a_106832991798_100011211530 [0,1,0,1,0,0|2,0,0]=4 28811 B14R1.123 CCCCNCCOC1CCCCO1 2230a_100000102301_100000744793 [0,1,0,1,0,0|1,0,0]=3 28812 B14R1.123 CCCCNCCOC1CCCCO1 7a_106832991798_100000744793 [0,1,0,1,0,0|1,0,0]=3 28813 B14R1.123 CCCCOCCCC1CCCCC1 34a_100000198086_100000210210 [0,1,0,1,0,0|1,0,0]=3 28814 B14R1.123 CCCCOCCCC1CCCCC1 34a_100000210227_100011713725 [0,1,0,1,0,0|1,0,0]=3 28815 B14R1.123 CCCCOCCCC1CCCCC1 7a_100000198086_100000210211 [0,1,0,1,0,0|1,0,0]=3 28816 B14R1.123 CCCCOCCCC1CCCCC1 7a_100000210227_100011713725 [0,1,0,1,0,0|1,0,0]=3 28817 B14R1.123 CCCCOCCCC1CCCCN1 34a_100011934581_100000210210 [0,1,0,1,0,0|1,0,0]=3 28818 B14R1.123 CCCCOCCCC1CCCNC1 34a_100150707839_100000210210 [0,1,0,1,0,0|2,0,0]=4 28819 B14R1.123 CCCCOCCCC1CCNCC1 34a_100016988962_100000210210 [0,1,0,1,0,0|2,0,0]=4 28820 B14R1.123 CCCCOCCCN1CCCCC1 34a_100000210227_100000690320 [0,1,0,1,0,0|2,0,0]=4 28821 B14R1.123 CCCCOCCCN1CCCCC1 34a_100000212458_100000210210 [0,1,0,1,0,0|2,0,0]=4 28822 B14R1.123 CCCCOCCCN1CCCCC1 7a_100000210227_100000007876 [0,1,0,1,0,0|2,0,0]=4 28823 B14R1.123 CCCCOCCNC1CCCCC1 2230a_100000182618_100000743108 [0,1,0,1,0,0|2,0,0]=4 28824 B14R1.123 CCCCOCCNC1CCCCC1 34a_100000182618_100000743108 [0,1,0,1,0,0|2,0,0]=4 28825 B14R1.123 CCCCOCCNC1CCCCC1 34a_100000200466_100000210210 [0,1,0,1,0,0|2,0,0]=4 28826 B14R1.123 CCCCOCCNC1CCCOC1 2230a_100000719290_100000743108 [0,1,0,1,0,0|2,0,0]=4 28827 B14R1.123 CCCCOCCNC1CCCOC1 34a_100000719290_100000743108 [0,1,0,1,0,0|2,0,0]=4 28828 B14R1.123 CCCCOCCOC1CCCCC1 34a_100000210227_100011211530 [0,1,0,1,0,0|2,0,0]=4 28829 B14R1.123 CCCCOCCOC1CCCCC1 34a_100000210231_100000743108 [0,1,0,1,0,0|2,0,0]=4 28830 B14R1.123 CCCCOCCOC1CCCCC1 34a_100000210238_100000210327 [0,1,0,1,0,0|2,0,0]=4 28831 B14R1.123 CCCCOCCOC1CCCCC1 34a_100011249652_100000210210 [0,1,0,1,0,0|2,0,0]=4 28832 B14R1.123 CCCCOCCOC1CCCCC1 7a_100000210227_100011211530 [0,1,0,1,0,0|2,0,0]=4 28833 B14R1.123 CCCCOCCOC1CCCCC1 7a_100000210231_100000743108 [0,1,0,1,0,0|2,0,0]=4 28834 B14R1.123 CCCCOCCOC1CCCCC1 7a_100000210238_100000210327 [0,1,0,1,0,0|2,0,0]=4 28835 B14R1.123 CCCCOCCOC1CCCCC1 7a_100011249652_100000210211 [0,1,0,1,0,0|2,0,0]=4 28836 B14R1.123 CCCCOCCOC1CCCCO1 34a_100000033831_100000743108 [0,1,0,1,0,0|1,0,0]=3 28837 B14R1.123 CCCCOCCOC1CCCCO1 34a_100000034223_100000210210 [0,1,0,1,0,0|1,0,0]=3 28838 B14R1.123 CCCCOCCOC1CCCCO1 34a_100000210227_100000744793 [0,1,0,1,0,0|1,0,0]=3 28839 B14R1.123 CCCCOCCOC1CCCCO1 7a_100000034223_100000210211 [0,1,0,1,0,0|1,0,0]=3 28840 B14R1.123 CCCCOCCOC1CCCCO1 7a_100000210227_100000744793 [0,1,0,1,0,0|1,0,0]=3 28841 B14R1.123 CCCCOCCOC1CCCOC1 34a_100000210238_100000693364 [0,1,0,1,0,0|2,0,0]=4 28842 B14R1.123 CCCCOCCOC1CCCOC1 34a_100000754041_100000743108 [0,1,0,1,0,0|2,0,0]=4 28843 B14R1.123 CCCCOCCOC1CCCOC1 7a_100000210238_100000693364 [0,1,0,1,0,0|2,0,0]=4 28844 B14R1.123 CCCCOCCSC1CCCCC1 62a_100000210327_100000743108 [0,1,0,1,0,0|2,0,0]=4 28845 B14R1.123 CCCCOCCSC1CCCCC1 62a_100000743108_100000210327 [0,1,0,1,0,0|2,0,0]=4 28846 B14R1.123 CCCCOCCSC1CCCOC1 62a_100000743108_100000693364 [0,1,0,1,0,0|2,0,0]=4 28847 B14R1.123 CCCCOCNCC1CCCCC1 2230a_100000210473_100011995733 [0,1,0,1,0,0|2,0,0]=4 28848 B14R1.123 CCCCOCNCC1CCCCC1 34a_100000210473_100011995733 [0,1,0,1,0,0|2,0,0]=4 28849 B14R1.123 CCCCOCNCC1CCCCO1 2230a_100000174945_100011995733 [0,1,0,1,0,0|1,0,0]=3 28850 B14R1.123 CCCCOCNCC1CCCCO1 34a_100000174945_100011995733 [0,1,0,1,0,0|1,0,0]=3 28851 B14R1.123 CCCCOCNCC1CCCOC1 2230a_100000720124_100011995733 [0,1,0,1,0,0|2,0,0]=4 28852 B14R1.123 CCCCOCNCC1CCCOC1 34a_100000720124_100011995733 [0,1,0,1,0,0|2,0,0]=4 28853 B14R1.123 CCCCOCNC[C@H]1COCCO1 2230a_100010981119_100011995733 [0,1,0,1,0,0|2,0,0]=4 28854 B14R1.123 CCCCOCNC[C@H]1COCCO1 34a_100010981119_100011995733 [0,1,0,1,0,0|2,0,0]=4 28855 B14R1.123 CCCCOCOCC1CCCCC1 34a_100000212181_100011995733 [0,1,0,1,0,0|2,0,0]=4 28856 B14R1.123 CCCCOCOCC1CCCCN1 34a_100000210821_100011995733 [0,1,0,1,0,0|2,0,0]=4 28857 B14R1.123 CCCCOCOCC1CCCCO1 34a_100000211370_100011995733 [0,1,0,1,0,0|1,0,0]=3 28858 B14R1.123 CCCCOCOCC1CCCOC1 34a_100000741520_100011995733 [0,1,0,1,0,0|2,0,0]=4 28859 B14R1.123 CCCCOCOC[C@@H]1CNCCO1 34a_100015189573_100011995733 [0,1,0,1,0,0|2,0,0]=4 28860 B14R1.123 CCCCOCOC[C@H]1COCCO1 34a_100009875890_100011995733 [0,1,0,1,0,0|2,0,0]=4 28861 B14R1.123 CCCCOCSCC1CCCCC1 62a_100000211423_100011995733 [0,1,0,1,0,0|2,0,0]=4 28862 B14R1.123 CCCCOCSCC1CCCCC1 62a_100011995733_100000211423 [0,1,0,1,0,0|2,0,0]=4 28863 B14R1.123 CCCCOCSCC1CCCCO1 62a_100000211543_100011995733 [0,1,0,1,0,0|1,0,0]=3 28864 B14R1.123 CCCCOCSCC1CCCCO1 62a_100011995733_100000211543 [0,1,0,1,0,0|1,0,0]=3 28865 B14R1.123 CCCCOCSCC1CCCOC1 62a_100000741521_100011995733 [0,1,0,1,0,0|2,0,0]=4 28866 B14R1.123 CCCCOCSCC1CCCOC1 62a_100011995733_100000741521 [0,1,0,1,0,0|2,0,0]=4 28867 B14R1.123 CCCCSCCCC1CCCCC1 62a_100000210211_100011713725 [0,1,0,1,0,0|1,0,0]=3 28868 B14R1.123 CCCCSCCCC1CCCCC1 62a_100011713725_100000210210 [0,1,0,1,0,0|1,0,0]=3 28869 B14R1.123 CCCCSCCCN1CCCCC1 62a_100000210211_100000007876 [0,1,0,1,0,0|2,0,0]=4 28870 B14R1.123 CCCCSCCCN1CCCCC1 62a_100132302099_100000210210 [0,1,0,1,0,0|2,0,0]=4 28871 B14R1.123 CCCCSCCNC1CCCCC1 270004a_100025743550_100000210434 [0,1,0,1,0,0|2,0,0]=4 28872 B14R1.123 CCCCSCCNC1CCCOC1 270004a_100025743550_100000753404 [0,1,0,1,0,0|2,0,0]=4 28873 B14R1.123 CCCCSCCOC1CCCCC1 34a_200000230436_100000210327 [0,1,0,1,0,0|2,0,0]=4 28874 B14R1.123 CCCCSCCOC1CCCCC1 62a_100000210211_100011211530 [0,1,0,1,0,0|2,0,0]=4 28875 B14R1.123 CCCCSCCOC1CCCCC1 62a_100011211530_100000210210 [0,1,0,1,0,0|2,0,0]=4 28876 B14R1.123 CCCCSCCOC1CCCCC1 7a_200000230436_100000210327 [0,1,0,1,0,0|2,0,0]=4 28877 B14R1.123 CCCCSCCOC1CCCCO1 62a_100000210211_100000744793 [0,1,0,1,0,0|1,0,0]=3 28878 B14R1.123 CCCCSCCOC1CCCCO1 62a_100000744793_100000210210 [0,1,0,1,0,0|1,0,0]=3 28879 B14R1.123 CCCCSCCOC1CCCOC1 34a_200000230436_100000693364 [0,1,0,1,0,0|2,0,0]=4 28880 B14R1.123 CCCCSCCOC1CCCOC1 7a_200000230436_100000693364 [0,1,0,1,0,0|2,0,0]=4 28881 B14R1.123 CCCNCCCOC1CCCCC1 34a_100000205933_100000210303 [0,1,0,1,0,0|2,0,0]=4 28882 B14R1.123 CCCOCCCCC1CCCCC1 34a_100011215267_100000210303 [0,1,0,1,0,0|1,0,0]=3 28883 B14R1.123 CCCOCCCCC1CCCCC1 7a_100011215267_100000210303 [0,1,0,1,0,0|1,0,0]=3 28884 B14R1.123 CCCOCCCCC1CCNCC1 34a_100016989291_100000210303 [0,1,0,1,0,0|2,0,0]=4 28885 B14R1.123 CCCOCCCNC1CCCCC1 270004a_100011217757_100000210434 [0,1,0,1,0,0|2,0,0]=4 28886 B14R1.123 CCCOCCCNC1CCCCC1 34a_100011217757_100000210327 [0,1,0,1,0,0|2,0,0]=4 28887 B14R1.123 CCCOCCCNC1CCCOC1 270004a_100011217757_100000753404 [0,1,0,1,0,0|2,0,0]=4 28888 B14R1.123 CCCOCCCNC1CCCOC1 34a_100011217757_100000693364 [0,1,0,1,0,0|2,0,0]=4 28889 B14R1.123 CCCOCCCOC1CCCCO1 34a_100000210258_100000700653 [0,1,0,1,0,0|1,0,0]=3 28890 B14R1.123 CCCOCCNCC1CCCCC1 2230a_100000210473_100011215938 [0,1,0,1,0,0|2,0,0]=4 28891 B14R1.123 CCCOCCNCC1CCCCC1 2230a_100161115042_100000211423 [0,1,0,1,0,0|2,0,0]=4 28892 B14R1.123 CCCOCCNCC1CCCCC1 269862a_100161115042_100000211278 [0,1,0,1,0,0|2,0,0]=4 28893 B14R1.123 CCCOCCNCC1CCCCC1 34a_100000210473_100011215938 [0,1,0,1,0,0|2,0,0]=4 28894 B14R1.123 CCCOCCNCC1CCCCC1 34a_100161115042_100000211423 [0,1,0,1,0,0|2,0,0]=4 28895 B14R1.123 CCCOCCNCC1CCCCO1 2230a_100000174945_100011215938 [0,1,0,1,0,0|1,0,0]=3 28896 B14R1.123 CCCOCCNCC1CCCCO1 2230a_100161115042_100000211543 [0,1,0,1,0,0|1,0,0]=3 28897 B14R1.123 CCCOCCNCC1CCCCO1 34a_100000174945_100011215938 [0,1,0,1,0,0|1,0,0]=3 28898 B14R1.123 CCCOCCNCC1CCCCO1 34a_100161115042_100000211543 [0,1,0,1,0,0|1,0,0]=3 28899 B14R1.123 CCCOCCNCC1CCCOC1 2230a_100000720124_100011215938 [0,1,0,1,0,0|2,0,0]=4 28900 B14R1.123 CCCOCCNCC1CCCOC1 2230a_100161115042_100000741521 [0,1,0,1,0,0|2,0,0]=4 28901 B14R1.123 CCCOCCNCC1CCCOC1 34a_100000720124_100011215938 [0,1,0,1,0,0|2,0,0]=4 28902 B14R1.123 CCCOCCNCC1CCCOC1 34a_100161115042_100000741521 [0,1,0,1,0,0|2,0,0]=4 28903 B14R1.123 CCCOCCNC[C@H]1COCCO1 2230a_100010981119_100011215938 [0,1,0,1,0,0|2,0,0]=4 28904 B14R1.123 CCCOCCNC[C@H]1COCCO1 34a_100010981119_100011215938 [0,1,0,1,0,0|2,0,0]=4 28905 B14R1.123 CCCOCCOCC1CCCCC1 34a_100000212181_100011215938 [0,1,0,1,0,0|2,0,0]=4 28906 B14R1.123 CCCOCCOCC1CCCCC1 34a_100000752267_100000211423 [0,1,0,1,0,0|2,0,0]=4 28907 B14R1.123 CCCOCCOCC1CCCCC1 7a_100000212181_100011215938 [0,1,0,1,0,0|2,0,0]=4 28908 B14R1.123 CCCOCCOCC1CCCCC1 7a_100000752267_100000211423 [0,1,0,1,0,0|2,0,0]=4 28909 B14R1.123 CCCOCCOCC1CCCCN1 34a_100000210821_100011215938 [0,1,0,1,0,0|2,0,0]=4 28910 B14R1.123 CCCOCCOCC1CCCCO1 34a_100000211370_100011215938 [0,1,0,1,0,0|1,0,0]=3 28911 B14R1.123 CCCOCCOCC1CCCCO1 34a_100000752267_100000211543 [0,1,0,1,0,0|1,0,0]=3 28912 B14R1.123 CCCOCCOCC1CCCCO1 7a_100000211370_100011215938 [0,1,0,1,0,0|1,0,0]=3 28913 B14R1.123 CCCOCCOCC1CCCCO1 7a_100000752267_100000211543 [0,1,0,1,0,0|1,0,0]=3 28914 B14R1.123 CCCOCCOCC1CCCOC1 34a_100000741520_100011215938 [0,1,0,1,0,0|2,0,0]=4 28915 B14R1.123 CCCOCCOCC1CCCOC1 34a_100000752267_100000741521 [0,1,0,1,0,0|2,0,0]=4 28916 B14R1.123 CCCOCCOCC1CCCOC1 7a_100000752267_100000741521 [0,1,0,1,0,0|2,0,0]=4 28917 B14R1.123 CCCOCCOC[C@@H]1CNCCO1 34a_100015189573_100011215938 [0,1,0,1,0,0|2,0,0]=4 28918 B14R1.123 CCCOCCOC[C@H]1COCCO1 34a_100009875890_100011215938 [0,1,0,1,0,0|2,0,0]=4 28919 B14R1.123 CCCOCCSCC1CCCCC1 62a_100000211423_100011215938 [0,1,0,1,0,0|2,0,0]=4 28920 B14R1.123 CCCOCCSCC1CCCCC1 62a_100011215938_100000211423 [0,1,0,1,0,0|2,0,0]=4 28921 B14R1.123 CCCOCCSCC1CCCCO1 62a_100000211543_100011215938 [0,1,0,1,0,0|1,0,0]=3 28922 B14R1.123 CCCOCCSCC1CCCCO1 62a_100011215938_100000211543 [0,1,0,1,0,0|1,0,0]=3 28923 B14R1.123 CCCOCCSCC1CCCOC1 62a_100000741521_100011215938 [0,1,0,1,0,0|2,0,0]=4 28924 B14R1.123 CCCOCCSCC1CCCOC1 62a_100011215938_100000741521 [0,1,0,1,0,0|2,0,0]=4 28925 B14R1.123 CCCSCCCOC1CCCCO1 62a_100000210303_100000700653 [0,1,0,1,0,0|1,0,0]=3 28926 B14R1.123 CCCSCCCOC1CCCCO1 62a_100000700653_100000210303 [0,1,0,1,0,0|1,0,0]=3 28927 B14R1.123 CCCSCCNCC1CCCCC1 2230a_100020603323_100000211423 [0,1,0,1,0,0|2,0,0]=4 28928 B14R1.123 CCCSCCNCC1CCCCC1 269862a_100020603323_100000211278 [0,1,0,1,0,0|2,0,0]=4 28929 B14R1.123 CCCSCCNCC1CCCCO1 2230a_100020603323_100000211543 [0,1,0,1,0,0|1,0,0]=3 28930 B14R1.123 CCCSCCNCC1CCCOC1 2230a_100020603323_100000741521 [0,1,0,1,0,0|2,0,0]=4 28931 B14R1.123 CCCSCCOCC1CCCCC1 34a_200000230433_100000211423 [0,1,0,1,0,0|2,0,0]=4 28932 B14R1.123 CCCSCCOCC1CCCCC1 7a_200000230433_100000211423 [0,1,0,1,0,0|2,0,0]=4 28933 B14R1.123 CCCSCCOCC1CCCCO1 34a_200000230433_100000211543 [0,1,0,1,0,0|1,0,0]=3 28934 B14R1.123 CCCSCCOCC1CCCCO1 7a_200000230433_100000211543 [0,1,0,1,0,0|1,0,0]=3 28935 B14R1.123 CCCSCCOCC1CCCOC1 34a_200000230433_100000741521 [0,1,0,1,0,0|2,0,0]=4 28936 B14R1.123 CCCSCCOCC1CCCOC1 7a_200000230433_100000741521 [0,1,0,1,0,0|2,0,0]=4 28937 B14R1.123 CCNCCCCOC1CCCCO1 2230a_100015525214_100000031530 [0,1,0,1,0,0|1,0,0]=3 28938 B14R1.123 CCOCCCCCN1CCCCC1 34a_100011216611_100000210202 [0,1,0,1,0,0|2,0,0]=4 28939 B14R1.123 CCOCCCCCN1CCCCC1 7a_100011216611_100000210202 [0,1,0,1,0,0|2,0,0]=4 28940 B14R1.123 CCOCCCCOC1CCCCO1 34a_100121572206_100000031530 [0,1,0,1,0,0|1,0,0]=3 28941 B14R1.123 CCOCCCNCC1CCCCC1 2230a_100000210473_100012232248 [0,1,0,1,0,0|2,0,0]=4 28942 B14R1.123 CCOCCCNCC1CCCCC1 2230a_100000210961_100000211423 [0,1,0,1,0,0|2,0,0]=4 28943 B14R1.123 CCOCCCNCC1CCCCC1 269862a_100000210961_100000211278 [0,1,0,1,0,0|2,0,0]=4 28944 B14R1.123 CCOCCCNCC1CCCCC1 34a_100000210473_100012232248 [0,1,0,1,0,0|2,0,0]=4 28945 B14R1.123 CCOCCCNCC1CCCCC1 34a_100000210961_100000211423 [0,1,0,1,0,0|2,0,0]=4 28946 B14R1.123 CCOCCCNCC1CCCCO1 2230a_100000174945_100012232248 [0,1,0,1,0,0|1,0,0]=3 28947 B14R1.123 CCOCCCNCC1CCCCO1 2230a_100000210961_100000211543 [0,1,0,1,0,0|1,0,0]=3 28948 B14R1.123 CCOCCCNCC1CCCCO1 34a_100000174945_100012232248 [0,1,0,1,0,0|1,0,0]=3 28949 B14R1.123 CCOCCCNCC1CCCCO1 34a_100000210961_100000211543 [0,1,0,1,0,0|1,0,0]=3 28950 B14R1.123 CCOCCCNCC1CCCOC1 2230a_100000210961_100000741521 [0,1,0,1,0,0|2,0,0]=4 28951 B14R1.123 CCOCCCNCC1CCCOC1 2230a_100000720124_100012232248 [0,1,0,1,0,0|2,0,0]=4 28952 B14R1.123 CCOCCCNCC1CCCOC1 34a_100000210961_100000741521 [0,1,0,1,0,0|2,0,0]=4 28953 B14R1.123 CCOCCCNCC1CCCOC1 34a_100000720124_100012232248 [0,1,0,1,0,0|2,0,0]=4 28954 B14R1.123 CCOCCCNC[C@H]1COCCO1 2230a_100010981119_100012232248 [0,1,0,1,0,0|2,0,0]=4 28955 B14R1.123 CCOCCCNC[C@H]1COCCO1 34a_100010981119_100012232248 [0,1,0,1,0,0|2,0,0]=4 28956 B14R1.123 CCOCCCOCC1CCCCC1 34a_100000212181_100012232248 [0,1,0,1,0,0|2,0,0]=4 28957 B14R1.123 CCOCCCOCC1CCCCC1 34a_100000757476_100000211423 [0,1,0,1,0,0|2,0,0]=4 28958 B14R1.123 CCOCCCOCC1CCCCC1 7a_100000212181_100012232248 [0,1,0,1,0,0|2,0,0]=4 28959 B14R1.123 CCOCCCOCC1CCCCC1 7a_100000757476_100000211423 [0,1,0,1,0,0|2,0,0]=4 28960 B14R1.123 CCOCCCOCC1CCCCN1 34a_100000210821_100012232248 [0,1,0,1,0,0|2,0,0]=4 28961 B14R1.123 CCOCCCOCC1CCCCO1 34a_100000211370_100012232248 [0,1,0,1,0,0|1,0,0]=3 28962 B14R1.123 CCOCCCOCC1CCCCO1 34a_100000757476_100000211543 [0,1,0,1,0,0|1,0,0]=3 28963 B14R1.123 CCOCCCOCC1CCCCO1 7a_100000211370_100012232248 [0,1,0,1,0,0|1,0,0]=3 28964 B14R1.123 CCOCCCOCC1CCCCO1 7a_100000757476_100000211543 [0,1,0,1,0,0|1,0,0]=3 28965 B14R1.123 CCOCCCOCC1CCCOC1 34a_100000741520_100012232248 [0,1,0,1,0,0|2,0,0]=4 28966 B14R1.123 CCOCCCOCC1CCCOC1 34a_100000757476_100000741521 [0,1,0,1,0,0|2,0,0]=4 28967 B14R1.123 CCOCCCOCC1CCCOC1 7a_100000757476_100000741521 [0,1,0,1,0,0|2,0,0]=4 28968 B14R1.123 CCOCCCOC[C@@H]1CNCCO1 34a_100015189573_100012232248 [0,1,0,1,0,0|2,0,0]=4 28969 B14R1.123 CCOCCCOC[C@H]1COCCO1 34a_100009875890_100012232248 [0,1,0,1,0,0|2,0,0]=4 28970 B14R1.123 CCOCCCSCC1CCCCC1 62a_100000211423_100012232248 [0,1,0,1,0,0|2,0,0]=4 28971 B14R1.123 CCOCCCSCC1CCCCC1 62a_100012232248_100000211423 [0,1,0,1,0,0|2,0,0]=4 28972 B14R1.123 CCOCCCSCC1CCCCO1 62a_100000211543_100012232248 [0,1,0,1,0,0|1,0,0]=3 28973 B14R1.123 CCOCCCSCC1CCCCO1 62a_100012232248_100000211543 [0,1,0,1,0,0|1,0,0]=3 28974 B14R1.123 CCOCCCSCC1CCCOC1 62a_100000741521_100012232248 [0,1,0,1,0,0|2,0,0]=4 28975 B14R1.123 CCOCCCSCC1CCCOC1 62a_100012232248_100000741521 [0,1,0,1,0,0|2,0,0]=4 28976 B14R1.123 CCOCCNCCC1CCCCC1 2230a_100000738074_100011215890 [0,1,0,1,0,0|2,0,0]=4 28977 B14R1.123 CCOCCNCCC1CCCCC1 2230a_102516460346_100012355289 [0,1,0,1,0,0|2,0,0]=4 28978 B14R1.123 CCOCCNCCC1CCCCC1 270004a_102516460346_100011713444 [0,1,0,1,0,0|2,0,0]=4 28979 B14R1.123 CCOCCNCCC1CCCCC1 34a_100000738074_100000210147 [0,1,0,1,0,0|2,0,0]=4 28980 B14R1.123 CCOCCNCCC1CCCCC1 34a_102516460346_100011209188 [0,1,0,1,0,0|2,0,0]=4 28981 B14R1.123 CCOCCNCCC1CCCCO1 2230a_100015183643_100011215890 [0,1,0,1,0,0|1,0,0]=3 28982 B14R1.123 CCOCCNCCC1CCCCO1 34a_100015183643_100000210147 [0,1,0,1,0,0|1,0,0]=3 28983 B14R1.123 CCOCCNCCC1OCCCO1 2230a_102516460346_100000764188 [0,1,0,1,0,0|2,0,0]=4 28984 B14R1.123 CCOCCNCCC1OCCCO1 34a_102516460346_100000764188 [0,1,0,1,0,0|2,0,0]=4 28985 B14R1.123 CCOCCOCCC1CCCCC1 34a_100000210136_100011209188 [0,1,0,1,0,0|2,0,0]=4 28986 B14R1.123 CCOCCOCCC1CCCCC1 34a_100011217863_100000210147 [0,1,0,1,0,0|2,0,0]=4 28987 B14R1.123 CCOCCOCCC1CCCCC1 7a_100000210136_100011273959 [0,1,0,1,0,0|2,0,0]=4 28988 B14R1.123 CCOCCOCCC1CCCCC1 7a_100011217863_100011215890 [0,1,0,1,0,0|2,0,0]=4 28989 B14R1.123 CCOCCOCCC1CCCCN1 34a_100000211664_100000210147 [0,1,0,1,0,0|2,0,0]=4 28990 B14R1.123 CCOCCOCCC1OCCCO1 34a_100000210136_100000764188 [0,1,0,1,0,0|2,0,0]=4 28991 B14R1.123 CCOCCOCCC1OCCCO1 7a_100000210136_100000764188 [0,1,0,1,0,0|2,0,0]=4 28992 B14R1.123 CCOCCSCCC1CCCCC1 62a_100000210147_100012355289 [0,1,0,1,0,0|2,0,0]=4 28993 B14R1.123 CCOCCSCCC1CCCCC1 62a_100012355289_100011215890 [0,1,0,1,0,0|2,0,0]=4 28994 B14R1.123 CCOCCSCCC1OCCCO1 62a_100000210147_100000764188 [0,1,0,1,0,0|2,0,0]=4 28995 B14R1.123 CCOCCSCCC1OCCCO1 62a_100000764188_100011215890 [0,1,0,1,0,0|2,0,0]=4 28996 B14R1.123 CCOCSCCCC1CCCCC1 62a_100000739092_100011713725 [0,1,0,1,0,0|2,0,0]=4 28997 B14R1.123 CCOCSCCCC1CCCCC1 62a_100011713725_100000739092 [0,1,0,1,0,0|2,0,0]=4 28998 B14R1.123 CCOCSCCOC1CCCCO1 62a_100000739092_100000744793 [0,1,0,1,0,0|2,0,0]=4 28999 B14R1.123 CCOCSCCOC1CCCCO1 62a_100000744793_100000739092 [0,1,0,1,0,0|2,0,0]=4 29000 B14R1.123 CCSCCCCOC1CCCCO1 62a_100000031530_100000210202 [0,1,0,1,0,0|1,0,0]=3 29001 B14R1.123 CCSCCCCOC1CCCCO1 62a_100000210202_100000031530 [0,1,0,1,0,0|1,0,0]=3 29002 B14R1.123 CCSCCCOCC1CCCCC1 34a_100011216438_100000211423 [0,1,0,1,0,0|2,0,0]=4 29003 B14R1.123 CCSCCCOCC1CCCCC1 7a_100011216438_100000211423 [0,1,0,1,0,0|2,0,0]=4 29004 B14R1.123 CCSCCCOCC1CCCCO1 34a_100011216438_100000211543 [0,1,0,1,0,0|1,0,0]=3 29005 B14R1.123 CCSCCCOCC1CCCCO1 7a_100011216438_100000211543 [0,1,0,1,0,0|1,0,0]=3 29006 B14R1.123 CCSCCCOCC1CCCOC1 34a_100011216438_100000741521 [0,1,0,1,0,0|2,0,0]=4 29007 B14R1.123 CCSCCCOCC1CCCOC1 7a_100011216438_100000741521 [0,1,0,1,0,0|2,0,0]=4 29008 B14R1.123 CCSCCNCCC1CCCCC1 2230a_100000106463_100012355289 [0,1,0,1,0,0|2,0,0]=4 29009 B14R1.123 CCSCCNCCC1CCCCC1 2230a_100000738074_100000757381 [0,1,0,1,0,0|2,0,0]=4 29010 B14R1.123 CCSCCNCCC1CCCCC1 270004a_100000106463_100011713444 [0,1,0,1,0,0|2,0,0]=4 29011 B14R1.123 CCSCCNCCC1CCCCC1 34a_100000738074_100000757381 [0,1,0,1,0,0|2,0,0]=4 29012 B14R1.123 CCSCCNCCC1CCCCO1 2230a_100015183643_100000757381 [0,1,0,1,0,0|1,0,0]=3 29013 B14R1.123 CCSCCNCCC1CCCCO1 34a_100015183643_100000757381 [0,1,0,1,0,0|1,0,0]=3 29014 B14R1.123 CCSCCNCCC1OCCCO1 2230a_100000106463_100000764188 [0,1,0,1,0,0|2,0,0]=4 29015 B14R1.123 CCSCCOCCC1CCCCC1 34a_100000212035_100011209188 [0,1,0,1,0,0|2,0,0]=4 29016 B14R1.123 CCSCCOCCC1CCCCC1 34a_100011217863_100000757381 [0,1,0,1,0,0|2,0,0]=4 29017 B14R1.123 CCSCCOCCC1CCCCC1 7a_100000212035_100011273959 [0,1,0,1,0,0|2,0,0]=4 29018 B14R1.123 CCSCCOCCC1CCCCC1 7a_100011217863_100000757381 [0,1,0,1,0,0|2,0,0]=4 29019 B14R1.123 CCSCCOCCC1CCCCN1 34a_100000211664_100000757381 [0,1,0,1,0,0|2,0,0]=4 29020 B14R1.123 CCSCCOCCC1OCCCO1 34a_100000212035_100000764188 [0,1,0,1,0,0|2,0,0]=4 29021 B14R1.123 CCSCCOCCC1OCCCO1 7a_100000212035_100000764188 [0,1,0,1,0,0|2,0,0]=4 29022 B14R1.123 CCSCCSCCC1CCCCC1 62a_100000757381_100012355289 [0,1,0,1,0,0|2,0,0]=4 29023 B14R1.123 CCSCCSCCC1CCCCC1 62a_100012355289_100000757381 [0,1,0,1,0,0|2,0,0]=4 29024 B14R1.123 CCSCCSCCC1OCCCO1 62a_100000757381_100000764188 [0,1,0,1,0,0|2,0,0]=4 29025 B14R1.123 CCSCCSCCC1OCCCO1 62a_100000764188_100000757381 [0,1,0,1,0,0|2,0,0]=4 29026 B14R1.123 CNCCCCCOC1CCCCC1 34a_100000722520_100000210327 [0,1,0,1,0,0|2,0,0]=4 29027 B14R1.123 CNCCCCCOC1CCCOC1 34a_100000722520_100000693364 [0,1,0,1,0,0|2,0,0]=4 29028 B14R1.123 CNCCCOCCC1CCCCC1 34a_100000213112_100011209188 [0,1,0,1,0,0|2,0,0]=4 29029 B14R1.123 CNCCCOCCC1OCCCO1 34a_100000213112_100000764188 [0,1,0,1,0,0|2,0,0]=4 29030 B14R1.123 COCCCCCCN1CCCOC1 2230a_100000131196_100011998445 [0,1,0,1,0,0|2,0,0]=4 29031 B14R1.123 COCCCCCCN1CCCOC1 269982a_100000131196_100011998445 [0,1,0,1,0,0|2,0,0]=4 29032 B14R1.123 COCCCCCCN1CCCOC1 34a_100000131196_100011998445 [0,1,0,1,0,0|2,0,0]=4 29033 B14R1.123 COCCCCCCN1CCOCC1 2230a_100015191051_100011998445 [0,1,0,1,0,0|2,0,0]=4 29034 B14R1.123 COCCCCCCN1CCOCC1 269982a_100015191051_100011998445 [0,1,0,1,0,0|2,0,0]=4 29035 B14R1.123 COCCCCCCN1CCOCC1 34a_100015191051_100011998445 [0,1,0,1,0,0|2,0,0]=4 29036 B14R1.123 COCCCCCCN1CCSCC1 2230a_100000737611_100011998445 [0,1,0,1,0,0|2,0,0]=4 29037 B14R1.123 COCCCCCCN1CCSCC1 269982a_100000737611_100011998445 [0,1,0,1,0,0|2,0,0]=4 29038 B14R1.123 COCCCCCNC1CCCCC1 270004a_100000747528_100000210434 [0,1,0,1,0,0|1,0,0]=3 29039 B14R1.123 COCCCCCNC1CCCCC1 34a_100000747528_100000210327 [0,1,0,1,0,0|1,0,0]=3 29040 B14R1.123 COCCCCCNC1CCCOC1 270004a_100000747528_100000753404 [0,1,0,1,0,0|2,0,0]=4 29041 B14R1.123 COCCCCCNC1CCCOC1 34a_100000747528_100000693364 [0,1,0,1,0,0|2,0,0]=4 29042 B14R1.123 COCCCCCNC1CCCSC1 270004a_100000747528_100000057913 [0,1,0,1,0,0|2,0,0]=4 29043 B14R1.123 COCCCCCNC1CCNCC1 270004a_100000747528_100015192401 [0,1,0,1,0,0|2,0,0]=4 29044 B14R1.123 COCCCCCNC1CCOCC1 270004a_100000747528_100011217826 [0,1,0,1,0,0|2,0,0]=4 29045 B14R1.123 COCCCCCNC1CCSCC1 270004a_100000747528_100000203788 [0,1,0,1,0,0|2,0,0]=4 29046 B14R1.123 COCCCCCNC1CCSCC1 34a_100000747528_100000069128 [0,1,0,1,0,0|2,0,0]=4 29047 B14R1.123 COCCCCNCC1CCCCC1 2230a_100000210473_100000730899 [0,1,0,1,0,0|1,0,0]=3 29048 B14R1.123 COCCCCNCC1CCCCC1 34a_100000210473_100000755781 [0,1,0,1,0,0|1,0,0]=3 29049 B14R1.123 COCCCCNCC1CCCCO1 2230a_100000174945_100000730899 [0,1,0,1,0,0|1,0,0]=3 29050 B14R1.123 COCCCCNCC1CCCCO1 34a_100000174945_100000755781 [0,1,0,1,0,0|1,0,0]=3 29051 B14R1.123 COCCCCNCC1CCCOC1 2230a_100000720124_100000730899 [0,1,0,1,0,0|2,0,0]=4 29052 B14R1.123 COCCCCNCC1CCCOC1 34a_100000720124_100000755781 [0,1,0,1,0,0|2,0,0]=4 29053 B14R1.123 COCCCCNCC1CCOCC1 2230a_100000746373_100000730899 [0,1,0,1,0,0|2,0,0]=4 29054 B14R1.123 COCCCCNCC1CCOCC1 34a_100000746373_100000755781 [0,1,0,1,0,0|2,0,0]=4 29055 B14R1.123 COCCCCNCC1CCSCC1 2230a_100015188806_100000730899 [0,1,0,1,0,0|2,0,0]=4 29056 B14R1.123 COCCCCNCC1CCSCC1 34a_100015188806_100000755781 [0,1,0,1,0,0|2,0,0]=4 29057 B14R1.123 COCCCCNC[C@H]1COCCO1 2230a_100010981119_100000730899 [0,1,0,1,0,0|2,0,0]=4 29058 B14R1.123 COCCCCNC[C@H]1COCCO1 34a_100010981119_100000755781 [0,1,0,1,0,0|2,0,0]=4 29059 B14R1.123 COCCCCOCC1CCCCC1 34a_100000212181_100000755781 [0,1,0,1,0,0|1,0,0]=3 29060 B14R1.123 COCCCCOCC1CCCCC1 34a_100000740925_100000211423 [0,1,0,1,0,0|1,0,0]=3 29061 B14R1.123 COCCCCOCC1CCCCC1 7a_100000212181_100000730899 [0,1,0,1,0,0|1,0,0]=3 29062 B14R1.123 COCCCCOCC1CCCCN1 34a_100000210821_100000755781 [0,1,0,1,0,0|2,0,0]=4 29063 B14R1.123 COCCCCOCC1CCCCO1 34a_100000211370_100000755781 [0,1,0,1,0,0|1,0,0]=3 29064 B14R1.123 COCCCCOCC1CCCCO1 34a_100000740925_100000211543 [0,1,0,1,0,0|1,0,0]=3 29065 B14R1.123 COCCCCOCC1CCCCO1 7a_100000211370_100000730899 [0,1,0,1,0,0|1,0,0]=3 29066 B14R1.123 COCCCCOCC1CCCNC1 34a_100000211344_100000755781 [0,1,0,1,0,0|2,0,0]=4 29067 B14R1.123 COCCCCOCC1CCCOC1 34a_100000740925_100000741521 [0,1,0,1,0,0|2,0,0]=4 29068 B14R1.123 COCCCCOCC1CCCOC1 34a_100000741520_100000755781 [0,1,0,1,0,0|2,0,0]=4 29069 B14R1.123 COCCCCOCC1CCNCC1 34a_100000738675_100000755781 [0,1,0,1,0,0|2,0,0]=4 29070 B14R1.123 COCCCCOCC1CCOCC1 34a_100000740925_100000754603 [0,1,0,1,0,0|2,0,0]=4 29071 B14R1.123 COCCCCOCC1CCOCC1 34a_100000749013_100000755781 [0,1,0,1,0,0|2,0,0]=4 29072 B14R1.123 COCCCCOCC1CCSCC1 34a_100000070558_100000755781 [0,1,0,1,0,0|2,0,0]=4 29073 B14R1.123 COCCCCOCC1CCSCC1 7a_100000070558_100000730899 [0,1,0,1,0,0|2,0,0]=4 29074 B14R1.123 COCCCCOC[C@@H]1CNCCO1 34a_100015189573_100000755781 [0,1,0,1,0,0|2,0,0]=4 29075 B14R1.123 COCCCCOC[C@H]1COCCO1 34a_100009875890_100000755781 [0,1,0,1,0,0|2,0,0]=4 29076 B14R1.123 COCCCCSCC1CCCCC1 62a_100000211423_100000730899 [0,1,0,1,0,0|1,0,0]=3 29077 B14R1.123 COCCCCSCC1CCCCC1 62a_100000730899_100000211423 [0,1,0,1,0,0|1,0,0]=3 29078 B14R1.123 COCCCCSCC1CCCCO1 62a_100000211543_100000730899 [0,1,0,1,0,0|1,0,0]=3 29079 B14R1.123 COCCCCSCC1CCCCO1 62a_100000730899_100000211543 [0,1,0,1,0,0|1,0,0]=3 29080 B14R1.123 COCCCCSCC1CCCOC1 62a_100000730899_100000741521 [0,1,0,1,0,0|2,0,0]=4 29081 B14R1.123 COCCCCSCC1CCCOC1 62a_100000741521_100000730899 [0,1,0,1,0,0|2,0,0]=4 29082 B14R1.123 COCCCCSCC1CCOCC1 62a_100000730899_100000749018 [0,1,0,1,0,0|2,0,0]=4 29083 B14R1.123 COCCCCSCC1CCOCC1 62a_100000754603_100000730899 [0,1,0,1,0,0|2,0,0]=4 29084 B14R1.123 COCCCNCCC1CCCCC1 2230a_100000738074_100000740836 [0,1,0,1,0,0|1,0,0]=3 29085 B14R1.123 COCCCNCCC1CCCCC1 270004a_100150723488_100011713444 [0,1,0,1,0,0|1,0,0]=3 29086 B14R1.123 COCCCNCCC1CCCCC1 34a_100000738074_100000740836 [0,1,0,1,0,0|1,0,0]=3 29087 B14R1.123 COCCCNCCC1CCCCC1 34a_100150723488_100011209188 [0,1,0,1,0,0|1,0,0]=3 29088 B14R1.123 COCCCNCCC1CCCCO1 2230a_100015183643_100000740836 [0,1,0,1,0,0|1,0,0]=3 29089 B14R1.123 COCCCNCCC1CCCCO1 34a_100015183643_100000740836 [0,1,0,1,0,0|1,0,0]=3 29090 B14R1.123 COCCCNCCC1CCOCC1 2230a_100000755988_100000740836 [0,1,0,1,0,0|2,0,0]=4 29091 B14R1.123 COCCCNCCC1CCOCC1 34a_100000755988_100000740836 [0,1,0,1,0,0|2,0,0]=4 29092 B14R1.123 COCCCNCCC1CCOCC1 34a_100150723488_100011934994 [0,1,0,1,0,0|2,0,0]=4 29093 B14R1.123 COCCCNCCC1OCCCO1 34a_100150723488_100000764188 [0,1,0,1,0,0|2,0,0]=4 29094 B14R1.123 COCCCNCCN1CCCCC1 34a_100150723488_100000739454 [0,1,0,1,0,0|2,0,0]=4 29095 B14R1.123 COCCCNCOC1CCCCC1 34a_100150723488_100011935260 [0,1,0,1,0,0|2,0,0]=4 29096 B14R1.123 COCCCOCCC1CCCCC1 34a_100000740835_100011209188 [0,1,0,1,0,0|1,0,0]=3 29097 B14R1.123 COCCCOCCC1CCCCC1 34a_100011217863_100000740836 [0,1,0,1,0,0|1,0,0]=3 29098 B14R1.123 COCCCOCCC1CCCCC1 7a_100011217863_100000740836 [0,1,0,1,0,0|1,0,0]=3 29099 B14R1.123 COCCCOCCC1CCCCN1 34a_100000211664_100000740836 [0,1,0,1,0,0|2,0,0]=4 29100 B14R1.123 COCCCOCCC1CCCNC1 34a_100000752241_100000740836 [0,1,0,1,0,0|2,0,0]=4 29101 B14R1.123 COCCCOCCC1CCNCC1 34a_100015190746_100000740836 [0,1,0,1,0,0|2,0,0]=4 29102 B14R1.123 COCCCOCCC1CCOCC1 34a_100000740835_100011934994 [0,1,0,1,0,0|2,0,0]=4 29103 B14R1.123 COCCCOCCC1CCOCC1 34a_100011933979_100000740836 [0,1,0,1,0,0|2,0,0]=4 29104 B14R1.123 COCCCOCCC1CCOCC1 7a_100011933979_100000740836 [0,1,0,1,0,0|2,0,0]=4 29105 B14R1.123 COCCCOCCC1OCCCO1 34a_100000740835_100000764188 [0,1,0,1,0,0|2,0,0]=4 29106 B14R1.123 COCCCOCCN1CCCCC1 34a_100000740835_100000739454 [0,1,0,1,0,0|2,0,0]=4 29107 B14R1.123 COCCCOCOC1CCCCC1 34a_100000740835_100011935260 [0,1,0,1,0,0|2,0,0]=4 29108 B14R1.123 COCCCSCCC1CCCCC1 62a_100000709357_100012355289 [0,1,0,1,0,0|1,0,0]=3 29109 B14R1.123 COCCCSCCC1CCCCC1 62a_100012355289_100000709357 [0,1,0,1,0,0|1,0,0]=3 29110 B14R1.123 COCCCSCCC1CCOCC1 62a_100000709357_100011934994 [0,1,0,1,0,0|2,0,0]=4 29111 B14R1.123 COCCCSCCC1CCOCC1 62a_100011934994_100000709357 [0,1,0,1,0,0|2,0,0]=4 29112 B14R1.123 COCCCSCCC1OCCCO1 62a_100000709357_100000764188 [0,1,0,1,0,0|2,0,0]=4 29113 B14R1.123 COCCCSCCC1OCCCO1 62a_100000764188_100000709357 [0,1,0,1,0,0|2,0,0]=4 29114 B14R1.123 COCCCSCCN1CCCCC1 62a_100000709357_100000739454 [0,1,0,1,0,0|2,0,0]=4 29115 B14R1.123 COCCCSCCN1CCCCC1 62a_100000739454_100000709357 [0,1,0,1,0,0|2,0,0]=4 29116 B14R1.123 COCCCSCOC1CCCCC1 62a_100000709357_100011935260 [0,1,0,1,0,0|2,0,0]=4 29117 B14R1.123 COCCCSCOC1CCCCC1 62a_100011935260_100000709357 [0,1,0,1,0,0|2,0,0]=4 29118 B14R1.123 COCCNCCCC1CCCCC1 2230a_100000209980_100011713725 [0,1,0,1,0,0|1,0,0]=3 29119 B14R1.123 COCCNCCCC1CCCCC1 2230a_100011211642_100011201679 [0,1,0,1,0,0|1,0,0]=3 29120 B14R1.123 COCCNCCCC1CCCCC1 34a_100011211642_100011201679 [0,1,0,1,0,0|1,0,0]=3 29121 B14R1.123 COCCNCCCN1CCCCC1 2230a_100000209980_100000690320 [0,1,0,1,0,0|2,0,0]=4 29122 B14R1.123 COCCNCCOC1CCCCC1 2230a_100000209980_100011211530 [0,1,0,1,0,0|2,0,0]=4 29123 B14R1.123 COCCNCCOC1CCCCC1 34a_100015206981_100011201679 [0,1,0,1,0,0|2,0,0]=4 29124 B14R1.123 COCCNCCOC1CCCCO1 2230a_100000209980_100000744793 [0,1,0,1,0,0|2,0,0]=4 29125 B14R1.123 COCCOCCCC1CCCCC1 34a_100000198086_100011201679 [0,1,0,1,0,0|1,0,0]=3 29126 B14R1.123 COCCOCCCC1CCCCC1 34a_100000210237_100011713725 [0,1,0,1,0,0|1,0,0]=3 29127 B14R1.123 COCCOCCCC1CCCCC1 7a_100000198086_100000233755 [0,1,0,1,0,0|1,0,0]=3 29128 B14R1.123 COCCOCCCC1CCCCN1 34a_100011934581_100011201679 [0,1,0,1,0,0|2,0,0]=4 29129 B14R1.123 COCCOCCCC1CCCNC1 34a_100150707839_100011201679 [0,1,0,1,0,0|2,0,0]=4 29130 B14R1.123 COCCOCCCC1CCNCC1 34a_100016988962_100011201679 [0,1,0,1,0,0|2,0,0]=4 29131 B14R1.123 COCCOCCCN1CCCCC1 34a_100000210237_100000690320 [0,1,0,1,0,0|2,0,0]=4 29132 B14R1.123 COCCOCCCN1CCCCC1 34a_100000212458_100011201679 [0,1,0,1,0,0|2,0,0]=4 29133 B14R1.123 COCCOCCNC1CCCCC1 2230a_100000182618_100000695917 [0,1,0,1,0,0|2,0,0]=4 29134 B14R1.123 COCCOCCNC1CCCCC1 270004a_100000745349_100000210434 [0,1,0,1,0,0|2,0,0]=4 29135 B14R1.123 COCCOCCNC1CCCCC1 34a_100000182618_100000695917 [0,1,0,1,0,0|2,0,0]=4 29136 B14R1.123 COCCOCCNC1CCCCC1 34a_100000200466_100011201679 [0,1,0,1,0,0|2,0,0]=4 29137 B14R1.123 COCCOCCNC1CCCCC1 34a_100000745349_100000210327 [0,1,0,1,0,0|2,0,0]=4 29138 B14R1.123 COCCOCCOC1CCCCC1 34a_100000210231_100000695917 [0,1,0,1,0,0|2,0,0]=4 29139 B14R1.123 COCCOCCOC1CCCCC1 34a_100000210237_100011211530 [0,1,0,1,0,0|2,0,0]=4 29140 B14R1.123 COCCOCCOC1CCCCC1 34a_100011215163_100000210327 [0,1,0,1,0,0|2,0,0]=4 29141 B14R1.123 COCCOCCOC1CCCCC1 34a_100011249652_100011201679 [0,1,0,1,0,0|2,0,0]=4 29142 B14R1.123 COCCOCCOC1CCCCC1 7a_100000210231_100000695917 [0,1,0,1,0,0|2,0,0]=4 29143 B14R1.123 COCCOCCOC1CCCCC1 7a_100011215163_100000210327 [0,1,0,1,0,0|2,0,0]=4 29144 B14R1.123 COCCOCCOC1CCCCC1 7a_100011249652_100000233755 [0,1,0,1,0,0|2,0,0]=4 29145 B14R1.123 COCCOCCOC1CCCCO1 34a_100000033831_100000695917 [0,1,0,1,0,0|2,0,0]=4 29146 B14R1.123 COCCOCCOC1CCCCO1 34a_100000034223_100011201679 [0,1,0,1,0,0|2,0,0]=4 29147 B14R1.123 COCCOCCOC1CCCCO1 34a_100000080444_200000210301 [0,1,0,1,0,0|2,0,0]=4 29148 B14R1.123 COCCOCCOC1CCCCO1 34a_100000210237_100000744793 [0,1,0,1,0,0|2,0,0]=4 29149 B14R1.123 COCCOCCOC1CCCCO1 7a_100000034223_100000233755 [0,1,0,1,0,0|2,0,0]=4 29150 B14R1.123 COCCOCCOC1CCCCO1 7a_100000080444_200000210301 [0,1,0,1,0,0|2,0,0]=4 29151 B14R1.123 COCCOCCSC1CCCCC1 62a_100000210327_100000695917 [0,1,0,1,0,0|2,0,0]=4 29152 B14R1.123 COCCOCCSC1CCCCC1 62a_100000695917_100000210327 [0,1,0,1,0,0|2,0,0]=4 29153 B14R1.123 COCCOCNCC1CCCCC1 2230a_100000210473_100000231047 [0,1,0,1,0,0|2,0,0]=4 29154 B14R1.123 COCCOCNCC1CCCCO1 2230a_100000174945_100000231047 [0,1,0,1,0,0|2,0,0]=4 29155 B14R1.123 COCCOCSCC1CCCCC1 62a_100000211423_100000231047 [0,1,0,1,0,0|2,0,0]=4 29156 B14R1.123 COCCOCSCC1CCCCC1 62a_100000231047_100000211423 [0,1,0,1,0,0|2,0,0]=4 29157 B14R1.123 COCCOCSCC1CCCCO1 62a_100000211543_100000231047 [0,1,0,1,0,0|2,0,0]=4 29158 B14R1.123 COCCOCSCC1CCCCO1 62a_100000231047_100000211543 [0,1,0,1,0,0|2,0,0]=4 29159 B14R1.123 COCCSCCCC1CCCCC1 62a_100000233755_100011713725 [0,1,0,1,0,0|1,0,0]=3 29160 B14R1.123 COCCSCCCC1CCCCC1 62a_100011713725_100000233755 [0,1,0,1,0,0|1,0,0]=3 29161 B14R1.123 COCCSCCCN1CCCCC1 62a_100000233755_100000007876 [0,1,0,1,0,0|2,0,0]=4 29162 B14R1.123 COCCSCCCN1CCCCC1 62a_100132302099_100000233755 [0,1,0,1,0,0|2,0,0]=4 29163 B14R1.123 COCCSCCOC1CCCCC1 62a_100000233755_100011211530 [0,1,0,1,0,0|2,0,0]=4 29164 B14R1.123 COCCSCCOC1CCCCC1 62a_100011211530_100000233755 [0,1,0,1,0,0|2,0,0]=4 29165 B14R1.123 COCCSCCOC1CCCCO1 62a_100000233755_100000744793 [0,1,0,1,0,0|2,0,0]=4 29166 B14R1.123 COCCSCCOC1CCCCO1 62a_100000744793_100000233755 [0,1,0,1,0,0|2,0,0]=4 29167 B14R1.123 COCSCCCOC1CCCCO1 62a_100000700653_100000766300 [0,1,0,1,0,0|2,0,0]=4 29168 B14R1.123 COCSCCCOC1CCCCO1 62a_100000766300_100000700653 [0,1,0,1,0,0|2,0,0]=4 29169 B14R1.123 CSCCCCOCC1CCCCC1 34a_100011217163_100000211423 [0,1,0,1,0,0|1,1,0]=4 29170 B14R1.123 CSCCCCOCC1CCCCC1 7a_100011217163_100000211423 [0,1,0,1,0,0|1,1,0]=4 29171 B14R1.123 CSCCCCOCC1CCCCO1 34a_100011217163_100000211543 [0,1,0,1,0,0|1,0,0]=3 29172 B14R1.123 CSCCCCOCC1CCCCO1 7a_100011217163_100000211543 [0,1,0,1,0,0|1,0,0]=3 29173 B14R1.123 CSCCCCOCC1CCCOC1 34a_100011217163_100000741521 [0,1,0,1,0,0|2,0,0]=4 29174 B14R1.123 CSCCCCOCC1CCCOC1 7a_100011217163_100000741521 [0,1,0,1,0,0|2,0,0]=4 29175 B14R1.123 CSCCCNCCC1CCCCC1 2230a_100000749238_100012355289 [0,1,0,1,0,0|1,1,0]=4 29176 B14R1.123 CSCCCNCCC1CCCCC1 270004a_100000749238_100011713444 [0,1,0,1,0,0|1,1,0]=4 29177 B14R1.123 CSCCCNCCC1OCCCO1 2230a_100000749238_100000764188 [0,1,0,1,0,0|2,0,0]=4 29178 B14R1.123 CSCCCOCCC1CCCCC1 34a_100000690336_100011209188 [0,1,0,1,0,0|1,1,0]=4 29179 B14R1.123 CSCCCOCCC1CCCCC1 7a_100000690336_100011273959 [0,1,0,1,0,0|1,1,0]=4 29180 B14R1.123 CSCCCOCCC1OCCCO1 34a_100000690336_100000764188 [0,1,0,1,0,0|2,0,0]=4 29181 B14R1.123 CSCCCOCCC1OCCCO1 7a_100000690336_100000764188 [0,1,0,1,0,0|2,0,0]=4 29182 B14R1.123 CSCCNCCCC1CCCCC1 2230a_100011211642_100000751147 [0,1,0,1,0,0|1,1,0]=4 29183 B14R1.123 CSCCNCCCC1CCCCC1 2230a_100020590264_100011713725 [0,1,0,1,0,0|1,1,0]=4 29184 B14R1.123 CSCCNCCCC1CCCCC1 34a_100011211642_100000212216 [0,1,0,1,0,0|1,1,0]=4 29185 B14R1.123 CSCCNCCOC1CCCCO1 2230a_100020590264_100000744793 [0,1,0,1,0,0|2,0,0]=4 29186 B14R1.123 CSCCOCCCC1CCCCC1 34a_100000198086_100000212216 [0,1,0,1,0,0|1,1,0]=4 29187 B14R1.123 CSCCOCCCC1CCCCC1 34a_100000230434_100011713725 [0,1,0,1,0,0|1,1,0]=4 29188 B14R1.123 CSCCOCCCC1CCCCC1 7a_100000198086_100000212216 [0,1,0,1,0,0|1,1,0]=4 29189 B14R1.123 CSCCOCCCC1CCCCC1 7a_100000230434_100011713725 [0,1,0,1,0,0|1,1,0]=4 29190 B14R1.123 CSCCOCCCC1CCCCN1 34a_100011934581_100000212216 [0,1,0,1,0,0|2,0,0]=4 29191 B14R1.123 CSCCOCCOC1CCCCO1 34a_100000034223_100000212216 [0,1,0,1,0,0|2,0,0]=4 29192 B14R1.123 CSCCOCCOC1CCCCO1 34a_100000230434_100000744793 [0,1,0,1,0,0|2,0,0]=4 29193 B14R1.123 CSCCOCCOC1CCCCO1 7a_100000034223_100000212216 [0,1,0,1,0,0|2,0,0]=4 29194 B14R1.123 CSCCOCCOC1CCCCO1 7a_100000230434_100000744793 [0,1,0,1,0,0|2,0,0]=4 29195 B14R1.123 CSCCSCCCC1CCCCC1 62a_100000212216_100011713725 [0,1,0,1,0,0|1,1,0]=4 29196 B14R1.123 CSCCSCCCC1CCCCC1 62a_100011713725_100000751147 [0,1,0,1,0,0|1,1,0]=4 29197 B14R1.123 CSCCSCCOC1CCCCO1 62a_100000212216_100000744793 [0,1,0,1,0,0|2,0,0]=4 29198 B14R1.123 CSCCSCCOC1CCCCO1 62a_100000744793_100000751147 [0,1,0,1,0,0|2,0,0]=4 29199 B14R1.123 CSCOCCCCC1CCCCC1 34a_100011215267_100011218213 [0,1,0,1,0,0|1,1,0]=4 29200 B14R1.123 CSCSCCCOC1CCCCO1 62a_100000700653_100011218213 [0,1,0,1,0,0|2,0,0]=4 29201 B14R1.123 CSCSCCCOC1CCCCO1 62a_100011218213_100000700653 [0,1,0,1,0,0|2,0,0]=4 29202 B14R1.123 ClCCCCCCOC1CCCCC1 34a_100000766143_100000210327 [0,1,0,1,0,0|1,0,0]=3 29203 B14R1.123 ClCCCCCCOC1CCCCC1 7a_100000766143_100000210327 [0,1,0,1,0,0|1,0,0]=3 29204 B14R1.123 ClCCCCCCOC1CCCOC1 34a_100000766143_100000693364 [0,1,0,1,0,0|2,0,0]=4 29205 B14R1.123 ClCCCCCCOC1CCCOC1 7a_100000766143_100000693364 [0,1,0,1,0,0|2,0,0]=4 29206 B14R1.123 ClCCCCCCOC1CCOCC1 7a_100000766143_100000686592 [0,1,0,1,0,0|2,0,0]=4 29207 B14R1.123 ClCCCCCCOC1CCSCC1 34a_100000766143_100000069128 [0,1,0,1,0,0|2,0,0]=4 29208 B14R1.123 ClCCCCCCOC1CCSCC1 7a_100000766143_100011500858 [0,1,0,1,0,0|2,0,0]=4 29209 B14R1.123 ClCCCCCOCC1CCCCC1 34a_100000746330_100000211423 [0,1,0,1,0,0|1,0,0]=3 29210 B14R1.123 ClCCCCCOCC1CCCCC1 7a_100000746330_100000211423 [0,1,0,1,0,0|1,0,0]=3 29211 B14R1.123 ClCCCCCOCC1CCCCO1 34a_100000746330_100000211543 [0,1,0,1,0,0|1,0,0]=3 29212 B14R1.123 ClCCCCCOCC1CCCCO1 7a_100000746330_100000211543 [0,1,0,1,0,0|1,0,0]=3 29213 B14R1.123 ClCCCCCOCC1CCCOC1 34a_100000746330_100000741521 [0,1,0,1,0,0|2,0,0]=4 29214 B14R1.123 ClCCCCCOCC1CCCOC1 7a_100000746330_100000741521 [0,1,0,1,0,0|2,0,0]=4 29215 B14R1.123 ClCCCCCOCC1CCOCC1 34a_100000746330_100000754603 [0,1,0,1,0,0|2,0,0]=4 29216 B14R1.123 ClCCCCCOCC1CCOCC1 7a_100000746330_100000754603 [0,1,0,1,0,0|2,0,0]=4 29217 B14R1.123 ClCCCCOCCC1CCCCC1 34a_100000210776_100011209188 [0,1,0,1,0,0|1,0,0]=3 29218 B14R1.123 ClCCCCOCCC1CCCCC1 7a_100000210776_100011273959 [0,1,0,1,0,0|1,0,0]=3 29219 B14R1.123 ClCCCCOCCC1CCOCC1 34a_100000210776_100011934994 [0,1,0,1,0,0|2,0,0]=4 29220 B14R1.123 ClCCCCOCCC1CCOCC1 7a_100000210776_100011934994 [0,1,0,1,0,0|2,0,0]=4 29221 B14R1.123 ClCCCCOCCC1OCCCO1 34a_100000210776_100000764188 [0,1,0,1,0,0|2,0,0]=4 29222 B14R1.123 ClCCCCOCCC1OCCCO1 7a_100000210776_100000764188 [0,1,0,1,0,0|2,0,0]=4 29223 B14R1.123 ClCCCCOCCN1CCCCC1 34a_100000210776_100000739454 [0,1,0,1,0,0|2,0,0]=4 29224 B14R1.123 ClCCCCOCCN1CCCCC1 7a_100000210776_100000739454 [0,1,0,1,0,0|2,0,0]=4 29225 B14R1.123 ClCCCCOCOC1CCCCC1 34a_100000210776_100011935260 [0,1,0,1,0,0|2,0,0]=4 29226 B14R1.123 ClCCCCOCOC1CCCCC1 7a_100000210776_100011935260 [0,1,0,1,0,0|2,0,0]=4 29227 B14R1.123 ClCCCOCCCC1CCCCC1 34a_100000230001_100011713725 [0,1,0,1,0,0|1,0,0]=3 29228 B14R1.123 ClCCCOCCCN1CCCCC1 34a_100000230001_100000690320 [0,1,0,1,0,0|2,0,0]=4 29229 B14R1.123 ClCCCOCCOC1CCCCC1 34a_100000230001_100011211530 [0,1,0,1,0,0|2,0,0]=4 29230 B14R1.123 ClCCCOCCOC1CCCCO1 34a_100000230001_100000744793 [0,1,0,1,0,0|2,0,0]=4 29231 B14R1.123 ClCCOCCOCC1CCCCC1 34a_100011215305_100000211423 [0,1,0,1,0,0|2,0,0]=4 29232 B14R1.123 ClCCOCCOCC1CCCCC1 7a_100011215305_100000211423 [0,1,0,1,0,0|2,0,0]=4 29233 B14R1.123 ClCCOCCOCC1CCCCO1 34a_100011215305_100000211543 [0,1,0,1,0,0|2,0,0]=4 29234 B14R1.123 ClCCOCCOCC1CCCCO1 7a_100011215305_100000211543 [0,1,0,1,0,0|2,0,0]=4 29235 B14R1.123 FCCCCCCNC1CCCCC1 2230a_100000182618_100015922095 [0,1,0,1,0,0|1,0,0]=3 29236 B14R1.123 FCCCCCCNC1CCCCC1 34a_100000182618_100015922095 [0,1,0,1,0,0|1,0,0]=3 29237 B14R1.123 FCCCCCCNC1CCCOC1 2230a_100000719290_100015922095 [0,1,0,1,0,0|2,0,0]=4 29238 B14R1.123 FCCCCCCNC1CCCOC1 34a_100000719290_100015922095 [0,1,0,1,0,0|2,0,0]=4 29239 B14R1.123 FCCCCCCNC1CCOCC1 2230a_100000741149_100015922095 [0,1,0,1,0,0|2,0,0]=4 29240 B14R1.123 FCCCCCCNC1CCOCC1 34a_100000741149_100015922095 [0,1,0,1,0,0|2,0,0]=4 29241 B14R1.123 FCCCCCCNC1CCSCC1 2230a_100000748639_100015922095 [0,1,0,1,0,0|2,0,0]=4 29242 B14R1.123 FCCCCCCNC1CCSCC1 34a_100000748639_100015922095 [0,1,0,1,0,0|2,0,0]=4 29243 B14R1.123 FCCCCCCOC1CCCCC1 34a_100000210231_100015922095 [0,1,0,1,0,0|1,0,0]=3 29244 B14R1.123 FCCCCCCOC1CCCCC1 34a_100000732779_100000210327 [0,1,0,1,0,0|1,0,0]=3 29245 B14R1.123 FCCCCCCOC1CCCCC1 7a_100000210231_100015922095 [0,1,0,1,0,0|1,0,0]=3 29246 B14R1.123 FCCCCCCOC1CCCCC1 7a_100000732779_100000210327 [0,1,0,1,0,0|1,0,0]=3 29247 B14R1.123 FCCCCCCOC1CCCCO1 34a_100000033831_100015922095 [0,1,0,1,0,0|1,0,0]=3 29248 B14R1.123 FCCCCCCOC1CCCOC1 34a_100000732779_100000693364 [0,1,0,1,0,0|2,0,0]=4 29249 B14R1.123 FCCCCCCOC1CCCOC1 34a_100000754041_100015922095 [0,1,0,1,0,0|2,0,0]=4 29250 B14R1.123 FCCCCCCOC1CCCOC1 7a_100000732779_100000693364 [0,1,0,1,0,0|2,0,0]=4 29251 B14R1.123 FCCCCCCOC1CCCSC1 7a_100015962668_100015922095 [0,1,0,1,0,0|2,0,0]=4 29252 B14R1.123 FCCCCCCOC1CCOCC1 34a_100000744328_100015922095 [0,1,0,1,0,0|2,0,0]=4 29253 B14R1.123 FCCCCCCOC1CCOCC1 7a_100000732779_100000686592 [0,1,0,1,0,0|2,0,0]=4 29254 B14R1.123 FCCCCCCOC1CCSCC1 34a_100000731022_100015922095 [0,1,0,1,0,0|2,0,0]=4 29255 B14R1.123 FCCCCCCOC1CCSCC1 34a_100000732779_100000069128 [0,1,0,1,0,0|2,0,0]=4 29256 B14R1.123 FCCCCCCOC1CCSCC1 7a_100000731022_100015922095 [0,1,0,1,0,0|2,0,0]=4 29257 B14R1.123 FCCCCCCOC1CCSCC1 7a_100000732779_100011500858 [0,1,0,1,0,0|2,0,0]=4 29258 B14R1.123 FCCCCCCSC1CCCCC1 62a_100000210327_100015922095 [0,1,0,1,0,0|1,0,0]=3 29259 B14R1.123 FCCCCCCSC1CCCCC1 62a_100015922095_100000210327 [0,1,0,1,0,0|1,0,0]=3 29260 B14R1.123 FCCCCCCSC1CCCOC1 62a_100015922095_100000693364 [0,1,0,1,0,0|2,0,0]=4 29261 B14R1.123 FCCCCCCSC1CCOCC1 62a_100015922095_100011324220 [0,1,0,1,0,0|2,0,0]=4 29262 B14R1.123 FCCCCCCSC1CCSCC1 62a_100015922095_100000069128 [0,1,0,1,0,0|2,0,0]=4 29263 B14R1.123 FCCCCCNCC1CCCCC1 2230a_100000210473_100000729378 [0,1,0,1,0,0|1,0,0]=3 29264 B14R1.123 FCCCCCNCC1CCCCC1 34a_100000210473_100000729378 [0,1,0,1,0,0|1,0,0]=3 29265 B14R1.123 FCCCCCNCC1CCCCO1 2230a_100000174945_100000729378 [0,1,0,1,0,0|1,0,0]=3 29266 B14R1.123 FCCCCCNCC1CCCCO1 34a_100000174945_100000729378 [0,1,0,1,0,0|1,0,0]=3 29267 B14R1.123 FCCCCCNCC1CCCOC1 2230a_100000720124_100000729378 [0,1,0,1,0,0|2,0,0]=4 29268 B14R1.123 FCCCCCNCC1CCCOC1 34a_100000720124_100000729378 [0,1,0,1,0,0|2,0,0]=4 29269 B14R1.123 FCCCCCNCC1CCOCC1 2230a_100000746373_100000729378 [0,1,0,1,0,0|2,0,0]=4 29270 B14R1.123 FCCCCCNCC1CCOCC1 34a_100000746373_100000729378 [0,1,0,1,0,0|2,0,0]=4 29271 B14R1.123 FCCCCCNCC1CCSCC1 2230a_100015188806_100000729378 [0,1,0,1,0,0|2,0,0]=4 29272 B14R1.123 FCCCCCNCC1CCSCC1 34a_100015188806_100000729378 [0,1,0,1,0,0|2,0,0]=4 29273 B14R1.123 FCCCCCNC[C@H]1COCCO1 2230a_100010981119_100000729378 [0,1,0,1,0,0|2,0,0]=4 29274 B14R1.123 FCCCCCNC[C@H]1COCCO1 34a_100010981119_100000729378 [0,1,0,1,0,0|2,0,0]=4 29275 B14R1.123 FCCCCCOCC1CCCCC1 34a_100000212181_100000729378 [0,1,0,1,0,0|1,0,0]=3 29276 B14R1.123 FCCCCCOCC1CCCCC1 7a_100000212181_100000729378 [0,1,0,1,0,0|1,0,0]=3 29277 B14R1.123 FCCCCCOCC1CCCCN1 34a_100000210821_100000729378 [0,1,0,1,0,0|2,0,0]=4 29278 B14R1.123 FCCCCCOCC1CCCCO1 34a_100000211370_100000729378 [0,1,0,1,0,0|1,0,0]=3 29279 B14R1.123 FCCCCCOCC1CCCCO1 7a_100000211370_100000729378 [0,1,0,1,0,0|1,0,0]=3 29280 B14R1.123 FCCCCCOCC1CCCNC1 34a_100000211344_100000729378 [0,1,0,1,0,0|2,0,0]=4 29281 B14R1.123 FCCCCCOCC1CCCOC1 34a_100000741520_100000729378 [0,1,0,1,0,0|2,0,0]=4 29282 B14R1.123 FCCCCCOCC1CCNCC1 34a_100000738675_100000729378 [0,1,0,1,0,0|2,0,0]=4 29283 B14R1.123 FCCCCCOCC1CCOCC1 34a_100000749013_100000729378 [0,1,0,1,0,0|2,0,0]=4 29284 B14R1.123 FCCCCCOCC1CCSCC1 34a_100000070558_100000729378 [0,1,0,1,0,0|2,0,0]=4 29285 B14R1.123 FCCCCCOCC1CCSCC1 7a_100000070558_100000729378 [0,1,0,1,0,0|2,0,0]=4 29286 B14R1.123 FCCCCCOC[C@@H]1CNCCO1 34a_100015189573_100000729378 [0,1,0,1,0,0|2,0,0]=4 29287 B14R1.123 FCCCCCOC[C@H]1COCCO1 34a_100009875890_100000729378 [0,1,0,1,0,0|2,0,0]=4 29288 B14R1.123 FCCCCCSCC1CCCCC1 62a_100000211423_100000729378 [0,1,0,1,0,0|1,0,0]=3 29289 B14R1.123 FCCCCCSCC1CCCCC1 62a_100000729378_100000211423 [0,1,0,1,0,0|1,0,0]=3 29290 B14R1.123 FCCCCCSCC1CCCCO1 62a_100000211543_100000729378 [0,1,0,1,0,0|1,0,0]=3 29291 B14R1.123 FCCCCCSCC1CCCCO1 62a_100000729378_100000211543 [0,1,0,1,0,0|1,0,0]=3 29292 B14R1.123 FCCCCCSCC1CCCOC1 62a_100000729378_100000741521 [0,1,0,1,0,0|2,0,0]=4 29293 B14R1.123 FCCCCCSCC1CCCOC1 62a_100000741521_100000729378 [0,1,0,1,0,0|2,0,0]=4 29294 B14R1.123 FCCCCCSCC1CCOCC1 62a_100000729378_100000749018 [0,1,0,1,0,0|2,0,0]=4 29295 B14R1.123 FCCCCCSCC1CCOCC1 62a_100000754603_100000729378 [0,1,0,1,0,0|2,0,0]=4 29296 B14R1.123 FCCCCNCCC1CCCCC1 2230a_100000738074_100000729493 [0,1,0,1,0,0|1,0,0]=3 29297 B14R1.123 FCCCCNCCC1CCCCC1 34a_100000738074_100000729493 [0,1,0,1,0,0|1,0,0]=3 29298 B14R1.123 FCCCCNCCC1CCCCO1 2230a_100015183643_100000729493 [0,1,0,1,0,0|1,0,0]=3 29299 B14R1.123 FCCCCNCCC1CCCCO1 34a_100015183643_100000729493 [0,1,0,1,0,0|1,0,0]=3 29300 B14R1.123 FCCCCNCCC1CCOCC1 2230a_100000755988_100000729493 [0,1,0,1,0,0|2,0,0]=4 29301 B14R1.123 FCCCCNCCC1CCOCC1 34a_100000755988_100000729493 [0,1,0,1,0,0|2,0,0]=4 29302 B14R1.123 FCCCCOCCC1CCCCC1 34a_100011217863_100000729493 [0,1,0,1,0,0|1,0,0]=3 29303 B14R1.123 FCCCCOCCC1CCCCC1 34a_100011995726_100011209188 [0,1,0,1,0,0|1,0,0]=3 29304 B14R1.123 FCCCCOCCC1CCCCC1 7a_100011217863_100000729493 [0,1,0,1,0,0|1,0,0]=3 29305 B14R1.123 FCCCCOCCC1CCCCC1 7a_100011995726_100011273959 [0,1,0,1,0,0|1,0,0]=3 29306 B14R1.123 FCCCCOCCC1CCCCN1 34a_100000211664_100000729493 [0,1,0,1,0,0|2,0,0]=4 29307 B14R1.123 FCCCCOCCC1CCCNC1 34a_100000752241_100000729493 [0,1,0,1,0,0|2,0,0]=4 29308 B14R1.123 FCCCCOCCC1CCNCC1 34a_100015190746_100000729493 [0,1,0,1,0,0|2,0,0]=4 29309 B14R1.123 FCCCCOCCC1CCOCC1 34a_100011933979_100000729493 [0,1,0,1,0,0|2,0,0]=4 29310 B14R1.123 FCCCCOCCC1CCOCC1 34a_100011995726_100011934994 [0,1,0,1,0,0|2,0,0]=4 29311 B14R1.123 FCCCCOCCC1CCOCC1 7a_100011933979_100000729493 [0,1,0,1,0,0|2,0,0]=4 29312 B14R1.123 FCCCCOCCC1CCOCC1 7a_100011995726_100011934994 [0,1,0,1,0,0|2,0,0]=4 29313 B14R1.123 FCCCCOCCC1OCCCO1 34a_100011995726_100000764188 [0,1,0,1,0,0|2,0,0]=4 29314 B14R1.123 FCCCCOCCC1OCCCO1 7a_100011995726_100000764188 [0,1,0,1,0,0|2,0,0]=4 29315 B14R1.123 FCCCCOCCN1CCCCC1 34a_100011995726_100000739454 [0,1,0,1,0,0|2,0,0]=4 29316 B14R1.123 FCCCCOCCN1CCCCC1 7a_100011995726_100000739454 [0,1,0,1,0,0|2,0,0]=4 29317 B14R1.123 FCCCCOCOC1CCCCC1 34a_100011995726_100011935260 [0,1,0,1,0,0|2,0,0]=4 29318 B14R1.123 FCCCCOCOC1CCCCC1 7a_100011995726_100011935260 [0,1,0,1,0,0|2,0,0]=4 29319 B14R1.123 FCCCCSCCC1CCCCC1 62a_100000729493_100012355289 [0,1,0,1,0,0|1,0,0]=3 29320 B14R1.123 FCCCCSCCC1CCCCC1 62a_100012355289_100000729493 [0,1,0,1,0,0|1,0,0]=3 29321 B14R1.123 FCCCCSCCC1CCOCC1 62a_100000729493_100011934994 [0,1,0,1,0,0|2,0,0]=4 29322 B14R1.123 FCCCCSCCC1CCOCC1 62a_100011934994_100000729493 [0,1,0,1,0,0|2,0,0]=4 29323 B14R1.123 FCCCCSCCC1OCCCO1 62a_100000729493_100000764188 [0,1,0,1,0,0|2,0,0]=4 29324 B14R1.123 FCCCCSCCC1OCCCO1 62a_100000764188_100000729493 [0,1,0,1,0,0|2,0,0]=4 29325 B14R1.123 FCCCCSCCN1CCCCC1 62a_100000729493_100000739454 [0,1,0,1,0,0|2,0,0]=4 29326 B14R1.123 FCCCCSCCN1CCCCC1 62a_100000739454_100000729493 [0,1,0,1,0,0|2,0,0]=4 29327 B14R1.123 FCCCCSCOC1CCCCC1 62a_100000729493_100011935260 [0,1,0,1,0,0|2,0,0]=4 29328 B14R1.123 FCCCCSCOC1CCCCC1 62a_100011935260_100000729493 [0,1,0,1,0,0|2,0,0]=4 29329 B14R1.123 FCCCNCCCC1CCCCC1 2230a_100011211642_100011934791 [0,1,0,1,0,0|1,0,0]=3 29330 B14R1.123 FCCCNCCCC1CCCCC1 2230a_100015189416_100011713725 [0,1,0,1,0,0|1,0,0]=3 29331 B14R1.123 FCCCNCCCC1CCCCC1 34a_100011211642_100011934791 [0,1,0,1,0,0|1,0,0]=3 29332 B14R1.123 FCCCNCCCC1CCCCC1 34a_100015189416_100011713725 [0,1,0,1,0,0|1,0,0]=3 29333 B14R1.123 FCCCNCCCN1CCCCC1 2230a_100015189416_100000690320 [0,1,0,1,0,0|2,0,0]=4 29334 B14R1.123 FCCCNCCCN1CCCCC1 34a_100015189416_100000690320 [0,1,0,1,0,0|2,0,0]=4 29335 B14R1.123 FCCCNCCOC1CCCCC1 2230a_100015189416_100011211530 [0,1,0,1,0,0|2,0,0]=4 29336 B14R1.123 FCCCNCCOC1CCCCC1 34a_100015189416_100011211530 [0,1,0,1,0,0|2,0,0]=4 29337 B14R1.123 FCCCNCCOC1CCCCC1 34a_100015206981_100011934791 [0,1,0,1,0,0|2,0,0]=4 29338 B14R1.123 FCCCNCCOC1CCCCO1 2230a_100015189416_100000744793 [0,1,0,1,0,0|2,0,0]=4 29339 B14R1.123 FCCCNCCOC1CCCCO1 34a_100015189416_100000744793 [0,1,0,1,0,0|2,0,0]=4 29340 B14R1.123 FCCCOCCCC1CCCCC1 34a_100000198086_100011934791 [0,1,0,1,0,0|1,0,0]=3 29341 B14R1.123 FCCCOCCCC1CCCCC1 34a_100000759539_100011713725 [0,1,0,1,0,0|1,0,0]=3 29342 B14R1.123 FCCCOCCCC1CCCCC1 7a_100000198086_100011934791 [0,1,0,1,0,0|1,0,0]=3 29343 B14R1.123 FCCCOCCCC1CCCCN1 34a_100011934581_100011934791 [0,1,0,1,0,0|2,0,0]=4 29344 B14R1.123 FCCCOCCCC1CCCNC1 34a_100150707839_100011934791 [0,1,0,1,0,0|2,0,0]=4 29345 B14R1.123 FCCCOCCCC1CCNCC1 34a_100016988962_100011934791 [0,1,0,1,0,0|2,0,0]=4 29346 B14R1.123 FCCCOCCCN1CCCCC1 34a_100000212458_100011934791 [0,1,0,1,0,0|2,0,0]=4 29347 B14R1.123 FCCCOCCCN1CCCCC1 34a_100000759539_100000690320 [0,1,0,1,0,0|2,0,0]=4 29348 B14R1.123 FCCCOCCNC1CCCCC1 34a_100000200466_100011934791 [0,1,0,1,0,0|2,0,0]=4 29349 B14R1.123 FCCCOCCOC1CCCCC1 34a_100000759539_100011211530 [0,1,0,1,0,0|2,0,0]=4 29350 B14R1.123 FCCCOCCOC1CCCCC1 34a_100011249652_100011934791 [0,1,0,1,0,0|2,0,0]=4 29351 B14R1.123 FCCCOCCOC1CCCCC1 7a_100011249652_100011934791 [0,1,0,1,0,0|2,0,0]=4 29352 B14R1.123 FCCCOCCOC1CCCCO1 34a_100000034223_100011934791 [0,1,0,1,0,0|2,0,0]=4 29353 B14R1.123 FCCCOCCOC1CCCCO1 34a_100000759539_100000744793 [0,1,0,1,0,0|2,0,0]=4 29354 B14R1.123 FCCCOCCOC1CCCCO1 7a_100000034223_100011934791 [0,1,0,1,0,0|2,0,0]=4 29355 B14R1.123 FCCCSCCCC1CCCCC1 62a_100011713725_100011934791 [0,1,0,1,0,0|1,0,0]=3 29356 B14R1.123 FCCCSCCCC1CCCCC1 62a_100011934791_100011713725 [0,1,0,1,0,0|1,0,0]=3 29357 B14R1.123 FCCCSCCCN1CCCCC1 62a_100011934791_100000007876 [0,1,0,1,0,0|2,0,0]=4 29358 B14R1.123 FCCCSCCCN1CCCCC1 62a_100132302099_100011934791 [0,1,0,1,0,0|2,0,0]=4 29359 B14R1.123 FCCCSCCOC1CCCCC1 62a_100011211530_100011934791 [0,1,0,1,0,0|2,0,0]=4 29360 B14R1.123 FCCCSCCOC1CCCCC1 62a_100011934791_100011211530 [0,1,0,1,0,0|2,0,0]=4 29361 B14R1.123 FCCCSCCOC1CCCCO1 62a_100000744793_100011934791 [0,1,0,1,0,0|2,0,0]=4 29362 B14R1.123 FCCCSCCOC1CCCCO1 62a_100011934791_100000744793 [0,1,0,1,0,0|2,0,0]=4 29363 B14R1.123 FCCNCCCOC1CCCCC1 34a_100000205933_100011217306 [0,1,0,1,0,0|2,0,0]=4 29364 B14R1.123 FCCNCCCOC1CCCCO1 34a_100000724931_100000700653 [0,1,0,1,0,0|2,0,0]=4 29365 B14R1.123 FCCOCCCCC1CCCCC1 34a_100011215267_100011217306 [0,1,0,1,0,0|1,0,0]=3 29366 B14R1.123 FCCOCCCCC1CCCCC1 7a_100011215267_100011217306 [0,1,0,1,0,0|1,0,0]=3 29367 B14R1.123 FCCOCCCCC1CCNCC1 34a_100016989291_100011217306 [0,1,0,1,0,0|2,0,0]=4 29368 B14R1.123 FCCOCCOCC1CCCCC1 34a_200015357709_100000211423 [0,1,0,1,0,0|2,0,0]=4 29369 B14R1.123 FCCOCCOCC1CCCCC1 7a_200015357709_100000211423 [0,1,0,1,0,0|2,0,0]=4 29370 B14R1.123 FCCOCCOCC1CCCCO1 34a_200015357709_100000211543 [0,1,0,1,0,0|2,0,0]=4 29371 B14R1.123 FCCOCCOCC1CCCCO1 7a_200015357709_100000211543 [0,1,0,1,0,0|2,0,0]=4 29372 B14R1.123 FCCSCCCOC1CCCCO1 62a_100000700653_100011217306 [0,1,0,1,0,0|2,0,0]=4 29373 B14R1.123 FCCSCCCOC1CCCCO1 62a_100011217306_100000700653 [0,1,0,1,0,0|2,0,0]=4 29374 B14R1.123 FCOCCCCCN1CCCCC1 34a_100011216611_100015361967 [0,1,0,1,0,0|2,0,0]=4 29375 B14R1.123 FCOCCCCCN1CCCCC1 7a_100011216611_100015361967 [0,1,0,1,0,0|2,0,0]=4 29376 B14R1.123 FCSCCCCOC1CCCCO1 62a_100000031530_100015361967 [0,1,0,1,0,0|2,0,0]=4 29377 B14R1.123 FCSCCCCOC1CCCCO1 62a_100015361967_100000031530 [0,1,0,1,0,0|2,0,0]=4 29378 B14R1.123 ICCCCCOCC1CCCCC1 34a_200012148887_100000211423 [0,1,0,1,0,0|1,0,0]=3 29379 B14R1.123 ICCCCCOCC1CCCCC1 7a_200012148887_100000211423 [0,1,0,1,0,0|1,0,0]=3 29380 B14R1.123 ICCCCCOCC1CCCCO1 34a_200012148887_100000211543 [0,1,0,1,0,0|1,0,0]=3 29381 B14R1.123 ICCCCCOCC1CCCCO1 7a_200012148887_100000211543 [0,1,0,1,0,0|1,0,0]=3 29382 B14R1.123 ICCCCCOCC1CCCOC1 34a_200012148887_100000741521 [0,1,0,1,0,0|2,0,0]=4 29383 B14R1.123 ICCCCCOCC1CCCOC1 7a_200012148887_100000741521 [0,1,0,1,0,0|2,0,0]=4 29384 B14R1.123 ICCCCCOCC1CCOCC1 34a_200012148887_100000754603 [0,1,0,1,0,0|2,0,0]=4 29385 B14R1.123 ICCCCCOCC1CCOCC1 7a_200012148887_100000754603 [0,1,0,1,0,0|2,0,0]=4 29386 B14R1.123 ICCCCOCCC1CCCCC1 34a_200012148704_100011209188 [0,1,0,1,0,0|1,0,0]=3 29387 B14R1.123 ICCCCOCCC1CCOCC1 34a_200012148704_100011934994 [0,1,0,1,0,0|2,0,0]=4 29388 B14R1.123 ICCCCOCCC1OCCCO1 34a_200012148704_100000764188 [0,1,0,1,0,0|2,0,0]=4 29389 B14R1.123 ICCCCOCCN1CCCCC1 34a_200012148704_100000739454 [0,1,0,1,0,0|2,0,0]=4 29390 B14R1.123 ICCCCOCOC1CCCCC1 34a_200012148704_100011935260 [0,1,0,1,0,0|2,0,0]=4 29391 B14R1.123 ICCOCCOCC1CCCCC1 34a_100012149058_100000211423 [0,1,0,1,0,0|2,0,0]=4 29392 B14R1.123 ICCOCCOCC1CCCCC1 7a_100012149058_100000211423 [0,1,0,1,0,0|2,0,0]=4 29393 B14R1.123 ICCOCCOCC1CCCCO1 34a_100012149058_100000211543 [0,1,0,1,0,0|2,0,0]=4 29394 B14R1.123 ICCOCCOCC1CCCCO1 7a_100012149058_100000211543 [0,1,0,1,0,0|2,0,0]=4 29395 B14R1.123 N#CCCCCCNC1CCCCC1 2230a_100000182618_100009813376 [0,1,0,1,0,0|1,0,1]=4 29396 B14R1.123 N#CCCCCCNC1CCCCC1 270004a_100000061152_100000210434 [0,1,0,1,0,0|1,0,1]=4 29397 B14R1.123 N#CCCCCCOC1CCCCC1 7a_100000210231_100009813376 [0,1,0,1,0,0|1,0,1]=4 29398 B14R1.123 N#CCCCCCSC1CCCCC1 62a_100000210327_100009813376 [0,1,0,1,0,0|1,0,1]=4 29399 B14R1.123 N#CCCCCCSC1CCCCC1 62a_100009813376_100000210327 [0,1,0,1,0,0|1,0,1]=4 29400 B14R1.123 N#CCCCCNCC1CCCCC1 2230a_100000210473_100000211819 [0,1,0,1,0,0|1,0,1]=4 29401 B14R1.123 N#CCCCCNCC1CCCCO1 2230a_100000174945_100000211819 [0,1,0,1,0,0|1,0,1]=4 29402 B14R1.123 N#CCCCCOCC1CCCCC1 7a_100000212181_100000211819 [0,1,0,1,0,0|1,0,1]=4 29403 B14R1.123 N#CCCCCOCC1CCCCO1 7a_100000211370_100000211819 [0,1,0,1,0,0|1,0,1]=4 29404 B14R1.123 N#CCCCCSCC1CCCCC1 62a_100000211423_100000211819 [0,1,0,1,0,0|1,0,1]=4 29405 B14R1.123 N#CCCCCSCC1CCCCC1 62a_100011219923_100000211423 [0,1,0,1,0,0|1,0,1]=4 29406 B14R1.123 N#CCCCCSCC1CCCCO1 62a_100000211543_100000211819 [0,1,0,1,0,0|1,0,1]=4 29407 B14R1.123 N#CCCCCSCC1CCCCO1 62a_100011219923_100000211543 [0,1,0,1,0,0|1,0,1]=4 29408 B14R1.123 N#CCCCNCCC1CCCCC1 2230a_100000738074_100000687738 [0,1,0,1,0,0|1,0,1]=4 29409 B14R1.123 N#CCCCNCCC1CCCCO1 2230a_100015183643_100000687738 [0,1,0,1,0,0|1,0,1]=4 29410 B14R1.123 N#CCCCOCCC1CCCCC1 7a_100011217863_100000687738 [0,1,0,1,0,0|1,0,1]=4 29411 B14R1.123 N#CCCCSCCC1CCCCC1 62a_100000687738_100012355289 [0,1,0,1,0,0|1,0,1]=4 29412 B14R1.123 N#CCCCSCCC1CCCCC1 62a_100012355289_100000687738 [0,1,0,1,0,0|1,0,1]=4 29413 B14R1.123 N#CCCNCCCC1CCCCC1 2230a_100011211642_100011215226 [0,1,0,1,0,0|1,0,1]=4 29414 B14R1.123 N#CCCOCCCC1CCCCC1 7a_100000198086_100000184422 [0,1,0,1,0,0|1,0,1]=4 29415 B14R1.123 N#CCCSCCCC1CCCCC1 62a_100011215226_100011713725 [0,1,0,1,0,0|1,0,1]=4 29416 B14R1.123 N#CCCSCCCC1CCCCC1 62a_100011713725_100011215226 [0,1,0,1,0,0|1,0,1]=4 29417 B14R1.123 N#CCOCCCCC1CCCCC1 7a_100011215267_100011215382 [0,1,0,1,0,0|1,0,1]=4 29418 B14R1.123 NCCCCCCOC1CCCCC1 34a_100000686447_100000210327 [0,1,0,1,0,0|1,0,0]=3 29419 B14R1.123 NCCCCCCOC1CCCOC1 34a_100000686447_100000693364 [0,1,0,1,0,0|2,0,0]=4 29420 B14R1.123 NCCCCCCOC1CCSCC1 34a_100000686447_100000069128 [0,1,0,1,0,0|2,0,0]=4 29421 B14R1.123 NCCCCCOCC1CCCCC1 34a_100000762737_100000211423 [0,1,0,1,0,0|1,0,0]=3 29422 B14R1.123 NCCCCCOCC1CCCCO1 34a_100000762737_100000211543 [0,1,0,1,0,0|1,0,0]=3 29423 B14R1.123 NCCCCCOCC1CCCOC1 34a_100000762737_100000741521 [0,1,0,1,0,0|2,0,0]=4 29424 B14R1.123 NCCCCCOCC1CCOCC1 34a_100000762737_100000754603 [0,1,0,1,0,0|2,0,0]=4 29425 B14R1.123 NCCCCOCCC1CCCCC1 34a_100000750430_100011209188 [0,1,0,1,0,0|1,0,0]=3 29426 B14R1.123 NCCCCOCCC1CCOCC1 34a_100000750430_100011934994 [0,1,0,1,0,0|2,0,0]=4 29427 B14R1.123 NCCCCOCCC1OCCCO1 34a_100000750430_100000764188 [0,1,0,1,0,0|2,0,0]=4 29428 B14R1.123 NCCCCOCCN1CCCCC1 34a_100000750430_100000739454 [0,1,0,1,0,0|2,0,0]=4 29429 B14R1.123 NCCCCOCOC1CCCCC1 34a_100000750430_100011935260 [0,1,0,1,0,0|2,0,0]=4 29430 B14R1.123 NCCCOCCCC1CCCCC1 34a_100000182051_100011713725 [0,1,0,1,0,0|1,0,0]=3 29431 B14R1.123 NCCCOCCCN1CCCCC1 34a_100000182051_100000690320 [0,1,0,1,0,0|2,0,0]=4 29432 B14R1.123 NCCCOCCOC1CCCCC1 34a_100000182051_100011211530 [0,1,0,1,0,0|2,0,0]=4 29433 B14R1.123 NCCCOCCOC1CCCCO1 34a_100000182051_100000744793 [0,1,0,1,0,0|2,0,0]=4 29434 B14R1.123 NCCOCCCOC1CCCCO1 34a_100000210304_100000700653 [0,1,0,1,0,0|2,0,0]=4 29435 B14R1.123 NCCOCCOCC1CCCCC1 34a_100000211614_100000211423 [0,1,0,1,0,0|2,0,0]=4 29436 B14R1.123 NCCOCCOCC1CCCCO1 34a_100000211614_100000211543 [0,1,0,1,0,0|2,0,0]=4 29437 B14R1.123 NOCCOCCCC1CCCCC1 34a_100000700252_100011713725 [0,1,0,1,0,0|1,0,0]=3 29438 B14R1.123 NOCCOCCCN1CCCCC1 34a_100000700252_100000690320 [0,1,0,1,0,0|2,0,0]=4 29439 B14R1.123 NOCCOCCOC1CCCCC1 34a_100000700252_100011211530 [0,1,0,1,0,0|2,0,0]=4 29440 B14R1.123 O=CCCCCCNC1CCCCC1 2230a_100000182618_100000139337 [0,1,0,1,0,0|0,0,2]=4 29441 B14R1.123 O=CCCCCCOC1CCCCC1 7a_100000210231_100000139337 [0,1,0,1,0,0|0,0,2]=4 29442 B14R1.123 O=CCCCCCSC1CCCCC1 62a_100000139337_100000210327 [0,1,0,1,0,0|0,0,2]=4 29443 B14R1.123 O=CCCCCCSC1CCCCC1 62a_100000210327_100000139337 [0,1,0,1,0,0|0,0,2]=4 29444 B14R1.123 O=CCCCCNCC1CCCCC1 2230a_100000210473_100000139335 [0,1,0,1,0,0|0,0,2]=4 29445 B14R1.123 O=CCCCCNCC1CCCCO1 2230a_100000174945_100000139335 [0,1,0,1,0,0|1,0,1]=4 29446 B14R1.123 O=CCCCCOCC1CCCCC1 7a_100000212181_100000139335 [0,1,0,1,0,0|0,0,2]=4 29447 B14R1.123 O=CCCCCOCC1CCCCO1 7a_100000211370_100000139335 [0,1,0,1,0,0|1,0,1]=4 29448 B14R1.123 O=CCCCCSCC1CCCCC1 62a_100000139335_100000211423 [0,1,0,1,0,0|0,0,2]=4 29449 B14R1.123 O=CCCCCSCC1CCCCC1 62a_100000211423_100000139335 [0,1,0,1,0,0|0,0,2]=4 29450 B14R1.123 O=CCCCCSCC1CCCCO1 62a_100000139335_100000211543 [0,1,0,1,0,0|1,0,1]=4 29451 B14R1.123 O=CCCCCSCC1CCCCO1 62a_100000211543_100000139335 [0,1,0,1,0,0|1,0,1]=4 29452 B14R1.123 O=CCCCNCCC1CCCCC1 2230a_100000738074_200011292268 [0,1,0,1,0,0|0,0,2]=4 29453 B14R1.123 O=CCCCNCCC1CCCCO1 2230a_100015183643_200011292268 [0,1,0,1,0,0|1,0,1]=4 29454 B14R1.123 O=CCCCOCCC1CCCCC1 7a_100011217863_200011292268 [0,1,0,1,0,0|0,0,2]=4 29455 B14R1.123 O=CCCCSCCC1CCCCC1 62a_100012355289_200011292268 [0,1,0,1,0,0|0,0,2]=4 29456 B14R1.123 O=CCCCSCCC1CCCCC1 62a_200011292268_100012355289 [0,1,0,1,0,0|0,0,2]=4 29457 B14R1.123 O=CCOCCCCC1CCCCC1 34a_100011215267_200009817547 [0,1,0,1,0,0|0,0,2]=4 29458 B14R1.123 O=CCOCCCCC1CCCCC1 7a_100011215267_200015260668 [0,1,0,1,0,0|0,0,2]=4 29459 B14R1.123 OCC#CCNCCC1CCCCC1 2230a_100000738074_200000047223 [0,1,0,1,0,0|0,0,2]=4 29460 B14R1.123 OCC#CCNCCC1CCCCC1 34a_100000738074_200000047223 [0,1,0,1,0,0|0,0,2]=4 29461 B14R1.123 OCC#CCOCCC1CCCCC1 34a_100011217863_200000047223 [0,1,0,1,0,0|0,0,2]=4 29462 B14R1.123 OCC#CCOCCC1CCCCC1 7a_100011217863_200000047223 [0,1,0,1,0,0|0,0,2]=4 29463 B14R1.123 OCC#CCSCCC1CCCCC1 62a_100012355289_200000047223 [0,1,0,1,0,0|0,0,2]=4 29464 B14R1.123 OCC#CCSCCC1CCCCC1 62a_200000047223_100012355289 [0,1,0,1,0,0|0,0,2]=4 29465 B14R1.123 OCCCCC=NNC1CCCCC1 4a_100000709804_100000031955 [0,1,0,1,0,0|1,0,1]=4 29466 B14R1.123 OCCCCCCCN1CC=CCC1 2230a_100000698166_100000760002 [0,1,0,1,0,0|0,0,2]=4 29467 B14R1.123 OCCCCCCCN1CC=CCC1 269982a_100000698166_100000760002 [0,1,0,1,0,0|0,0,2]=4 29468 B14R1.123 OCCCCCCCN1CC=CCC1 34a_100000698166_100000760002 [0,1,0,1,0,0|0,0,2]=4 29469 B14R1.123 OCCCCCCCN1CCCOC1 2230a_100000131196_100000760002 [0,1,0,1,0,0|1,0,0]=3 29470 B14R1.123 OCCCCCCCN1CCCOC1 269982a_100000131196_100000760002 [0,1,0,1,0,0|1,0,0]=3 29471 B14R1.123 OCCCCCCCN1CCCOC1 34a_100000131196_100000760002 [0,1,0,1,0,0|1,0,0]=3 29472 B14R1.123 OCCCCCCCN1CCOCC1 2230a_100015191051_100000760002 [0,1,0,1,0,0|1,0,0]=3 29473 B14R1.123 OCCCCCCCN1CCOCC1 269982a_100015191051_100000760002 [0,1,0,1,0,0|1,0,0]=3 29474 B14R1.123 OCCCCCCCN1CCOCC1 34a_100015191051_100000760002 [0,1,0,1,0,0|1,0,0]=3 29475 B14R1.123 OCCCCCCCN1CCSCC1 2230a_100000737611_100000760002 [0,1,0,1,0,0|1,0,0]=3 29476 B14R1.123 OCCCCCCCN1CCSCC1 269982a_100000737611_100000760002 [0,1,0,1,0,0|1,0,0]=3 29477 B14R1.123 OCCCCCCNC1C=CCCC1 2230a_100000686447_100000751183 [0,1,0,1,0,0|0,0,2]=4 29478 B14R1.123 OCCCCCCNC1CCCCC1 2230a_100000182618_100000766143 [0,1,0,1,0,0|0,0,0]=2 29479 B14R1.123 OCCCCCCNC1CCCCC1 270004a_100000686447_100000210434 [0,1,0,1,0,0|0,0,0]=2 29480 B14R1.123 OCCCCCCNC1CCCCC1 34a_100000182618_100000766143 [0,1,0,1,0,0|0,0,0]=2 29481 B14R1.123 OCCCCCCNC1CCCCC1 34a_100000686447_100000210327 [0,1,0,1,0,0|0,0,0]=2 29482 B14R1.123 OCCCCCCNC1CCCOC1 2230a_100000719290_100000766143 [0,1,0,1,0,0|1,0,0]=3 29483 B14R1.123 OCCCCCCNC1CCCOC1 270004a_100000686447_100000753404 [0,1,0,1,0,0|1,0,0]=3 29484 B14R1.123 OCCCCCCNC1CCCOC1 34a_100000686447_100000693364 [0,1,0,1,0,0|1,0,0]=3 29485 B14R1.123 OCCCCCCNC1CCCOC1 34a_100000719290_100000766143 [0,1,0,1,0,0|1,0,0]=3 29486 B14R1.123 OCCCCCCNC1CCCSC1 270004a_100000686447_100000057913 [0,1,0,1,0,0|1,0,0]=3 29487 B14R1.123 OCCCCCCNC1CCNCC1 270004a_100000686447_100015192401 [0,1,0,1,0,0|1,0,0]=3 29488 B14R1.123 OCCCCCCNC1CCOCC1 2230a_100000741149_100000766143 [0,1,0,1,0,0|1,0,0]=3 29489 B14R1.123 OCCCCCCNC1CCOCC1 270004a_100000686447_100011217826 [0,1,0,1,0,0|1,0,0]=3 29490 B14R1.123 OCCCCCCNC1CCOCC1 34a_100000741149_100000766143 [0,1,0,1,0,0|1,0,0]=3 29491 B14R1.123 OCCCCCCNC1CCSCC1 2230a_100000748639_100000766143 [0,1,0,1,0,0|1,0,0]=3 29492 B14R1.123 OCCCCCCNC1CCSCC1 270004a_100000686447_100000203788 [0,1,0,1,0,0|1,0,0]=3 29493 B14R1.123 OCCCCCCNC1CCSCC1 34a_100000686447_100000069128 [0,1,0,1,0,0|1,0,0]=3 29494 B14R1.123 OCCCCCCNC1CCSCC1 34a_100000748639_100000766143 [0,1,0,1,0,0|1,0,0]=3 29495 B14R1.123 OCCCCCCOC1C=CCCC1 34a_100011215024_100000766143 [0,1,0,1,0,0|0,0,2]=4 29496 B14R1.123 OCCCCCCOC1CC=CCC1 34a_100000073881_100000766143 [0,1,0,1,0,0|0,0,2]=4 29497 B14R1.123 OCCCCCCOC1CCCCC1 34a_100000210231_100000766143 [0,1,0,1,0,0|0,0,0]=2 29498 B14R1.123 OCCCCCCOC1CCCCC1 7a_100000210231_100000766143 [0,1,0,1,0,0|0,0,0]=2 29499 B14R1.123 OCCCCCCOC1CCCCO1 34a_100000033831_100000766143 [0,1,0,1,0,0|1,0,0]=3 29500 B14R1.123 OCCCCCCOC1CCCOC1 34a_100000754041_100000766143 [0,1,0,1,0,0|1,0,0]=3 29501 B14R1.123 OCCCCCCOC1CCCSC1 7a_100015962668_100000766143 [0,1,0,1,0,0|1,0,0]=3 29502 B14R1.123 OCCCCCCOC1CCOCC1 34a_100000744328_100000766143 [0,1,0,1,0,0|1,0,0]=3 29503 B14R1.123 OCCCCCCOC1CCSCC1 34a_100000731022_100000766143 [0,1,0,1,0,0|1,0,0]=3 29504 B14R1.123 OCCCCCCOC1CCSCC1 7a_100000731022_100000766143 [0,1,0,1,0,0|1,0,0]=3 29505 B14R1.123 OCCCCCCSC1C=CCCC1 62a_100000751183_100000766143 [0,1,0,1,0,0|0,0,2]=4 29506 B14R1.123 OCCCCCCSC1C=CCCC1 62a_100000766143_100000751183 [0,1,0,1,0,0|0,0,2]=4 29507 B14R1.123 OCCCCCCSC1CCCCC1 62a_100000210327_100000766143 [0,1,0,1,0,0|0,0,0]=2 29508 B14R1.123 OCCCCCCSC1CCCCC1 62a_100000766143_100000210327 [0,1,0,1,0,0|0,0,0]=2 29509 B14R1.123 OCCCCCCSC1CCCOC1 62a_100000766143_100000693364 [0,1,0,1,0,0|1,0,0]=3 29510 B14R1.123 OCCCCCCSC1CCOCC1 62a_100000766143_100011324220 [0,1,0,1,0,0|1,0,0]=3 29511 B14R1.123 OCCCCCCSC1CCSCC1 62a_100000766143_100000069128 [0,1,0,1,0,0|1,0,0]=3 29512 B14R1.123 OCCCCCNCC1CC=CCC1 270004a_100000762737_100000189434 [0,1,0,1,0,0|0,0,2]=4 29513 B14R1.123 OCCCCCNCC1CCCCC1 2230a_100000210473_100000746330 [0,1,0,1,0,0|0,0,0]=2 29514 B14R1.123 OCCCCCNCC1CCCCC1 2230a_100000762737_100000211423 [0,1,0,1,0,0|0,0,0]=2 29515 B14R1.123 OCCCCCNCC1CCCCC1 269862a_100000762737_100000211278 [0,1,0,1,0,0|0,0,0]=2 29516 B14R1.123 OCCCCCNCC1CCCCC1 34a_100000210473_100000746330 [0,1,0,1,0,0|0,0,0]=2 29517 B14R1.123 OCCCCCNCC1CCCCC1 34a_100000762737_100000211423 [0,1,0,1,0,0|0,0,0]=2 29518 B14R1.123 OCCCCCNCC1CCCCO1 2230a_100000174945_100000746330 [0,1,0,1,0,0|1,0,0]=3 29519 B14R1.123 OCCCCCNCC1CCCCO1 2230a_100000762737_100000211543 [0,1,0,1,0,0|1,0,0]=3 29520 B14R1.123 OCCCCCNCC1CCCCO1 34a_100000174945_100000746330 [0,1,0,1,0,0|1,0,0]=3 29521 B14R1.123 OCCCCCNCC1CCCCO1 34a_100000762737_100000211543 [0,1,0,1,0,0|1,0,0]=3 29522 B14R1.123 OCCCCCNCC1CCCOC1 2230a_100000720124_100000746330 [0,1,0,1,0,0|1,0,0]=3 29523 B14R1.123 OCCCCCNCC1CCCOC1 2230a_100000762737_100000741521 [0,1,0,1,0,0|1,0,0]=3 29524 B14R1.123 OCCCCCNCC1CCCOC1 34a_100000720124_100000746330 [0,1,0,1,0,0|1,0,0]=3 29525 B14R1.123 OCCCCCNCC1CCCOC1 34a_100000762737_100000741521 [0,1,0,1,0,0|1,0,0]=3 29526 B14R1.123 OCCCCCNCC1CCOCC1 2230a_100000746373_100000746330 [0,1,0,1,0,0|1,0,0]=3 29527 B14R1.123 OCCCCCNCC1CCOCC1 2230a_100000762737_100000754603 [0,1,0,1,0,0|1,0,0]=3 29528 B14R1.123 OCCCCCNCC1CCOCC1 269862a_100000762737_100000749017 [0,1,0,1,0,0|1,0,0]=3 29529 B14R1.123 OCCCCCNCC1CCOCC1 34a_100000746373_100000746330 [0,1,0,1,0,0|1,0,0]=3 29530 B14R1.123 OCCCCCNCC1CCOCC1 34a_100000762737_100000754603 [0,1,0,1,0,0|1,0,0]=3 29531 B14R1.123 OCCCCCNCC1CCSCC1 2230a_100015188806_100000746330 [0,1,0,1,0,0|1,0,0]=3 29532 B14R1.123 OCCCCCNCC1CCSCC1 269862a_100000762737_100000067145 [0,1,0,1,0,0|1,0,0]=3 29533 B14R1.123 OCCCCCNCC1CCSCC1 270004a_100000762737_100000067145 [0,1,0,1,0,0|1,0,0]=3 29534 B14R1.123 OCCCCCNCC1CCSCC1 34a_100015188806_100000746330 [0,1,0,1,0,0|1,0,0]=3 29535 B14R1.123 OCCCCCNC[C@H]1COCCO1 2230a_100010981119_100000746330 [0,1,0,1,0,0|2,0,0]=4 29536 B14R1.123 OCCCCCNC[C@H]1COCCO1 34a_100010981119_100000746330 [0,1,0,1,0,0|2,0,0]=4 29537 B14R1.123 OCCCCCOCC1CC=CCC1 34a_100000210713_100000746330 [0,1,0,1,0,0|0,0,2]=4 29538 B14R1.123 OCCCCCOCC1CCCCC1 34a_100000212181_100000746330 [0,1,0,1,0,0|0,0,0]=2 29539 B14R1.123 OCCCCCOCC1CCCCC1 7a_100000212181_100000746330 [0,1,0,1,0,0|0,0,0]=2 29540 B14R1.123 OCCCCCOCC1CCCCN1 34a_100000210821_100000746330 [0,1,0,1,0,0|1,0,0]=3 29541 B14R1.123 OCCCCCOCC1CCCCO1 34a_100000211370_100000746330 [0,1,0,1,0,0|1,0,0]=3 29542 B14R1.123 OCCCCCOCC1CCCCO1 7a_100000211370_100000746330 [0,1,0,1,0,0|1,0,0]=3 29543 B14R1.123 OCCCCCOCC1CCCNC1 34a_100000211344_100000746330 [0,1,0,1,0,0|1,0,0]=3 29544 B14R1.123 OCCCCCOCC1CCCOC1 34a_100000741520_100000746330 [0,1,0,1,0,0|1,0,0]=3 29545 B14R1.123 OCCCCCOCC1CCNCC1 34a_100000738675_100000746330 [0,1,0,1,0,0|1,0,0]=3 29546 B14R1.123 OCCCCCOCC1CCOCC1 34a_100000749013_100000746330 [0,1,0,1,0,0|1,0,0]=3 29547 B14R1.123 OCCCCCOCC1CCSCC1 34a_100000070558_100000746330 [0,1,0,1,0,0|1,0,0]=3 29548 B14R1.123 OCCCCCOCC1CCSCC1 7a_100000070558_100000746330 [0,1,0,1,0,0|1,0,0]=3 29549 B14R1.123 OCCCCCOC[C@@H]1CNCCO1 34a_100015189573_100000746330 [0,1,0,1,0,0|2,0,0]=4 29550 B14R1.123 OCCCCCOC[C@@H]1COCCN1 34a_100000717676_100000746330 [0,1,0,1,0,0|2,0,0]=4 29551 B14R1.123 OCCCCCOC[C@H]1COCCO1 34a_100009875890_100000746330 [0,1,0,1,0,0|2,0,0]=4 29552 B14R1.123 OCCCCCSCC1CCCCC1 62a_100000211423_100000746330 [0,1,0,1,0,0|0,0,0]=2 29553 B14R1.123 OCCCCCSCC1CCCCC1 62a_100000746330_100000211423 [0,1,0,1,0,0|0,0,0]=2 29554 B14R1.123 OCCCCCSCC1CCCCO1 62a_100000211543_100000746330 [0,1,0,1,0,0|1,0,0]=3 29555 B14R1.123 OCCCCCSCC1CCCCO1 62a_100000746330_100000211543 [0,1,0,1,0,0|1,0,0]=3 29556 B14R1.123 OCCCCCSCC1CCCOC1 62a_100000741521_100000746330 [0,1,0,1,0,0|1,0,0]=3 29557 B14R1.123 OCCCCCSCC1CCCOC1 62a_100000746330_100000741521 [0,1,0,1,0,0|1,0,0]=3 29558 B14R1.123 OCCCCCSCC1CCOCC1 62a_100000746330_100000749018 [0,1,0,1,0,0|1,0,0]=3 29559 B14R1.123 OCCCCCSCC1CCOCC1 62a_100000754603_100000746330 [0,1,0,1,0,0|1,0,0]=3 29560 B14R1.123 OCCCCNCCC1=CCCCC1 2230a_100000212019_100000210776 [0,1,0,1,0,0|0,0,2]=4 29561 B14R1.123 OCCCCNCCC1=CCCCC1 34a_100000212019_100011216708 [0,1,0,1,0,0|0,0,2]=4 29562 B14R1.123 OCCCCNCCC1CCCCC1 2230a_100000738074_100000210776 [0,1,0,1,0,0|0,0,0]=2 29563 B14R1.123 OCCCCNCCC1CCCCC1 2230a_100000750430_100012355289 [0,1,0,1,0,0|0,0,0]=2 29564 B14R1.123 OCCCCNCCC1CCCCC1 270004a_100000750430_100011713444 [0,1,0,1,0,0|0,0,0]=2 29565 B14R1.123 OCCCCNCCC1CCCCC1 34a_100000738074_100011216708 [0,1,0,1,0,0|0,0,0]=2 29566 B14R1.123 OCCCCNCCC1CCCCC1 34a_100000750430_100011209188 [0,1,0,1,0,0|0,0,0]=2 29567 B14R1.123 OCCCCNCCC1CCCCO1 2230a_100015183643_100000210776 [0,1,0,1,0,0|1,0,0]=3 29568 B14R1.123 OCCCCNCCC1CCCCO1 34a_100015183643_100011216708 [0,1,0,1,0,0|1,0,0]=3 29569 B14R1.123 OCCCCNCCC1CCOCC1 2230a_100000750430_100011934994 [0,1,0,1,0,0|1,0,0]=3 29570 B14R1.123 OCCCCNCCC1CCOCC1 2230a_100000755988_100000210776 [0,1,0,1,0,0|1,0,0]=3 29571 B14R1.123 OCCCCNCCC1CCOCC1 34a_100000750430_100011934994 [0,1,0,1,0,0|1,0,0]=3 29572 B14R1.123 OCCCCNCCC1CCOCC1 34a_100000755988_100011216708 [0,1,0,1,0,0|1,0,0]=3 29573 B14R1.123 OCCCCNCCC1OCCCO1 2230a_100000750430_100000764188 [0,1,0,1,0,0|2,0,0]=4 29574 B14R1.123 OCCCCNCCC1OCCCO1 34a_100000750430_100000764188 [0,1,0,1,0,0|2,0,0]=4 29575 B14R1.123 OCCCCNCCN1CCCCC1 2230a_100000750430_100000739454 [0,1,0,1,0,0|1,0,0]=3 29576 B14R1.123 OCCCCNCCN1CCCCC1 34a_100000750430_100000739454 [0,1,0,1,0,0|1,0,0]=3 29577 B14R1.123 OCCCCNCCN1CCOCC1 2230a_100000750430_100025781966 [0,1,0,1,0,0|2,0,0]=4 29578 B14R1.123 OCCCCNCCN1CCSCC1 2230a_100000755026_100000210776 [0,1,0,1,0,0|2,0,0]=4 29579 B14R1.123 OCCCCNCOC1CCCCC1 2230a_100000750430_100011935260 [0,1,0,1,0,0|1,0,0]=3 29580 B14R1.123 OCCCCNCOC1CCCCC1 34a_100000750430_100011935260 [0,1,0,1,0,0|1,0,0]=3 29581 B14R1.123 OCCCCOCCC1CCCCC1 34a_100011217863_100011216708 [0,1,0,1,0,0|0,0,0]=2 29582 B14R1.123 OCCCCOCCC1CCCCC1 7a_100011217863_100000210776 [0,1,0,1,0,0|0,0,0]=2 29583 B14R1.123 OCCCCOCCC1CCCCN1 34a_100000211664_100011216708 [0,1,0,1,0,0|1,0,0]=3 29584 B14R1.123 OCCCCOCCC1CCCNC1 34a_100000752241_100011216708 [0,1,0,1,0,0|1,0,0]=3 29585 B14R1.123 OCCCCOCCC1CCNCC1 34a_100015190746_100011216708 [0,1,0,1,0,0|1,0,0]=3 29586 B14R1.123 OCCCCOCCC1CCOCC1 34a_100011933979_100011216708 [0,1,0,1,0,0|1,0,0]=3 29587 B14R1.123 OCCCCOCCC1CCOCC1 7a_100011933979_100000210776 [0,1,0,1,0,0|1,0,0]=3 29588 B14R1.123 OCCCCOCCC1SCCCS1 34a_200011025297_100011216708 [0,1,0,1,0,0|2,0,0]=4 29589 B14R1.123 OCCCCOCCC1SCCCS1 7a_200011025297_100000210776 [0,1,0,1,0,0|2,0,0]=4 29590 B14R1.123 OCCCCOCCN1CCSCC1 7a_100000686052_100000210776 [0,1,0,1,0,0|2,0,0]=4 29591 B14R1.123 OCCCCOCC[C@@H]1CNCCN1 34a_100016989929_100011216708 [0,1,0,1,0,0|2,0,0]=4 29592 B14R1.123 OCCCCSCCC1CCCCC1 62a_100000210776_100012355289 [0,1,0,1,0,0|0,0,0]=2 29593 B14R1.123 OCCCCSCCC1CCCCC1 62a_100012355289_100000210776 [0,1,0,1,0,0|0,0,0]=2 29594 B14R1.123 OCCCCSCCC1CCOCC1 62a_100000210776_100011934994 [0,1,0,1,0,0|1,0,0]=3 29595 B14R1.123 OCCCCSCCC1CCOCC1 62a_100011934994_100000210776 [0,1,0,1,0,0|1,0,0]=3 29596 B14R1.123 OCCCCSCCC1OCCCO1 62a_100000210776_100000764188 [0,1,0,1,0,0|2,0,0]=4 29597 B14R1.123 OCCCCSCCC1OCCCO1 62a_100000764188_100000210776 [0,1,0,1,0,0|2,0,0]=4 29598 B14R1.123 OCCCCSCCN1CCCCC1 62a_100000210776_100000739454 [0,1,0,1,0,0|1,0,0]=3 29599 B14R1.123 OCCCCSCCN1CCCCC1 62a_100000739454_100000210776 [0,1,0,1,0,0|1,0,0]=3 29600 B14R1.123 OCCCCSCCN1CCOCC1 62a_100000210776_100000211760 [0,1,0,1,0,0|2,0,0]=4 29601 B14R1.123 OCCCCSCOC1CCCCC1 62a_100000210776_100011935260 [0,1,0,1,0,0|1,0,0]=3 29602 B14R1.123 OCCCCSCOC1CCCCC1 62a_100011935260_100000210776 [0,1,0,1,0,0|1,0,0]=3 29603 B14R1.123 OCCCNCCCC1CCCCC1 2230a_100011211642_100000230001 [0,1,0,1,0,0|0,0,0]=2 29604 B14R1.123 OCCCNCCCC1CCCCC1 34a_100011211642_100000230001 [0,1,0,1,0,0|0,0,0]=2 29605 B14R1.123 OCCCNCCOC1CCCCC1 34a_100015206981_100000230001 [0,1,0,1,0,0|1,0,0]=3 29606 B14R1.123 OCCCOCCCC1CCCCC1 34a_100000198086_100000230001 [0,1,0,1,0,0|0,0,0]=2 29607 B14R1.123 OCCCOCCCC1CCCCC1 7a_100000198086_100011215043 [0,1,0,1,0,0|0,0,0]=2 29608 B14R1.123 OCCCOCCCC1CCCCN1 34a_100011934581_100000230001 [0,1,0,1,0,0|1,0,0]=3 29609 B14R1.123 OCCCOCCCC1CCCNC1 34a_100150707839_100000230001 [0,1,0,1,0,0|1,0,0]=3 29610 B14R1.123 OCCCOCCCC1CCNCC1 34a_100016988962_100000230001 [0,1,0,1,0,0|1,0,0]=3 29611 B14R1.123 OCCCOCCCN1CCCCC1 34a_100000212458_100000230001 [0,1,0,1,0,0|1,0,0]=3 29612 B14R1.123 OCCCOCCCN1CCOCC1 34a_100000212840_100000230001 [0,1,0,1,0,0|2,0,0]=4 29613 B14R1.123 OCCCOCCNC1CCCCC1 34a_100000200466_100000230001 [0,1,0,1,0,0|1,0,0]=3 29614 B14R1.123 OCCCOCCNC1CCOCC1 34a_100000708129_100000230001 [0,1,0,1,0,0|2,0,0]=4 29615 B14R1.123 OCCCOCCOC1CCCCC1 34a_100011249652_100000230001 [0,1,0,1,0,0|1,0,0]=3 29616 B14R1.123 OCCCOCCOC1CCCCC1 7a_100011249652_100011215043 [0,1,0,1,0,0|1,0,0]=3 29617 B14R1.123 OCCCOCCOC1CCCCO1 34a_100000034223_100000230001 [0,1,0,1,0,0|2,0,0]=4 29618 B14R1.123 OCCCOCCOC1CCCCO1 7a_100000034223_100011215043 [0,1,0,1,0,0|2,0,0]=4 29619 B14R1.123 OCCCSCCCC1CCCCC1 62a_100011215043_100011713725 [0,1,0,1,0,0|0,0,0]=2 29620 B14R1.123 OCCCSCCCC1CCCCC1 62a_100011713725_100011215043 [0,1,0,1,0,0|0,0,0]=2 29621 B14R1.123 OCCCSCCCN1CCCCC1 62a_100011215043_100000007876 [0,1,0,1,0,0|1,0,0]=3 29622 B14R1.123 OCCCSCCCN1CCCCC1 62a_100132302099_100011215043 [0,1,0,1,0,0|1,0,0]=3 29623 B14R1.123 OCCCSCCCN1CCOCC1 62a_100011215043_100000748698 [0,1,0,1,0,0|2,0,0]=4 29624 B14R1.123 OCCCSCCOC1CCCCC1 62a_100011211530_100011215043 [0,1,0,1,0,0|1,0,0]=3 29625 B14R1.123 OCCCSCCOC1CCCCC1 62a_100011215043_100011211530 [0,1,0,1,0,0|1,0,0]=3 29626 B14R1.123 OCCCSCCOC1CCCCO1 62a_100000744793_100011215043 [0,1,0,1,0,0|2,0,0]=4 29627 B14R1.123 OCCCSCCOC1CCCCO1 62a_100011215043_100000744793 [0,1,0,1,0,0|2,0,0]=4 29628 B14R1.123 OCCNCCCOC1CCCCC1 34a_100000205933_100000211926 [0,1,0,1,0,0|1,0,0]=3 29629 B14R1.123 OCCNCCCOC1CCCCO1 2230a_100016997473_100000700653 [0,1,0,1,0,0|2,0,0]=4 29630 B14R1.123 OCCNCCCOC1CCCCO1 34a_100016990907_100000700653 [0,1,0,1,0,0|2,0,0]=4 29631 B14R1.123 OCCNN=CCCC1CCCCC1 4a_100000210001_200000189433 [0,1,0,1,0,0|1,0,1]=4 29632 B14R1.123 OCCOCCCCC1CCCCC1 34a_100011215267_100000211926 [0,1,0,1,0,0|0,0,0]=2 29633 B14R1.123 OCCOCCCCC1CCCCC1 7a_100011215267_100000211926 [0,1,0,1,0,0|0,0,0]=2 29634 B14R1.123 OCCOCCCCC1CCNCC1 34a_100016989291_100000211926 [0,1,0,1,0,0|1,0,0]=3 29635 B14R1.123 OCCOCCCCN1CCOCC1 34a_100000723369_100000211926 [0,1,0,1,0,0|2,0,0]=4 29636 B14R1.123 OCCOCCNCC1CCCCC1 2230a_100000210473_100011215305 [0,1,0,1,0,0|1,0,0]=3 29637 B14R1.123 OCCOCCNCC1CCCCC1 2230a_100000211614_100000211423 [0,1,0,1,0,0|1,0,0]=3 29638 B14R1.123 OCCOCCNCC1CCCCC1 269862a_100000211614_100000211278 [0,1,0,1,0,0|1,0,0]=3 29639 B14R1.123 OCCOCCNCC1CCCCC1 34a_100000210473_100000692535 [0,1,0,1,0,0|1,0,0]=3 29640 B14R1.123 OCCOCCNCC1CCCCC1 34a_100000211614_100000211423 [0,1,0,1,0,0|1,0,0]=3 29641 B14R1.123 OCCOCCNCC1CCCCO1 2230a_100000174945_100011215305 [0,1,0,1,0,0|2,0,0]=4 29642 B14R1.123 OCCOCCNCC1CCCCO1 2230a_100000211614_100000211543 [0,1,0,1,0,0|2,0,0]=4 29643 B14R1.123 OCCOCCNCC1CCCCO1 34a_100000174945_100000692535 [0,1,0,1,0,0|2,0,0]=4 29644 B14R1.123 OCCOCCNCC1CCCCO1 34a_100000211614_100000211543 [0,1,0,1,0,0|2,0,0]=4 29645 B14R1.123 OCCOCCNCC1CCCOC1 2230a_100000211614_100000741521 [0,1,0,1,0,0|2,0,0]=4 29646 B14R1.123 OCCOCCNCC1CCCOC1 2230a_100000720124_100011215305 [0,1,0,1,0,0|2,0,0]=4 29647 B14R1.123 OCCOCCNCC1CCCOC1 34a_100000211614_100000741521 [0,1,0,1,0,0|2,0,0]=4 29648 B14R1.123 OCCOCCNCC1CCCOC1 34a_100000720124_100000692535 [0,1,0,1,0,0|2,0,0]=4 29649 B14R1.123 OCCOCCNCC1CCOCC1 2230a_100000211614_100000754603 [0,1,0,1,0,0|2,0,0]=4 29650 B14R1.123 OCCOCCNCC1CCOCC1 2230a_100000746373_100011215305 [0,1,0,1,0,0|2,0,0]=4 29651 B14R1.123 OCCOCCNCC1CCOCC1 269862a_100000211614_100000749017 [0,1,0,1,0,0|2,0,0]=4 29652 B14R1.123 OCCOCCNCC1CCOCC1 34a_100000211614_100000754603 [0,1,0,1,0,0|2,0,0]=4 29653 B14R1.123 OCCOCCNCC1CCOCC1 34a_100000746373_100000692535 [0,1,0,1,0,0|2,0,0]=4 29654 B14R1.123 OCCOCCNCC1CCSCC1 2230a_100015188806_100011215305 [0,1,0,1,0,0|2,0,0]=4 29655 B14R1.123 OCCOCCNCC1CCSCC1 269862a_100000211614_100000067145 [0,1,0,1,0,0|2,0,0]=4 29656 B14R1.123 OCCOCCNCC1CCSCC1 270004a_100000211614_100000067145 [0,1,0,1,0,0|2,0,0]=4 29657 B14R1.123 OCCOCCNCC1CCSCC1 34a_100015188806_100000692535 [0,1,0,1,0,0|2,0,0]=4 29658 B14R1.123 OCCOCCOCC1CCCCC1 34a_100000212181_100000692535 [0,1,0,1,0,0|1,0,0]=3 29659 B14R1.123 OCCOCCOCC1CCCCC1 7a_100000212181_100011215305 [0,1,0,1,0,0|1,0,0]=3 29660 B14R1.123 OCCOCCOCC1CCCCN1 34a_100000210821_100000692535 [0,1,0,1,0,0|2,0,0]=4 29661 B14R1.123 OCCOCCOCC1CCCCO1 34a_100000211370_100000692535 [0,1,0,1,0,0|2,0,0]=4 29662 B14R1.123 OCCOCCOCC1CCCCO1 7a_100000211370_100011215305 [0,1,0,1,0,0|2,0,0]=4 29663 B14R1.123 OCCOCCOCC1CCCNC1 34a_100000211344_100000692535 [0,1,0,1,0,0|2,0,0]=4 29664 B14R1.123 OCCOCCOCC1CCCOC1 34a_100000741520_100000692535 [0,1,0,1,0,0|2,0,0]=4 29665 B14R1.123 OCCOCCOCC1CCNCC1 34a_100000738675_100000692535 [0,1,0,1,0,0|2,0,0]=4 29666 B14R1.123 OCCOCCOCC1CCOCC1 34a_100000749013_100000692535 [0,1,0,1,0,0|2,0,0]=4 29667 B14R1.123 OCCOCCOCC1CCSCC1 34a_100000070558_100000692535 [0,1,0,1,0,0|2,0,0]=4 29668 B14R1.123 OCCOCCOCC1CCSCC1 7a_100000070558_100011215305 [0,1,0,1,0,0|2,0,0]=4 29669 B14R1.123 OCCOCCSCC1CCCCC1 62a_100000211423_100011215305 [0,1,0,1,0,0|1,0,0]=3 29670 B14R1.123 OCCOCCSCC1CCCCC1 62a_100011215305_100000211423 [0,1,0,1,0,0|1,0,0]=3 29671 B14R1.123 OCCOCCSCC1CCCCO1 62a_100000211543_100011215305 [0,1,0,1,0,0|2,0,0]=4 29672 B14R1.123 OCCOCCSCC1CCCCO1 62a_100011215305_100000211543 [0,1,0,1,0,0|2,0,0]=4 29673 B14R1.123 OCCOCCSCC1CCCOC1 62a_100000741521_100011215305 [0,1,0,1,0,0|2,0,0]=4 29674 B14R1.123 OCCOCCSCC1CCCOC1 62a_100011215305_100000741521 [0,1,0,1,0,0|2,0,0]=4 29675 B14R1.123 OCCOCCSCC1CCOCC1 62a_100000754603_100011215305 [0,1,0,1,0,0|2,0,0]=4 29676 B14R1.123 OCCOCCSCC1CCOCC1 62a_100011215305_100000749018 [0,1,0,1,0,0|2,0,0]=4 29677 B14R1.123 OCCSCCCOC1CCCCO1 62a_100000211926_100000700653 [0,1,0,1,0,0|2,0,0]=4 29678 B14R1.123 OCCSCCCOC1CCCCO1 62a_100000700653_100000211926 [0,1,0,1,0,0|2,0,0]=4 29679 B14R1.123 OCCSCCNCC1CCCCC1 2230a_100011219999_100000211423 [0,1,0,1,0,0|1,0,0]=3 29680 B14R1.123 OCCSCCNCC1CCCCC1 269862a_100011219999_100000211278 [0,1,0,1,0,0|1,0,0]=3 29681 B14R1.123 OCCSCCNCC1CCCCO1 2230a_100011219999_100000211543 [0,1,0,1,0,0|2,0,0]=4 29682 B14R1.123 OCCSCCNCC1CCCOC1 2230a_100011219999_100000741521 [0,1,0,1,0,0|2,0,0]=4 29683 B14R1.123 OCCSCCNCC1CCOCC1 2230a_100011219999_100000754603 [0,1,0,1,0,0|2,0,0]=4 29684 B14R1.123 OCCSCCNCC1CCOCC1 269862a_100011219999_100000749017 [0,1,0,1,0,0|2,0,0]=4 29685 B14R1.123 OCCSCCNCC1CCSCC1 269862a_100011219999_100000067145 [0,1,0,1,0,0|2,0,0]=4 29686 B14R1.123 OCCSCCNCC1CCSCC1 270004a_100011219999_100000067145 [0,1,0,1,0,0|2,0,0]=4 29687 B14R1.123 [13CH3]OCCOCCOC1CCCCO1 34a_100000080444_200025704644 [0,1,0,1,0,0|2,0,0]=4 29688 B14R1.123 [13CH3]OCCOCCOC1CCCCO1 7a_100000080444_200025704644 [0,1,0,1,0,0|2,0,0]=4 29689 B14R1.156 CC(CCCCl)OCC1CCCCC1 34a_200000718107_100000211423 [0,1,0,1,0,0|2,0,0]=4 29690 B14R1.156 CC(CCCCl)OCC1CCCCC1 7a_200000718107_100000211423 [0,1,0,1,0,0|2,0,0]=4 29691 B14R1.156 CC(CCCCl)OCC1CCCCO1 34a_200000718107_100000211543 [0,1,0,1,0,0|2,0,0]=4 29692 B14R1.156 CC(CCCCl)OCC1CCCCO1 7a_200000718107_100000211543 [0,1,0,1,0,0|2,0,0]=4 29693 B14R1.156 CC(CCN1CCCCC1)NCCO 270004a_100000210304_100000727156 [0,1,0,1,0,0|2,0,0]=4 29694 B14R1.156 CC(CNC1CCCCC1)OCCO 34a_100000202029_100000211926 [0,1,0,1,0,0|2,0,0]=4 29695 B14R1.156 CCCCC(=O)CCC1CCCCC1 1458a_100000210183_100011273959 [0,1,0,1,0,0|1,0,1]=4 29696 B14R1.156 CCCCC(=O)CCC1CCCCC1 1458a_100000211375_100000210211 [0,1,0,1,0,0|1,0,1]=4 29697 B14R1.156 CCCCC(=O)CCC1OCCCO1 1458a_100000210183_100000764188 [0,1,0,1,0,0|1,0,1]=4 29698 B14R1.156 CCCCC(=O)CCN1CCCCO1 1458a_200015184090_100000210211 [0,1,0,1,0,0|1,0,1]=4 29699 B14R1.156 CCCCC(=O)NCC1CCCCO1 11a_100000174945_100000210183 [0,1,0,1,0,0|1,0,1]=4 29700 B14R1.156 CCCCC(=O)NCC1CCCCO1 1626a_100000174945_100000210183 [0,1,0,1,0,0|1,0,1]=4 29701 B14R1.156 CCCCC(=O)NCC1CCCCO1 240690a_100000174945_100000210183 [0,1,0,1,0,0|1,0,1]=4 29702 B14R1.156 CCCCC(=O)NCC1CCCCO1 527a_100000174945_100000210183 [0,1,0,1,0,0|1,0,1]=4 29703 B14R1.156 CCCCC(C)COC1CCCCC1 34a_100011995851_100000210327 [0,1,0,1,0,0|2,0,0]=4 29704 B14R1.156 CCCCC(C)COC1CCCCC1 7a_100011995851_100000210327 [0,1,0,1,0,0|2,0,0]=4 29705 B14R1.156 CCCCC(C)NCC1CCCCC1 2230a_100000126638_100000211423 [0,1,0,1,0,0|2,0,0]=4 29706 B14R1.156 CCCCC(C)NCC1CCCCC1 2230a_100000210473_200011215066 [0,1,0,1,0,0|2,0,0]=4 29707 B14R1.156 CCCCC(C)NCC1CCCCC1 269862a_100000126638_100000211278 [0,1,0,1,0,0|2,0,0]=4 29708 B14R1.156 CCCCC(C)NCC1CCCCC1 270004a_100000210473_100000210087 [0,1,0,1,0,0|2,0,0]=4 29709 B14R1.156 CCCCC(C)NCC1CCCCC1 34a_100000210473_200011215066 [0,1,0,1,0,0|2,0,0]=4 29710 B14R1.156 CCCCC(C)NCC1CCCCO1 2230a_100000126638_100000211543 [0,1,0,1,0,0|1,0,0]=3 29711 B14R1.156 CCCCC(C)NCC1CCCCO1 2230a_100000174945_200011215066 [0,1,0,1,0,0|1,0,0]=3 29712 B14R1.156 CCCCC(C)NCC1CCCCO1 270004a_100000174945_100000210087 [0,1,0,1,0,0|1,0,0]=3 29713 B14R1.156 CCCCC(C)NCC1CCCCO1 34a_100000174945_200011215066 [0,1,0,1,0,0|1,0,0]=3 29714 B14R1.156 CCCCC(C)NC[C@H]1COCCO1 2230a_100010981119_200011215066 [0,1,0,1,0,0|2,0,0]=4 29715 B14R1.156 CCCCC(C)NC[C@H]1COCCO1 270004a_100010981119_100000210087 [0,1,0,1,0,0|2,0,0]=4 29716 B14R1.156 CCCCC(C)NC[C@H]1COCCO1 34a_100010981119_200011215066 [0,1,0,1,0,0|2,0,0]=4 29717 B14R1.156 CCCCC(C)OCC1CCCCC1 34a_100000212181_200011215066 [0,1,0,1,0,0|2,0,0]=4 29718 B14R1.156 CCCCC(C)OCC1CCCCC1 34a_100000687866_100000211423 [0,1,0,1,0,0|2,0,0]=4 29719 B14R1.156 CCCCC(C)OCC1CCCCC1 7a_100000212181_200011215066 [0,1,0,1,0,0|2,0,0]=4 29720 B14R1.156 CCCCC(C)OCC1CCCCC1 7a_100000687866_100000211423 [0,1,0,1,0,0|2,0,0]=4 29721 B14R1.156 CCCCC(C)OCC1CCCCN1 34a_100000210821_200011215066 [0,1,0,1,0,0|2,0,0]=4 29722 B14R1.156 CCCCC(C)OCC1CCCCO1 34a_100000211370_200011215066 [0,1,0,1,0,0|1,0,0]=3 29723 B14R1.156 CCCCC(C)OCC1CCCCO1 34a_100000687866_100000211543 [0,1,0,1,0,0|1,0,0]=3 29724 B14R1.156 CCCCC(C)OCC1CCCCO1 7a_100000211370_200011215066 [0,1,0,1,0,0|1,0,0]=3 29725 B14R1.156 CCCCC(C)OCC1CCCCO1 7a_100000687866_100000211543 [0,1,0,1,0,0|1,0,0]=3 29726 B14R1.156 CCCCC(C)OC[C@@H]1CNCCO1 34a_100015189573_200011215066 [0,1,0,1,0,0|2,0,0]=4 29727 B14R1.156 CCCCC(C)OC[C@H]1COCCO1 34a_100009875890_200011215066 [0,1,0,1,0,0|2,0,0]=4 29728 B14R1.156 CCCCC(C)SCC1CCCCC1 62a_100000211423_200011215066 [0,1,0,1,0,0|2,0,0]=4 29729 B14R1.156 CCCCC(C)SCC1CCCCC1 62a_200011215066_100000211423 [0,1,0,1,0,0|2,0,0]=4 29730 B14R1.156 CCCCC(C)SCC1CCCCO1 62a_100000211543_200011215066 [0,1,0,1,0,0|1,0,0]=3 29731 B14R1.156 CCCCC(C)SCC1CCCCO1 62a_200011215066_100000211543 [0,1,0,1,0,0|1,0,0]=3 29732 B14R1.156 CCCCN(C)CCC1CCCCC1 2230a_100000207549_100012355289 [0,1,0,1,0,0|2,0,0]=4 29733 B14R1.156 CCCCN(C)CCC1CCCCC1 269982a_100000207549_100011273959 [0,1,0,1,0,0|2,0,0]=4 29734 B14R1.156 CCCCN(C)CCC1CCCCC1 270004a_100000207549_100011713444 [0,1,0,1,0,0|2,0,0]=4 29735 B14R1.156 CCCCN(C)CCC1CCCCO1 2230a_100015183322_100000210211 [0,1,0,1,0,0|1,0,0]=3 29736 B14R1.156 CCCCN(C)CCC1CCCCO1 269982a_100015183322_100000210211 [0,1,0,1,0,0|1,0,0]=3 29737 B14R1.156 CCCCN(C)CCC1CCCCO1 34a_100015183322_100000210210 [0,1,0,1,0,0|1,0,0]=3 29738 B14R1.156 CCCCN(C)CCC1OCCCO1 2230a_100000207549_100000764188 [0,1,0,1,0,0|2,0,0]=4 29739 B14R1.156 CCCCN(C)CCC1OCCCO1 269982a_100000207549_100000764188 [0,1,0,1,0,0|2,0,0]=4 29740 B14R1.156 CCCC[C@H](N)COC1CCCCC1 34a_100011934283_100000210327 [0,1,0,1,0,0|2,0,0]=4 29741 B14R1.156 CCOCC(C)OCC1CCCCO1 34a_100000718985_100000211543 [0,1,0,1,0,0|2,0,0]=4 29742 B14R1.156 CCOCC(C)OCC1CCCCO1 7a_100000718985_100000211543 [0,1,0,1,0,0|2,0,0]=4 29743 B14R1.156 CCOCN(C)CCC1CCCCO1 269982a_100015183322_100000739092 [0,1,0,1,0,0|2,0,0]=4 29744 B14R1.156 CCSCC(C)NCC1CCCCO1 270004a_100000174945_200011216171 [0,1,0,1,0,0|2,0,0]=4 29745 B14R1.156 CN(CCCF)CCC1CCCCO1 2230a_100015183322_100011934791 [0,1,0,1,0,0|2,0,0]=4 29746 B14R1.156 CN(CCCF)CCC1CCCCO1 269982a_100015183322_100011934791 [0,1,0,1,0,0|2,0,0]=4 29747 B14R1.156 CN(CCCF)CCC1CCCCO1 34a_100015183322_100011934791 [0,1,0,1,0,0|2,0,0]=4 29748 B14R1.156 CN(CCCO)CCC1CCCCC1 2230a_100000213112_100012355289 [0,1,0,1,0,0|1,0,0]=3 29749 B14R1.156 CN(CCCO)CCC1CCCCC1 269982a_100000213112_100011273959 [0,1,0,1,0,0|1,0,0]=3 29750 B14R1.156 CN(CCCO)CCC1CCCCC1 270004a_100000213112_100011713444 [0,1,0,1,0,0|1,0,0]=3 29751 B14R1.156 CN(CCCO)CCC1CCCCO1 2230a_100015183322_100000230001 [0,1,0,1,0,0|2,0,0]=4 29752 B14R1.156 CN(CCCO)CCC1CCCCO1 269982a_100015183322_100011215043 [0,1,0,1,0,0|2,0,0]=4 29753 B14R1.156 CN(CCCO)CCC1CCCCO1 34a_100015183322_100000230001 [0,1,0,1,0,0|2,0,0]=4 29754 B14R1.156 CN(CCCO)CCC1CCOCC1 2230a_100000213112_100011934994 [0,1,0,1,0,0|2,0,0]=4 29755 B14R1.156 CN(CCCO)CCC1CCOCC1 269982a_100000213112_100011934994 [0,1,0,1,0,0|2,0,0]=4 29756 B14R1.156 CN(CCCO)CCN1CCCCC1 2230a_100000213112_100000739454 [0,1,0,1,0,0|2,0,0]=4 29757 B14R1.156 CN(CCCO)CCN1CCCCC1 269982a_100000213112_100000739454 [0,1,0,1,0,0|2,0,0]=4 29758 B14R1.156 CN(CCCO)COC1CCCCC1 2230a_100000213112_100011935260 [0,1,0,1,0,0|2,0,0]=4 29759 B14R1.156 CN(CCCO)COC1CCCCC1 269982a_100000213112_100011935260 [0,1,0,1,0,0|2,0,0]=4 29760 B14R1.156 COCCC(C)NCC1CCCCO1 270004a_100000174945_100000742357 [0,1,0,1,0,0|2,0,0]=4 29761 B14R1.156 COCCN(C)CCC1CCCCO1 2230a_100015183322_100011201679 [0,1,0,1,0,0|2,0,0]=4 29762 B14R1.156 COCCN(C)CCC1CCCCO1 269982a_100015183322_100000233755 [0,1,0,1,0,0|2,0,0]=4 29763 B14R1.156 COCCN(C)CCC1CCCCO1 34a_100015183322_100011201679 [0,1,0,1,0,0|2,0,0]=4 29764 B14R1.156 CSCCC(C)NCC1CCCCO1 270004a_100000174945_100011217047 [0,1,0,1,0,0|2,0,0]=4 29765 B14R1.156 CSCCN(C)CCC1CCCCO1 2230a_100015183322_100000751147 [0,1,0,1,0,0|2,0,0]=4 29766 B14R1.156 CSCCN(C)CCC1CCCCO1 269982a_100015183322_100000212216 [0,1,0,1,0,0|2,0,0]=4 29767 B14R1.156 CSCCN(C)CCC1CCCCO1 34a_100015183322_100000212216 [0,1,0,1,0,0|2,0,0]=4 29768 B14R1.156 C[C@H](CCCO)CNC1CCCCC1 270004a_100160569302_100000210434 [0,1,0,1,0,0|1,0,0]=3 29769 B14R1.156 C[C@H](CCCO)CNC1CCCCC1 34a_100160569302_100000210327 [0,1,0,1,0,0|1,0,0]=3 29770 B14R1.156 C[C@H](CCCO)CNC1CCCOC1 270004a_100160569302_100000753404 [0,1,0,1,0,0|2,0,0]=4 29771 B14R1.156 C[C@H](CCCO)CNC1CCCOC1 34a_100160569302_100000693364 [0,1,0,1,0,0|2,0,0]=4 29772 B14R1.156 C[C@H](CCCO)CNC1CCCSC1 270004a_100160569302_100000057913 [0,1,0,1,0,0|2,0,0]=4 29773 B14R1.156 C[C@H](CCCO)CNC1CCNCC1 270004a_100160569302_100015192401 [0,1,0,1,0,0|2,0,0]=4 29774 B14R1.156 C[C@H](CCCO)CNC1CCOCC1 270004a_100160569302_100011217826 [0,1,0,1,0,0|2,0,0]=4 29775 B14R1.156 C[C@H](CCCO)CNC1CCSCC1 270004a_100160569302_100000203788 [0,1,0,1,0,0|2,0,0]=4 29776 B14R1.156 C[C@H](CCCO)CNC1CCSCC1 34a_100160569302_100000069128 [0,1,0,1,0,0|2,0,0]=4 29777 B14R1.156 O=C(CCC1CCCCC1)NCCO 240690a_100000210304_100000211375 [0,1,0,1,0,0|1,0,1]=4 29778 B14R1.156 O=C(CCC1CCCCC1)NCCO 527a_100000210304_100000211375 [0,1,0,1,0,0|1,0,1]=4 29779 B14R1.156 O=C(CCCF)CCC1CCCCC1 1458a_100000211375_100011934791 [0,1,0,1,0,0|1,0,1]=4 29780 B14R1.156 O=C(CCCO)CCC1CCCCC1 1458a_100000211375_100011215043 [0,1,0,1,0,0|0,0,1]=3 29781 B14R1.156 O=C(CCCO)CCN1CCCCC1 1458a_100000743487_100011215043 [0,1,0,1,0,0|1,0,1]=4 29782 B14R1.156 O=C(CCCO)COC1CCCCC1 1458a_100011223303_100011215043 [0,1,0,1,0,0|1,0,1]=4 29783 B14R1.177 CC(CCCCl)OCCC1CCCC1 34a_200000718107_100000760354 [0,1,0,1,0,0|2,0,0]=4 29784 B14R1.177 CC(CCCCl)OCCC1CCCC1 7a_200000718107_100000760354 [0,1,0,1,0,0|2,0,0]=4 29785 B14R1.177 CCCCC(=O)CCCC1CCCC1 1458a_100000210183_100011713738 [0,1,0,1,0,0|1,0,1]=4 29786 B14R1.177 CCCCC(=O)CCCC1OCCO1 1458a_100000210183_100000042513 [0,1,0,1,0,0|1,0,1]=4 29787 B14R1.177 CCCCC(=O)COCC1CCCO1 1458a_100011223388_100000210211 [0,1,0,1,0,0|1,0,1]=4 29788 B14R1.177 CCCCC(=O)CSCC1CCCO1 1458a_100000217298_100000210211 [0,1,0,1,0,0|1,0,1]=4 29789 B14R1.177 CCCCC(C)COCC1CCCC1 34a_100011995851_100000740388 [0,1,0,1,0,0|2,0,0]=4 29790 B14R1.177 CCCCC(C)COCC1CCCC1 7a_100011995851_100000740388 [0,1,0,1,0,0|2,0,0]=4 29791 B14R1.177 CCCCC(C)COCC1CCCO1 7a_100011995851_100000203698 [0,1,0,1,0,0|1,0,0]=3 29792 B14R1.177 CCCCC(C)COCC1OCCO1 34a_100011995851_100000755774 [0,1,0,1,0,0|2,0,0]=4 29793 B14R1.177 CCCCC(C)COCC1OCCO1 7a_100011995851_100000755774 [0,1,0,1,0,0|2,0,0]=4 29794 B14R1.177 CCCCC(C)NCCC1CCCC1 2230a_100000126638_100000760354 [0,1,0,1,0,0|2,0,0]=4 29795 B14R1.177 CCCCC(C)NCCC1CCCC1 2230a_100000739158_200011215066 [0,1,0,1,0,0|2,0,0]=4 29796 B14R1.177 CCCCC(C)NCCC1CCCC1 270004a_100000739158_100000210087 [0,1,0,1,0,0|2,0,0]=4 29797 B14R1.177 CCCCC(C)NCCC1CCCC1 34a_100000739158_200011215066 [0,1,0,1,0,0|2,0,0]=4 29798 B14R1.177 CCCCC(C)NCCC1OCCO1 2230a_100000034215_200011215066 [0,1,0,1,0,0|2,0,0]=4 29799 B14R1.177 CCCCC(C)NCCC1OCCO1 2230a_100000126638_100000740749 [0,1,0,1,0,0|2,0,0]=4 29800 B14R1.177 CCCCC(C)NCCC1OCCO1 270004a_100000034215_100000210087 [0,1,0,1,0,0|2,0,0]=4 29801 B14R1.177 CCCCC(C)NCCC1OCCO1 34a_100000034215_200011215066 [0,1,0,1,0,0|2,0,0]=4 29802 B14R1.177 CCCCC(C)OCCC1CCCC1 34a_100000687866_100000760354 [0,1,0,1,0,0|2,0,0]=4 29803 B14R1.177 CCCCC(C)OCCC1CCCC1 34a_100000749090_200011215066 [0,1,0,1,0,0|2,0,0]=4 29804 B14R1.177 CCCCC(C)OCCC1CCCC1 7a_100000687866_100000760354 [0,1,0,1,0,0|2,0,0]=4 29805 B14R1.177 CCCCC(C)OCCC1CCCC1 7a_100000749090_200011215066 [0,1,0,1,0,0|2,0,0]=4 29806 B14R1.177 CCCCC(C)OCCC1OCCO1 34a_100000687866_100000740749 [0,1,0,1,0,0|2,0,0]=4 29807 B14R1.177 CCCCC(C)OCCC1OCCO1 7a_100000687866_100000740749 [0,1,0,1,0,0|2,0,0]=4 29808 B14R1.177 CCCCC(C)SCCC1CCCC1 62a_100000760354_200011215066 [0,1,0,1,0,0|2,0,0]=4 29809 B14R1.177 CCCCC(C)SCCC1CCCC1 62a_200011215066_100000760354 [0,1,0,1,0,0|2,0,0]=4 29810 B14R1.177 CCCCC(C)SCCC1OCCO1 62a_200011215066_100000740749 [0,1,0,1,0,0|2,0,0]=4 29811 B14R1.177 CCCCN(C)CCCC1CCCC1 2230a_100000207549_100011713738 [0,1,0,1,0,0|2,0,0]=4 29812 B14R1.177 CCCCN(C)CCCC1CCCC1 2230a_100015186261_100000210211 [0,1,0,1,0,0|2,0,0]=4 29813 B14R1.177 CCCCN(C)CCCC1CCCC1 269982a_100000207549_100011713738 [0,1,0,1,0,0|2,0,0]=4 29814 B14R1.177 CCCCN(C)CCCC1CCCC1 269982a_100015186261_100000210211 [0,1,0,1,0,0|2,0,0]=4 29815 B14R1.177 CCCCN(C)CCCC1CCCC1 34a_100015186261_100000210210 [0,1,0,1,0,0|2,0,0]=4 29816 B14R1.177 CCCCN(C)CCCC1CCCO1 2230a_100011698863_100000210211 [0,1,0,1,0,0|1,0,0]=3 29817 B14R1.177 CCCCN(C)CCCC1CCCO1 269982a_100011698863_100000210211 [0,1,0,1,0,0|1,0,0]=3 29818 B14R1.177 CCCCN(C)CCCC1CCCO1 34a_100011698863_100000210210 [0,1,0,1,0,0|1,0,0]=3 29819 B14R1.177 CCCCN(C)CCCC1OCCO1 2230a_100000207549_100000042513 [0,1,0,1,0,0|2,0,0]=4 29820 B14R1.177 CCCCN(C)CCCC1OCCO1 269982a_100000207549_100000042513 [0,1,0,1,0,0|2,0,0]=4 29821 B14R1.177 CCCC[C@H](N)COCC1CCCC1 34a_100011934283_100000740388 [0,1,0,1,0,0|2,0,0]=4 29822 B14R1.177 CCCC[C@H](N)COCC1OCCO1 34a_100011934283_100000755774 [0,1,0,1,0,0|2,0,0]=4 29823 B14R1.177 CCCOC(C)CNCC1CCCO1 2230a_100015185124_100000203698 [0,1,0,1,0,0|2,0,0]=4 29824 B14R1.177 CCOCC(O)CNCC1CCCO1 2230a_102515437182_100000203698 [0,1,0,1,0,0|2,0,0]=4 29825 B14R1.177 CCOCN(C)CCCC1CCCO1 269982a_100011698863_100000739092 [0,1,0,1,0,0|2,0,0]=4 29826 B14R1.177 CN(CCCF)CCCC1CCCC1 2230a_100015186261_100011934791 [0,1,0,1,0,0|2,0,0]=4 29827 B14R1.177 CN(CCCF)CCCC1CCCC1 269982a_100015186261_100011934791 [0,1,0,1,0,0|2,0,0]=4 29828 B14R1.177 CN(CCCF)CCCC1CCCC1 34a_100015186261_100011934791 [0,1,0,1,0,0|2,0,0]=4 29829 B14R1.177 CN(CCCF)CCCC1CCCO1 2230a_100011698863_100011934791 [0,1,0,1,0,0|2,0,0]=4 29830 B14R1.177 CN(CCCF)CCCC1CCCO1 269982a_100011698863_100011934791 [0,1,0,1,0,0|2,0,0]=4 29831 B14R1.177 CN(CCCF)CCCC1CCCO1 34a_100011698863_100011934791 [0,1,0,1,0,0|2,0,0]=4 29832 B14R1.177 CN(CCCO)CCCC1CCCC1 2230a_100000213112_100011713738 [0,1,0,1,0,0|1,0,0]=3 29833 B14R1.177 CN(CCCO)CCCC1CCCC1 2230a_100015186261_100000230001 [0,1,0,1,0,0|1,0,0]=3 29834 B14R1.177 CN(CCCO)CCCC1CCCC1 269982a_100000213112_100011713738 [0,1,0,1,0,0|1,0,0]=3 29835 B14R1.177 CN(CCCO)CCCC1CCCC1 269982a_100015186261_100011215043 [0,1,0,1,0,0|1,0,0]=3 29836 B14R1.177 CN(CCCO)CCCC1CCCC1 34a_100015186261_100000230001 [0,1,0,1,0,0|1,0,0]=3 29837 B14R1.177 CN(CCCO)CCCC1CCCO1 2230a_100011698863_100000230001 [0,1,0,1,0,0|2,0,0]=4 29838 B14R1.177 CN(CCCO)CCCC1CCCO1 269982a_100011698863_100011215043 [0,1,0,1,0,0|2,0,0]=4 29839 B14R1.177 CN(CCCO)CCCC1CCCO1 34a_100011698863_100000230001 [0,1,0,1,0,0|2,0,0]=4 29840 B14R1.177 CN(CCCO)CCCN1CCCC1 2230a_100000213112_100011445909 [0,1,0,1,0,0|2,0,0]=4 29841 B14R1.177 CN(CCCO)CCCN1CCCC1 269982a_100000213112_100011445909 [0,1,0,1,0,0|2,0,0]=4 29842 B14R1.177 CN(CCCO)CCCN1CCCC1 269982a_100000233079_100011215043 [0,1,0,1,0,0|2,0,0]=4 29843 B14R1.177 COCCN(C)CCCC1CCCO1 2230a_100011698863_100011201679 [0,1,0,1,0,0|2,0,0]=4 29844 B14R1.177 COCCN(C)CCCC1CCCO1 269982a_100011698863_100000233755 [0,1,0,1,0,0|2,0,0]=4 29845 B14R1.177 COCCN(C)CCCC1CCCO1 34a_100011698863_100011201679 [0,1,0,1,0,0|2,0,0]=4 29846 B14R1.177 CSCCN(C)CCCC1CCCO1 2230a_100011698863_100000751147 [0,1,0,1,0,0|2,0,0]=4 29847 B14R1.177 CSCCN(C)CCCC1CCCO1 269982a_100011698863_100000212216 [0,1,0,1,0,0|2,0,0]=4 29848 B14R1.177 CSCCN(C)CCCC1CCCO1 34a_100011698863_100000212216 [0,1,0,1,0,0|2,0,0]=4 29849 B14R1.177 C[C@H](CCCO)CNCC1CCCC1 2230a_100160569302_100000740388 [0,1,0,1,0,0|1,0,0]=3 29850 B14R1.177 C[C@H](CCCO)CNCC1CCCC1 269862a_100160569302_100000746403 [0,1,0,1,0,0|1,0,0]=3 29851 B14R1.177 C[C@H](CCCO)CNCC1CCCC1 34a_100160569302_100000740388 [0,1,0,1,0,0|1,0,0]=3 29852 B14R1.177 C[C@H](CCCO)CNCC1CCCO1 2230a_100160569302_100000203698 [0,1,0,1,0,0|2,0,0]=4 29853 B14R1.177 C[C@H](CCCO)CNCC1CCOC1 2230a_100160569302_100000702531 [0,1,0,1,0,0|2,0,0]=4 29854 B14R1.177 C[C@H](CCCO)CNCC1CCOC1 34a_100160569302_100011261433 [0,1,0,1,0,0|2,0,0]=4 29855 B14R1.177 O=C(CCCO)CCCN1CCCC1 1458a_100000743284_100011215043 [0,1,0,1,0,0|1,0,1]=4 29856 B14R1.218 CC1CCC(C(C1)NCCCCO)C 269862a_100000750430_100000034887 [0,1,0,1,0,0|1,0,0]=3 29857 B14R1.218 CC1CCC(C(C1)NCCCCO)C 270004a_100000750430_100000034887 [0,1,0,1,0,0|1,0,0]=3 29858 B14R1.218 CC1CCC(C(C1)OCCCCF)C 34a_100011217446_100000729493 [0,1,0,1,0,0|2,0,0]=4 29859 B14R1.218 CC1CCC(C(C1)OCCCCF)C 7a_100011217446_100000729493 [0,1,0,1,0,0|2,0,0]=4 29860 B14R1.218 CC1CCC(C(C1)OCCCCO)C 34a_100011217446_100011216708 [0,1,0,1,0,0|1,0,0]=3 29861 B14R1.218 CC1CCC(C(C1)OCCCCO)C 7a_100011217446_100000210776 [0,1,0,1,0,0|1,0,0]=3 29862 B14R1.218 CCCCCNC1CC(CCC1C)C 269862a_100000209983_100000034887 [0,1,0,1,0,0|2,0,0]=4 29863 B14R1.218 CCCCCNC1CC(CCC1C)C 270004a_100000209983_100000034887 [0,1,0,1,0,0|2,0,0]=4 29864 B14R1.218 CCCCCOC1CC(CCC1C)C 34a_100011217446_100000718602 [0,1,0,1,0,0|2,0,0]=4 29865 B14R1.218 CCCCCOC1CC(CCC1C)C 7a_100011217446_100000210326 [0,1,0,1,0,0|2,0,0]=4 29866 B14R1.218 C[C@@H]1CN([C@@H](CO1)C)CCCCCO 2230a_100016991869_100000746330 [0,1,0,1,0,0|2,0,0]=4 29867 B14R1.218 C[C@@H]1CN([C@@H](CO1)C)CCCCCO 269982a_100016991869_100000746330 [0,1,0,1,0,0|2,0,0]=4 29868 B14R1.218 C[C@@H]1CN([C@@H](CO1)C)CCCCCO 34a_100016991869_100000746330 [0,1,0,1,0,0|2,0,0]=4 29869 B14R1.222 CCCCCCN1C[C@@H](C[C@H]1CO)O 2230a_100000707816_100000210314 [0,1,0,1,0,0|1,0,0]=3 29870 B14R1.222 CCCCCCN1C[C@@H](C[C@H]1CO)O 269982a_100000707816_100000210757 [0,1,0,1,0,0|1,0,0]=3 29871 B14R1.222 CCCCCCN1C[C@H](C[C@H]1CO)F 2230a_100015204000_100000210314 [0,1,0,1,0,0|1,0,0]=3 29872 B14R1.222 CCCCCCN1C[C@H](C[C@H]1CO)F 269982a_100015204000_100000210757 [0,1,0,1,0,0|1,0,0]=3 29873 B14R1.222 CCCCCCN1C[C@H](C[C@H]1CO)F 34a_100015204000_100000210314 [0,1,0,1,0,0|1,0,0]=3 29874 B14R1.222 CCCCOCN1C[C@@H](C[C@H]1CO)O 2230a_100000707816_100011995733 [0,1,0,1,0,0|2,0,0]=4 29875 B14R1.222 CCCCOCN1C[C@@H](C[C@H]1CO)O 269982a_100000707816_100011995733 [0,1,0,1,0,0|2,0,0]=4 29876 B14R1.222 CCCCOCN1C[C@H](C[C@H]1CO)F 2230a_100015204000_100011995733 [0,1,0,1,0,0|2,0,0]=4 29877 B14R1.222 CCCCOCN1C[C@H](C[C@H]1CO)F 269982a_100015204000_100011995733 [0,1,0,1,0,0|2,0,0]=4 29878 B14R1.222 CCCCOCN1C[C@H](C[C@H]1CO)F 34a_100015204000_100011995733 [0,1,0,1,0,0|2,0,0]=4 29879 B14R1.222 CCCOCCN1C[C@@H](C[C@H]1CO)O 2230a_100000707816_100011215938 [0,1,0,1,0,0|2,0,0]=4 29880 B14R1.222 CCCOCCN1C[C@@H](C[C@H]1CO)O 269982a_100000707816_100011215938 [0,1,0,1,0,0|2,0,0]=4 29881 B14R1.222 CCCOCCN1C[C@H](C[C@H]1CO)F 2230a_100015204000_100011215938 [0,1,0,1,0,0|2,0,0]=4 29882 B14R1.222 CCCOCCN1C[C@H](C[C@H]1CO)F 269982a_100015204000_100011215938 [0,1,0,1,0,0|2,0,0]=4 29883 B14R1.222 CCCOCCN1C[C@H](C[C@H]1CO)F 34a_100015204000_100011215938 [0,1,0,1,0,0|2,0,0]=4 29884 B14R1.222 CCOCCCN1C[C@@H](C[C@H]1CO)O 2230a_100000707816_100012232248 [0,1,0,1,0,0|2,0,0]=4 29885 B14R1.222 CCOCCCN1C[C@@H](C[C@H]1CO)O 269982a_100000707816_100012232248 [0,1,0,1,0,0|2,0,0]=4 29886 B14R1.222 CCOCCCN1C[C@H](C[C@H]1CO)F 2230a_100015204000_100012232248 [0,1,0,1,0,0|2,0,0]=4 29887 B14R1.222 CCOCCCN1C[C@H](C[C@H]1CO)F 269982a_100015204000_100012232248 [0,1,0,1,0,0|2,0,0]=4 29888 B14R1.222 CCOCCCN1C[C@H](C[C@H]1CO)F 34a_100015204000_100012232248 [0,1,0,1,0,0|2,0,0]=4 29889 B14R1.222 COCCCCN1C[C@@H](C[C@H]1CO)O 2230a_100000707816_100000730899 [0,1,0,1,0,0|2,0,0]=4 29890 B14R1.222 COCCCCN1C[C@@H](C[C@H]1CO)O 269982a_100000707816_100000730899 [0,1,0,1,0,0|2,0,0]=4 29891 B14R1.222 COCCCCN1C[C@H](C[C@H]1CO)F 2230a_100015204000_100000730899 [0,1,0,1,0,0|2,0,0]=4 29892 B14R1.222 COCCCCN1C[C@H](C[C@H]1CO)F 269982a_100015204000_100000730899 [0,1,0,1,0,0|2,0,0]=4 29893 B14R1.222 COCCCCN1C[C@H](C[C@H]1CO)F 34a_100015204000_100000755781 [0,1,0,1,0,0|2,0,0]=4 29894 B14R1.222 OCCCCCN1C[C@@H](C[C@H]1CO)O 2230a_100000707816_100000746330 [0,1,0,1,0,0|2,0,0]=4 29895 B14R1.222 OCCCCCN1C[C@@H](C[C@H]1CO)O 269982a_100000707816_100000746330 [0,1,0,1,0,0|2,0,0]=4 29896 B14R1.222 OCCCCCN1C[C@H](C[C@H]1CO)F 2230a_100015204000_100000746330 [0,1,0,1,0,0|2,0,0]=4 29897 B14R1.222 OCCCCCN1C[C@H](C[C@H]1CO)F 269982a_100015204000_100000746330 [0,1,0,1,0,0|2,0,0]=4 29898 B14R1.222 OCCCCCN1C[C@H](C[C@H]1CO)F 34a_100015204000_100000746330 [0,1,0,1,0,0|2,0,0]=4 29899 B14R1.222 OC[C@@H]1C[C@@H](CN1CCCCCF)F 2230a_100015204000_100000729378 [0,1,0,1,0,0|2,0,0]=4 29900 B14R1.222 OC[C@@H]1C[C@@H](CN1CCCCCF)F 269982a_100015204000_100000729378 [0,1,0,1,0,0|2,0,0]=4 29901 B14R1.222 OC[C@@H]1C[C@@H](CN1CCCCCF)F 34a_100015204000_100000729378 [0,1,0,1,0,0|2,0,0]=4 29902 B14R1.222 OC[C@@H]1C[C@H](CN1CCCCCF)O 2230a_100000707816_100000729378 [0,1,0,1,0,0|2,0,0]=4 29903 B14R1.222 OC[C@@H]1C[C@H](CN1CCCCCF)O 269982a_100000707816_100000729378 [0,1,0,1,0,0|2,0,0]=4 29904 B14R1.461 CCC1CN(CCN1CCCCO)C 2230a_100011941019_100000210776 [0,1,0,1,0,0|2,0,0]=4 29905 B14R1.461 CCC1CN(CCN1CCCCO)C 269982a_100011941019_100000210776 [0,1,0,1,0,0|2,0,0]=4 29906 B14R1.779 CCCCN1CCCC(C1)CCCO 2230a_100150707839_100000210211 [0,1,0,1,0,0|1,0,0]=3 29907 B14R1.779 CCCCN1CCCC(C1)CCCO 269982a_100150707839_100000210211 [0,1,0,1,0,0|1,0,0]=3 29908 B14R1.779 CCCCN1CCCC(C1)CCCO 34a_100150707839_100000210210 [0,1,0,1,0,0|1,0,0]=3 29909 B14R1.779 CCCOC1CCCN(C1)CCCO 2230a_100000743837_100000230001 [0,1,0,1,0,0|2,0,0]=4 29910 B14R1.779 CCCOC1CCCN(C1)CCCO 269982a_100000743837_100011215043 [0,1,0,1,0,0|2,0,0]=4 29911 B14R1.779 CCCOC1CCCN(C1)CCCO 34a_100000743837_100000230001 [0,1,0,1,0,0|2,0,0]=4 29912 B14R1.779 CCOCN1CCCC(C1)CCCO 269982a_100150707839_100000739092 [0,1,0,1,0,0|2,0,0]=4 29913 B14R1.779 COCCC1CCCN(C1)CCCO 2230a_100011653411_100000230001 [0,1,0,1,0,0|2,0,0]=4 29914 B14R1.779 COCCC1CCCN(C1)CCCO 269982a_100011653411_100011215043 [0,1,0,1,0,0|2,0,0]=4 29915 B14R1.779 COCCC1CCCN(C1)CCCO 34a_100011653411_100000230001 [0,1,0,1,0,0|2,0,0]=4 29916 B14R1.779 COCCN1CCCC(C1)CCCO 2230a_100150707839_100011201679 [0,1,0,1,0,0|2,0,0]=4 29917 B14R1.779 COCCN1CCCC(C1)CCCO 269982a_100150707839_100000233755 [0,1,0,1,0,0|2,0,0]=4 29918 B14R1.779 COCCN1CCCC(C1)CCCO 34a_100150707839_100011201679 [0,1,0,1,0,0|2,0,0]=4 29919 B14R1.779 CSCCN1CCCC(C1)CCCO 2230a_100150707839_100000751147 [0,1,0,1,0,0|2,0,0]=4 29920 B14R1.779 CSCCN1CCCC(C1)CCCO 269982a_100150707839_100000212216 [0,1,0,1,0,0|2,0,0]=4 29921 B14R1.779 CSCCN1CCCC(C1)CCCO 34a_100150707839_100000212216 [0,1,0,1,0,0|2,0,0]=4 29922 B14R1.779 OCCCC1CCCN(C1)CCCF 2230a_100150707839_100011934791 [0,1,0,1,0,0|2,0,0]=4 29923 B14R1.779 OCCCC1CCCN(C1)CCCF 269982a_100150707839_100011934791 [0,1,0,1,0,0|2,0,0]=4 29924 B14R1.779 OCCCC1CCCN(C1)CCCF 34a_100150707839_100011934791 [0,1,0,1,0,0|2,0,0]=4 29925 B14R1.779 OCCCC1CCCN(C1)CCCO 2230a_100150707839_100000230001 [0,1,0,1,0,0|2,0,0]=4 29926 B14R1.779 OCCCC1CCCN(C1)CCCO 269982a_100150707839_100011215043 [0,1,0,1,0,0|2,0,0]=4 29927 B14R1.779 OCCCC1CCCN(C1)CCCO 34a_100150707839_100000230001 [0,1,0,1,0,0|2,0,0]=4 29928 B14R1.882 C#CCCCCCN1CCCCC1C 2230a_100000211376_100012094781 [0,1,0,1,0,0|1,0,1]=4 29929 B14R1.882 C#CCCCCCN1CCCCC1C 269982a_100000211376_100012094781 [0,1,0,1,0,0|1,0,1]=4 29930 B14R1.882 C#CCCCCCN1CCCCC1C 34a_100000211376_100012094781 [0,1,0,1,0,0|1,0,1]=4 29931 B14R1.882 C#CCCCCNC1CCCCC1C 2230a_100000211402_100010269958 [0,1,0,1,0,0|1,0,1]=4 29932 B14R1.882 C#CCCCCNC1CCCCC1C 34a_100000211402_100010269958 [0,1,0,1,0,0|1,0,1]=4 29933 B14R1.882 C#CCCCCNC1CCCCC1O 34a_100000706060_100000038908 [0,1,0,1,0,0|0,0,2]=4 29934 B14R1.882 C#CCCCCOC1CCCCC1C 34a_100000211207_100010269958 [0,1,0,1,0,0|1,0,1]=4 29935 B14R1.882 C#CCCCCOC1CCCCC1C 7a_100000211207_100010269958 [0,1,0,1,0,0|1,0,1]=4 29936 B14R1.882 C#CCCCCOC1CCCCC1O 34a_100000766709_100000038908 [0,1,0,1,0,0|0,0,2]=4 29937 B14R1.882 C#CCCCCSC1CCCCC1O 62a_100000038908_100010269958 [0,1,0,1,0,0|0,0,2]=4 29938 B14R1.882 C#CCCCCSC1CCCCC1O 62a_100010269958_100000038908 [0,1,0,1,0,0|0,0,2]=4 29939 B14R1.882 C#CCCCNCC1CCCCC1O 34a_100011216029_100000695029 [0,1,0,1,0,0|0,0,2]=4 29940 B14R1.882 C=CCCCCCN1CCCCC1C 2230a_100000211376_100000700193 [0,1,0,1,0,0|1,0,1]=4 29941 B14R1.882 C=CCCCCCN1CCCCC1C 269982a_100000211376_100000700193 [0,1,0,1,0,0|1,0,1]=4 29942 B14R1.882 C=CCCCCCN1CCCCC1C 34a_100000211376_100000700193 [0,1,0,1,0,0|1,0,1]=4 29943 B14R1.882 C=CCCCCNC1CCCCC1C 2230a_100000211402_100011215482 [0,1,0,1,0,0|1,0,1]=4 29944 B14R1.882 C=CCCCCNC1CCCCC1C 269862a_100000703577_100000210921 [0,1,0,1,0,0|1,0,1]=4 29945 B14R1.882 C=CCCCCNC1CCCCC1C 270004a_100000703577_100000210921 [0,1,0,1,0,0|1,0,1]=4 29946 B14R1.882 C=CCCCCNC1CCCCC1C 34a_100000211402_100011215482 [0,1,0,1,0,0|1,0,1]=4 29947 B14R1.882 C=CCCCCNC1CCCCC1O 34a_100000703577_100000038908 [0,1,0,1,0,0|0,0,2]=4 29948 B14R1.882 C=CCCCCOC1CCCCC1C 34a_100000211207_100011215482 [0,1,0,1,0,0|1,0,1]=4 29949 B14R1.882 C=CCCCCOC1CCCCC1C 7a_100000211207_100011215482 [0,1,0,1,0,0|1,0,1]=4 29950 B14R1.882 C=CCCCCOC1CCCCC1O 34a_100000766645_100000038908 [0,1,0,1,0,0|0,0,2]=4 29951 B14R1.882 C=CCCCCSC1CCCCC1O 62a_100000038908_100011215482 [0,1,0,1,0,0|0,0,2]=4 29952 B14R1.882 C=CCCCCSC1CCCCC1O 62a_100011215482_100000038908 [0,1,0,1,0,0|0,0,2]=4 29953 B14R1.882 C=CCCCNCC1CCCCC1O 34a_100011216029_100000757094 [0,1,0,1,0,0|0,0,2]=4 29954 B14R1.882 CC/C=C\CCOC1CCCCC1O 34a_100016288707_100000038908 [0,1,0,1,0,0|0,0,2]=4 29955 B14R1.882 CC/C=C\CCSC1CCCCC1O 62a_100000038908_100015370543 [0,1,0,1,0,0|0,0,2]=4 29956 B14R1.882 CC/C=C\CCSC1CCCCC1O 62a_100015370543_100000038908 [0,1,0,1,0,0|0,0,2]=4 29957 B14R1.882 CC/C=C\CNCC1CCCCC1O 34a_100011216029_100103147603 [0,1,0,1,0,0|0,0,2]=4 29958 B14R1.882 CC1CC=CCC1CNCCCCO 269862a_100000750430_100000117039 [0,1,0,1,0,0|0,0,2]=4 29959 B14R1.882 CC1CC=CCC1CNCCCCO 270004a_100000750430_100000117039 [0,1,0,1,0,0|0,0,2]=4 29960 B14R1.882 CC1CC=CCC1COCCCCO 34a_100000211322_100011216708 [0,1,0,1,0,0|0,0,2]=4 29961 B14R1.882 CC1CCCCC1NCCCCC#N 2230a_100000211402_100000211819 [0,1,0,1,0,0|1,0,1]=4 29962 B14R1.882 CC1CCCCC1NCCCCC#N 270004a_100000751965_100000210921 [0,1,0,1,0,0|1,0,1]=4 29963 B14R1.882 CC1CCCCC1NCCCCC=O 2230a_100000211402_100000139335 [0,1,0,1,0,0|0,0,2]=4 29964 B14R1.882 CC1CCCCC1NCCCCCF 2230a_100000211402_100000729378 [0,1,0,1,0,0|1,0,0]=3 29965 B14R1.882 CC1CCCCC1NCCCCCF 34a_100000211402_100000729378 [0,1,0,1,0,0|1,0,0]=3 29966 B14R1.882 CC1CCCCC1NCCCCCO 2230a_100000211402_100000746330 [0,1,0,1,0,0|0,0,0]=2 29967 B14R1.882 CC1CCCCC1NCCCCCO 269862a_100000762737_100000210921 [0,1,0,1,0,0|0,0,0]=2 29968 B14R1.882 CC1CCCCC1NCCCCCO 270004a_100000762737_100000210921 [0,1,0,1,0,0|0,0,0]=2 29969 B14R1.882 CC1CCCCC1NCCCCCO 34a_100000211402_100000746330 [0,1,0,1,0,0|0,0,0]=2 29970 B14R1.882 CC1CCCCC1NCCOCCO 2230a_100000211402_100011215305 [0,1,0,1,0,0|1,0,0]=3 29971 B14R1.882 CC1CCCCC1NCCOCCO 269862a_100000211614_100000210921 [0,1,0,1,0,0|1,0,0]=3 29972 B14R1.882 CC1CCCCC1NCCOCCO 270004a_100000211614_100000210921 [0,1,0,1,0,0|1,0,0]=3 29973 B14R1.882 CC1CCCCC1NCCOCCO 34a_100000211402_100000692535 [0,1,0,1,0,0|1,0,0]=3 29974 B14R1.882 CC1CCCCC1NCCSCCO 269862a_100011219999_100000210921 [0,1,0,1,0,0|1,0,0]=3 29975 B14R1.882 CC1CCCCC1NCCSCCO 270004a_100011219999_100000210921 [0,1,0,1,0,0|1,0,0]=3 29976 B14R1.882 CC1CCCCC1OCCCCC#N 7a_100000211207_100000211819 [0,1,0,1,0,0|1,0,1]=4 29977 B14R1.882 CC1CCCCC1OCCCCC=O 7a_100000211207_100000139335 [0,1,0,1,0,0|0,0,2]=4 29978 B14R1.882 CC1CCCCC1OCCCCCF 34a_100000211207_100000729378 [0,1,0,1,0,0|1,0,0]=3 29979 B14R1.882 CC1CCCCC1OCCCCCF 7a_100000211207_100000729378 [0,1,0,1,0,0|1,0,0]=3 29980 B14R1.882 CC1CCCCC1OCCCCCO 34a_100000211207_100000746330 [0,1,0,1,0,0|0,0,0]=2 29981 B14R1.882 CC1CCCCC1OCCCCCO 7a_100000211207_100000746330 [0,1,0,1,0,0|0,0,0]=2 29982 B14R1.882 CC1CCCCC1OCCOCCO 34a_100000211207_100000692535 [0,1,0,1,0,0|1,0,0]=3 29983 B14R1.882 CC1CCCCC1OCCOCCO 7a_100000211207_100011215305 [0,1,0,1,0,0|1,0,0]=3 29984 B14R1.882 CC1CCCCN1CCCCCC#N 2230a_100000211376_100009813376 [0,1,0,1,0,0|1,0,1]=4 29985 B14R1.882 CC1CCCCN1CCCCCC#N 269982a_100000211376_100009813376 [0,1,0,1,0,0|1,0,1]=4 29986 B14R1.882 CC1CCCCN1CCCCCC=O 2230a_100000211376_100000139337 [0,1,0,1,0,0|0,0,2]=4 29987 B14R1.882 CC1CCCCN1CCCCCC=O 269982a_100000211376_100000139337 [0,1,0,1,0,0|0,0,2]=4 29988 B14R1.882 CC1CCCCN1CCCCCCF 2230a_100000211376_100015922095 [0,1,0,1,0,0|1,0,0]=3 29989 B14R1.882 CC1CCCCN1CCCCCCF 269982a_100000211376_100015922095 [0,1,0,1,0,0|1,0,0]=3 29990 B14R1.882 CC1CCCCN1CCCCCCF 34a_100000211376_100015922095 [0,1,0,1,0,0|1,0,0]=3 29991 B14R1.882 CC1CCCCN1CCCCCCO 2230a_100000211376_100000766143 [0,1,0,1,0,0|0,0,0]=2 29992 B14R1.882 CC1CCCCN1CCCCCCO 269982a_100000211376_100000766143 [0,1,0,1,0,0|0,0,0]=2 29993 B14R1.882 CC1CCCCN1CCCCCCO 34a_100000211376_100000766143 [0,1,0,1,0,0|0,0,0]=2 29994 B14R1.882 CC1CCCCN1CCCNCCF 34a_100000212276_100011217306 [0,1,0,1,0,0|2,0,0]=4 29995 B14R1.882 CC1CCCCN1CCCNCCO 34a_100000212276_100000211926 [0,1,0,1,0,0|1,0,0]=3 29996 B14R1.882 CC1CCCCN1CCCOCCF 34a_100000213889_100011217306 [0,1,0,1,0,0|2,0,0]=4 29997 B14R1.882 CC1CCCCN1CCCOCCF 7a_100000213889_100011217306 [0,1,0,1,0,0|2,0,0]=4 29998 B14R1.882 CC1CCCCN1CCCOCCO 34a_100000213889_100000211926 [0,1,0,1,0,0|1,0,0]=3 29999 B14R1.882 CC1CCCCN1CCCOCCO 7a_100000213889_100000211926 [0,1,0,1,0,0|1,0,0]=3 30000 B14R1.882 CC1CCCCN1CCNCCCF 2230a_100000739827_100011934791 [0,1,0,1,0,0|2,0,0]=4 30001 B14R1.882 CC1CCCCN1CCNCCCF 34a_100000739827_100011934791 [0,1,0,1,0,0|2,0,0]=4 30002 B14R1.882 CC1CCCCN1CCNCCCO 2230a_100000739827_100000230001 [0,1,0,1,0,0|1,0,0]=3 30003 B14R1.882 CC1CCCCN1CCNCCCO 34a_100000739827_100000230001 [0,1,0,1,0,0|1,0,0]=3 30004 B14R1.882 CC1CCCCN1CCOCCCF 34a_100011305533_100011934791 [0,1,0,1,0,0|2,0,0]=4 30005 B14R1.882 CC1CCCCN1CCOCCCO 34a_100011305533_100000230001 [0,1,0,1,0,0|1,0,0]=3 30006 B14R1.882 CC1CCNCC1OCCCCCF 34a_100000696640_100000729378 [0,1,0,1,0,0|2,0,0]=4 30007 B14R1.882 CC1CCNCC1OCCCCCO 34a_100000696640_100000746330 [0,1,0,1,0,0|1,0,0]=3 30008 B14R1.882 CC1CCNCC1OCCOCCO 34a_100000696640_100000692535 [0,1,0,1,0,0|2,0,0]=4 30009 B14R1.882 CC1CNCCC1NCCCCCO 270004a_100000762737_100000703950 [0,1,0,1,0,0|1,0,0]=3 30010 B14R1.882 CC1CNCCC1NCCOCCO 270004a_100000211614_100000703950 [0,1,0,1,0,0|2,0,0]=4 30011 B14R1.882 CC1CNCCC1NCCSCCO 270004a_100011219999_100000703950 [0,1,0,1,0,0|2,0,0]=4 30012 B14R1.882 CC1CNCCC1OCCCCCF 34a_100011998114_100000729378 [0,1,0,1,0,0|2,0,0]=4 30013 B14R1.882 CC1CNCCC1OCCCCCO 34a_100011998114_100000746330 [0,1,0,1,0,0|1,0,0]=3 30014 B14R1.882 CC1CNCCC1OCCOCCO 34a_100011998114_100000692535 [0,1,0,1,0,0|2,0,0]=4 30015 B14R1.882 CC1COCCC1NCCCCCO 270004a_100000762737_100000755695 [0,1,0,1,0,0|1,0,0]=3 30016 B14R1.882 CC1COCCC1NCCOCCO 270004a_100000211614_100000755695 [0,1,0,1,0,0|2,0,0]=4 30017 B14R1.882 CC1COCCC1NCCSCCO 270004a_100011219999_100000755695 [0,1,0,1,0,0|2,0,0]=4 30018 B14R1.882 CC=CCCCOC1CCCCC1O 34a_100020645299_100000038908 [0,1,0,1,0,0|0,0,2]=4 30019 B14R1.882 CCC#CCCOC1CCCCC1O 34a_100000036655_100000038908 [0,1,0,1,0,0|0,0,2]=4 30020 B14R1.882 CCC#CCNCC1CCCCC1O 34a_100011216029_100009813939 [0,1,0,1,0,0|0,0,2]=4 30021 B14R1.882 CCC/C=C/COC1CCCCC1O 34a_100016278788_100000038908 [0,1,0,1,0,0|0,0,2]=4 30022 B14R1.882 CCCC#CCOC1CCCCC1O 34a_100000034806_100000038908 [0,1,0,1,0,0|0,0,2]=4 30023 B14R1.882 CCCCCCCN1CCCCC1C 2230a_100000211376_100000210681 [0,1,0,1,0,0|1,0,0]=3 30024 B14R1.882 CCCCCCCN1CCCCC1C 269982a_100000211376_100000210681 [0,1,0,1,0,0|1,0,0]=3 30025 B14R1.882 CCCCCCCN1CCCCC1C 34a_100000211376_100000210614 [0,1,0,1,0,0|1,0,0]=3 30026 B14R1.882 CCCCCCCN1CCOC[C@@H]1C 2230a_100009815349_100000210681 [0,1,0,1,0,0|2,0,0]=4 30027 B14R1.882 CCCCCCCN1CCOC[C@@H]1C 269982a_100009815349_100000210681 [0,1,0,1,0,0|2,0,0]=4 30028 B14R1.882 CCCCCCCN1CCOC[C@@H]1C 34a_100009815349_100000210614 [0,1,0,1,0,0|2,0,0]=4 30029 B14R1.882 CCCCCCNC1CCCCC1C 2230a_100000211402_100000210314 [0,1,0,1,0,0|1,0,0]=3 30030 B14R1.882 CCCCCCNC1CCCCC1C 269862a_100000210581_100000210921 [0,1,0,1,0,0|1,0,0]=3 30031 B14R1.882 CCCCCCNC1CCCCC1C 270004a_100000210581_100000210921 [0,1,0,1,0,0|1,0,0]=3 30032 B14R1.882 CCCCCCNC1CCCCC1C 34a_100000211402_100000210314 [0,1,0,1,0,0|1,0,0]=3 30033 B14R1.882 CCCCCCNC1CCNCC1C 270004a_100000210581_100000703950 [0,1,0,1,0,0|2,0,0]=4 30034 B14R1.882 CCCCCCNC1CCOCC1C 270004a_100000210581_100000755695 [0,1,0,1,0,0|2,0,0]=4 30035 B14R1.882 CCCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000210314 [0,1,0,1,0,0|1,0,0]=3 30036 B14R1.882 CCCCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000210314 [0,1,0,1,0,0|1,0,0]=3 30037 B14R1.882 CCCCCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100000210314 [0,1,0,1,0,0|1,0,0]=3 30038 B14R1.882 CCCCCCN[C@H]1CCOC[C@@H]1F 2230a_100016994078_100000210314 [0,1,0,1,0,0|2,0,0]=4 30039 B14R1.882 CCCCCCN[C@H]1CCOC[C@@H]1F 34a_100016994078_100000210314 [0,1,0,1,0,0|2,0,0]=4 30040 B14R1.882 CCCCCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000210314 [0,1,0,1,0,0|1,0,0]=3 30041 B14R1.882 CCCCCCOC1CCCCC1=O 34a_100000210259_100000754470 [0,1,0,1,0,0|0,0,2]=4 30042 B14R1.882 CCCCCCOC1CCCCC1=O 34a_100011214950_100000210314 [0,1,0,1,0,0|0,0,2]=4 30043 B14R1.882 CCCCCCOC1CCCCC1=O 7a_100000210259_100000204591 [0,1,0,1,0,0|0,0,2]=4 30044 B14R1.882 CCCCCCOC1CCCCC1C 34a_100000211207_100000210314 [0,1,0,1,0,0|1,0,0]=3 30045 B14R1.882 CCCCCCOC1CCCCC1C 7a_100000211207_100000210314 [0,1,0,1,0,0|1,0,0]=3 30046 B14R1.882 CCCCCCOC1CCCCC1Cl 34a_100000038908_100000210314 [0,1,0,1,0,0|1,0,0]=3 30047 B14R1.882 CCCCCCOC1CCCCC1Cl 7a_100000038908_100000210314 [0,1,0,1,0,0|1,0,0]=3 30048 B14R1.882 CCCCCCOC1CCCCC1F 34a_100000210259_100015423560 [0,1,0,1,0,0|1,0,0]=3 30049 B14R1.882 CCCCCCOC1CCCCC1O 34a_100000210259_100000038908 [0,1,0,1,0,0|0,0,0]=2 30050 B14R1.882 CCCCCCOC1CCNCC1C 34a_100011998114_100000210314 [0,1,0,1,0,0|2,0,0]=4 30051 B14R1.882 CCCCCCOC1CNCCC1C 34a_100000696640_100000210314 [0,1,0,1,0,0|2,0,0]=4 30052 B14R1.882 CCCCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000210314 [0,1,0,1,0,0|1,0,0]=3 30053 B14R1.882 CCCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000210314 [0,1,0,1,0,0|1,0,0]=3 30054 B14R1.882 CCCCCCO[C@@H]1CCNC[C@@H]1F 34a_200016994291_100000210314 [0,1,0,1,0,0|2,0,0]=4 30055 B14R1.882 CCCCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000210314 [0,1,0,1,0,0|1,0,0]=3 30056 B14R1.882 CCCCCCO[C@H]1CCOC[C@@H]1N 34a_100015739063_100000210314 [0,1,0,1,0,0|2,0,0]=4 30057 B14R1.882 CCCCCCO[C@H]1COCC[C@H]1N 34a_100016994285_100000210314 [0,1,0,1,0,0|2,0,0]=4 30058 B14R1.882 CCCCCCSC1CCCCC1=O 62a_100000204591_100000210757 [0,1,0,1,0,0|0,0,2]=4 30059 B14R1.882 CCCCCCSC1CCCCC1=O 62a_100000210314_100000204591 [0,1,0,1,0,0|0,0,2]=4 30060 B14R1.882 CCCCCCSC1CCCCC1F 62a_100000210314_100015423560 [0,1,0,1,0,0|1,0,0]=3 30061 B14R1.882 CCCCCCSC1CCCCC1F 62a_100015423560_100000210757 [0,1,0,1,0,0|1,0,0]=3 30062 B14R1.882 CCCCCCSC1CCCCC1O 62a_100000038908_100000210757 [0,1,0,1,0,0|0,0,0]=2 30063 B14R1.882 CCCCCCSC1CCCCC1O 62a_100000210314_100000038908 [0,1,0,1,0,0|0,0,0]=2 30064 B14R1.882 CCCCCNCC1CCCCC1O 34a_100011216029_100000718602 [0,1,0,1,0,0|0,0,0]=2 30065 B14R1.882 CCCCCNCC1CCCCN1C 34a_100011228421_100000718602 [0,1,0,1,0,0|2,0,0]=4 30066 B14R1.882 CCCCCNN=C1CCCCC1O 4a_100000694160_100011214950 [0,1,0,1,0,0|1,0,1]=4 30067 B14R1.882 CCCCCOCC1CCCCC1=O 34a_100009861125_100000718602 [0,1,0,1,0,0|0,0,2]=4 30068 B14R1.882 CCCCCOCC1CCCCC1=O 7a_100009861125_100000210326 [0,1,0,1,0,0|0,0,2]=4 30069 B14R1.882 CCCCCOCC1CCCCN1C 34a_100000210253_100015186950 [0,1,0,1,0,0|2,0,0]=4 30070 B14R1.882 CCCCCOCC1CCCCN1C 34a_100000225079_100000718602 [0,1,0,1,0,0|2,0,0]=4 30071 B14R1.882 CCCCCOCC1CCCCN1C 7a_100000210253_100015185383 [0,1,0,1,0,0|2,0,0]=4 30072 B14R1.882 CCCCCOCC1COCCC1N 34a_214813039666_100000718602 [0,1,0,1,0,0|2,0,0]=4 30073 B14R1.882 CCCCCSCC1CCCCN1C 62a_100000210326_100015185383 [0,1,0,1,0,0|2,0,0]=4 30074 B14R1.882 CCCCCSCC1CCCCN1C 62a_100015185383_100000210326 [0,1,0,1,0,0|2,0,0]=4 30075 B14R1.882 CCCCNCCC1CCCCN1C 2230a_100000102301_100000211948 [0,1,0,1,0,0|2,0,0]=4 30076 B14R1.882 CCCCNCCC1CCCCN1C 7a_106832991798_100000211948 [0,1,0,1,0,0|2,0,0]=4 30077 B14R1.882 CCCCNCCN1CCCCC1C 2230a_100000739827_100000210211 [0,1,0,1,0,0|2,0,0]=4 30078 B14R1.882 CCCCNCCN1CCCCC1C 34a_100000739827_100000210210 [0,1,0,1,0,0|2,0,0]=4 30079 B14R1.882 CCCCOCCC1CCCCN1C 34a_100000210227_100000211948 [0,1,0,1,0,0|2,0,0]=4 30080 B14R1.882 CCCCOCCC1CCCCN1C 7a_100000210227_100000211948 [0,1,0,1,0,0|2,0,0]=4 30081 B14R1.882 CCCCOCCN1CCCCC1C 2230a_100000211376_100000743108 [0,1,0,1,0,0|2,0,0]=4 30082 B14R1.882 CCCCOCCN1CCCCC1C 269982a_100000211376_100000743108 [0,1,0,1,0,0|2,0,0]=4 30083 B14R1.882 CCCCOCCN1CCCCC1C 34a_100000211376_100000743108 [0,1,0,1,0,0|2,0,0]=4 30084 B14R1.882 CCCCOCCN1CCCCC1C 34a_100011305533_100000210210 [0,1,0,1,0,0|2,0,0]=4 30085 B14R1.882 CCCCOCNC1CCCCC1C 2230a_100000211402_100011995733 [0,1,0,1,0,0|2,0,0]=4 30086 B14R1.882 CCCCOCNC1CCCCC1C 34a_100000211402_100011995733 [0,1,0,1,0,0|2,0,0]=4 30087 B14R1.882 CCCCOCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100011995733 [0,1,0,1,0,0|2,0,0]=4 30088 B14R1.882 CCCCOCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100011995733 [0,1,0,1,0,0|2,0,0]=4 30089 B14R1.882 CCCCOCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100011995733 [0,1,0,1,0,0|2,0,0]=4 30090 B14R1.882 CCCCOCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100011995733 [0,1,0,1,0,0|2,0,0]=4 30091 B14R1.882 CCCCOCOC1CCCCC1C 34a_100000211207_100011995733 [0,1,0,1,0,0|2,0,0]=4 30092 B14R1.882 CCCCOCOC1CCCCC1Cl 34a_100000038908_100011995733 [0,1,0,1,0,0|2,0,0]=4 30093 B14R1.882 CCCCOCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100011995733 [0,1,0,1,0,0|2,0,0]=4 30094 B14R1.882 CCCCOCO[C@H]1CCCC[C@H]1N 34a_100015191688_100011995733 [0,1,0,1,0,0|2,0,0]=4 30095 B14R1.882 CCCCOCSC1CCCCC1F 62a_100011995733_100015423560 [0,1,0,1,0,0|2,0,0]=4 30096 B14R1.882 CCCCOCSC1CCCCC1F 62a_100015423560_100011995733 [0,1,0,1,0,0|2,0,0]=4 30097 B14R1.882 CCCCOCSC1CCCCC1O 62a_100000038908_100011995733 [0,1,0,1,0,0|1,0,0]=3 30098 B14R1.882 CCCCOCSC1CCCCC1O 62a_100011995733_100000038908 [0,1,0,1,0,0|1,0,0]=3 30099 B14R1.882 CCCCSCCC1CCCCN1C 62a_100000210211_100000211948 [0,1,0,1,0,0|2,0,0]=4 30100 B14R1.882 CCCCSCCC1CCCCN1C 62a_100000211948_100000210210 [0,1,0,1,0,0|2,0,0]=4 30101 B14R1.882 CCCNCCCN1CCCCC1C 34a_100000212276_100000210303 [0,1,0,1,0,0|2,0,0]=4 30102 B14R1.882 CCCOCCCN1CCCCC1C 34a_100000213889_100000210303 [0,1,0,1,0,0|2,0,0]=4 30103 B14R1.882 CCCOCCCN1CCCCC1C 7a_100000213889_100000210303 [0,1,0,1,0,0|2,0,0]=4 30104 B14R1.882 CCCOCCNC1CCCCC1C 2230a_100000211402_100011215938 [0,1,0,1,0,0|2,0,0]=4 30105 B14R1.882 CCCOCCNC1CCCCC1C 269862a_100161115042_100000210921 [0,1,0,1,0,0|2,0,0]=4 30106 B14R1.882 CCCOCCNC1CCCCC1C 270004a_100161115042_100000210921 [0,1,0,1,0,0|2,0,0]=4 30107 B14R1.882 CCCOCCNC1CCCCC1C 34a_100000211402_100011215938 [0,1,0,1,0,0|2,0,0]=4 30108 B14R1.882 CCCOCCNC1CCCCC1F 34a_100161115042_100015423560 [0,1,0,1,0,0|2,0,0]=4 30109 B14R1.882 CCCOCCNC1CCCCC1O 34a_100161115042_100000038908 [0,1,0,1,0,0|1,0,0]=3 30110 B14R1.882 CCCOCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100011215938 [0,1,0,1,0,0|2,0,0]=4 30111 B14R1.882 CCCOCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100011215938 [0,1,0,1,0,0|2,0,0]=4 30112 B14R1.882 CCCOCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100011215938 [0,1,0,1,0,0|2,0,0]=4 30113 B14R1.882 CCCOCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100011215938 [0,1,0,1,0,0|2,0,0]=4 30114 B14R1.882 CCCOCCOC1CCCCC1C 34a_100000211207_100011215938 [0,1,0,1,0,0|2,0,0]=4 30115 B14R1.882 CCCOCCOC1CCCCC1C 7a_100000211207_100011215938 [0,1,0,1,0,0|2,0,0]=4 30116 B14R1.882 CCCOCCOC1CCCCC1Cl 34a_100000038908_100011215938 [0,1,0,1,0,0|2,0,0]=4 30117 B14R1.882 CCCOCCOC1CCCCC1Cl 7a_100000038908_100011215938 [0,1,0,1,0,0|2,0,0]=4 30118 B14R1.882 CCCOCCOC1CCCCC1F 34a_100000752267_100015423560 [0,1,0,1,0,0|2,0,0]=4 30119 B14R1.882 CCCOCCOC1CCCCC1O 34a_100000752267_100000038908 [0,1,0,1,0,0|1,0,0]=3 30120 B14R1.882 CCCOCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100011215938 [0,1,0,1,0,0|2,0,0]=4 30121 B14R1.882 CCCOCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100011215938 [0,1,0,1,0,0|2,0,0]=4 30122 B14R1.882 CCCOCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100011215938 [0,1,0,1,0,0|2,0,0]=4 30123 B14R1.882 CCCOCCSC1CCCCC1F 62a_100011215938_100015423560 [0,1,0,1,0,0|2,0,0]=4 30124 B14R1.882 CCCOCCSC1CCCCC1F 62a_100015423560_100011215938 [0,1,0,1,0,0|2,0,0]=4 30125 B14R1.882 CCCOCCSC1CCCCC1O 62a_100000038908_100011215938 [0,1,0,1,0,0|1,0,0]=3 30126 B14R1.882 CCCOCCSC1CCCCC1O 62a_100011215938_100000038908 [0,1,0,1,0,0|1,0,0]=3 30127 B14R1.882 CCCSCCNC1CCCCC1C 269862a_100020603323_100000210921 [0,1,0,1,0,0|2,0,0]=4 30128 B14R1.882 CCCSCCNC1CCCCC1C 270004a_100020603323_100000210921 [0,1,0,1,0,0|2,0,0]=4 30129 B14R1.882 CCCSCCOC1CCCCC1F 34a_200000230433_100015423560 [0,1,0,1,0,0|2,0,0]=4 30130 B14R1.882 CCCSCCOC1CCCCC1O 34a_200000230433_100000038908 [0,1,0,1,0,0|1,0,0]=3 30131 B14R1.882 CCOCCCNC1CCCCC1C 2230a_100000211402_100012232248 [0,1,0,1,0,0|2,0,0]=4 30132 B14R1.882 CCOCCCNC1CCCCC1C 269862a_100000210961_100000210921 [0,1,0,1,0,0|2,0,0]=4 30133 B14R1.882 CCOCCCNC1CCCCC1C 270004a_100000210961_100000210921 [0,1,0,1,0,0|2,0,0]=4 30134 B14R1.882 CCOCCCNC1CCCCC1C 34a_100000211402_100012232248 [0,1,0,1,0,0|2,0,0]=4 30135 B14R1.882 CCOCCCNC1CCCCC1F 34a_100000210961_100015423560 [0,1,0,1,0,0|2,0,0]=4 30136 B14R1.882 CCOCCCNC1CCCCC1O 34a_100000210961_100000038908 [0,1,0,1,0,0|1,0,0]=3 30137 B14R1.882 CCOCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100012232248 [0,1,0,1,0,0|2,0,0]=4 30138 B14R1.882 CCOCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100012232248 [0,1,0,1,0,0|2,0,0]=4 30139 B14R1.882 CCOCCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100012232248 [0,1,0,1,0,0|2,0,0]=4 30140 B14R1.882 CCOCCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100012232248 [0,1,0,1,0,0|2,0,0]=4 30141 B14R1.882 CCOCCCOC1CCCCC1C 34a_100000211207_100012232248 [0,1,0,1,0,0|2,0,0]=4 30142 B14R1.882 CCOCCCOC1CCCCC1C 7a_100000211207_100012232248 [0,1,0,1,0,0|2,0,0]=4 30143 B14R1.882 CCOCCCOC1CCCCC1Cl 34a_100000038908_100012232248 [0,1,0,1,0,0|2,0,0]=4 30144 B14R1.882 CCOCCCOC1CCCCC1Cl 7a_100000038908_100012232248 [0,1,0,1,0,0|2,0,0]=4 30145 B14R1.882 CCOCCCOC1CCCCC1F 34a_100000757476_100015423560 [0,1,0,1,0,0|2,0,0]=4 30146 B14R1.882 CCOCCCOC1CCCCC1O 34a_100000757476_100000038908 [0,1,0,1,0,0|1,0,0]=3 30147 B14R1.882 CCOCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100012232248 [0,1,0,1,0,0|2,0,0]=4 30148 B14R1.882 CCOCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100012232248 [0,1,0,1,0,0|2,0,0]=4 30149 B14R1.882 CCOCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100012232248 [0,1,0,1,0,0|2,0,0]=4 30150 B14R1.882 CCOCCCSC1CCCCC1F 62a_100012232248_100015423560 [0,1,0,1,0,0|2,0,0]=4 30151 B14R1.882 CCOCCCSC1CCCCC1F 62a_100015423560_100012232248 [0,1,0,1,0,0|2,0,0]=4 30152 B14R1.882 CCOCCCSC1CCCCC1O 62a_100000038908_100012232248 [0,1,0,1,0,0|1,0,0]=3 30153 B14R1.882 CCOCCCSC1CCCCC1O 62a_100012232248_100000038908 [0,1,0,1,0,0|1,0,0]=3 30154 B14R1.882 CCOCCNCC1CCCCC1O 34a_100011216029_100000210147 [0,1,0,1,0,0|1,0,0]=3 30155 B14R1.882 CCSCCCOC1CCCCC1F 34a_100011216438_100015423560 [0,1,0,1,0,0|2,0,0]=4 30156 B14R1.882 CCSCCCOC1CCCCC1O 34a_100011216438_100000038908 [0,1,0,1,0,0|1,0,0]=3 30157 B14R1.882 CCSCCNCC1CCCCC1O 34a_100011216029_100000757381 [0,1,0,1,0,0|1,0,0]=3 30158 B14R1.882 CN1CCCCC1CCNCCCF 2230a_100015189416_100000211948 [0,1,0,1,0,0|2,0,0]=4 30159 B14R1.882 CN1CCCCC1CCNCCCF 34a_100015189416_100000211948 [0,1,0,1,0,0|2,0,0]=4 30160 B14R1.882 CN1CCCCC1CCOCCCBr 34a_100011217188_100000211948 [0,1,0,1,0,0|2,0,0]=4 30161 B14R1.882 CN1CCCCC1CCOCCCCl 34a_100000230001_100000211948 [0,1,0,1,0,0|2,0,0]=4 30162 B14R1.882 CN1CCCCC1CCOCCCF 34a_100000759539_100000211948 [0,1,0,1,0,0|2,0,0]=4 30163 B14R1.882 CN1CCCCC1CCOCCCN 34a_100000182051_100000211948 [0,1,0,1,0,0|2,0,0]=4 30164 B14R1.882 CN1CCCCC1CCOCCON 34a_100000700252_100000211948 [0,1,0,1,0,0|2,0,0]=4 30165 B14R1.882 CN1CCCCC1CCSCCCF 62a_100000211948_100011934791 [0,1,0,1,0,0|2,0,0]=4 30166 B14R1.882 CN1CCCCC1CCSCCCF 62a_100011934791_100000211948 [0,1,0,1,0,0|2,0,0]=4 30167 B14R1.882 CN1CCCCC1CCSCCCO 62a_100000211948_100011215043 [0,1,0,1,0,0|1,0,0]=3 30168 B14R1.882 CN1CCCCC1CCSCCCO 62a_100011215043_100000211948 [0,1,0,1,0,0|1,0,0]=3 30169 B14R1.882 CN1CCCCC1CNCCCCF 34a_100011228421_100000729493 [0,1,0,1,0,0|2,0,0]=4 30170 B14R1.882 CN1CCCCC1CNCCCCO 34a_100000750430_100015186950 [0,1,0,1,0,0|1,0,0]=3 30171 B14R1.882 CN1CCCCC1CNCCCCO 34a_100011228421_100011216708 [0,1,0,1,0,0|1,0,0]=3 30172 B14R1.882 CN1CCCCC1COCCCCBr 34a_100011216708_100015186950 [0,1,0,1,0,0|2,0,0]=4 30173 B14R1.882 CN1CCCCC1COCCCCCl 34a_100000210776_100015186950 [0,1,0,1,0,0|2,0,0]=4 30174 B14R1.882 CN1CCCCC1COCCCCCl 7a_100000210776_100015185383 [0,1,0,1,0,0|2,0,0]=4 30175 B14R1.882 CN1CCCCC1COCCCCF 34a_100000225079_100000729493 [0,1,0,1,0,0|2,0,0]=4 30176 B14R1.882 CN1CCCCC1COCCCCF 34a_100011995726_100015186950 [0,1,0,1,0,0|2,0,0]=4 30177 B14R1.882 CN1CCCCC1COCCCCF 7a_100011995726_100015185383 [0,1,0,1,0,0|2,0,0]=4 30178 B14R1.882 CN1CCCCC1COCCCCI 34a_200012148704_100015186950 [0,1,0,1,0,0|2,0,0]=4 30179 B14R1.882 CN1CCCCC1COCCCCN 34a_100000750430_100015186950 [0,1,0,1,0,0|2,0,0]=4 30180 B14R1.882 CN1CCCCC1COCCCCO 34a_100000225079_100011216708 [0,1,0,1,0,0|1,0,0]=3 30181 B14R1.882 CN1CCCCC1CSCCCCF 62a_100000729493_100015185383 [0,1,0,1,0,0|2,0,0]=4 30182 B14R1.882 CN1CCCCC1CSCCCCF 62a_100015185383_100000729493 [0,1,0,1,0,0|2,0,0]=4 30183 B14R1.882 CN1CCCCC1CSCCCCO 62a_100000210776_100015185383 [0,1,0,1,0,0|1,0,0]=3 30184 B14R1.882 CN1CCCCC1CSCCCCO 62a_100015185383_100000210776 [0,1,0,1,0,0|1,0,0]=3 30185 B14R1.882 CN1CCOCC1COCCCCO 34a_100013547906_100011216708 [0,1,0,1,0,0|2,0,0]=4 30186 B14R1.882 COCCCCNC1CCCCC1C 2230a_100000211402_100000730899 [0,1,0,1,0,0|1,0,0]=3 30187 B14R1.882 COCCCCNC1CCCCC1C 34a_100000211402_100000755781 [0,1,0,1,0,0|1,0,0]=3 30188 B14R1.882 COCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000730899 [0,1,0,1,0,0|2,0,0]=4 30189 B14R1.882 COCCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000755781 [0,1,0,1,0,0|2,0,0]=4 30190 B14R1.882 COCCCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100000730899 [0,1,0,1,0,0|2,0,0]=4 30191 B14R1.882 COCCCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000730899 [0,1,0,1,0,0|2,0,0]=4 30192 B14R1.882 COCCCCOC1CCCCC1C 34a_100000211207_100000755781 [0,1,0,1,0,0|1,0,0]=3 30193 B14R1.882 COCCCCOC1CCCCC1C 7a_100000211207_100000730899 [0,1,0,1,0,0|1,0,0]=3 30194 B14R1.882 COCCCCOC1CCCCC1Cl 34a_100000038908_100000755781 [0,1,0,1,0,0|2,0,0]=4 30195 B14R1.882 COCCCCOC1CCCCC1Cl 7a_100000038908_100000730899 [0,1,0,1,0,0|2,0,0]=4 30196 B14R1.882 COCCCCOC1CCCCC1F 34a_100000740925_100015423560 [0,1,0,1,0,0|2,0,0]=4 30197 B14R1.882 COCCCCOC1CCCCC1O 34a_100000740925_100000038908 [0,1,0,1,0,0|1,0,0]=3 30198 B14R1.882 COCCCCOC1CCNCC1C 34a_100011998114_100000755781 [0,1,0,1,0,0|2,0,0]=4 30199 B14R1.882 COCCCCOC1CNCCC1C 34a_100000696640_100000755781 [0,1,0,1,0,0|2,0,0]=4 30200 B14R1.882 COCCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000755781 [0,1,0,1,0,0|2,0,0]=4 30201 B14R1.882 COCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000730899 [0,1,0,1,0,0|2,0,0]=4 30202 B14R1.882 COCCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000755781 [0,1,0,1,0,0|2,0,0]=4 30203 B14R1.882 COCCCCSC1CCCCC1F 62a_100000730899_100015423560 [0,1,0,1,0,0|2,0,0]=4 30204 B14R1.882 COCCCCSC1CCCCC1F 62a_100015423560_100000730899 [0,1,0,1,0,0|2,0,0]=4 30205 B14R1.882 COCCCCSC1CCCCC1O 62a_100000038908_100000730899 [0,1,0,1,0,0|1,0,0]=3 30206 B14R1.882 COCCCCSC1CCCCC1O 62a_100000730899_100000038908 [0,1,0,1,0,0|1,0,0]=3 30207 B14R1.882 COCCCNCC1CCCCC1O 34a_100011216029_100000740836 [0,1,0,1,0,0|1,0,0]=3 30208 B14R1.882 COCCCNCC1CCCCN1C 34a_100011228421_100000740836 [0,1,0,1,0,0|2,0,0]=4 30209 B14R1.882 COCCCNCC1CCCCN1C 34a_100150723488_100015186950 [0,1,0,1,0,0|2,0,0]=4 30210 B14R1.882 COCCCOCC1CCCCN1C 34a_100000225079_100000740836 [0,1,0,1,0,0|2,0,0]=4 30211 B14R1.882 COCCCOCC1CCCCN1C 34a_100000740835_100015186950 [0,1,0,1,0,0|2,0,0]=4 30212 B14R1.882 COCCCSCC1CCCCN1C 62a_100000709357_100015185383 [0,1,0,1,0,0|2,0,0]=4 30213 B14R1.882 COCCCSCC1CCCCN1C 62a_100015185383_100000709357 [0,1,0,1,0,0|2,0,0]=4 30214 B14R1.882 COCCNCCC1CCCCN1C 2230a_100000209980_100000211948 [0,1,0,1,0,0|2,0,0]=4 30215 B14R1.882 COCCNCCN1CCCCC1C 2230a_100000739827_100011201679 [0,1,0,1,0,0|2,0,0]=4 30216 B14R1.882 COCCNCCN1CCCCC1C 34a_100000739827_100011201679 [0,1,0,1,0,0|2,0,0]=4 30217 B14R1.882 COCCOCCC1CCCCN1C 34a_100000210237_100000211948 [0,1,0,1,0,0|2,0,0]=4 30218 B14R1.882 COCCOCCN1CCCCC1C 2230a_100000211376_100000695917 [0,1,0,1,0,0|2,0,0]=4 30219 B14R1.882 COCCOCCN1CCCCC1C 269982a_100000211376_100000695917 [0,1,0,1,0,0|2,0,0]=4 30220 B14R1.882 COCCOCCN1CCCCC1C 34a_100000211376_100000695917 [0,1,0,1,0,0|2,0,0]=4 30221 B14R1.882 COCCOCCN1CCCCC1C 34a_100011305533_100011201679 [0,1,0,1,0,0|2,0,0]=4 30222 B14R1.882 COCCOCNC1CCCCC1C 2230a_100000211402_100000231047 [0,1,0,1,0,0|2,0,0]=4 30223 B14R1.882 COCCOCSC1CCCCC1O 62a_100000038908_100000231047 [0,1,0,1,0,0|2,0,0]=4 30224 B14R1.882 COCCOCSC1CCCCC1O 62a_100000231047_100000038908 [0,1,0,1,0,0|2,0,0]=4 30225 B14R1.882 COCCSCCC1CCCCN1C 62a_100000211948_100000233755 [0,1,0,1,0,0|2,0,0]=4 30226 B14R1.882 COCCSCCC1CCCCN1C 62a_100000233755_100000211948 [0,1,0,1,0,0|2,0,0]=4 30227 B14R1.882 CSCCCCOC1CCCCC1F 34a_100011217163_100015423560 [0,1,0,1,0,0|2,0,0]=4 30228 B14R1.882 CSCCCCOC1CCCCC1O 34a_100011217163_100000038908 [0,1,0,1,0,0|1,0,0]=3 30229 B14R1.882 C[C@H]1COCCN1CCCCCCF 2230a_100009815349_100015922095 [0,1,0,1,0,0|2,0,0]=4 30230 B14R1.882 C[C@H]1COCCN1CCCCCCF 269982a_100009815349_100015922095 [0,1,0,1,0,0|2,0,0]=4 30231 B14R1.882 C[C@H]1COCCN1CCCCCCF 34a_100009815349_100015922095 [0,1,0,1,0,0|2,0,0]=4 30232 B14R1.882 C[C@H]1COCCN1CCCCCCO 2230a_100009815349_100000766143 [0,1,0,1,0,0|1,0,0]=3 30233 B14R1.882 C[C@H]1COCCN1CCCCCCO 269982a_100009815349_100000766143 [0,1,0,1,0,0|1,0,0]=3 30234 B14R1.882 C[C@H]1COCCN1CCCCCCO 34a_100009815349_100000766143 [0,1,0,1,0,0|1,0,0]=3 30235 B14R1.882 FC1CCCCC1OCCCCCBr 34a_100000746331_100015423560 [0,1,0,1,0,0|2,0,0]=4 30236 B14R1.882 FC1CCCCC1OCCCCCCl 34a_100000746330_100015423560 [0,1,0,1,0,0|2,0,0]=4 30237 B14R1.882 FC1CCCCC1OCCCCCI 34a_200012148887_100015423560 [0,1,0,1,0,0|2,0,0]=4 30238 B14R1.882 FCCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000729378 [0,1,0,1,0,0|2,0,0]=4 30239 B14R1.882 FCCCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000729378 [0,1,0,1,0,0|2,0,0]=4 30240 B14R1.882 FCCCCCOC1CCCCC1Cl 34a_100000038908_100000729378 [0,1,0,1,0,0|2,0,0]=4 30241 B14R1.882 FCCCCCOC1CCCCC1Cl 7a_100000038908_100000729378 [0,1,0,1,0,0|2,0,0]=4 30242 B14R1.882 FCCCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000729378 [0,1,0,1,0,0|2,0,0]=4 30243 B14R1.882 FCCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000729378 [0,1,0,1,0,0|2,0,0]=4 30244 B14R1.882 FCCCCCSC1CCCCC1F 62a_100000729378_100015423560 [0,1,0,1,0,0|2,0,0]=4 30245 B14R1.882 FCCCCCSC1CCCCC1F 62a_100015423560_100000729378 [0,1,0,1,0,0|2,0,0]=4 30246 B14R1.882 N#CCCCCSC1CCCCC1O 62a_100000038908_100000211819 [0,1,0,1,0,0|1,0,1]=4 30247 B14R1.882 N#CCCCCSC1CCCCC1O 62a_100011219923_100000038908 [0,1,0,1,0,0|1,0,1]=4 30248 B14R1.882 NC1CCOCC1COCCCCO 34a_214813039666_100011216708 [0,1,0,1,0,0|2,0,0]=4 30249 B14R1.882 NCCCCCOC1CCCCC1F 34a_100000762737_100015423560 [0,1,0,1,0,0|2,0,0]=4 30250 B14R1.882 NCCCCCOC1CCCCC1O 34a_100000762737_100000038908 [0,1,0,1,0,0|1,0,0]=3 30251 B14R1.882 NCCOCCOC1CCCCC1O 34a_100000211614_100000038908 [0,1,0,1,0,0|2,0,0]=4 30252 B14R1.882 N[C@@H]1CCCC[C@@H]1OCCCCCF 34a_100015191688_100000729378 [0,1,0,1,0,0|2,0,0]=4 30253 B14R1.882 N[C@@H]1CCCC[C@@H]1OCCCCCO 34a_100015191688_100000746330 [0,1,0,1,0,0|1,0,0]=3 30254 B14R1.882 N[C@@H]1CCCC[C@@H]1OCCOCCO 34a_100015191688_100000692535 [0,1,0,1,0,0|2,0,0]=4 30255 B14R1.882 N[C@@H]1CCOC[C@@H]1OCCCCCO 34a_100016994285_100000746330 [0,1,0,1,0,0|2,0,0]=4 30256 B14R1.882 N[C@H]1COCC[C@@H]1OCCCCCO 34a_100015739063_100000746330 [0,1,0,1,0,0|2,0,0]=4 30257 B14R1.882 O=C1CCCCC1COCCCCO 34a_100009861125_100011216708 [0,1,0,1,0,0|1,0,1]=4 30258 B14R1.882 O=C1CCCCC1COCCCCO 7a_100009861125_100000210776 [0,1,0,1,0,0|1,0,1]=4 30259 B14R1.882 O=C1CCCCC1NCCCCCO 34a_100000762737_100000754470 [0,1,0,1,0,0|1,0,1]=4 30260 B14R1.882 O=C1CCCCC1OCCCCCO 34a_100011214950_100000746330 [0,1,0,1,0,0|1,0,1]=4 30261 B14R1.882 O=C1CCCCC1SCCCCCO 62a_100000204591_100000746330 [0,1,0,1,0,0|1,0,1]=4 30262 B14R1.882 O=C1CCCCC1SCCCCCO 62a_100000746330_100000204591 [0,1,0,1,0,0|1,0,1]=4 30263 B14R1.882 O=CCCCCSC1CCCCC1O 62a_100000038908_100000139335 [0,1,0,1,0,0|1,0,1]=4 30264 B14R1.882 O=CCCCCSC1CCCCC1O 62a_100000139335_100000038908 [0,1,0,1,0,0|1,0,1]=4 30265 B14R1.882 OC1CCCCC1CNCCCCF 34a_100011216029_100000729493 [0,1,0,1,0,0|1,0,0]=3 30266 B14R1.882 OC1CCCCC1OCCCCCBr 34a_100000746331_100000038908 [0,1,0,1,0,0|1,0,0]=3 30267 B14R1.882 OC1CCCCC1OCCCCCCl 34a_100000746330_100000038908 [0,1,0,1,0,0|1,0,0]=3 30268 B14R1.882 OC1CCCCC1OCCCCCI 34a_200012148887_100000038908 [0,1,0,1,0,0|1,0,0]=3 30269 B14R1.882 OC1CCCCC1OCCOCCBr 34a_100000692535_100000038908 [0,1,0,1,0,0|2,0,0]=4 30270 B14R1.882 OC1CCCCC1OCCOCCCl 34a_100011215305_100000038908 [0,1,0,1,0,0|2,0,0]=4 30271 B14R1.882 OC1CCCCC1OCCOCCF 34a_200015357709_100000038908 [0,1,0,1,0,0|2,0,0]=4 30272 B14R1.882 OC1CCCCC1OCCOCCI 34a_100012149058_100000038908 [0,1,0,1,0,0|2,0,0]=4 30273 B14R1.882 OC1CCCCC1SCCCCCF 62a_100000038908_100000729378 [0,1,0,1,0,0|1,0,0]=3 30274 B14R1.882 OC1CCCCC1SCCCCCF 62a_100000729378_100000038908 [0,1,0,1,0,0|1,0,0]=3 30275 B14R1.882 OCCCCCNC1CCCCC1F 34a_100000762737_100015423560 [0,1,0,1,0,0|1,0,0]=3 30276 B14R1.882 OCCCCCNC1CCCCC1O 34a_100000762737_100000038908 [0,1,0,1,0,0|1,0,0]=3 30277 B14R1.882 OCCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000746330 [0,1,0,1,0,0|1,0,0]=3 30278 B14R1.882 OCCCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000746330 [0,1,0,1,0,0|1,0,0]=3 30279 B14R1.882 OCCCCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100000746330 [0,1,0,1,0,0|2,0,0]=4 30280 B14R1.882 OCCCCCN[C@H]1CCOC[C@@H]1F 2230a_100016994078_100000746330 [0,1,0,1,0,0|2,0,0]=4 30281 B14R1.882 OCCCCCN[C@H]1CCOC[C@@H]1F 34a_100016994078_100000746330 [0,1,0,1,0,0|2,0,0]=4 30282 B14R1.882 OCCCCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000746330 [0,1,0,1,0,0|2,0,0]=4 30283 B14R1.882 OCCCCCOC1CCCCC1Cl 34a_100000038908_100000746330 [0,1,0,1,0,0|1,0,0]=3 30284 B14R1.882 OCCCCCOC1CCCCC1Cl 7a_100000038908_100000746330 [0,1,0,1,0,0|1,0,0]=3 30285 B14R1.882 OCCCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000746330 [0,1,0,1,0,0|1,0,0]=3 30286 B14R1.882 OCCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000746330 [0,1,0,1,0,0|1,0,0]=3 30287 B14R1.882 OCCCCCO[C@@H]1CCNC[C@@H]1F 34a_200016994291_100000746330 [0,1,0,1,0,0|2,0,0]=4 30288 B14R1.882 OCCCCCSC1CCCCC1F 62a_100000746330_100015423560 [0,1,0,1,0,0|1,0,0]=3 30289 B14R1.882 OCCCCCSC1CCCCC1F 62a_100015423560_100000746330 [0,1,0,1,0,0|1,0,0]=3 30290 B14R1.882 OCCCCCSC1CCCCC1O 62a_100000038908_100000746330 [0,1,0,1,0,0|1,0,0]=3 30291 B14R1.882 OCCCCCSC1CCCCC1O 62a_100000746330_100000038908 [0,1,0,1,0,0|1,0,0]=3 30292 B14R1.882 OCCCCNCC1CCCCC1O 34a_100011216029_100011216708 [0,1,0,1,0,0|1,0,0]=3 30293 B14R1.882 OCCOCCNC1CCCCC1F 34a_100000211614_100015423560 [0,1,0,1,0,0|2,0,0]=4 30294 B14R1.882 OCCOCCNC1CCCCC1O 34a_100000211614_100000038908 [0,1,0,1,0,0|2,0,0]=4 30295 B14R1.882 OCCOCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100011215305 [0,1,0,1,0,0|2,0,0]=4 30296 B14R1.882 OCCOCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000692535 [0,1,0,1,0,0|2,0,0]=4 30297 B14R1.882 OCCOCCOC1CCCCC1Cl 34a_100000038908_100000692535 [0,1,0,1,0,0|2,0,0]=4 30298 B14R1.882 OCCOCCOC1CCCCC1Cl 7a_100000038908_100011215305 [0,1,0,1,0,0|2,0,0]=4 30299 B14R1.882 OCCOCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000692535 [0,1,0,1,0,0|2,0,0]=4 30300 B14R1.882 OCCOCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100011215305 [0,1,0,1,0,0|2,0,0]=4 30301 B14R1.882 OCCOCCSC1CCCCC1F 62a_100011215305_100015423560 [0,1,0,1,0,0|2,0,0]=4 30302 B14R1.882 OCCOCCSC1CCCCC1F 62a_100015423560_100011215305 [0,1,0,1,0,0|2,0,0]=4 30303 B14R1.882 OCCOCCSC1CCCCC1O 62a_100000038908_100011215305 [0,1,0,1,0,0|2,0,0]=4 30304 B14R1.882 OCCOCCSC1CCCCC1O 62a_100011215305_100000038908 [0,1,0,1,0,0|2,0,0]=4 30305 B14R1.882 O[C@H]1CCOC[C@@H]1NCCCCCF 2230a_100015739063_100000729378 [0,1,0,1,0,0|2,0,0]=4 30306 B14R1.882 O[C@H]1COCC[C@H]1NCCCCCF 2230a_100016994285_100000729378 [0,1,0,1,0,0|2,0,0]=4 30307 B14R1.887 CCCOCC1CCN(C1)CCCO 2230a_200011652792_100000230001 [0,1,0,1,0,0|2,0,0]=4 30308 B14R1.887 CCCOCC1CCN(C1)CCCO 269982a_200011652792_100011215043 [0,1,0,1,0,0|2,0,0]=4 30309 B14R1.887 CCCOCC1CCN(C1)CCCO 34a_200011652792_100000230001 [0,1,0,1,0,0|2,0,0]=4 30310 B14R1.915 CCCCC(C)NC1CCCC1CC 269862a_100000126638_100000749056 [0,1,0,1,0,0|2,0,0]=4 30311 B14R1.915 CCCCC(C)NC1CCCC1CC 270004a_100000126638_100000749056 [0,1,0,1,0,0|2,0,0]=4 30312 B14R1.916 CC1CCCC1NC[C@H](C)CCCO 269862a_100160569302_100000752053 [0,1,0,1,0,0|1,0,0]=3 30313 B14R1.916 CC1OCCC1NC[C@H](C)CCCO 270004a_100160569302_100000691750 [0,1,0,1,0,0|2,0,0]=4 30314 B14R1.916 CCCCC(C)COC1COCC1O 34a_100011995851_200000725654 [0,1,0,1,0,0|2,0,0]=4 30315 B14R1.916 CCCCC(C)COC1COCC1O 7a_100011995851_200000725654 [0,1,0,1,0,0|2,0,0]=4 30316 B14R1.916 CCCC[C@H](N)COC1COCC1O 34a_100011934283_200000725654 [0,1,0,1,0,0|2,0,0]=4 30317 B14R1.916 CN(CCCO)CCC1CCCN1C 2230a_100000213112_100000005710 [0,1,0,1,0,0|2,0,0]=4 30318 B14R1.916 CN(CCCO)CCC1CCCN1C 269982a_100000213112_100000005710 [0,1,0,1,0,0|2,0,0]=4 30319 B14R1.927 CCCCC(C)CCCCOC1CC1 34a_200011021034_100000211595 [0,1,0,1,0,0|2,0,0]=4 30320 B14R1.927 CCCCC(C)COCCCC1CO1 34a_100011995851_100000733510 [0,1,0,1,0,0|1,0,0]=3 30321 B14R1.927 CCCCC(C)COCCCC1CO1 7a_100011995851_100000733510 [0,1,0,1,0,0|1,0,0]=3 30322 B14R1.927 CCCC[C@H](N)COCCCC1CO1 34a_100011934283_100000733510 [0,1,0,1,0,0|1,0,0]=3 30323 B14R1.927 CCCOC(C)CNCCCC1CO1 2230a_100015185124_100000733510 [0,1,0,1,0,0|2,0,0]=4 30324 B14R1.927 CCCOC(C)CNCCCC1CO1 34a_100015185124_100000733510 [0,1,0,1,0,0|2,0,0]=4 30325 B14R1.927 CCOCC(O)CNCCCC1CO1 2230a_102515437182_100000733510 [0,1,0,1,0,0|2,0,0]=4 30326 B14R1.927 CCOCC(O)CNCCCC1CO1 34a_102515437182_100000733510 [0,1,0,1,0,0|2,0,0]=4 30327 B14R1.927 CSCC[C@H](N)COCCCC1CO1 34a_100011827619_100000733510 [0,1,0,1,0,0|2,0,0]=4 30328 B14R1.927 C[C@H](CCCO)CNCCCC1CO1 2230a_100160569302_100000733510 [0,1,0,1,0,0|2,0,0]=4 30329 B14R1.927 C[C@H](CCCO)CNCCCC1CO1 34a_100160569302_100000733510 [0,1,0,1,0,0|2,0,0]=4 30330 B14R1.938 CN1CCCCCC1C(=O)CCCO 1458a_100015187800_100011215043 [0,1,0,1,0,0|1,0,1]=4 30331 B14R1.939 CCC1CCCCC1N(C)CCCO 270004a_100000213112_100000757040 [0,1,0,1,0,0|1,0,0]=3 30332 B14R1.939 CCCCC(=O)N1CCCCC1CO 240690a_100000210821_100000210183 [0,1,0,1,0,0|1,0,1]=4 30333 B14R1.939 CCCCC(C)N1CCCCC1CC 2230a_100000210034_200011215066 [0,1,0,1,0,0|2,0,0]=4 30334 B14R1.939 CCCCC(C)N1CCCCC1CC 269982a_100000210034_200011215066 [0,1,0,1,0,0|2,0,0]=4 30335 B14R1.939 CCCCC(C)N1CCCCC1CC 270004a_100000210034_100000210087 [0,1,0,1,0,0|2,0,0]=4 30336 B14R1.939 CCCCC(C)N1CCCCC1CC 34a_100000210034_200011215066 [0,1,0,1,0,0|2,0,0]=4 30337 B14R1.939 CCCCC(C)N1CCCCC1CO 2230a_100000210821_200011215066 [0,1,0,1,0,0|1,0,0]=3 30338 B14R1.939 CCCCC(C)N1CCCCC1CO 269982a_100000210821_200011215066 [0,1,0,1,0,0|1,0,0]=3 30339 B14R1.939 CCCCC(C)N1CCCCC1CO 34a_100000210821_200011215066 [0,1,0,1,0,0|1,0,0]=3 30340 B14R1.939 CCCCC(C)N1CCOC[C@H]1CO 2230a_100000717676_200011215066 [0,1,0,1,0,0|2,0,0]=4 30341 B14R1.939 CCCCC(C)N1CCOC[C@H]1CO 269982a_100000717676_200011215066 [0,1,0,1,0,0|2,0,0]=4 30342 B14R1.939 CCCCC(C)N1CCOC[C@H]1CO 270004a_100000717676_100000210087 [0,1,0,1,0,0|2,0,0]=4 30343 B14R1.939 CCCCC(C)N1CCOC[C@H]1CO 34a_100000717676_200011215066 [0,1,0,1,0,0|2,0,0]=4 30344 B14R1.939 CCCCN(C)C1CCCCC1CC 270004a_100000207549_100000757040 [0,1,0,1,0,0|2,0,0]=4 30345 B14R1.939 CCCCN(C)C1CCCCC1CO 270004a_100000207549_100009861125 [0,1,0,1,0,0|1,0,0]=3 30346 B14R1.939 CCN1CCCCC1C(=O)CCCO 1458a_100000743832_100011215043 [0,1,0,1,0,0|1,0,1]=4 30347 B14R1.939 CN(CCCO)C1CCCCC1CO 270004a_100000213112_100009861125 [0,1,0,1,0,0|2,0,0]=4 30348 B14R1.939 COC1CCCCC1N(C)CCCO 270004a_100000213112_100000740605 [0,1,0,1,0,0|2,0,0]=4 30349 B14R1.939 COCCN(C)C1CCCCC1CO 270004a_100000743101_100009861125 [0,1,0,1,0,0|2,0,0]=4 30350 B14R1.939 CSCCN(C)C1CCCCC1CO 270004a_100000686725_100009861125 [0,1,0,1,0,0|2,0,0]=4 30351 B14R1.943 CCCC1CCCC1N(C)CCCO 270004a_100000213112_100000723119 [0,1,0,1,0,0|1,0,0]=3 30352 B14R1.943 CCCCN(C)C1CCCC1CCC 270004a_100000207549_100000723119 [0,1,0,1,0,0|2,0,0]=4 30353 B14R1.946 CC(CCCCl)OC1CCCCC1O 34a_200000718107_100000038908 [0,1,0,1,0,0|2,0,0]=4 30354 B14R1.946 CCCCC(=O)N[C@@H]1CCCC[C@@H]1O 240690a_100015191688_100000210183 [0,1,0,1,0,0|1,0,1]=4 30355 B14R1.946 CCCCC(=O)N[C@@H]1CCCC[C@@H]1O 527a_100015191688_100000210183 [0,1,0,1,0,0|1,0,1]=4 30356 B14R1.946 CCCCC(C)NC1CCCCC1C 2230a_100000211402_200011215066 [0,1,0,1,0,0|2,0,0]=4 30357 B14R1.946 CCCCC(C)NC1CCCCC1C 269862a_100000126638_100000210921 [0,1,0,1,0,0|2,0,0]=4 30358 B14R1.946 CCCCC(C)NC1CCCCC1C 270004a_100000126638_100000210921 [0,1,0,1,0,0|2,0,0]=4 30359 B14R1.946 CCCCC(C)NC1CCCCC1C 270004a_100000211402_100000210087 [0,1,0,1,0,0|2,0,0]=4 30360 B14R1.946 CCCCC(C)NC1CCCCC1C 34a_100000211402_200011215066 [0,1,0,1,0,0|2,0,0]=4 30361 B14R1.946 CCCCC(C)N[C@@H]1CCCC[C@@H]1O 270004a_100015191688_100000210087 [0,1,0,1,0,0|1,0,0]=3 30362 B14R1.946 CCCCC(C)N[C@@H]1CCCC[C@H]1F 2230a_100015195156_200011215066 [0,1,0,1,0,0|2,0,0]=4 30363 B14R1.946 CCCCC(C)N[C@@H]1CCCC[C@H]1F 270004a_100015195156_100000210087 [0,1,0,1,0,0|2,0,0]=4 30364 B14R1.946 CCCCC(C)N[C@@H]1CCCC[C@H]1F 34a_100015195156_200011215066 [0,1,0,1,0,0|2,0,0]=4 30365 B14R1.946 CCCCC(C)N[C@@H]1CCOC[C@@H]1O 2230a_100016994285_200011215066 [0,1,0,1,0,0|2,0,0]=4 30366 B14R1.946 CCCCC(C)N[C@@H]1CCOC[C@@H]1O 270004a_100016994285_100000210087 [0,1,0,1,0,0|2,0,0]=4 30367 B14R1.946 CCCCC(C)N[C@H]1COCC[C@@H]1O 2230a_100015739063_200011215066 [0,1,0,1,0,0|2,0,0]=4 30368 B14R1.946 CCCCC(C)N[C@H]1COCC[C@@H]1O 270004a_100015739063_100000210087 [0,1,0,1,0,0|2,0,0]=4 30369 B14R1.946 CCCCC(C)OC1CCCCC1C 34a_100000211207_200011215066 [0,1,0,1,0,0|2,0,0]=4 30370 B14R1.946 CCCCC(C)OC1CCCCC1C 7a_100000211207_200011215066 [0,1,0,1,0,0|2,0,0]=4 30371 B14R1.946 CCCCC(C)OC1CCCCC1Cl 34a_100000038908_200011215066 [0,1,0,1,0,0|2,0,0]=4 30372 B14R1.946 CCCCC(C)OC1CCCCC1Cl 7a_100000038908_200011215066 [0,1,0,1,0,0|2,0,0]=4 30373 B14R1.946 CCCCC(C)OC1CCCCC1F 34a_100000687866_100015423560 [0,1,0,1,0,0|2,0,0]=4 30374 B14R1.946 CCCCC(C)OC1CCCCC1O 34a_100000687866_100000038908 [0,1,0,1,0,0|1,0,0]=3 30375 B14R1.946 CCCCC(C)O[C@@H]1CCCC[C@H]1F 34a_100009816020_200011215066 [0,1,0,1,0,0|2,0,0]=4 30376 B14R1.946 CCCCC(C)O[C@@H]1CCCC[C@H]1F 7a_100009816020_200011215066 [0,1,0,1,0,0|2,0,0]=4 30377 B14R1.946 CCCCC(C)O[C@H]1CCCC[C@H]1N 34a_100015191688_200011215066 [0,1,0,1,0,0|2,0,0]=4 30378 B14R1.946 CCCCC(C)SC1CCCCC1F 62a_100015423560_200011215066 [0,1,0,1,0,0|2,0,0]=4 30379 B14R1.946 CCCCC(C)SC1CCCCC1F 62a_200011215066_100015423560 [0,1,0,1,0,0|2,0,0]=4 30380 B14R1.946 CCCCC(C)SC1CCCCC1O 62a_100000038908_200011215066 [0,1,0,1,0,0|1,0,0]=3 30381 B14R1.946 CCCCC(C)SC1CCCCC1O 62a_200011215066_100000038908 [0,1,0,1,0,0|1,0,0]=3 30382 B14R1.946 CCOCC(C)OC1CCCCC1O 34a_100000718985_100000038908 [0,1,0,1,0,0|2,0,0]=4 30383 B14R1.946 CCSCC(C)N[C@@H]1CCCC[C@@H]1O 270004a_100015191688_200011216171 [0,1,0,1,0,0|2,0,0]=4 30384 B14R1.946 CN(CCCO)CC1CCCCN1C 2230a_100015185953_100000230001 [0,1,0,1,0,0|2,0,0]=4 30385 B14R1.946 CN(CCCO)CC1CCCCN1C 269982a_100000213112_100015185383 [0,1,0,1,0,0|2,0,0]=4 30386 B14R1.946 CN(CCCO)CC1CCCCN1C 269982a_100015185953_100011215043 [0,1,0,1,0,0|2,0,0]=4 30387 B14R1.946 COCCC(C)N[C@@H]1CCCC[C@@H]1O 270004a_100015191688_100000742357 [0,1,0,1,0,0|2,0,0]=4 30388 B14R1.946 CSCCC(C)N[C@@H]1CCCC[C@@H]1O 270004a_100015191688_100011217047 [0,1,0,1,0,0|2,0,0]=4 30389 B14R1.1237 CC1CCC(N1CCCCCCF)C 2230a_100000687148_100015922095 [0,1,0,1,0,0|2,0,0]=4 30390 B14R1.1237 CC1CCC(N1CCCCCCF)C 269982a_100000687148_100015922095 [0,1,0,1,0,0|2,0,0]=4 30391 B14R1.1237 CC1CCC(N1CCCCCCF)C 34a_100000687148_100015922095 [0,1,0,1,0,0|2,0,0]=4 30392 B14R1.1237 CC1CCC(N1CCCCCCO)C 2230a_100000687148_100000766143 [0,1,0,1,0,0|1,0,0]=3 30393 B14R1.1237 CC1CCC(N1CCCCCCO)C 269982a_100000687148_100000766143 [0,1,0,1,0,0|1,0,0]=3 30394 B14R1.1237 CC1CCC(N1CCCCCCO)C 34a_100000687148_100000766143 [0,1,0,1,0,0|1,0,0]=3 30395 B14R1.1237 CCCCCCCN1C(CCC1C)C 2230a_100000687148_100000210681 [0,1,0,1,0,0|2,0,0]=4 30396 B14R1.1237 CCCCCCCN1C(CCC1C)C 269982a_100000687148_100000210681 [0,1,0,1,0,0|2,0,0]=4 30397 B14R1.1237 CCCCCCCN1C(CCC1C)C 34a_100000687148_100000210614 [0,1,0,1,0,0|2,0,0]=4 30398 B14R1.1260 CCCOC1CN(C1)CCCCCO 269982a_200020626125_100000746330 [0,1,0,1,0,0|2,0,0]=4 30399 B14R1.1260 CCCOC1CN(C1)CCCCCO 34a_200020626125_100000746330 [0,1,0,1,0,0|2,0,0]=4 30400 B14R1.2470 CCCCC(C)N1CCCCCCC1 2230a_100000211400_200011215066 [0,1,0,1,0,0|2,0,0]=4 30401 B14R1.2470 CCCCC(C)N1CCCCCCC1 269982a_100000211400_200011215066 [0,1,0,1,0,0|2,0,0]=4 30402 B14R1.2470 CCCCC(C)N1CCCCCCC1 270004a_100000211400_100000210087 [0,1,0,1,0,0|2,0,0]=4 30403 B14R1.2470 CCCCC(C)N1CCCCCCC1 34a_100000211400_200011215066 [0,1,0,1,0,0|2,0,0]=4 30404 B14R1.2470 CCCCN(C)C1CCCCCCC1 270004a_100000207549_100000210524 [0,1,0,1,0,0|2,0,0]=4 30405 B14R1.2470 CN(CCCO)C1CCCCCCC1 270004a_100000213112_100000210524 [0,1,0,1,0,0|1,0,0]=3 30406 B14R1.2596 CC(CCCCl)OC1CCCCCC1 34a_200000718107_100011217769 [0,1,0,1,0,0|2,0,0]=4 30407 B14R1.2596 CCCCC(=O)CC1CCCCCC1 1458a_100000210183_200000696569 [0,1,0,1,0,0|1,0,1]=4 30408 B14R1.2596 CCCCC(=O)CC1CCCCCC1 1458a_100000685095_100000210211 [0,1,0,1,0,0|1,0,1]=4 30409 B14R1.2596 CCCCC(C)NC1CCCCCC1 2230a_100000210984_200011215066 [0,1,0,1,0,0|2,0,0]=4 30410 B14R1.2596 CCCCC(C)NC1CCCCCC1 270004a_100000126638_100000210131 [0,1,0,1,0,0|2,0,0]=4 30411 B14R1.2596 CCCCC(C)NC1CCCCCC1 270004a_100000210984_100000210087 [0,1,0,1,0,0|2,0,0]=4 30412 B14R1.2596 CCCCC(C)NC1CCCCCC1 34a_100000210984_200011215066 [0,1,0,1,0,0|2,0,0]=4 30413 B14R1.2596 CCCCC(C)OC1CCCCCC1 34a_100000210887_200011215066 [0,1,0,1,0,0|2,0,0]=4 30414 B14R1.2596 CCCCC(C)OC1CCCCCC1 34a_100000687866_100011217769 [0,1,0,1,0,0|2,0,0]=4 30415 B14R1.2596 CCCCC(C)OC1CCCCCC1 7a_100000210887_200011215066 [0,1,0,1,0,0|2,0,0]=4 30416 B14R1.2596 CCCCC(C)SC1CCCCCC1 62a_100011217769_200011215066 [0,1,0,1,0,0|2,0,0]=4 30417 B14R1.2596 CCCCC(C)SC1CCCCCC1 62a_200011215066_100011217769 [0,1,0,1,0,0|2,0,0]=4 30418 B14R1.2596 CCCCN(C)CC1CCCCCC1 2230a_100000207549_200000696569 [0,1,0,1,0,0|2,0,0]=4 30419 B14R1.2596 CCCCN(C)CC1CCCCCC1 269982a_100000207549_200000696569 [0,1,0,1,0,0|2,0,0]=4 30420 B14R1.2596 CN(CCCO)CC1CCCCCC1 2230a_100000213112_200000696569 [0,1,0,1,0,0|1,0,0]=3 30421 B14R1.2596 CN(CCCO)CC1CCCCCC1 269982a_100000213112_200000696569 [0,1,0,1,0,0|1,0,0]=3 30422 B14R1.2596 O=C(CC1CCCCCC1)NCCO 240690a_100000210304_100000685095 [0,1,0,1,0,0|1,0,1]=4 30423 B14R1.2596 O=C(CC1CCCCCC1)NCCO 527a_100000210304_100000685095 [0,1,0,1,0,0|1,0,1]=4 30424 B14R1.2596 O=C(CCCF)CC1CCCCCC1 1458a_100000685095_100011934791 [0,1,0,1,0,0|1,0,1]=4 30425 B14R1.2596 O=C(CCCO)CC1CCCCCC1 1458a_100000685095_100011215043 [0,1,0,1,0,0|0,0,1]=3 30426 B14R1.2596 O=C(CCCO)CN1CCCCCC1 1458a_100000740298_100011215043 [0,1,0,1,0,0|1,0,1]=4 30427 B14R1.3768 CC(NCCCCCCF)C1CCC1 2230a_100016994624_100015922095 [0,1,0,1,0,0|2,0,0]=4 30428 B14R1.3768 CC(NCCCCCCF)C1CCC1 34a_100016994624_100015922095 [0,1,0,1,0,0|2,0,0]=4 30429 B14R1.3768 CC(NCCCCCCO)C1CCC1 2230a_100016994624_100000766143 [0,1,0,1,0,0|1,0,0]=3 30430 B14R1.3768 CC(NCCCCCCO)C1CCC1 269862a_100000686447_100000760154 [0,1,0,1,0,0|1,0,0]=3 30431 B14R1.3768 CC(NCCCCCCO)C1CCC1 34a_100016994624_100000766143 [0,1,0,1,0,0|1,0,0]=3 30432 B14R1.3768 CC(OCCCCCCF)C1CCC1 34a_100000766398_100015922095 [0,1,0,1,0,0|2,0,0]=4 30433 B14R1.3768 CC(OCCCCCCF)C1CCC1 7a_100000766398_100015922095 [0,1,0,1,0,0|2,0,0]=4 30434 B14R1.3768 CC(OCCCCCCO)C1CCC1 34a_100000766398_100000766143 [0,1,0,1,0,0|1,0,0]=3 30435 B14R1.3768 CC(OCCCCCCO)C1CCC1 7a_100000766398_100000766143 [0,1,0,1,0,0|1,0,0]=3 30436 B14R1.3768 CCCCCCCCC(=O)C1CCC1 1458a_100000209988_100000210759 [0,1,0,1,0,0|1,0,1]=4 30437 B14R1.3768 CCCCCCCCC(=O)C1CCC1 1458a_100000210188_100000749161 [0,1,0,1,0,0|1,0,1]=4 30438 B14R1.3768 CCCCCCCCC(=O)C1CCO1 1458a_100000089072_100000210759 [0,1,0,1,0,0|0,0,1]=3 30439 B14R1.3768 CCCCCCCCN(C)C1CCC1 2230a_100000758072_100000210759 [0,1,0,1,0,0|2,0,0]=4 30440 B14R1.3768 CCCCCCCCN(C)C1CCC1 269982a_100000207567_100000749161 [0,1,0,1,0,0|2,0,0]=4 30441 B14R1.3768 CCCCCCCCN(C)C1CCC1 269982a_100000758072_100000210759 [0,1,0,1,0,0|2,0,0]=4 30442 B14R1.3768 CCCCCCCCN(C)C1CCC1 270004a_100000207567_100000241760 [0,1,0,1,0,0|2,0,0]=4 30443 B14R1.3768 CCCCCCCCN(C)C1CCC1 34a_100000758072_100000210759 [0,1,0,1,0,0|2,0,0]=4 30444 B14R1.3768 CCCCCCCNC(=O)C1CCO1 11a_100000229938_100000089072 [0,1,0,1,0,0|1,0,1]=4 30445 B14R1.3768 CCCCCCCNC(=O)C1CCO1 1626a_100000229938_100000089072 [0,1,0,1,0,0|1,0,1]=4 30446 B14R1.3768 CCCCCCCNC(=O)C1CCO1 240690a_100000229938_100000089072 [0,1,0,1,0,0|1,0,1]=4 30447 B14R1.3768 CCCCCCCNC(=O)C1CCO1 527a_100000229938_100000089072 [0,1,0,1,0,0|1,0,1]=4 30448 B14R1.3768 CCCCCCCNC(C)C1CCC1 2230a_100016994624_100000210681 [0,1,0,1,0,0|2,0,0]=4 30449 B14R1.3768 CCCCCCCNC(C)C1CCC1 269862a_100000229938_100000760154 [0,1,0,1,0,0|2,0,0]=4 30450 B14R1.3768 CCCCCCCNC(C)C1CCC1 34a_100016994624_100000210614 [0,1,0,1,0,0|2,0,0]=4 30451 B14R1.3768 CCCCCCCOC(C)C1CCC1 34a_100000766398_100000210614 [0,1,0,1,0,0|2,0,0]=4 30452 B14R1.3768 CCCCCCCOC(C)C1CCC1 7a_100000766398_100000210614 [0,1,0,1,0,0|2,0,0]=4 30453 B14R1.3768 CN(CCCCCCCO)C1CCC1 2230a_100000758072_100000760002 [0,1,0,1,0,0|1,0,0]=3 30454 B14R1.3768 CN(CCCCCCCO)C1CCC1 269982a_100000758072_100000760002 [0,1,0,1,0,0|1,0,0]=3 30455 B14R1.3768 CN(CCCCCCCO)C1CCC1 34a_100000758072_100000760002 [0,1,0,1,0,0|1,0,0]=3 30456 B14R1.3768 CN(CCCCCCCO)C1COC1 2230a_100102693430_100000760002 [0,1,0,1,0,0|2,0,0]=4 30457 B14R1.3768 CN(CCCCCCCO)C1COC1 269982a_100102693430_100000760002 [0,1,0,1,0,0|2,0,0]=4 30458 B14R1.3768 COCCCCCCC(=O)C1CCO1 1458a_100000089072_100011998445 [0,1,0,1,0,0|1,0,1]=4 30459 B14R1.3768 N[C@H](COCCCCCO)C1COC1 34a_217856628679_100000746330 [0,1,0,1,0,0|2,0,0]=4 30460 B14R1.3768 O=C(CCCCCCCO)C1CCC1 1458a_100000209988_100000760002 [0,1,0,1,0,0|0,0,1]=3 30461 B14R1.3768 O=C(CCCCCCCO)C1CCC1 1458a_100011219782_100000749161 [0,1,0,1,0,0|0,0,1]=3 30462 B14R1.3768 O=C(CCCCCCCO)C1CCO1 1458a_100000089072_100000760002 [0,1,0,1,0,0|1,0,1]=4 30463 B14R1.3768 O=C(CCCCCCCO)C1COC1 1458a_100000758290_100000760002 [0,1,0,1,0,0|1,0,1]=4 30464 B14R1.3768 O=C(CCCCCCCO)C1COC1 1458a_100011219782_100000687716 [0,1,0,1,0,0|1,0,1]=4 30465 B14R1.3768 O=C(CCCCCCCO)N1CCC1 240690a_100000754969_100011219782 [0,1,0,1,0,0|1,0,1]=4 30466 B14R1.3768 O=C(CNCCCCCO)C1CCC1 2230a_100000762737_100000686122 [0,1,0,1,0,0|1,0,1]=4 30467 B14R1.3768 O=C(CNCCCCCO)C1CCC1 34a_100000762737_100000686122 [0,1,0,1,0,0|1,0,1]=4 30468 B14R1.3768 O=C(CSCCCCCO)C1CCC1 62a_100000686122_100000746330 [0,1,0,1,0,0|1,0,1]=4 30469 B14R1.3768 O=C(CSCCCCCO)C1CCC1 62a_100000746330_100000686122 [0,1,0,1,0,0|1,0,1]=4 30470 B14R1.3768 O=C(NCCCCCCO)C1CCC1 240690a_100000686447_100000209988 [0,1,0,1,0,0|1,0,1]=4 30471 B14R1.3768 O=C(NCCCCCCO)C1CCC1 527a_100000686447_100000209988 [0,1,0,1,0,0|1,0,1]=4 30472 B14R1.3770 CC(CC1CC1)NCCCCCCO 270004a_100000686447_200000686933 [0,1,0,1,0,0|1,0,0]=3 30473 B14R1.3770 CCCCCCCCC(=O)CC1CC1 1458a_100000210188_100000742324 [0,1,0,1,0,0|1,0,1]=4 30474 B14R1.3770 CCCCCCCCC(=O)CC1CC1 1458a_100000738066_100000210759 [0,1,0,1,0,0|1,0,1]=4 30475 B14R1.3770 CCCCCCCCC(=O)CC1CO1 1458a_100000210188_100011216344 [0,1,0,1,0,0|0,0,1]=3 30476 B14R1.3770 CCCCCCCCC(=O)CC1CS1 1458a_100000210188_100000031435 [0,1,0,1,0,0|0,1,1]=4 30477 B14R1.3770 CCCCCCCCC(=O)C[C@@H]1CO1 1458a_100000210188_100000745022 [0,1,0,1,0,0|0,0,1]=3 30478 B14R1.3770 CCCCCCCCC(C)OC1CC1 34a_100000210740_100000211595 [0,1,0,1,0,0|2,0,0]=4 30479 B14R1.3770 CCCCCCCCN(C)CC1CC1 2230a_100000207567_100000742324 [0,1,0,1,0,0|2,0,0]=4 30480 B14R1.3770 CCCCCCCCN(C)CC1CC1 2230a_100000741881_100000210759 [0,1,0,1,0,0|2,0,0]=4 30481 B14R1.3770 CCCCCCCCN(C)CC1CC1 269982a_100000207567_100000756562 [0,1,0,1,0,0|2,0,0]=4 30482 B14R1.3770 CCCCCCCCN(C)CC1CC1 269982a_100000741881_100000210759 [0,1,0,1,0,0|2,0,0]=4 30483 B14R1.3770 CCCCCCCCN(C)CC1CO1 2230a_100000207567_100011216344 [0,1,0,1,0,0|1,0,0]=3 30484 B14R1.3770 CCCCCCCCN(C)CC1CO1 269982a_100000207567_102125554688 [0,1,0,1,0,0|1,0,0]=3 30485 B14R1.3770 CCCCCCCCN(C)CC1CS1 269982a_100000207567_100000031435 [0,1,0,1,0,0|1,1,0]=4 30486 B14R1.3770 CCCCCCCCN(C)C[C@@H]1CO1 269982a_100000207567_100000745022 [0,1,0,1,0,0|1,0,0]=3 30487 B14R1.3770 CCCCCCCNC(C)CC1CC1 270004a_100000229938_200000686933 [0,1,0,1,0,0|2,0,0]=4 30488 B14R1.3770 CN(CCCCCCCO)CC1CC1 2230a_100000741881_100000760002 [0,1,0,1,0,0|1,0,0]=3 30489 B14R1.3770 CN(CCCCCCCO)CC1CC1 269982a_100000741881_100000760002 [0,1,0,1,0,0|1,0,0]=3 30490 B14R1.3770 O=C(CC1CC1)NCCCCCCO 240690a_100000686447_100000738066 [0,1,0,1,0,0|1,0,1]=4 30491 B14R1.3770 O=C(CC1CC1)NCCCCCCO 527a_100000686447_100000738066 [0,1,0,1,0,0|1,0,1]=4 30492 B14R1.3770 O=C(CCCCCCCO)CC1CC1 1458a_100000738066_100000760002 [0,1,0,1,0,0|0,0,1]=3 30493 B14R1.3770 O=C(CCCCCCCO)CC1CC1 1458a_100011219782_100000742324 [0,1,0,1,0,0|0,0,1]=3 30494 B14R1.3770 O=C(CCCCCCCO)CC1CO1 1458a_100011219782_100011216344 [0,1,0,1,0,0|1,0,1]=4 30495 B14R1.3770 O=C(CCCCCCCO)CC1CS1 1458a_100011219782_100000031435 [0,1,0,1,0,0|1,0,1]=4 30496 B14R1.3770 O=C(CCCCCCCO)C[C@@H]1CO1 1458a_100011219782_100000745022 [0,1,0,1,0,0|1,0,1]=4 30497 B14R1.3770 O=C(CCCCCCCO)NC1CC1 240690a_100000212008_100011219782 [0,1,0,1,0,0|1,0,1]=4 30498 B14R1.4731 CC1(CCCC1)OCCCCCCF 34a_100000751722_100015922095 [0,1,0,1,0,0|2,0,0]=4 30499 B14R1.4731 CC1(CCCC1)OCCCCCCF 7a_100000751722_100015922095 [0,1,0,1,0,0|2,0,0]=4 30500 B14R1.4731 CC1(CCCC1)OCCCCCCO 34a_100000751722_100000766143 [0,1,0,1,0,0|1,0,0]=3 30501 B14R1.4731 CC1(CCCC1)OCCCCCCO 7a_100000751722_100000766143 [0,1,0,1,0,0|1,0,0]=3 30502 B14R1.4731 CC1(CCOC1)NCCCCCCO 2230a_100000693475_100000766143 [0,1,0,1,0,0|2,0,0]=4 30503 B14R1.4731 CCCCCCCOC1(CCCC1)C 34a_100000751722_100000210614 [0,1,0,1,0,0|2,0,0]=4 30504 B14R1.4731 CCCCCCCOC1(CCCC1)C 7a_100000751722_100000210614 [0,1,0,1,0,0|2,0,0]=4 30505 B14R1.4731 CCCCCCNCC1(CCCC1)O 2230a_100000737848_100000210314 [0,1,0,1,0,0|2,0,0]=4 30506 B14R1.4731 CCCCCCNCC1(OCCO1)C 2230a_100000691740_100000210314 [0,1,0,1,0,0|2,0,0]=4 30507 B14R1.4731 CCCCCCOCC1(CCCC1)N 34a_100000749328_100000210314 [0,1,0,1,0,0|2,0,0]=4 30508 B14R1.4731 CCCCCCOC[C@@]1(CCCN1)C 34a_100016195882_100000210314 [0,1,0,1,0,0|2,0,0]=4 30509 B14R1.4731 CCCCCCSCC1(OCCO1)C 62a_100000210314_100009818610 [0,1,0,1,0,0|2,0,0]=4 30510 B14R1.4731 CCCCCCSCC1(OCCO1)C 62a_100009818610_100000210757 [0,1,0,1,0,0|2,0,0]=4 30511 B14R1.4731 CCCCCNCCC1(CCCC1)O 34a_100000719956_100000718602 [0,1,0,1,0,0|2,0,0]=4 30512 B14R1.4731 CCCCCNCCC1(OCCO1)C 2230a_100000073055_100000210326 [0,1,0,1,0,0|2,0,0]=4 30513 B14R1.4731 CCCCCNCCC1(OCCO1)C 2230a_100000209983_100000758764 [0,1,0,1,0,0|2,0,0]=4 30514 B14R1.4731 CCCCCOCCC1(OCCO1)C 34a_100000210253_100000758764 [0,1,0,1,0,0|2,0,0]=4 30515 B14R1.4731 CCCCCOCCC1(OCCO1)C 7a_100000210253_100000758764 [0,1,0,1,0,0|2,0,0]=4 30516 B14R1.4731 CCCCCOCCC1(OCCO1)C 7a_100009861814_100000210326 [0,1,0,1,0,0|2,0,0]=4 30517 B14R1.4731 CCCCCSCCC1(OCCO1)C 62a_100000210326_100000758764 [0,1,0,1,0,0|2,0,0]=4 30518 B14R1.4731 CCCCCSCCC1(OCCO1)C 62a_100000758764_100000210326 [0,1,0,1,0,0|2,0,0]=4 30519 B14R1.4731 CCCCNCCCC1(OCCO1)C 2230a_100000102301_100000037737 [0,1,0,1,0,0|2,0,0]=4 30520 B14R1.4731 CCCCNCCCC1(OCCO1)C 7a_106832991798_100000037737 [0,1,0,1,0,0|2,0,0]=4 30521 B14R1.4731 CCCCOCCCC1(OCCO1)C 34a_100000210227_100000037737 [0,1,0,1,0,0|2,0,0]=4 30522 B14R1.4731 CCCCOCCCC1(OCCO1)C 7a_100000210227_100000037737 [0,1,0,1,0,0|2,0,0]=4 30523 B14R1.4731 CCCCSCCCC1(OCCO1)C 62a_100000037737_100000210210 [0,1,0,1,0,0|2,0,0]=4 30524 B14R1.4731 CCCCSCCCC1(OCCO1)C 62a_100000210211_100000037737 [0,1,0,1,0,0|2,0,0]=4 30525 B14R1.4731 C[C@]1(CCCN1)COCCCCCO 34a_100016195882_100000746330 [0,1,0,1,0,0|2,0,0]=4 30526 B14R1.4731 NC1(CCCC1)COCCCCCF 34a_100000749328_100000729378 [0,1,0,1,0,0|2,0,0]=4 30527 B14R1.4731 NC1(CCCC1)COCCCCCO 34a_100000749328_100000746330 [0,1,0,1,0,0|1,0,0]=3 30528 B14R1.4731 NC1(CCCC1)COCCOCCO 34a_100000749328_100000692535 [0,1,0,1,0,0|2,0,0]=4 30529 B14R1.4731 OC1(CCCC1)CCNCCCCF 34a_100000719956_100000729493 [0,1,0,1,0,0|2,0,0]=4 30530 B14R1.4731 OC1(CCCC1)CNCCCCCF 2230a_100000737848_100000729378 [0,1,0,1,0,0|2,0,0]=4 30531 B14R1.4731 OCCCCCNCC1(CCCC1)O 2230a_100000737848_100000746330 [0,1,0,1,0,0|1,0,0]=3 30532 B14R1.4731 OCCCCNCCC1(CCCC1)O 34a_100000719956_100011216708 [0,1,0,1,0,0|1,0,0]=3 30533 B14R1.4731 OCCOCCNCC1(CCCC1)O 2230a_100000737848_100011215305 [0,1,0,1,0,0|2,0,0]=4 30534 B14R1.4734 CCC1CN(C1)CCCCCCCO 2230a_100015205115_100000760002 [0,1,0,1,0,0|1,0,0]=3 30535 B14R1.4734 CCC1CN(C1)CCCCCCCO 269982a_100015205115_100000760002 [0,1,0,1,0,0|1,0,0]=3 30536 B14R1.4734 CCCCCCCCN1CC(C1)CC 2230a_100015205115_100000210759 [0,1,0,1,0,0|2,0,0]=4 30537 B14R1.4734 CCCCCCCCN1CC(C1)CC 269982a_100015205115_100000210759 [0,1,0,1,0,0|2,0,0]=4 30538 B14R1.4734 CCCCCCCCN1CC(C1)CF 269982a_100010363649_100000210759 [0,1,0,1,0,0|2,0,0]=4 30539 B14R1.4734 CCCCCCCCN1CC(C1)CF 34a_100010363649_100000210759 [0,1,0,1,0,0|2,0,0]=4 30540 B14R1.4734 CCCCCCCCN1CC(C1)CO 269982a_100016987283_100000210759 [0,1,0,1,0,0|1,0,0]=3 30541 B14R1.4734 CCCCCCCCN1CC(C1)CO 34a_100016987283_100000210759 [0,1,0,1,0,0|1,0,0]=3 30542 B14R1.4734 CCCCCCCNC1CC(C1)CO 270004a_100000229938_100000101936 [0,1,0,1,0,0|1,0,0]=3 30543 B14R1.4734 CCCCCCCSC1CC(C1)CO 62a_100000210614_100009874164 [0,1,0,1,0,0|1,0,0]=3 30544 B14R1.4734 CCCCCCCSC1CC(C1)CO 62a_100009874164_100000210316 [0,1,0,1,0,0|1,0,0]=3 30545 B14R1.4734 CCCCOCCSC1CC(C1)CO 62a_100000743108_100009874164 [0,1,0,1,0,0|2,0,0]=4 30546 B14R1.4734 CCCCOCCSC1CC(C1)CO 62a_100009874164_100000743108 [0,1,0,1,0,0|2,0,0]=4 30547 B14R1.4734 CCCCSCCNC1CC(C1)CO 270004a_100025743550_100000101936 [0,1,0,1,0,0|2,0,0]=4 30548 B14R1.4734 CCCOCCCNC1CC(C1)CO 270004a_100011217757_100000101936 [0,1,0,1,0,0|2,0,0]=4 30549 B14R1.4734 CCN1CC(C1)NCCCCCCO 2230a_200015199589_100000766143 [0,1,0,1,0,0|2,0,0]=4 30550 B14R1.4734 COC1CN(C1)CCCCCCCO 269982a_100000755009_100000760002 [0,1,0,1,0,0|2,0,0]=4 30551 B14R1.4734 COCCCCCCN1CC(C1)CO 269982a_100016987283_100011998445 [0,1,0,1,0,0|2,0,0]=4 30552 B14R1.4734 COCCCCCCN1CC(C1)CO 34a_100016987283_100011998445 [0,1,0,1,0,0|2,0,0]=4 30553 B14R1.4734 COCCCCCNC1CC(C1)CO 270004a_100000747528_100000101936 [0,1,0,1,0,0|2,0,0]=4 30554 B14R1.4734 CO[C@H]1C[C@@H](C1)NCCCCCCO 2230a_100121570643_100000766143 [0,1,0,1,0,0|2,0,0]=4 30555 B14R1.4734 CSC1CN(C1)CCCCCCCO 269982a_100016990038_100000760002 [0,1,0,1,0,0|2,0,0]=4 30556 B14R1.4734 OCC1CC(C1)SCCCCCCF 62a_100009874164_100015922095 [0,1,0,1,0,0|2,0,0]=4 30557 B14R1.4734 OCC1CC(C1)SCCCCCCF 62a_100015922095_100009874164 [0,1,0,1,0,0|2,0,0]=4 30558 B14R1.4734 OCCCCCCCN1CC(C1)CF 269982a_100010363649_100000760002 [0,1,0,1,0,0|2,0,0]=4 30559 B14R1.4734 OCCCCCCCN1CC(C1)CF 34a_100010363649_100000760002 [0,1,0,1,0,0|2,0,0]=4 30560 B14R1.4734 OCCCCCCCN1CC(C1)CO 269982a_100016987283_100000760002 [0,1,0,1,0,0|2,0,0]=4 30561 B14R1.4734 OCCCCCCCN1CC(C1)CO 34a_100016987283_100000760002 [0,1,0,1,0,0|2,0,0]=4 30562 B14R1.4734 OCCCCCCNC1CC(C1)CO 270004a_100000686447_100000101936 [0,1,0,1,0,0|2,0,0]=4 30563 B14R1.4734 OCCCCCCSC1CC(C1)CO 62a_100000766143_100009874164 [0,1,0,1,0,0|2,0,0]=4 30564 B14R1.4734 OCCCCCCSC1CC(C1)CO 62a_100009874164_100000766143 [0,1,0,1,0,0|2,0,0]=4 30565 B14R1.16946 CC1CC1C(=O)CCCCCCCO 1458a_100000211227_100000760002 [0,1,0,1,0,0|0,0,1]=3 30566 B14R1.16946 CC1CC1C(=O)NCCCCCCO 527a_100000686447_100000211227 [0,1,0,1,0,0|1,0,1]=4 30567 B14R1.16946 CCCCCCCCC(=O)C1CC1C 1458a_100000211227_100000210759 [0,1,0,1,0,0|1,0,1]=4 30568 B14R1.16946 CCCCCCCCC(=O)[C@@H]1C[C@@H]1F 1458a_100015396687_100000210759 [0,1,0,1,0,0|1,0,1]=4 30569 B14R1.16946 O=C(CCCCCCCO)[C@@H]1C[C@@H]1F 1458a_100015396687_100000760002 [0,1,0,1,0,0|1,0,1]=4 30570 B14R1.9 CC1CCCC(C1C)NCCCCF 2230a_100000211273_100000729493 [0,1,0,1,0,0|2,0,0]=4 30571 B14R1.9 CC1CCCC(C1C)NCCCCF 34a_100000211273_100000729493 [0,1,0,1,0,0|2,0,0]=4 30572 B14R1.9 CC1CCCC(C1C)NCCCCO 2230a_100000211273_100000210776 [0,1,0,1,0,0|1,0,0]=3 30573 B14R1.9 CC1CCCC(C1C)NCCCCO 34a_100000211273_100011216708 [0,1,0,1,0,0|1,0,0]=3 30574 B14R1.9 CC1CCCC(C1C)OCCCCF 34a_100011217532_100000729493 [0,1,0,1,0,0|2,0,0]=4 30575 B14R1.9 CC1CCCC(C1C)OCCCCF 7a_100011217532_100000729493 [0,1,0,1,0,0|2,0,0]=4 30576 B14R1.9 CC1CCCC(C1C)OCCCCO 34a_100011217532_100011216708 [0,1,0,1,0,0|1,0,0]=3 30577 B14R1.9 CC1CCCC(C1C)OCCCCO 7a_100011217532_100000210776 [0,1,0,1,0,0|1,0,0]=3 30578 B14R1.9 CCCCCNC1CCCC(C1C)C 2230a_100000211273_100000210326 [0,1,0,1,0,0|2,0,0]=4 30579 B14R1.9 CCCCCNC1CCCC(C1C)C 34a_100000211273_100000718602 [0,1,0,1,0,0|2,0,0]=4 30580 B14R1.9 CCCCCOC1CCCC(C1C)C 34a_100011217532_100000718602 [0,1,0,1,0,0|2,0,0]=4 30581 B14R1.9 CCCCCOC1CCCC(C1C)C 7a_100011217532_100000210326 [0,1,0,1,0,0|2,0,0]=4 30582 B14R1.14 C=C1CCC(CC1)COCCCCO 34a_100000074039_100011216708 [0,1,0,1,0,0|1,0,1]=4 30583 B14R1.14 C=C1CCC(CC1)NCCCCCO 270004a_100000762737_100010272673 [0,1,0,1,0,0|1,0,1]=4 30584 B14R1.14 C=C1CCN(CC1)CCCCCCO 2230a_100000752442_100000766143 [0,1,0,1,0,0|1,0,1]=4 30585 B14R1.14 C=C1CCN(CC1)CCCCCCO 269982a_100000752442_100000766143 [0,1,0,1,0,0|1,0,1]=4 30586 B14R1.14 C=C1CCN(CC1)CCCCCCO 34a_100000752442_100000766143 [0,1,0,1,0,0|1,0,1]=4 30587 B14R1.14 CC1CCC(CC1)CNCCCCF 2230a_103436935547_100000729493 [0,1,0,1,0,0|2,0,0]=4 30588 B14R1.14 CC1CCC(CC1)CNCCCCF 34a_103436935547_100000729493 [0,1,0,1,0,0|2,0,0]=4 30589 B14R1.14 CC1CCC(CC1)CNCCCCO 2230a_103436935547_100000210776 [0,1,0,1,0,0|1,0,0]=3 30590 B14R1.14 CC1CCC(CC1)CNCCCCO 34a_103436935547_100011216708 [0,1,0,1,0,0|1,0,0]=3 30591 B14R1.14 CC1CCC(CC1)COCCCCF 34a_100000701341_100000729493 [0,1,0,1,0,0|2,0,0]=4 30592 B14R1.14 CC1CCC(CC1)COCCCCO 34a_100000701341_100011216708 [0,1,0,1,0,0|1,0,0]=3 30593 B14R1.14 CC1CCC(CC1)NCCCCCO 270004a_100000762737_100000185489 [0,1,0,1,0,0|1,0,0]=3 30594 B14R1.14 CC1CCC(CC1)NCCCCCO 34a_100000762737_200011216234 [0,1,0,1,0,0|1,0,0]=3 30595 B14R1.14 CC1CCC(CC1)NCCOCCO 270004a_100000211614_100000185489 [0,1,0,1,0,0|2,0,0]=4 30596 B14R1.14 CC1CCC(CC1)NCCOCCO 34a_100000211614_200011216234 [0,1,0,1,0,0|2,0,0]=4 30597 B14R1.14 CC1CCC(CC1)NCCSCCO 270004a_100011219999_100000185489 [0,1,0,1,0,0|2,0,0]=4 30598 B14R1.14 CC1CCC(CC1)OCCCCCBr 34a_100000746331_200011216234 [0,1,0,1,0,0|2,0,0]=4 30599 B14R1.14 CC1CCC(CC1)OCCCCCCl 34a_100000746330_200011216234 [0,1,0,1,0,0|2,0,0]=4 30600 B14R1.14 CC1CCC(CC1)OCCCCCF 34a_100000210714_100000729378 [0,1,0,1,0,0|2,0,0]=4 30601 B14R1.14 CC1CCC(CC1)OCCCCCF 7a_100000210714_100000729378 [0,1,0,1,0,0|2,0,0]=4 30602 B14R1.14 CC1CCC(CC1)OCCCCCI 34a_200012148887_200011216234 [0,1,0,1,0,0|2,0,0]=4 30603 B14R1.14 CC1CCC(CC1)OCCCCCN 34a_100000762737_200011216234 [0,1,0,1,0,0|2,0,0]=4 30604 B14R1.14 CC1CCC(CC1)OCCCCCO 34a_100000210714_100000746330 [0,1,0,1,0,0|1,0,0]=3 30605 B14R1.14 CC1CCC(CC1)OCCCCCO 7a_100000210714_100000746330 [0,1,0,1,0,0|1,0,0]=3 30606 B14R1.14 CC1CCC(CC1)OCCOCCO 34a_100000210714_100000692535 [0,1,0,1,0,0|2,0,0]=4 30607 B14R1.14 CC1CCC(CC1)OCCOCCO 7a_100000210714_100011215305 [0,1,0,1,0,0|2,0,0]=4 30608 B14R1.14 CC1CCC(CC1)SCCCCCF 62a_100000729378_200011216234 [0,1,0,1,0,0|2,0,0]=4 30609 B14R1.14 CC1CCC(CC1)SCCCCCO 62a_100000746330_200011216234 [0,1,0,1,0,0|1,0,0]=3 30610 B14R1.14 CC1CCC(CC1)SCCOCCO 62a_100011215305_200011216234 [0,1,0,1,0,0|2,0,0]=4 30611 B14R1.14 CC1CCN(CC1)CCCCCCF 2230a_100000188429_100015922095 [0,1,0,1,0,0|2,0,0]=4 30612 B14R1.14 CC1CCN(CC1)CCCCCCF 269982a_100000188429_100015922095 [0,1,0,1,0,0|2,0,0]=4 30613 B14R1.14 CC1CCN(CC1)CCCCCCF 34a_100000188429_100015922095 [0,1,0,1,0,0|2,0,0]=4 30614 B14R1.14 CC1CCN(CC1)CCCCCCO 2230a_100000188429_100000766143 [0,1,0,1,0,0|1,0,0]=3 30615 B14R1.14 CC1CCN(CC1)CCCCCCO 269982a_100000188429_100000766143 [0,1,0,1,0,0|1,0,0]=3 30616 B14R1.14 CC1CCN(CC1)CCCCCCO 34a_100000188429_100000766143 [0,1,0,1,0,0|1,0,0]=3 30617 B14R1.14 CC1CCN(CC1)CCCOCCO 34a_200000213400_100000211926 [0,1,0,1,0,0|2,0,0]=4 30618 B14R1.14 CCCCCCCN1CCC(CC1)C 2230a_100000188429_100000210681 [0,1,0,1,0,0|2,0,0]=4 30619 B14R1.14 CCCCCCCN1CCC(CC1)C 269982a_100000188429_100000210681 [0,1,0,1,0,0|2,0,0]=4 30620 B14R1.14 CCCCCCCN1CCC(CC1)C 34a_100000188429_100000210614 [0,1,0,1,0,0|2,0,0]=4 30621 B14R1.14 CCCCCCCN1CCC(CC1)F 2230a_100015193889_100000210681 [0,1,0,1,0,0|2,0,0]=4 30622 B14R1.14 CCCCCCCN1CCC(CC1)F 269982a_100015193889_100000210681 [0,1,0,1,0,0|2,0,0]=4 30623 B14R1.14 CCCCCCCN1CCC(CC1)F 34a_100015193889_100000210614 [0,1,0,1,0,0|2,0,0]=4 30624 B14R1.14 CCCCCCCN1CCC(CC1)O 2230a_100025773856_100000210681 [0,1,0,1,0,0|2,0,0]=4 30625 B14R1.14 CCCCCCCN1CCC(CC1)O 269982a_100025773856_100000210681 [0,1,0,1,0,0|2,0,0]=4 30626 B14R1.14 CCCCCCNC1CCC(CC1)C 270004a_100000210581_100000185489 [0,1,0,1,0,0|2,0,0]=4 30627 B14R1.14 CCCCCCNC1CCC(CC1)O 270004a_100000210581_100000764474 [0,1,0,1,0,0|2,0,0]=4 30628 B14R1.14 CCCCCCN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100000210314 [0,1,0,1,0,0|2,0,0]=4 30629 B14R1.14 CCCCCCN[C@H]1CC[C@@H](CC1)C 34a_100020625639_100000210314 [0,1,0,1,0,0|2,0,0]=4 30630 B14R1.14 CCCCCCOC1CCC(CC1)C 34a_100000210259_200011216234 [0,1,0,1,0,0|2,0,0]=4 30631 B14R1.14 CCCCCCOC1CCC(CC1)C 34a_100000210714_100000210314 [0,1,0,1,0,0|2,0,0]=4 30632 B14R1.14 CCCCCCOC1CCC(CC1)C 7a_100000210714_100000210314 [0,1,0,1,0,0|2,0,0]=4 30633 B14R1.14 CCCCCCO[C@H]1CC[C@H](CC1)N 34a_100020628982_100000210314 [0,1,0,1,0,0|2,0,0]=4 30634 B14R1.14 CCCCCCSC1CCC(CC1)C 62a_100000210314_200011216234 [0,1,0,1,0,0|2,0,0]=4 30635 B14R1.14 CCCCCNCC1CCC(CC1)C 2230a_103436935547_100000210326 [0,1,0,1,0,0|2,0,0]=4 30636 B14R1.14 CCCCCNCC1CCC(CC1)C 34a_103436935547_100000718602 [0,1,0,1,0,0|2,0,0]=4 30637 B14R1.14 CCCCCOCC1CCC(CC1)C 34a_100000701341_100000718602 [0,1,0,1,0,0|2,0,0]=4 30638 B14R1.14 CCCCCOC[C@H]1CC[C@@H](CC1)N 34a_100009821084_100000718602 [0,1,0,1,0,0|2,0,0]=4 30639 B14R1.14 CCCCNCCC1CCC(CC1)O 34a_200011935226_100000210210 [0,1,0,1,0,0|2,0,0]=4 30640 B14R1.14 CCCCOCCC1CCC(CC1)N 34a_100000070672_100000210210 [0,1,0,1,0,0|2,0,0]=4 30641 B14R1.14 CN1CCC(CC1)CCCOCCO 34a_100000083870_100000211926 [0,1,0,1,0,0|2,0,0]=4 30642 B14R1.14 CN1CCC(CC1)CCCOCCO 7a_100000083870_100000211926 [0,1,0,1,0,0|2,0,0]=4 30643 B14R1.14 CN1CCC(CC1)CSCCCCO 62a_100000210776_100015183002 [0,1,0,1,0,0|2,0,0]=4 30644 B14R1.14 CN1CCC(CC1)CSCCCCO 62a_100015183002_100000210776 [0,1,0,1,0,0|2,0,0]=4 30645 B14R1.14 CN1CCC(CC1)NCCCCCO 270004a_100000762737_100000210137 [0,1,0,1,0,0|2,0,0]=4 30646 B14R1.14 CN1CCC(CC1)SCCCCCO 62a_100000746330_100011215917 [0,1,0,1,0,0|2,0,0]=4 30647 B14R1.14 CN1CCN(CC1)CCCCCCO 2230a_100000188432_100000766143 [0,1,0,1,0,0|2,0,0]=4 30648 B14R1.14 CN1CCN(CC1)CCCCCCO 269982a_100000188432_100000766143 [0,1,0,1,0,0|2,0,0]=4 30649 B14R1.14 C[C@H]1CC[C@@H](CC1)NCCCCCF 2230a_100020625639_100000729378 [0,1,0,1,0,0|2,0,0]=4 30650 B14R1.14 C[C@H]1CC[C@@H](CC1)NCCCCCF 34a_100020625639_100000729378 [0,1,0,1,0,0|2,0,0]=4 30651 B14R1.14 C[C@H]1CC[C@@H](CC1)NCCCCCO 2230a_100020625639_100000746330 [0,1,0,1,0,0|1,0,0]=3 30652 B14R1.14 C[C@H]1CC[C@@H](CC1)NCCCCCO 34a_100020625639_100000746330 [0,1,0,1,0,0|1,0,0]=3 30653 B14R1.14 C[C@H]1CC[C@@H](CC1)NCCOCCO 2230a_100020625639_100011215305 [0,1,0,1,0,0|2,0,0]=4 30654 B14R1.14 C[C@H]1CC[C@@H](CC1)NCCOCCO 34a_100020625639_100000692535 [0,1,0,1,0,0|2,0,0]=4 30655 B14R1.14 FCCCCCCN1CCC(CC1)F 2230a_100015193889_100015922095 [0,1,0,1,0,0|2,0,0]=4 30656 B14R1.14 FCCCCCCN1CCC(CC1)F 269982a_100015193889_100015922095 [0,1,0,1,0,0|2,0,0]=4 30657 B14R1.14 FCCCCCCN1CCC(CC1)F 34a_100015193889_100015922095 [0,1,0,1,0,0|2,0,0]=4 30658 B14R1.14 NC1CCC(CC1)CCOCCCF 34a_100000070672_100011934791 [0,1,0,1,0,0|2,0,0]=4 30659 B14R1.14 NC1CCC(CC1)CCOCCCO 34a_100000070672_100000230001 [0,1,0,1,0,0|1,0,0]=3 30660 B14R1.14 N[C@H]1CC[C@@H](CC1)COCCCCF 34a_100009821084_100000729493 [0,1,0,1,0,0|2,0,0]=4 30661 B14R1.14 N[C@H]1CC[C@@H](CC1)COCCCCO 34a_100009821084_100011216708 [0,1,0,1,0,0|1,0,0]=3 30662 B14R1.14 N[C@H]1CC[C@H](CC1)OCCCCCF 34a_100020628982_100000729378 [0,1,0,1,0,0|2,0,0]=4 30663 B14R1.14 N[C@H]1CC[C@H](CC1)OCCCCCO 34a_100020628982_100000746330 [0,1,0,1,0,0|1,0,0]=3 30664 B14R1.14 N[C@H]1CC[C@H](CC1)OCCOCCO 34a_100020628982_100000692535 [0,1,0,1,0,0|2,0,0]=4 30665 B14R1.14 O=C1CCC(CC1)COCCCCO 34a_100000062911_100011216708 [0,1,0,1,0,0|1,0,1]=4 30666 B14R1.14 O=C1CCC(CC1)OCCCCCO 34a_100000764474_100000746330 [0,1,0,1,0,0|1,0,1]=4 30667 B14R1.14 O=C1CCC(CC1)OCCCCCO 7a_100000764474_100000746330 [0,1,0,1,0,0|1,0,1]=4 30668 B14R1.14 O=S1CCN(CC1)CCCCCCO 2230a_100000752083_100000766143 [0,1,0,1,0,0|2,0,0]=4 30669 B14R1.14 O=S1CCN(CC1)CCCCCCO 269982a_100000752083_100000766143 [0,1,0,1,0,0|2,0,0]=4 30670 B14R1.14 OC1CCC(CC1)CCNCCCF 34a_200011935226_100011934791 [0,1,0,1,0,0|2,0,0]=4 30671 B14R1.14 OC1CCN(CC1)CCCCCCF 2230a_100025773856_100015922095 [0,1,0,1,0,0|2,0,0]=4 30672 B14R1.14 OC1CCN(CC1)CCCCCCF 269982a_100025773856_100015922095 [0,1,0,1,0,0|2,0,0]=4 30673 B14R1.14 OCCCCCCN1CCC(CC1)F 2230a_100015193889_100000766143 [0,1,0,1,0,0|1,0,0]=3 30674 B14R1.14 OCCCCCCN1CCC(CC1)F 269982a_100015193889_100000766143 [0,1,0,1,0,0|1,0,0]=3 30675 B14R1.14 OCCCCCCN1CCC(CC1)F 34a_100015193889_100000766143 [0,1,0,1,0,0|1,0,0]=3 30676 B14R1.14 OCCCCCCN1CCC(CC1)O 2230a_100025773856_100000766143 [0,1,0,1,0,0|1,0,0]=3 30677 B14R1.14 OCCCCCCN1CCC(CC1)O 269982a_100025773856_100000766143 [0,1,0,1,0,0|1,0,0]=3 30678 B14R1.14 OCCCCCNC1CCC(CC1)O 270004a_100000762737_100000764474 [0,1,0,1,0,0|1,0,0]=3 30679 B14R1.14 OCCCNCCC1CCC(CC1)O 34a_200011935226_100000230001 [0,1,0,1,0,0|1,0,0]=3 30680 B14R1.14 OCCOCCNC1CCC(CC1)O 270004a_100000211614_100000764474 [0,1,0,1,0,0|2,0,0]=4 30681 B14R1.14 OCCSCCNC1CCC(CC1)O 270004a_100011219999_100000764474 [0,1,0,1,0,0|2,0,0]=4 30682 B14R1.109 CCC(C)CCNC1CCCC1CC 269862a_100020591266_100000749056 [0,1,0,1,0,0|2,0,0]=4 30683 B14R1.109 CCC(C)CCNC1CCCC1CC 270004a_100020591266_100000749056 [0,1,0,1,0,0|2,0,0]=4 30684 B14R1.109 CCC1CCCC1NCCC(C)CO 269862a_106354213184_100000749056 [0,1,0,1,0,0|1,0,0]=3 30685 B14R1.109 CCC1CCCC1NCCC(C)CO 270004a_106354213184_100000749056 [0,1,0,1,0,0|1,0,0]=3 30686 B14R1.109 CCN(C)CCCN1CCC[C@@H]1CO 2230a_100000745186_100015186262 [0,1,0,1,0,0|2,0,0]=4 30687 B14R1.109 CCN(C)CCCN1CCC[C@@H]1CO 269982a_100000745186_100015186262 [0,1,0,1,0,0|2,0,0]=4 30688 B14R1.109 CCN1CCCC1CNCC(O)CO 2230a_100000211693_100011219619 [0,1,0,1,0,0|2,0,0]=4 30689 B14R1.109 CCN1CCCC1CNC[C@@H](C)CO 2230a_100000211693_100000059175 [0,1,0,1,0,0|2,0,0]=4 30690 B14R1.109 CCN1CCCC1CNC[C@@H](O)CO 2230a_100000211693_100009815848 [0,1,0,1,0,0|2,0,0]=4 30691 B14R1.109 CCN1CCC[C@@H]1COCC(O)CO 34a_100011739246_100011219619 [0,1,0,1,0,0|2,0,0]=4 30692 B14R1.109 CCN1CCC[C@@H]1COCC(O)CO 7a_100011739246_100011219619 [0,1,0,1,0,0|2,0,0]=4 30693 B14R1.109 CCN1CCC[C@@H]1COC[C@@H](C)CO 34a_100011739246_100000059175 [0,1,0,1,0,0|2,0,0]=4 30694 B14R1.109 CCN1CCC[C@@H]1COC[C@@H](C)CO 7a_100011739246_100000059175 [0,1,0,1,0,0|2,0,0]=4 30695 B14R1.109 CCN1CCC[C@@H]1COC[C@@H](O)CO 34a_100011739246_100009815848 [0,1,0,1,0,0|2,0,0]=4 30696 B14R1.109 CCN1CCC[C@@H]1COC[C@@H](O)CO 7a_100011739246_100009815848 [0,1,0,1,0,0|2,0,0]=4 30697 B14R1.228 CCC1CCCC(C1)NCCCCO 270004a_100000750430_100000756783 [0,1,0,1,0,0|1,0,0]=3 30698 B14R1.228 CCC1CCCC(C1)OCCCCF 7a_100011985506_100000729493 [0,1,0,1,0,0|2,0,0]=4 30699 B14R1.228 CCC1CCCC(C1)OCCCCO 7a_100011985506_100000210776 [0,1,0,1,0,0|1,0,0]=3 30700 B14R1.228 CCC1CN(CCO1)CCCCCO 2230a_100000736320_100000746330 [0,1,0,1,0,0|2,0,0]=4 30701 B14R1.228 CCC1CN(CCO1)CCCCCO 269982a_100000736320_100000746330 [0,1,0,1,0,0|2,0,0]=4 30702 B14R1.228 CCC1CN(CCO1)CCCCCO 34a_100000736320_100000746330 [0,1,0,1,0,0|2,0,0]=4 30703 B14R1.228 CCCCCCN1CCCC(C1)CF 2230a_100016992999_100000210314 [0,1,0,1,0,0|2,0,0]=4 30704 B14R1.228 CCCCCCN1CCCC(C1)CF 269982a_100016992999_100000210757 [0,1,0,1,0,0|2,0,0]=4 30705 B14R1.228 CCCCCCN1CCCC(C1)CF 34a_100016992999_100000210314 [0,1,0,1,0,0|2,0,0]=4 30706 B14R1.228 CCCCCCN1CCCC(C1)CO 2230a_100000211344_100000210314 [0,1,0,1,0,0|1,0,0]=3 30707 B14R1.228 CCCCCCN1CCCC(C1)CO 269982a_100000211344_100000210757 [0,1,0,1,0,0|1,0,0]=3 30708 B14R1.228 CCCCCCN1CCCC(C1)CO 34a_100000211344_100000210314 [0,1,0,1,0,0|1,0,0]=3 30709 B14R1.228 CCCCCCN1CCO[C@@H](C1)CO 2230a_100015189573_100000210314 [0,1,0,1,0,0|2,0,0]=4 30710 B14R1.228 CCCCCCN1CCO[C@@H](C1)CO 269982a_100015189573_100000210757 [0,1,0,1,0,0|2,0,0]=4 30711 B14R1.228 CCCCCCN1CCO[C@@H](C1)CO 34a_100015189573_100000210314 [0,1,0,1,0,0|2,0,0]=4 30712 B14R1.228 CCCCCNC1CCCC(C1)CC 270004a_100000209983_100000756783 [0,1,0,1,0,0|2,0,0]=4 30713 B14R1.228 CCCCCOC1CCCC(C1)CC 7a_100011985506_100000210326 [0,1,0,1,0,0|2,0,0]=4 30714 B14R1.228 CCCCCOC1CCCC(C1)CN 34a_100011254705_100000718602 [0,1,0,1,0,0|2,0,0]=4 30715 B14R1.228 CCCCOCN1CCCC(C1)CO 2230a_100000211344_100011995733 [0,1,0,1,0,0|2,0,0]=4 30716 B14R1.228 CCCCOCN1CCCC(C1)CO 269982a_100000211344_100011995733 [0,1,0,1,0,0|2,0,0]=4 30717 B14R1.228 CCCCOCN1CCCC(C1)CO 34a_100000211344_100011995733 [0,1,0,1,0,0|2,0,0]=4 30718 B14R1.228 CCCOCCN1CCCC(C1)CO 2230a_100000211344_100011215938 [0,1,0,1,0,0|2,0,0]=4 30719 B14R1.228 CCCOCCN1CCCC(C1)CO 269982a_100000211344_100011215938 [0,1,0,1,0,0|2,0,0]=4 30720 B14R1.228 CCCOCCN1CCCC(C1)CO 34a_100000211344_100011215938 [0,1,0,1,0,0|2,0,0]=4 30721 B14R1.228 CCN1CCCC(C1)CNCCCO 2230a_100000747413_100000230001 [0,1,0,1,0,0|2,0,0]=4 30722 B14R1.228 CCN1CCCC(C1)COCCCO 7a_200000227639_100011215043 [0,1,0,1,0,0|2,0,0]=4 30723 B14R1.228 CCN1CCC[C@H](C1)NCCCCO 2230a_100025775482_100000210776 [0,1,0,1,0,0|2,0,0]=4 30724 B14R1.228 CCOCCCN1CCCC(C1)CO 2230a_100000211344_100012232248 [0,1,0,1,0,0|2,0,0]=4 30725 B14R1.228 CCOCCCN1CCCC(C1)CO 269982a_100000211344_100012232248 [0,1,0,1,0,0|2,0,0]=4 30726 B14R1.228 CCOCCCN1CCCC(C1)CO 34a_100000211344_100012232248 [0,1,0,1,0,0|2,0,0]=4 30727 B14R1.228 COC1CCCN(C1)CCCCCO 2230a_100000695604_100000746330 [0,1,0,1,0,0|2,0,0]=4 30728 B14R1.228 COC1CCCN(C1)CCCCCO 269982a_100000695604_100000746330 [0,1,0,1,0,0|2,0,0]=4 30729 B14R1.228 COC1CCCN(C1)CCCCCO 34a_100000695604_100000746330 [0,1,0,1,0,0|2,0,0]=4 30730 B14R1.228 COCCCCN1CCCC(C1)CO 2230a_100000211344_100000730899 [0,1,0,1,0,0|2,0,0]=4 30731 B14R1.228 COCCCCN1CCCC(C1)CO 269982a_100000211344_100000730899 [0,1,0,1,0,0|2,0,0]=4 30732 B14R1.228 COCCCCN1CCCC(C1)CO 34a_100000211344_100000755781 [0,1,0,1,0,0|2,0,0]=4 30733 B14R1.228 CSC1CCCC(C1)NCCCCO 270004a_100000750430_100012138059 [0,1,0,1,0,0|2,0,0]=4 30734 B14R1.228 NCC1CCCC(C1)OCCCCO 34a_100011254705_100011216708 [0,1,0,1,0,0|2,0,0]=4 30735 B14R1.228 OCC1CCCN(C1)CCCCCF 2230a_100000211344_100000729378 [0,1,0,1,0,0|2,0,0]=4 30736 B14R1.228 OCC1CCCN(C1)CCCCCF 269982a_100000211344_100000729378 [0,1,0,1,0,0|2,0,0]=4 30737 B14R1.228 OCC1CCCN(C1)CCCCCF 34a_100000211344_100000729378 [0,1,0,1,0,0|2,0,0]=4 30738 B14R1.228 OCCCCCN1CCCC(C1)CF 2230a_100016992999_100000746330 [0,1,0,1,0,0|2,0,0]=4 30739 B14R1.228 OCCCCCN1CCCC(C1)CF 269982a_100016992999_100000746330 [0,1,0,1,0,0|2,0,0]=4 30740 B14R1.228 OCCCCCN1CCCC(C1)CF 34a_100016992999_100000746330 [0,1,0,1,0,0|2,0,0]=4 30741 B14R1.228 OCCCCCN1CCCC(C1)CO 2230a_100000211344_100000746330 [0,1,0,1,0,0|2,0,0]=4 30742 B14R1.228 OCCCCCN1CCCC(C1)CO 269982a_100000211344_100000746330 [0,1,0,1,0,0|2,0,0]=4 30743 B14R1.228 OCCCCCN1CCCC(C1)CO 34a_100000211344_100000746330 [0,1,0,1,0,0|2,0,0]=4 30744 B14R1.229 C#CCCCCCCCN1CCC1C 269982a_100000755817_100153394163 [0,1,0,1,0,0|1,0,1]=4 30745 B14R1.229 C#CCCCCCCCN1CCC1C 34a_100000755817_100153394163 [0,1,0,1,0,0|1,0,1]=4 30746 B14R1.229 C=CCCCCCCCN1CCC1C 269982a_100000755817_100012355270 [0,1,0,1,0,0|1,0,1]=4 30747 B14R1.229 C=CCCCCCCCN1CCC1C 34a_100000755817_100012355270 [0,1,0,1,0,0|1,0,1]=4 30748 B14R1.229 CC1CCN1CCCCCCCCO 269982a_100000755817_100000033203 [0,1,0,1,0,0|0,0,0]=2 30749 B14R1.229 CC1CCN1CCCCCCCCO 34a_100000755817_100000033203 [0,1,0,1,0,0|0,0,0]=2 30750 B14R1.229 CC1CCN1CCOCCOCCO 269982a_100000755817_100000032323 [0,1,0,1,0,0|2,0,0]=4 30751 B14R1.229 CC1CCN1CCOCCOCCO 34a_100000755817_100000032323 [0,1,0,1,0,0|2,0,0]=4 30752 B14R1.229 CCCCCCCCCN1CCC1C 269982a_100000755817_100000210670 [0,1,0,1,0,0|1,0,0]=3 30753 B14R1.229 CCCCCCCCCN1CCC1C 34a_100000755817_100011214924 [0,1,0,1,0,0|1,0,0]=3 30754 B14R1.229 CCCCCCCCNC1CCC1=O 34a_100000229939_100009892977 [0,1,0,1,0,0|0,0,2]=4 30755 B14R1.229 CCCCCCCCOC1CCC1=O 34a_100000210232_100009892977 [0,1,0,1,0,0|0,0,2]=4 30756 B14R1.229 CCCCCCCCOC1CCC1=O 7a_100000210232_100009892977 [0,1,0,1,0,0|0,0,2]=4 30757 B14R1.229 CCCCCCCCSC1CCC1=O 62a_100000210759_100009892977 [0,1,0,1,0,0|0,0,2]=4 30758 B14R1.229 CCCCCCCCSC1CCC1=O 62a_100009892977_100000210317 [0,1,0,1,0,0|0,0,2]=4 30759 B14R1.229 CCCCCCNCCC1CCC1=O 2230a_100000210581_200016118888 [0,1,0,1,0,0|0,0,2]=4 30760 B14R1.229 CCCCCCOCCC1CCC1=O 7a_100000210259_200016118888 [0,1,0,1,0,0|0,0,2]=4 30761 B14R1.229 CCCCCCSCCC1CCC1=O 62a_100000210314_200016118888 [0,1,0,1,0,0|0,0,2]=4 30762 B14R1.229 CCCCCCSCCC1CCC1=O 62a_200016118888_100000210757 [0,1,0,1,0,0|0,0,2]=4 30763 B14R1.229 O=C1CCC1CCNCCCCCO 2230a_100000762737_200016118888 [0,1,0,1,0,0|1,0,1]=4 30764 B14R1.229 O=C1CCC1CCSCCCCCO 62a_100000746330_200016118888 [0,1,0,1,0,0|1,0,1]=4 30765 B14R1.229 O=C1CCC1CCSCCCCCO 62a_200016118888_100000746330 [0,1,0,1,0,0|1,0,1]=4 30766 B14R1.229 O=C1CCC1NCCCCCCCO 34a_100011996573_100009892977 [0,1,0,1,0,0|1,0,1]=4 30767 B14R1.229 O=C1CCC1SCCCCCCCO 62a_100000760002_100009892977 [0,1,0,1,0,0|1,0,1]=4 30768 B14R1.229 O=C1CCC1SCCCCCCCO 62a_100009892977_100000760002 [0,1,0,1,0,0|1,0,1]=4 30769 B14R1.235 CCCCCCN1CCC[C@@]1(C)CO 2230a_100016195882_100000210314 [0,1,0,1,0,0|1,0,0]=3 30770 B14R1.235 CCCCCCN1CCC[C@@]1(C)CO 269982a_100016195882_100000210757 [0,1,0,1,0,0|1,0,0]=3 30771 B14R1.235 CCCCCCN1CCC[C@@]1(C)CO 34a_100016195882_100000210314 [0,1,0,1,0,0|1,0,0]=3 30772 B14R1.235 CCCCOCN1CCC[C@@]1(C)CO 2230a_100016195882_100011995733 [0,1,0,1,0,0|2,0,0]=4 30773 B14R1.235 CCCCOCN1CCC[C@@]1(C)CO 269982a_100016195882_100011995733 [0,1,0,1,0,0|2,0,0]=4 30774 B14R1.235 CCCCOCN1CCC[C@@]1(C)CO 34a_100016195882_100011995733 [0,1,0,1,0,0|2,0,0]=4 30775 B14R1.235 CCCOCCN1CCC[C@@]1(C)CO 2230a_100016195882_100011215938 [0,1,0,1,0,0|2,0,0]=4 30776 B14R1.235 CCCOCCN1CCC[C@@]1(C)CO 269982a_100016195882_100011215938 [0,1,0,1,0,0|2,0,0]=4 30777 B14R1.235 CCCOCCN1CCC[C@@]1(C)CO 34a_100016195882_100011215938 [0,1,0,1,0,0|2,0,0]=4 30778 B14R1.235 CCOCCCN1CCC[C@@]1(C)CO 2230a_100016195882_100012232248 [0,1,0,1,0,0|2,0,0]=4 30779 B14R1.235 CCOCCCN1CCC[C@@]1(C)CO 269982a_100016195882_100012232248 [0,1,0,1,0,0|2,0,0]=4 30780 B14R1.235 CCOCCCN1CCC[C@@]1(C)CO 34a_100016195882_100012232248 [0,1,0,1,0,0|2,0,0]=4 30781 B14R1.235 COCCCCN1CCC[C@@]1(C)CO 2230a_100016195882_100000730899 [0,1,0,1,0,0|2,0,0]=4 30782 B14R1.235 COCCCCN1CCC[C@@]1(C)CO 269982a_100016195882_100000730899 [0,1,0,1,0,0|2,0,0]=4 30783 B14R1.235 COCCCCN1CCC[C@@]1(C)CO 34a_100016195882_100000755781 [0,1,0,1,0,0|2,0,0]=4 30784 B14R1.235 C[C@]1(CCCN1CCCCCF)CO 2230a_100016195882_100000729378 [0,1,0,1,0,0|2,0,0]=4 30785 B14R1.235 C[C@]1(CCCN1CCCCCF)CO 269982a_100016195882_100000729378 [0,1,0,1,0,0|2,0,0]=4 30786 B14R1.235 C[C@]1(CCCN1CCCCCF)CO 34a_100016195882_100000729378 [0,1,0,1,0,0|2,0,0]=4 30787 B14R1.235 C[C@]1(CCCN1CCCCCO)CO 2230a_100016195882_100000746330 [0,1,0,1,0,0|2,0,0]=4 30788 B14R1.235 C[C@]1(CCCN1CCCCCO)CO 269982a_100016195882_100000746330 [0,1,0,1,0,0|2,0,0]=4 30789 B14R1.235 C[C@]1(CCCN1CCCCCO)CO 34a_100016195882_100000746330 [0,1,0,1,0,0|2,0,0]=4 30790 B14R1.272 CCCC1CCCC1NCC(C)CC 269862a_100020588543_100000723119 [0,1,0,1,0,0|2,0,0]=4 30791 B14R1.272 CCCC1CCCC1NCC(C)CC 270004a_100020588543_100000723119 [0,1,0,1,0,0|2,0,0]=4 30792 B14R1.272 CCCC1CCCC1NCC(C)CO 269862a_100000744482_100000723119 [0,1,0,1,0,0|1,0,0]=3 30793 B14R1.272 CCCC1CCCC1NCC(O)CC 269862a_100011218483_100000723119 [0,1,0,1,0,0|2,0,0]=4 30794 B14R1.272 CCCC1CCCC1NCC(O)CC 270004a_100011218483_100000723119 [0,1,0,1,0,0|2,0,0]=4 30795 B14R1.272 CCCC1CCCC1NC[C@@H](F)CO 269862a_100015665980_100000723119 [0,1,0,1,0,0|1,0,0]=3 30796 B14R1.272 CCCC1CCCC1NC[C@@H](F)CO 270004a_100015665980_100000723119 [0,1,0,1,0,0|1,0,0]=3 30797 B14R1.272 CCCC1CCCC1NC[C@H](O)CO 269862a_100020644852_100000723119 [0,1,0,1,0,0|1,0,0]=3 30798 B14R1.272 CCCN1CCCC1COC(C)CO 34a_200000694710_100012180447 [0,1,0,1,0,0|2,0,0]=4 30799 B14R1.272 CCCN1CCCC1COC(C)CO 7a_200000694710_100012180447 [0,1,0,1,0,0|2,0,0]=4 30800 B14R1.483 CCC(=O)CN1CCCCC1CCO 269982a_100000211664_100000747405 [0,1,0,1,0,0|1,0,1]=4 30801 B14R1.483 CCC(C)CN1CCCCC1CCO 2230a_100000211664_100000748023 [0,1,0,1,0,0|1,0,0]=3 30802 B14R1.483 CCC(C)CN1CCCCC1CCO 269982a_100000211664_100000748023 [0,1,0,1,0,0|1,0,0]=3 30803 B14R1.483 CCC(C)CN1CCCCC1CCO 270004a_100000211664_100000243153 [0,1,0,1,0,0|1,0,0]=3 30804 B14R1.483 CCC(C)CN1CCCCC1CCO 34a_100000211664_100000748023 [0,1,0,1,0,0|1,0,0]=3 30805 B14R1.483 CCC(O)CN1CCCCC1CCO 2230a_100000211664_100011218378 [0,1,0,1,0,0|1,0,0]=3 30806 B14R1.483 CCC(O)CN1CCCCC1CCO 269982a_100000211664_100011218378 [0,1,0,1,0,0|1,0,0]=3 30807 B14R1.483 CCC(O)CN1CCCCC1CCO 34a_100000211664_100011218378 [0,1,0,1,0,0|1,0,0]=3 30808 B14R1.483 CCCC1CCCCC1NC(C)CC 269862a_100000209981_100011218038 [0,1,0,1,0,0|2,0,0]=4 30809 B14R1.483 CCCC1CCCCC1NC(C)CC 270004a_100000209981_100011218038 [0,1,0,1,0,0|2,0,0]=4 30810 B14R1.483 CCCC1CCCCC1N[C@H](C)CF 269862a_100102880703_100011218038 [0,1,0,1,0,0|2,0,0]=4 30811 B14R1.483 CCCC1CCCCC1N[C@H](C)CF 270004a_100102880703_100011218038 [0,1,0,1,0,0|2,0,0]=4 30812 B14R1.483 CCCC1CCCCC1N[C@H](C)CO 269862a_100000737577_100011218038 [0,1,0,1,0,0|1,0,0]=3 30813 B14R1.483 CCCC1CCCCC1N[C@H](C)CO 270004a_100000737577_100011218038 [0,1,0,1,0,0|1,0,0]=3 30814 B14R1.483 CCCC1CCCCC1OC(C)CC 34a_100011217265_100011215416 [0,1,0,1,0,0|2,0,0]=4 30815 B14R1.483 CCCC1CCCCC1OC(C)CC 7a_100011217265_100000758301 [0,1,0,1,0,0|2,0,0]=4 30816 B14R1.483 CCCC1CCCCC1OC(C)CO 34a_100011217265_100012180447 [0,1,0,1,0,0|1,0,0]=3 30817 B14R1.483 CCCC1CCCCC1OC(C)CO 7a_100011217265_100012180447 [0,1,0,1,0,0|1,0,0]=3 30818 B14R1.483 CCCC1CCCCN1CC(C)CC 2230a_100000701414_100000748023 [0,1,0,1,0,0|2,0,0]=4 30819 B14R1.483 CCCC1CCCCN1CC(C)CC 269982a_100000701414_100000748023 [0,1,0,1,0,0|2,0,0]=4 30820 B14R1.483 CCCC1CCCCN1CC(C)CC 270004a_100000701414_100000243153 [0,1,0,1,0,0|2,0,0]=4 30821 B14R1.483 CCCC1CCCCN1CC(C)CC 34a_100000701414_100000748023 [0,1,0,1,0,0|2,0,0]=4 30822 B14R1.483 CCCC1CCCCN1CC(O)CC 2230a_100000701414_100011218378 [0,1,0,1,0,0|2,0,0]=4 30823 B14R1.483 CCCC1CCCCN1CC(O)CC 269982a_100000701414_100011218378 [0,1,0,1,0,0|2,0,0]=4 30824 B14R1.483 CCCC1CCCCN1CC(O)CC 34a_100000701414_100011218378 [0,1,0,1,0,0|2,0,0]=4 30825 B14R1.483 CCCC1CCCCN1CC(O)CO 2230a_100000701414_100011219619 [0,1,0,1,0,0|1,0,0]=3 30826 B14R1.483 CCCC1CCCCN1CC(O)CO 34a_100000701414_100011219619 [0,1,0,1,0,0|1,0,0]=3 30827 B14R1.483 CCCC1CCCCN1C[C@@H](C)CC 2230a_100000701414_100009816398 [0,1,0,1,0,0|2,0,0]=4 30828 B14R1.483 CCCC1CCCCN1C[C@@H](C)CC 269982a_100000701414_100009816398 [0,1,0,1,0,0|2,0,0]=4 30829 B14R1.483 CCCC1CCCCN1C[C@@H](C)CC 34a_100000701414_100009816398 [0,1,0,1,0,0|2,0,0]=4 30830 B14R1.483 CCCC1CCCCN1C[C@@H](C)CO 2230a_100000701414_100000059175 [0,1,0,1,0,0|1,0,0]=3 30831 B14R1.483 CCCC1CCCCN1C[C@@H](C)CO 269982a_100000701414_100000059175 [0,1,0,1,0,0|1,0,0]=3 30832 B14R1.483 CCCC1CCCCN1C[C@@H](C)CO 34a_100000701414_100000059175 [0,1,0,1,0,0|1,0,0]=3 30833 B14R1.483 CCCC1CCCCN1C[C@@H](O)CF 2230a_100000701414_100015614560 [0,1,0,1,0,0|2,0,0]=4 30834 B14R1.483 CCCC1CCCCN1C[C@@H](O)CF 34a_100000701414_100015614560 [0,1,0,1,0,0|2,0,0]=4 30835 B14R1.483 CCCC1CCCCN1C[C@@H](O)CO 2230a_100000701414_100009815848 [0,1,0,1,0,0|1,0,0]=3 30836 B14R1.483 CCCC1CCCCN1C[C@@H](O)CO 34a_100000701414_100009815848 [0,1,0,1,0,0|1,0,0]=3 30837 B14R1.483 CCCC1COCCN1CC(O)CO 2230a_102495339903_100011219619 [0,1,0,1,0,0|2,0,0]=4 30838 B14R1.483 CCCC1COCCN1CC(O)CO 34a_102495339903_100011219619 [0,1,0,1,0,0|2,0,0]=4 30839 B14R1.483 CCCC1COCCN1C[C@@H](C)CO 2230a_102495339903_100000059175 [0,1,0,1,0,0|2,0,0]=4 30840 B14R1.483 CCCC1COCCN1C[C@@H](C)CO 269982a_102495339903_100000059175 [0,1,0,1,0,0|2,0,0]=4 30841 B14R1.483 CCCC1COCCN1C[C@@H](C)CO 34a_102495339903_100000059175 [0,1,0,1,0,0|2,0,0]=4 30842 B14R1.483 CCCC1COCCN1C[C@@H](O)CO 2230a_102495339903_100009815848 [0,1,0,1,0,0|2,0,0]=4 30843 B14R1.483 CCCC1COCCN1C[C@@H](O)CO 34a_102495339903_100009815848 [0,1,0,1,0,0|2,0,0]=4 30844 B14R1.483 CCOC1CCCCC1N[C@H](C)CO 270004a_100000737577_200000031474 [0,1,0,1,0,0|2,0,0]=4 30845 B14R1.483 CC[C@H](C)CN1CCCCC1CCO 2230a_100000211664_100009816398 [0,1,0,1,0,0|1,0,0]=3 30846 B14R1.483 CC[C@H](C)CN1CCCCC1CCO 269982a_100000211664_100009816398 [0,1,0,1,0,0|1,0,0]=3 30847 B14R1.483 CC[C@H](C)CN1CCCCC1CCO 34a_100000211664_100009816398 [0,1,0,1,0,0|1,0,0]=3 30848 B14R1.483 COCC1CCCCN1CC(O)CO 2230a_100015184032_100011219619 [0,1,0,1,0,0|2,0,0]=4 30849 B14R1.483 COCC1CCCCN1CC(O)CO 34a_100015184032_100011219619 [0,1,0,1,0,0|2,0,0]=4 30850 B14R1.483 COCC1CCCCN1C[C@@H](C)CO 2230a_100015184032_100000059175 [0,1,0,1,0,0|2,0,0]=4 30851 B14R1.483 COCC1CCCCN1C[C@@H](C)CO 269982a_100015184032_100000059175 [0,1,0,1,0,0|2,0,0]=4 30852 B14R1.483 COCC1CCCCN1C[C@@H](C)CO 34a_100015184032_100000059175 [0,1,0,1,0,0|2,0,0]=4 30853 B14R1.483 COCC1CCCCN1C[C@@H](O)CO 2230a_100015184032_100009815848 [0,1,0,1,0,0|2,0,0]=4 30854 B14R1.483 COCC1CCCCN1C[C@@H](O)CO 34a_100015184032_100009815848 [0,1,0,1,0,0|2,0,0]=4 30855 B14R1.483 C[C@@H](CO)CN1CCCCC1CCO 2230a_100000211664_100000059175 [0,1,0,1,0,0|2,0,0]=4 30856 B14R1.483 C[C@@H](CO)CN1CCCCC1CCO 269982a_100000211664_100000059175 [0,1,0,1,0,0|2,0,0]=4 30857 B14R1.483 C[C@@H](CO)CN1CCCCC1CCO 34a_100000211664_100000059175 [0,1,0,1,0,0|2,0,0]=4 30858 B14R1.483 OCCC1CCCCN1CC(O)CO 2230a_100000211664_100011219619 [0,1,0,1,0,0|2,0,0]=4 30859 B14R1.483 OCCC1CCCCN1CC(O)CO 34a_100000211664_100011219619 [0,1,0,1,0,0|2,0,0]=4 30860 B14R1.483 OCCC1CCCCN1C[C@@H](O)CF 2230a_100000211664_100015614560 [0,1,0,1,0,0|2,0,0]=4 30861 B14R1.483 OCCC1CCCCN1C[C@@H](O)CF 34a_100000211664_100015614560 [0,1,0,1,0,0|2,0,0]=4 30862 B14R1.483 OCCC1CCCCN1C[C@@H](O)CO 2230a_100000211664_100009815848 [0,1,0,1,0,0|2,0,0]=4 30863 B14R1.483 OCCC1CCCCN1C[C@@H](O)CO 34a_100000211664_100009815848 [0,1,0,1,0,0|2,0,0]=4 30864 B14R1.716 CC(CF)OCCCC1CCCCC1 34a_100016041109_100011713725 [0,1,0,1,0,0|2,0,0]=4 30865 B14R1.716 CC(CF)OCCCC1CCCCC1 7a_100016041109_100011713725 [0,1,0,1,0,0|2,0,0]=4 30866 B14R1.716 CC(CN)COCCC1CCCCC1 34a_100000744482_100011209188 [0,1,0,1,0,0|2,0,0]=4 30867 B14R1.716 CC(CN)OCCCC1CCCCC1 34a_100000210904_100011713725 [0,1,0,1,0,0|2,0,0]=4 30868 B14R1.716 CC(CO)CCNCC1CCCCC1 2230a_106354213184_100000211423 [0,1,0,1,0,0|1,0,0]=3 30869 B14R1.716 CC(CO)CCNCC1CCCCC1 269862a_106354213184_100000211278 [0,1,0,1,0,0|1,0,0]=3 30870 B14R1.716 CC(CO)CCNCC1CCCCC1 34a_106354213184_100000211423 [0,1,0,1,0,0|1,0,0]=3 30871 B14R1.716 CC(CO)CCNCC1CCCCO1 2230a_106354213184_100000211543 [0,1,0,1,0,0|2,0,0]=4 30872 B14R1.716 CC(CO)CCNCC1CCCCO1 34a_106354213184_100000211543 [0,1,0,1,0,0|2,0,0]=4 30873 B14R1.716 CC(CO)CCNCC1CCCOC1 2230a_106354213184_100000741521 [0,1,0,1,0,0|2,0,0]=4 30874 B14R1.716 CC(CO)CCNCC1CCCOC1 34a_106354213184_100000741521 [0,1,0,1,0,0|2,0,0]=4 30875 B14R1.716 CC(CO)CCNCC1CCOCC1 2230a_106354213184_100000754603 [0,1,0,1,0,0|2,0,0]=4 30876 B14R1.716 CC(CO)CCNCC1CCOCC1 269862a_106354213184_100000749017 [0,1,0,1,0,0|2,0,0]=4 30877 B14R1.716 CC(CO)CCNCC1CCOCC1 34a_106354213184_100000754603 [0,1,0,1,0,0|2,0,0]=4 30878 B14R1.716 CC(CO)CCNCC1CCSCC1 269862a_106354213184_100000067145 [0,1,0,1,0,0|2,0,0]=4 30879 B14R1.716 CC(CO)CCNCC1CCSCC1 270004a_106354213184_100000067145 [0,1,0,1,0,0|2,0,0]=4 30880 B14R1.716 CC(CO)CNCCC1CCCCC1 34a_100000744482_100011209188 [0,1,0,1,0,0|1,0,0]=3 30881 B14R1.716 CC(CO)CNCCC1CCOCC1 34a_100000744482_100011934994 [0,1,0,1,0,0|2,0,0]=4 30882 B14R1.716 CC(CO)CNCCN1CCCCC1 34a_100000744482_100000739454 [0,1,0,1,0,0|2,0,0]=4 30883 B14R1.716 CC(CO)CNCOC1CCCCC1 34a_100000744482_100011935260 [0,1,0,1,0,0|2,0,0]=4 30884 B14R1.716 CC(CO)NCCCC1CCCCC1 2230a_100011211642_100012180447 [0,1,0,1,0,0|1,0,0]=3 30885 B14R1.716 CC(CO)NCCCC1CCCCC1 34a_100011211642_100012180447 [0,1,0,1,0,0|1,0,0]=3 30886 B14R1.716 CC(CO)NCCOC1CCCCC1 34a_100015206981_100012180447 [0,1,0,1,0,0|2,0,0]=4 30887 B14R1.716 CC(CO)OCCCC1CCCCC1 34a_100000198086_100012180447 [0,1,0,1,0,0|1,0,0]=3 30888 B14R1.716 CC(CO)OCCCC1CCCCC1 7a_100000198086_100012180447 [0,1,0,1,0,0|1,0,0]=3 30889 B14R1.716 CC(CO)OCCCC1CCCCN1 34a_100011934581_100012180447 [0,1,0,1,0,0|2,0,0]=4 30890 B14R1.716 CC(CO)OCCCC1CCCNC1 34a_100150707839_100012180447 [0,1,0,1,0,0|2,0,0]=4 30891 B14R1.716 CC(CO)OCCCC1CCNCC1 34a_100016988962_100012180447 [0,1,0,1,0,0|2,0,0]=4 30892 B14R1.716 CC(CO)OCCCN1CCCCC1 34a_100000212458_100012180447 [0,1,0,1,0,0|2,0,0]=4 30893 B14R1.716 CC(CO)OCCNC1CCCCC1 34a_100000200466_100012180447 [0,1,0,1,0,0|2,0,0]=4 30894 B14R1.716 CC(CO)OCCOC1CCCCC1 34a_100011249652_100012180447 [0,1,0,1,0,0|2,0,0]=4 30895 B14R1.716 CC(CO)OCCOC1CCCCC1 7a_100011249652_100012180447 [0,1,0,1,0,0|2,0,0]=4 30896 B14R1.716 CC(CO)SCCCC1CCCCC1 62a_100012180447_100011713725 [0,1,0,1,0,0|1,0,0]=3 30897 B14R1.716 CC(CO)SCCCN1CCCCC1 62a_100012180447_100000007876 [0,1,0,1,0,0|2,0,0]=4 30898 B14R1.716 CC(CO)SCCOC1CCCCC1 62a_100012180447_100011211530 [0,1,0,1,0,0|2,0,0]=4 30899 B14R1.716 CCC(=O)CCCCC1CCCCC1 1458a_200011215547_100000210202 [0,1,0,1,0,0|1,0,1]=4 30900 B14R1.716 CCC(=O)CCCOC1CCCCO1 1458a_100000210414_100000700653 [0,1,0,1,0,0|1,0,1]=4 30901 B14R1.716 CCC(C)CCCOC1CCCCC1 7a_100011216074_100000210327 [0,1,0,1,0,0|2,0,0]=4 30902 B14R1.716 CCC(C)CCNCC1CCCCC1 2230a_100020591266_100000211423 [0,1,0,1,0,0|2,0,0]=4 30903 B14R1.716 CCC(C)CCNCC1CCCCC1 269862a_100020591266_100000211278 [0,1,0,1,0,0|2,0,0]=4 30904 B14R1.716 CCC(C)CCNCC1CCCCO1 2230a_100020591266_100000211543 [0,1,0,1,0,0|1,0,0]=3 30905 B14R1.716 CCC(C)CCOCC1CCCCC1 7a_100011215188_100000211423 [0,1,0,1,0,0|2,0,0]=4 30906 B14R1.716 CCC(C)CCOCC1CCCCO1 7a_100011215188_100000211543 [0,1,0,1,0,0|1,0,0]=3 30907 B14R1.716 CCC(C)CNCCC1CCCCC1 2230a_100000738074_100000748023 [0,1,0,1,0,0|2,0,0]=4 30908 B14R1.716 CCC(C)CNCCC1CCCCC1 2230a_100020588543_100012355289 [0,1,0,1,0,0|2,0,0]=4 30909 B14R1.716 CCC(C)CNCCC1CCCCC1 270004a_100000738074_100000243153 [0,1,0,1,0,0|2,0,0]=4 30910 B14R1.716 CCC(C)CNCCC1CCCCC1 270004a_100020588543_100011713444 [0,1,0,1,0,0|2,0,0]=4 30911 B14R1.716 CCC(C)CNCCC1CCCCC1 34a_100000738074_100000748023 [0,1,0,1,0,0|2,0,0]=4 30912 B14R1.716 CCC(C)CNCCC1CCCCO1 2230a_100015183643_100000748023 [0,1,0,1,0,0|1,0,0]=3 30913 B14R1.716 CCC(C)CNCCC1CCCCO1 270004a_100015183643_100000243153 [0,1,0,1,0,0|1,0,0]=3 30914 B14R1.716 CCC(C)CNCCC1CCCCO1 34a_100015183643_100000748023 [0,1,0,1,0,0|1,0,0]=3 30915 B14R1.716 CCC(C)CNCCC1OCCCO1 2230a_100020588543_100000764188 [0,1,0,1,0,0|2,0,0]=4 30916 B14R1.716 CCC(C)COCCC1CCCCC1 34a_100011217863_100000748023 [0,1,0,1,0,0|2,0,0]=4 30917 B14R1.716 CCC(C)COCCC1CCCCC1 7a_100011217863_100000748023 [0,1,0,1,0,0|2,0,0]=4 30918 B14R1.716 CCC(C)COCCC1CCCCN1 34a_100000211664_100000748023 [0,1,0,1,0,0|2,0,0]=4 30919 B14R1.716 CCC(C)CSCCC1CCCCC1 62a_100000748023_100012355289 [0,1,0,1,0,0|2,0,0]=4 30920 B14R1.716 CCC(C)CSCCC1CCCCC1 62a_100012355289_100000748023 [0,1,0,1,0,0|2,0,0]=4 30921 B14R1.716 CCC(C)CSCCC1OCCCO1 62a_100000748023_100000764188 [0,1,0,1,0,0|2,0,0]=4 30922 B14R1.716 CCC(C)CSCCC1OCCCO1 62a_100000764188_100000748023 [0,1,0,1,0,0|2,0,0]=4 30923 B14R1.716 CCC(C)NCCCC1CCCCC1 2230a_100000209981_100011713725 [0,1,0,1,0,0|2,0,0]=4 30924 B14R1.716 CCC(C)NCCCC1CCCCC1 2230a_100011211642_100000758301 [0,1,0,1,0,0|2,0,0]=4 30925 B14R1.716 CCC(C)NCCCC1CCCCC1 34a_100011211642_100011215416 [0,1,0,1,0,0|2,0,0]=4 30926 B14R1.716 CCC(C)NCCOC1CCCCO1 2230a_100000209981_100000744793 [0,1,0,1,0,0|2,0,0]=4 30927 B14R1.716 CCC(C)OCCCC1CCCCC1 34a_100000198086_100011215416 [0,1,0,1,0,0|2,0,0]=4 30928 B14R1.716 CCC(C)OCCCC1CCCCC1 7a_100000198086_100000758301 [0,1,0,1,0,0|2,0,0]=4 30929 B14R1.716 CCC(C)OCCCC1CCCCC1 7a_100000210228_100011713725 [0,1,0,1,0,0|2,0,0]=4 30930 B14R1.716 CCC(C)OCCCC1CCCCN1 34a_100011934581_100011215416 [0,1,0,1,0,0|2,0,0]=4 30931 B14R1.716 CCC(C)OCCOC1CCCCO1 34a_100000034223_100011215416 [0,1,0,1,0,0|2,0,0]=4 30932 B14R1.716 CCC(C)OCCOC1CCCCO1 7a_100000034223_100000758301 [0,1,0,1,0,0|2,0,0]=4 30933 B14R1.716 CCC(C)OCCOC1CCCCO1 7a_100000210228_100000744793 [0,1,0,1,0,0|2,0,0]=4 30934 B14R1.716 CCC(C)SCCCC1CCCCC1 62a_100000758301_100011713725 [0,1,0,1,0,0|2,0,0]=4 30935 B14R1.716 CCC(C)SCCCC1CCCCC1 62a_100011713725_100000758301 [0,1,0,1,0,0|2,0,0]=4 30936 B14R1.716 CCC(C)SCCOC1CCCCO1 62a_100000744793_100000758301 [0,1,0,1,0,0|2,0,0]=4 30937 B14R1.716 CCC(C)SCCOC1CCCCO1 62a_100000758301_100000744793 [0,1,0,1,0,0|2,0,0]=4 30938 B14R1.716 CCC(O)CNCCC1CCCCC1 2230a_100000738074_100011218378 [0,1,0,1,0,0|2,0,0]=4 30939 B14R1.716 CCC(O)CNCCC1CCCCC1 2230a_100011218483_100012355289 [0,1,0,1,0,0|2,0,0]=4 30940 B14R1.716 CCC(O)CNCCC1CCCCC1 270004a_100011218483_100011713444 [0,1,0,1,0,0|2,0,0]=4 30941 B14R1.716 CCC(O)CNCCC1CCCCC1 34a_100000738074_100011218378 [0,1,0,1,0,0|2,0,0]=4 30942 B14R1.716 CCC(O)CNCCC1CCCCO1 2230a_100015183643_100011218378 [0,1,0,1,0,0|1,0,0]=3 30943 B14R1.716 CCC(O)CNCCC1CCCCO1 34a_100015183643_100011218378 [0,1,0,1,0,0|1,0,0]=3 30944 B14R1.716 CCC(O)CNCCC1OCCCO1 2230a_100011218483_100000764188 [0,1,0,1,0,0|2,0,0]=4 30945 B14R1.716 CCC(O)COCCC1CCCCC1 34a_100011217863_100011218378 [0,1,0,1,0,0|2,0,0]=4 30946 B14R1.716 CCC(O)COCCC1CCCCC1 7a_100011217863_100011218378 [0,1,0,1,0,0|2,0,0]=4 30947 B14R1.716 CCC(O)COCCC1CCCCN1 34a_100000211664_100011218378 [0,1,0,1,0,0|2,0,0]=4 30948 B14R1.716 CCC(O)CSCCC1CCCCC1 62a_100011218378_100012355289 [0,1,0,1,0,0|2,0,0]=4 30949 B14R1.716 CCC(O)CSCCC1CCCCC1 62a_100012355289_100011218378 [0,1,0,1,0,0|2,0,0]=4 30950 B14R1.716 CCC(O)CSCCC1OCCCO1 62a_100000764188_100011218378 [0,1,0,1,0,0|2,0,0]=4 30951 B14R1.716 CCC(O)CSCCC1OCCCO1 62a_100011218378_100000764188 [0,1,0,1,0,0|2,0,0]=4 30952 B14R1.716 CCN(C)CCCOC1CCCCO1 2230a_100000225621_100000700653 [0,1,0,1,0,0|2,0,0]=4 30953 B14R1.716 CCN(C)CCCOC1CCCCO1 269982a_100000225621_100000700653 [0,1,0,1,0,0|2,0,0]=4 30954 B14R1.716 CC[C@H](C)CNCCC1CCCCC1 2230a_100000738074_100009816398 [0,1,0,1,0,0|2,0,0]=4 30955 B14R1.716 CC[C@H](C)CNCCC1CCCCC1 34a_100000738074_100009816398 [0,1,0,1,0,0|2,0,0]=4 30956 B14R1.716 CC[C@H](C)CNCCC1CCCCO1 2230a_100015183643_100009816398 [0,1,0,1,0,0|1,0,0]=3 30957 B14R1.716 CC[C@H](C)CNCCC1CCCCO1 34a_100015183643_100009816398 [0,1,0,1,0,0|1,0,0]=3 30958 B14R1.716 CC[C@H](C)COCCC1CCCCC1 34a_100011217863_100009816398 [0,1,0,1,0,0|2,0,0]=4 30959 B14R1.716 CC[C@H](C)COCCC1CCCCC1 7a_100009816381_100011273959 [0,1,0,1,0,0|2,0,0]=4 30960 B14R1.716 CC[C@H](C)COCCC1CCCCC1 7a_100011217863_100009816398 [0,1,0,1,0,0|2,0,0]=4 30961 B14R1.716 CC[C@H](C)COCCC1CCCCN1 34a_100000211664_100009816398 [0,1,0,1,0,0|2,0,0]=4 30962 B14R1.716 CC[C@H](C)COCCC1OCCCO1 7a_100009816381_100000764188 [0,1,0,1,0,0|2,0,0]=4 30963 B14R1.716 CC[C@H](C)CSCCC1CCCCC1 62a_100009816398_100012355289 [0,1,0,1,0,0|2,0,0]=4 30964 B14R1.716 CC[C@H](C)CSCCC1CCCCC1 62a_100012355289_100009816398 [0,1,0,1,0,0|2,0,0]=4 30965 B14R1.716 CC[C@H](C)CSCCC1OCCCO1 62a_100000764188_100009816398 [0,1,0,1,0,0|2,0,0]=4 30966 B14R1.716 CC[C@H](C)CSCCC1OCCCO1 62a_100009816398_100000764188 [0,1,0,1,0,0|2,0,0]=4 30967 B14R1.716 COC(C)CCOCC1CCCCO1 7a_100000764861_100000211543 [0,1,0,1,0,0|2,0,0]=4 30968 B14R1.716 C[C@@H](CN)CCCOC1CCCCC1 34a_100160569302_100000210327 [0,1,0,1,0,0|2,0,0]=4 30969 B14R1.716 C[C@@H](CO)CNCCC1CCCCC1 2230a_100000738074_100000059175 [0,1,0,1,0,0|1,0,0]=3 30970 B14R1.716 C[C@@H](CO)CNCCC1CCCCC1 34a_100000738074_100000059175 [0,1,0,1,0,0|1,0,0]=3 30971 B14R1.716 C[C@@H](CO)CNCCC1CCCCO1 2230a_100015183643_100000059175 [0,1,0,1,0,0|2,0,0]=4 30972 B14R1.716 C[C@@H](CO)CNCCC1CCCCO1 34a_100015183643_100000059175 [0,1,0,1,0,0|2,0,0]=4 30973 B14R1.716 C[C@@H](CO)CNCCC1CCOCC1 2230a_100000755988_100000059175 [0,1,0,1,0,0|2,0,0]=4 30974 B14R1.716 C[C@@H](CO)CNCCC1CCOCC1 34a_100000755988_100000059175 [0,1,0,1,0,0|2,0,0]=4 30975 B14R1.716 C[C@@H](CO)COCCC1CCCCC1 34a_100011217863_100000059175 [0,1,0,1,0,0|1,0,0]=3 30976 B14R1.716 C[C@@H](CO)COCCC1CCCCC1 7a_100011217863_100000059175 [0,1,0,1,0,0|1,0,0]=3 30977 B14R1.716 C[C@@H](CO)COCCC1CCCCN1 34a_100000211664_100000059175 [0,1,0,1,0,0|2,0,0]=4 30978 B14R1.716 C[C@@H](CO)COCCC1CCCNC1 34a_100000752241_100000059175 [0,1,0,1,0,0|2,0,0]=4 30979 B14R1.716 C[C@@H](CO)COCCC1CCNCC1 34a_100015190746_100000059175 [0,1,0,1,0,0|2,0,0]=4 30980 B14R1.716 C[C@@H](CO)COCCC1CCOCC1 34a_100011933979_100000059175 [0,1,0,1,0,0|2,0,0]=4 30981 B14R1.716 C[C@@H](CO)COCCC1CCOCC1 7a_100011933979_100000059175 [0,1,0,1,0,0|2,0,0]=4 30982 B14R1.716 C[C@@H](CO)CSCCC1CCCCC1 62a_100000059175_100012355289 [0,1,0,1,0,0|1,0,0]=3 30983 B14R1.716 C[C@@H](CO)CSCCC1CCCCC1 62a_100012355289_100000059175 [0,1,0,1,0,0|1,0,0]=3 30984 B14R1.716 C[C@@H](CO)CSCCC1CCOCC1 62a_100000059175_100011934994 [0,1,0,1,0,0|2,0,0]=4 30985 B14R1.716 C[C@@H](CO)CSCCC1CCOCC1 62a_100011934994_100000059175 [0,1,0,1,0,0|2,0,0]=4 30986 B14R1.716 C[C@@H](CO)CSCCN1CCCCC1 62a_100000059175_100000739454 [0,1,0,1,0,0|2,0,0]=4 30987 B14R1.716 C[C@@H](CO)CSCCN1CCCCC1 62a_100000739454_100000059175 [0,1,0,1,0,0|2,0,0]=4 30988 B14R1.716 C[C@@H](CO)CSCOC1CCCCC1 62a_100000059175_100011935260 [0,1,0,1,0,0|2,0,0]=4 30989 B14R1.716 C[C@@H](CO)CSCOC1CCCCC1 62a_100011935260_100000059175 [0,1,0,1,0,0|2,0,0]=4 30990 B14R1.716 C[C@H](CO)NCCCC1CCCCC1 2230a_100000737577_100011713725 [0,1,0,1,0,0|1,0,0]=3 30991 B14R1.716 C[C@H](CO)NCCCN1CCCCC1 2230a_100000737577_100000690320 [0,1,0,1,0,0|2,0,0]=4 30992 B14R1.716 C[C@H](CO)NCCOC1CCCCC1 2230a_100000737577_100011211530 [0,1,0,1,0,0|2,0,0]=4 30993 B14R1.716 C[C@H](CO)SCCCC1CCCCC1 62a_100011713725_100016084084 [0,1,0,1,0,0|1,0,0]=3 30994 B14R1.716 C[C@H](CO)SCCCC1CCCCC1 62a_100016084084_100011713725 [0,1,0,1,0,0|1,0,0]=3 30995 B14R1.716 C[C@H](CO)SCCCN1CCCCC1 62a_100016084084_100000007876 [0,1,0,1,0,0|2,0,0]=4 30996 B14R1.716 C[C@H](CO)SCCCN1CCCCC1 62a_100132302099_100016084084 [0,1,0,1,0,0|2,0,0]=4 30997 B14R1.716 C[C@H](CO)SCCOC1CCCCC1 62a_100011211530_100016084084 [0,1,0,1,0,0|2,0,0]=4 30998 B14R1.716 C[C@H](CO)SCCOC1CCCCC1 62a_100016084084_100011211530 [0,1,0,1,0,0|2,0,0]=4 30999 B14R1.716 ClCC(Cl)COCCC1CCCCC1 34a_100000033668_100011209188 [0,1,0,1,0,0|2,0,0]=4 31000 B14R1.716 NC[C@@H](F)COCCC1CCCCC1 34a_100015665980_100011209188 [0,1,0,1,0,0|2,0,0]=4 31001 B14R1.716 O=C(CF)CCCCC1CCCCC1 1458a_200011215547_100015361967 [0,1,0,1,0,0|1,0,1]=4 31002 B14R1.716 O=C(CO)NCCCC1CCCCC1 240690a_100011211642_100000210174 [0,1,0,1,0,0|1,0,1]=4 31003 B14R1.716 O=C(CO)NCCCC1CCCCC1 527a_100011211642_100000210174 [0,1,0,1,0,0|1,0,1]=4 31004 B14R1.716 OCC(O)CNCCC1CCCCC1 2230a_100000738074_100011219619 [0,1,0,1,0,0|1,0,0]=3 31005 B14R1.716 OCC(O)CNCCC1CCCCC1 34a_100000738074_100011219619 [0,1,0,1,0,0|1,0,0]=3 31006 B14R1.716 OCC(O)CNCCC1CCCCO1 2230a_100015183643_100011219619 [0,1,0,1,0,0|2,0,0]=4 31007 B14R1.716 OCC(O)CNCCC1CCCCO1 34a_100015183643_100011219619 [0,1,0,1,0,0|2,0,0]=4 31008 B14R1.716 OCC(O)CNCCC1CCOCC1 2230a_100000755988_100011219619 [0,1,0,1,0,0|2,0,0]=4 31009 B14R1.716 OCC(O)CNCCC1CCOCC1 34a_100000755988_100011219619 [0,1,0,1,0,0|2,0,0]=4 31010 B14R1.716 OCC(O)COCCC1CCCCC1 34a_100011217863_100011219619 [0,1,0,1,0,0|1,0,0]=3 31011 B14R1.716 OCC(O)COCCC1CCCCC1 7a_100011217863_100011219619 [0,1,0,1,0,0|1,0,0]=3 31012 B14R1.716 OCC(O)COCCC1CCCCN1 34a_100000211664_100011219619 [0,1,0,1,0,0|2,0,0]=4 31013 B14R1.716 OCC(O)COCCC1CCCNC1 34a_100000752241_100011219619 [0,1,0,1,0,0|2,0,0]=4 31014 B14R1.716 OCC(O)COCCC1CCNCC1 34a_100015190746_100011219619 [0,1,0,1,0,0|2,0,0]=4 31015 B14R1.716 OCC(O)COCCC1CCOCC1 34a_100011933979_100011219619 [0,1,0,1,0,0|2,0,0]=4 31016 B14R1.716 OCC(O)COCCC1CCOCC1 7a_100011933979_100011219619 [0,1,0,1,0,0|2,0,0]=4 31017 B14R1.716 OCC(O)CSCCC1CCCCC1 62a_100011219619_100012355289 [0,1,0,1,0,0|1,0,0]=3 31018 B14R1.716 OCC(O)CSCCC1CCCCC1 62a_100012355289_100011219619 [0,1,0,1,0,0|1,0,0]=3 31019 B14R1.716 OCC(O)CSCCC1CCOCC1 62a_100011219619_100011934994 [0,1,0,1,0,0|2,0,0]=4 31020 B14R1.716 OCC(O)CSCCC1CCOCC1 62a_100011934994_100011219619 [0,1,0,1,0,0|2,0,0]=4 31021 B14R1.716 OCC(O)CSCCN1CCCCC1 62a_100000739454_100011219619 [0,1,0,1,0,0|2,0,0]=4 31022 B14R1.716 OCC(O)CSCCN1CCCCC1 62a_100011219619_100000739454 [0,1,0,1,0,0|2,0,0]=4 31023 B14R1.716 OCC(O)CSCOC1CCCCC1 62a_100011219619_100011935260 [0,1,0,1,0,0|2,0,0]=4 31024 B14R1.716 OCC(O)CSCOC1CCCCC1 62a_100011935260_100011219619 [0,1,0,1,0,0|2,0,0]=4 31025 B14R1.716 OC[C@@H](O)CNCCC1CCCCC1 2230a_100020644852_100012355289 [0,1,0,1,0,0|1,0,0]=3 31026 B14R1.716 OC[C@@H](O)CNCCC1CCOCC1 2230a_100020644852_100011934994 [0,1,0,1,0,0|2,0,0]=4 31027 B14R1.716 OC[C@@H](O)CNCCN1CCCCC1 2230a_100020644852_100000739454 [0,1,0,1,0,0|2,0,0]=4 31028 B14R1.716 OC[C@@H](O)CNCOC1CCCCC1 2230a_100020644852_100011935260 [0,1,0,1,0,0|2,0,0]=4 31029 B14R1.716 OC[C@H](F)CNCCC1CCCCC1 270004a_100015665980_100011713444 [0,1,0,1,0,0|1,0,0]=3 31030 B14R1.716 OC[C@H](F)CNCCC1CCCCC1 34a_100015665980_100011209188 [0,1,0,1,0,0|1,0,0]=3 31031 B14R1.716 OC[C@H](F)CNCCC1CCOCC1 34a_100015665980_100011934994 [0,1,0,1,0,0|2,0,0]=4 31032 B14R1.716 OC[C@H](F)CNCCN1CCCCC1 34a_100015665980_100000739454 [0,1,0,1,0,0|2,0,0]=4 31033 B14R1.716 OC[C@H](F)CNCOC1CCCCC1 34a_100015665980_100011935260 [0,1,0,1,0,0|2,0,0]=4 31034 B14R1.716 OC[C@H](O)CNCCC1CCCCC1 2230a_100000738074_100009815848 [0,1,0,1,0,0|1,0,0]=3 31035 B14R1.716 OC[C@H](O)CNCCC1CCCCC1 34a_100000738074_100009815848 [0,1,0,1,0,0|1,0,0]=3 31036 B14R1.716 OC[C@H](O)CNCCC1CCCCO1 2230a_100015183643_100009815848 [0,1,0,1,0,0|2,0,0]=4 31037 B14R1.716 OC[C@H](O)CNCCC1CCCCO1 34a_100015183643_100009815848 [0,1,0,1,0,0|2,0,0]=4 31038 B14R1.716 OC[C@H](O)CNCCC1CCOCC1 2230a_100000755988_100009815848 [0,1,0,1,0,0|2,0,0]=4 31039 B14R1.716 OC[C@H](O)CNCCC1CCOCC1 34a_100000755988_100009815848 [0,1,0,1,0,0|2,0,0]=4 31040 B14R1.716 OC[C@H](O)COCCC1CCCCC1 34a_100011217863_100009815848 [0,1,0,1,0,0|1,0,0]=3 31041 B14R1.716 OC[C@H](O)COCCC1CCCCC1 7a_100011217863_100009815848 [0,1,0,1,0,0|1,0,0]=3 31042 B14R1.716 OC[C@H](O)COCCC1CCCCN1 34a_100000211664_100009815848 [0,1,0,1,0,0|2,0,0]=4 31043 B14R1.716 OC[C@H](O)COCCC1CCCNC1 34a_100000752241_100009815848 [0,1,0,1,0,0|2,0,0]=4 31044 B14R1.716 OC[C@H](O)COCCC1CCNCC1 34a_100015190746_100009815848 [0,1,0,1,0,0|2,0,0]=4 31045 B14R1.716 OC[C@H](O)COCCC1CCOCC1 34a_100011933979_100009815848 [0,1,0,1,0,0|2,0,0]=4 31046 B14R1.716 OC[C@H](O)COCCC1CCOCC1 7a_100011933979_100009815848 [0,1,0,1,0,0|2,0,0]=4 31047 B14R1.716 OC[C@H](O)CSCCC1CCCCC1 62a_100009815848_100012355289 [0,1,0,1,0,0|1,0,0]=3 31048 B14R1.716 OC[C@H](O)CSCCC1CCCCC1 62a_100012355289_100009815848 [0,1,0,1,0,0|1,0,0]=3 31049 B14R1.716 OC[C@H](O)CSCCC1CCOCC1 62a_100009815848_100011934994 [0,1,0,1,0,0|2,0,0]=4 31050 B14R1.716 OC[C@H](O)CSCCC1CCOCC1 62a_100011934994_100009815848 [0,1,0,1,0,0|2,0,0]=4 31051 B14R1.716 OC[C@H](O)CSCCN1CCCCC1 62a_100000739454_100009815848 [0,1,0,1,0,0|2,0,0]=4 31052 B14R1.716 OC[C@H](O)CSCCN1CCCCC1 62a_100009815848_100000739454 [0,1,0,1,0,0|2,0,0]=4 31053 B14R1.716 OC[C@H](O)CSCOC1CCCCC1 62a_100009815848_100011935260 [0,1,0,1,0,0|2,0,0]=4 31054 B14R1.716 OC[C@H](O)CSCOC1CCCCC1 62a_100011935260_100009815848 [0,1,0,1,0,0|2,0,0]=4 31055 B14R1.716 O[C@@H](CF)CNCCC1CCCCC1 2230a_100000738074_100015614560 [0,1,0,1,0,0|2,0,0]=4 31056 B14R1.716 O[C@@H](CF)CNCCC1CCCCC1 34a_100000738074_100015614560 [0,1,0,1,0,0|2,0,0]=4 31057 B14R1.716 O[C@@H](CF)CNCCC1CCCCO1 2230a_100015183643_100015614560 [0,1,0,1,0,0|2,0,0]=4 31058 B14R1.716 O[C@@H](CF)CNCCC1CCCCO1 34a_100015183643_100015614560 [0,1,0,1,0,0|2,0,0]=4 31059 B14R1.716 O[C@@H](CF)COCCC1CCCCC1 34a_100011217863_100015614560 [0,1,0,1,0,0|2,0,0]=4 31060 B14R1.716 O[C@@H](CF)COCCC1CCCCC1 7a_100011217863_100015614560 [0,1,0,1,0,0|2,0,0]=4 31061 B14R1.716 O[C@@H](CF)CSCCC1CCCCC1 62a_100012355289_100015614560 [0,1,0,1,0,0|2,0,0]=4 31062 B14R1.716 O[C@@H](CF)CSCCC1CCCCC1 62a_100015614560_100012355289 [0,1,0,1,0,0|2,0,0]=4 31063 B14R1.730 CC(CN)COCCCC1CCCC1 34a_100000744482_100011713738 [0,1,0,1,0,0|2,0,0]=4 31064 B14R1.730 CC(CO)CCNCCC1CCCC1 2230a_106354213184_100000760354 [0,1,0,1,0,0|1,0,0]=3 31065 B14R1.730 CC(CO)CCNCCC1CCCC1 34a_106354213184_100000760354 [0,1,0,1,0,0|1,0,0]=3 31066 B14R1.730 CC(CO)CNCCCC1CCCC1 34a_100000744482_100011713738 [0,1,0,1,0,0|1,0,0]=3 31067 B14R1.730 CC(CO)CNCCCN1CCCC1 34a_100000744482_100016991639 [0,1,0,1,0,0|2,0,0]=4 31068 B14R1.730 CC(CO)NCCCOC1CCCC1 34a_100000747560_100012180447 [0,1,0,1,0,0|2,0,0]=4 31069 B14R1.730 CCC(C)CCCOCC1CCCC1 7a_100011216074_100000740388 [0,1,0,1,0,0|2,0,0]=4 31070 B14R1.730 CCC(C)CCCOCC1CCCO1 7a_100011216074_100000203698 [0,1,0,1,0,0|1,0,0]=3 31071 B14R1.730 CCC(C)CCCOCC1OCCO1 7a_100011216074_100000755774 [0,1,0,1,0,0|2,0,0]=4 31072 B14R1.730 CCC(C)CCNCCC1CCCC1 2230a_100020591266_100000760354 [0,1,0,1,0,0|2,0,0]=4 31073 B14R1.730 CCC(C)CCNCCC1OCCO1 2230a_100020591266_100000740749 [0,1,0,1,0,0|2,0,0]=4 31074 B14R1.730 CCC(C)CCOCCC1CCCC1 7a_100011215188_100000760354 [0,1,0,1,0,0|2,0,0]=4 31075 B14R1.730 CCC(C)CCOCCC1OCCO1 7a_100011215188_100000740749 [0,1,0,1,0,0|2,0,0]=4 31076 B14R1.730 CCC(C)CNCCCC1CCCC1 2230a_100000736752_100000748023 [0,1,0,1,0,0|2,0,0]=4 31077 B14R1.730 CCC(C)CNCCCC1CCCC1 2230a_100020588543_100011713738 [0,1,0,1,0,0|2,0,0]=4 31078 B14R1.730 CCC(C)CNCCCC1CCCC1 270004a_100000736752_100000243153 [0,1,0,1,0,0|2,0,0]=4 31079 B14R1.730 CCC(C)CNCCCC1CCCC1 34a_100000736752_100000748023 [0,1,0,1,0,0|2,0,0]=4 31080 B14R1.730 CCC(C)CNCCCC1OCCO1 2230a_100020588543_100000042513 [0,1,0,1,0,0|2,0,0]=4 31081 B14R1.730 CCC(C)COCCCC1CCCC1 34a_100011215328_100000748023 [0,1,0,1,0,0|2,0,0]=4 31082 B14R1.730 CCC(C)COCCCC1CCCC1 7a_100011215328_100000748023 [0,1,0,1,0,0|2,0,0]=4 31083 B14R1.730 CCC(C)COCCCC1OCCO1 34a_100009871617_100000748023 [0,1,0,1,0,0|2,0,0]=4 31084 B14R1.730 CCC(C)COCCCC1OCCO1 7a_100009871617_100000748023 [0,1,0,1,0,0|2,0,0]=4 31085 B14R1.730 CCC(C)CSCCCC1CCCC1 62a_100000748023_100011713738 [0,1,0,1,0,0|2,0,0]=4 31086 B14R1.730 CCC(C)CSCCCC1CCCC1 62a_100011713738_100000748023 [0,1,0,1,0,0|2,0,0]=4 31087 B14R1.730 CCC(C)CSCCCC1OCCO1 62a_100000748023_100000042513 [0,1,0,1,0,0|2,0,0]=4 31088 B14R1.730 CCC(C)NCCCCC1OCCO1 2230a_100000209981_100000034956 [0,1,0,1,0,0|2,0,0]=4 31089 B14R1.730 CCC(C)OCCCCC1OCCO1 7a_100000210228_100000034956 [0,1,0,1,0,0|2,0,0]=4 31090 B14R1.730 CCC(C)SCCCCC1OCCO1 62a_100000758301_100000034956 [0,1,0,1,0,0|2,0,0]=4 31091 B14R1.730 CCC(O)CNCCCC1CCCC1 2230a_100000736752_100011218378 [0,1,0,1,0,0|2,0,0]=4 31092 B14R1.730 CCC(O)CNCCCC1CCCC1 2230a_100011218483_100011713738 [0,1,0,1,0,0|2,0,0]=4 31093 B14R1.730 CCC(O)CNCCCC1CCCC1 34a_100000736752_100011218378 [0,1,0,1,0,0|2,0,0]=4 31094 B14R1.730 CCC(O)CNCCCC1OCCO1 2230a_100011218483_100000042513 [0,1,0,1,0,0|2,0,0]=4 31095 B14R1.730 CCC(O)COCCCC1CCCC1 34a_100011215328_100011218378 [0,1,0,1,0,0|2,0,0]=4 31096 B14R1.730 CCC(O)COCCCC1CCCC1 7a_100011215328_100011218378 [0,1,0,1,0,0|2,0,0]=4 31097 B14R1.730 CCC(O)COCCCC1OCCO1 34a_100009871617_100011218378 [0,1,0,1,0,0|2,0,0]=4 31098 B14R1.730 CCC(O)COCCCC1OCCO1 7a_100009871617_100011218378 [0,1,0,1,0,0|2,0,0]=4 31099 B14R1.730 CCC(O)CSCCCC1CCCC1 62a_100011218378_100011713738 [0,1,0,1,0,0|2,0,0]=4 31100 B14R1.730 CCC(O)CSCCCC1CCCC1 62a_100011713738_100011218378 [0,1,0,1,0,0|2,0,0]=4 31101 B14R1.730 CCC(O)CSCCCC1OCCO1 62a_100011218378_100000042513 [0,1,0,1,0,0|2,0,0]=4 31102 B14R1.730 CCN(C)CCCNC[C@@H]1CCCO1 2230a_100020590478_100015186262 [0,1,0,1,0,0|2,0,0]=4 31103 B14R1.730 CCN(C)CCCOCC1CCCO1 7a_100000210270_100015186262 [0,1,0,1,0,0|2,0,0]=4 31104 B14R1.730 CCN(C)CCCSCC1CCCO1 62a_100000203698_100015186262 [0,1,0,1,0,0|2,0,0]=4 31105 B14R1.730 CC[C@H](C)CNCCCC1CCCC1 2230a_100000736752_100009816398 [0,1,0,1,0,0|2,0,0]=4 31106 B14R1.730 CC[C@H](C)CNCCCC1CCCC1 34a_100000736752_100009816398 [0,1,0,1,0,0|2,0,0]=4 31107 B14R1.730 CC[C@H](C)COCCCC1CCCC1 34a_100011215328_100009816398 [0,1,0,1,0,0|2,0,0]=4 31108 B14R1.730 CC[C@H](C)COCCCC1CCCC1 7a_100009816381_100011713738 [0,1,0,1,0,0|2,0,0]=4 31109 B14R1.730 CC[C@H](C)COCCCC1CCCC1 7a_100011215328_100009816398 [0,1,0,1,0,0|2,0,0]=4 31110 B14R1.730 CC[C@H](C)COCCCC1OCCO1 34a_100009871617_100009816398 [0,1,0,1,0,0|2,0,0]=4 31111 B14R1.730 CC[C@H](C)COCCCC1OCCO1 7a_100009816381_100000042513 [0,1,0,1,0,0|2,0,0]=4 31112 B14R1.730 CC[C@H](C)COCCCC1OCCO1 7a_100009871617_100009816398 [0,1,0,1,0,0|2,0,0]=4 31113 B14R1.730 CC[C@H](C)CSCCCC1CCCC1 62a_100009816398_100011713738 [0,1,0,1,0,0|2,0,0]=4 31114 B14R1.730 CC[C@H](C)CSCCCC1CCCC1 62a_100011713738_100009816398 [0,1,0,1,0,0|2,0,0]=4 31115 B14R1.730 CC[C@H](C)CSCCCC1OCCO1 62a_100009816398_100000042513 [0,1,0,1,0,0|2,0,0]=4 31116 B14R1.730 C[C@@H](CN)CCCOCC1CCCC1 34a_100160569302_100000740388 [0,1,0,1,0,0|2,0,0]=4 31117 B14R1.730 C[C@@H](CO)CNCCCC1CCCC1 2230a_100000736752_100000059175 [0,1,0,1,0,0|1,0,0]=3 31118 B14R1.730 C[C@@H](CO)CNCCCC1CCCC1 34a_100000736752_100000059175 [0,1,0,1,0,0|1,0,0]=3 31119 B14R1.730 C[C@@H](CO)CNCCOC1CCCC1 34a_100000741755_100000059175 [0,1,0,1,0,0|2,0,0]=4 31120 B14R1.730 C[C@@H](CO)COCCCC1CCCC1 34a_100011215328_100000059175 [0,1,0,1,0,0|1,0,0]=3 31121 B14R1.730 C[C@@H](CO)COCCCC1CCCC1 7a_100011215328_100000059175 [0,1,0,1,0,0|1,0,0]=3 31122 B14R1.730 C[C@@H](CO)COCCNC1CCCC1 34a_200000200444_100000059175 [0,1,0,1,0,0|2,0,0]=4 31123 B14R1.730 C[C@@H](CO)COCCOC1CCCC1 34a_100000738311_100000059175 [0,1,0,1,0,0|2,0,0]=4 31124 B14R1.730 C[C@@H](CO)COCCOC1CCCC1 7a_100000738311_100000059175 [0,1,0,1,0,0|2,0,0]=4 31125 B14R1.730 C[C@@H](CO)CSCCCC1CCCC1 62a_100000059175_100011713738 [0,1,0,1,0,0|1,0,0]=3 31126 B14R1.730 C[C@@H](CO)CSCCCC1CCCC1 62a_100011713738_100000059175 [0,1,0,1,0,0|1,0,0]=3 31127 B14R1.730 C[C@@H](CO)CSCCCN1CCCC1 62a_100000059175_100011445909 [0,1,0,1,0,0|2,0,0]=4 31128 B14R1.730 C[C@@H](CO)CSCCCN1CCCC1 62a_100016991639_100000059175 [0,1,0,1,0,0|2,0,0]=4 31129 B14R1.730 ClCC(Cl)COCCCC1CCCC1 34a_100000033668_100011713738 [0,1,0,1,0,0|2,0,0]=4 31130 B14R1.730 NC[C@@H](F)COCCCC1CCCC1 34a_100015665980_100011713738 [0,1,0,1,0,0|2,0,0]=4 31131 B14R1.730 OCC(O)CNCCCC1CCCC1 2230a_100000736752_100011219619 [0,1,0,1,0,0|1,0,0]=3 31132 B14R1.730 OCC(O)CNCCCC1CCCC1 34a_100000736752_100011219619 [0,1,0,1,0,0|1,0,0]=3 31133 B14R1.730 OCC(O)CNCCOC1CCCC1 34a_100000741755_100011219619 [0,1,0,1,0,0|2,0,0]=4 31134 B14R1.730 OCC(O)COCCCC1CCCC1 34a_100011215328_100011219619 [0,1,0,1,0,0|1,0,0]=3 31135 B14R1.730 OCC(O)COCCCC1CCCC1 7a_100011215328_100011219619 [0,1,0,1,0,0|1,0,0]=3 31136 B14R1.730 OCC(O)COCCNC1CCCC1 34a_200000200444_100011219619 [0,1,0,1,0,0|2,0,0]=4 31137 B14R1.730 OCC(O)COCCOC1CCCC1 34a_100000738311_100011219619 [0,1,0,1,0,0|2,0,0]=4 31138 B14R1.730 OCC(O)COCCOC1CCCC1 7a_100000738311_100011219619 [0,1,0,1,0,0|2,0,0]=4 31139 B14R1.730 OCC(O)CSCCCC1CCCC1 62a_100011219619_100011713738 [0,1,0,1,0,0|1,0,0]=3 31140 B14R1.730 OCC(O)CSCCCC1CCCC1 62a_100011713738_100011219619 [0,1,0,1,0,0|1,0,0]=3 31141 B14R1.730 OCC(O)CSCCCN1CCCC1 62a_100011219619_100011445909 [0,1,0,1,0,0|2,0,0]=4 31142 B14R1.730 OCC(O)CSCCCN1CCCC1 62a_100016991639_100011219619 [0,1,0,1,0,0|2,0,0]=4 31143 B14R1.730 OC[C@@H](O)CNCCCC1CCCC1 2230a_100020644852_100011713738 [0,1,0,1,0,0|1,0,0]=3 31144 B14R1.730 OC[C@@H](O)CNCCCN1CCCC1 2230a_100020644852_100011445909 [0,1,0,1,0,0|2,0,0]=4 31145 B14R1.730 OC[C@H](F)CNCCCC1CCCC1 34a_100015665980_100011713738 [0,1,0,1,0,0|1,0,0]=3 31146 B14R1.730 OC[C@H](F)CNCCCN1CCCC1 34a_100015665980_100016991639 [0,1,0,1,0,0|2,0,0]=4 31147 B14R1.730 OC[C@H](O)CNCCCC1CCCC1 2230a_100000736752_100009815848 [0,1,0,1,0,0|1,0,0]=3 31148 B14R1.730 OC[C@H](O)CNCCCC1CCCC1 34a_100000736752_100009815848 [0,1,0,1,0,0|1,0,0]=3 31149 B14R1.730 OC[C@H](O)CNCCOC1CCCC1 34a_100000741755_100009815848 [0,1,0,1,0,0|2,0,0]=4 31150 B14R1.730 OC[C@H](O)COCCCC1CCCC1 34a_100011215328_100009815848 [0,1,0,1,0,0|1,0,0]=3 31151 B14R1.730 OC[C@H](O)COCCCC1CCCC1 7a_100011215328_100009815848 [0,1,0,1,0,0|1,0,0]=3 31152 B14R1.730 OC[C@H](O)COCCNC1CCCC1 34a_200000200444_100009815848 [0,1,0,1,0,0|2,0,0]=4 31153 B14R1.730 OC[C@H](O)COCCOC1CCCC1 34a_100000738311_100009815848 [0,1,0,1,0,0|2,0,0]=4 31154 B14R1.730 OC[C@H](O)COCCOC1CCCC1 7a_100000738311_100009815848 [0,1,0,1,0,0|2,0,0]=4 31155 B14R1.730 OC[C@H](O)CSCCCC1CCCC1 62a_100009815848_100011713738 [0,1,0,1,0,0|1,0,0]=3 31156 B14R1.730 OC[C@H](O)CSCCCC1CCCC1 62a_100011713738_100009815848 [0,1,0,1,0,0|1,0,0]=3 31157 B14R1.730 OC[C@H](O)CSCCCN1CCCC1 62a_100009815848_100011445909 [0,1,0,1,0,0|2,0,0]=4 31158 B14R1.730 OC[C@H](O)CSCCCN1CCCC1 62a_100016991639_100009815848 [0,1,0,1,0,0|2,0,0]=4 31159 B14R1.730 O[C@@H](CF)CNCCCC1CCCC1 2230a_100000736752_100015614560 [0,1,0,1,0,0|2,0,0]=4 31160 B14R1.730 O[C@@H](CF)CNCCCC1CCCC1 34a_100000736752_100015614560 [0,1,0,1,0,0|2,0,0]=4 31161 B14R1.730 O[C@@H](CF)COCCCC1CCCC1 34a_100011215328_100015614560 [0,1,0,1,0,0|2,0,0]=4 31162 B14R1.730 O[C@@H](CF)COCCCC1CCCC1 7a_100011215328_100015614560 [0,1,0,1,0,0|2,0,0]=4 31163 B14R1.730 O[C@@H](CF)CSCCCC1CCCC1 62a_100011713738_100015614560 [0,1,0,1,0,0|2,0,0]=4 31164 B14R1.730 O[C@@H](CF)CSCCCC1CCCC1 62a_100015614560_100011713738 [0,1,0,1,0,0|2,0,0]=4 31165 B14R1.789 CC(CO)N1CCCCC1CCCO 2230a_100011934581_100012180447 [0,1,0,1,0,0|2,0,0]=4 31166 B14R1.789 CC(CO)N1CCCCC1CCCO 34a_100011934581_100012180447 [0,1,0,1,0,0|2,0,0]=4 31167 B14R1.789 CCC(=O)N1CCCCC1CCCO 240690a_100011934581_100000210414 [0,1,0,1,0,0|1,0,1]=4 31168 B14R1.789 CCC(C)C1CCCCC1NCCF 269862a_100000724931_100011216798 [0,1,0,1,0,0|2,0,0]=4 31169 B14R1.789 CCC(C)C1CCCCC1NCCO 269862a_100000210304_100011216798 [0,1,0,1,0,0|1,0,0]=3 31170 B14R1.789 CCC(C)N1CCCCC1CCCO 2230a_100011934581_100000758301 [0,1,0,1,0,0|1,0,0]=3 31171 B14R1.789 CCC(C)N1CCCCC1CCCO 269982a_100011934581_100000758301 [0,1,0,1,0,0|1,0,0]=3 31172 B14R1.789 CCC(C)N1CCCCC1CCCO 34a_100011934581_100011215416 [0,1,0,1,0,0|1,0,0]=3 31173 B14R1.789 CCCNC1CCCCC1C(C)CC 269862a_100020643023_100011216798 [0,1,0,1,0,0|2,0,0]=4 31174 B14R1.789 COC(C)N1CCCCC1CCCO 269982a_100011934581_100009879195 [0,1,0,1,0,0|2,0,0]=4 31175 B14R1.789 COCCC1CCCCN1C(C)CO 2230a_100015186528_100012180447 [0,1,0,1,0,0|2,0,0]=4 31176 B14R1.789 COCCC1CCCCN1C(C)CO 34a_100015186528_100012180447 [0,1,0,1,0,0|2,0,0]=4 31177 B14R1.789 COCCC1CCCCN1[C@H](C)CO 269982a_100015186528_100016084084 [0,1,0,1,0,0|2,0,0]=4 31178 B14R1.789 C[C@H](CO)N1CCCCC1CCCO 269982a_100011934581_100016084084 [0,1,0,1,0,0|2,0,0]=4 31179 B14R1.800 CCCCC1CCCC1NC(C)CC 269862a_100000209981_100000750825 [0,1,0,1,0,0|2,0,0]=4 31180 B14R1.800 CCCCC1CCCC1NC(C)CC 270004a_100000209981_100000750825 [0,1,0,1,0,0|2,0,0]=4 31181 B14R1.800 CCCCC1CCCC1N[C@H](C)CF 269862a_100102880703_100000750825 [0,1,0,1,0,0|2,0,0]=4 31182 B14R1.800 CCCCC1CCCC1N[C@H](C)CF 270004a_100102880703_100000750825 [0,1,0,1,0,0|2,0,0]=4 31183 B14R1.800 CCCCC1CCCC1N[C@H](C)CO 269862a_100000737577_100000750825 [0,1,0,1,0,0|1,0,0]=3 31184 B14R1.800 CCCCC1CCCC1N[C@H](C)CO 270004a_100000737577_100000750825 [0,1,0,1,0,0|1,0,0]=3 31185 B14R1.819 CC(CO)CNCCC1CCCN1C 34a_100000744482_100000005710 [0,1,0,1,0,0|2,0,0]=4 31186 B14R1.819 CCC(C)CCCOC1COCC1O 7a_100011216074_200000725654 [0,1,0,1,0,0|2,0,0]=4 31187 B14R1.819 CCN(C)CCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100015186262 [0,1,0,1,0,0|2,0,0]=4 31188 B14R1.819 CN1CCCC1CCNC[C@@H](F)CO 34a_100015665980_100000005710 [0,1,0,1,0,0|2,0,0]=4 31189 B14R1.819 CN1CCCC1CCNC[C@H](O)CO 2230a_100020644852_100000005710 [0,1,0,1,0,0|2,0,0]=4 31190 B14R1.819 CN1CCCC1CCOCC(O)CO 34a_100011215177_100011219619 [0,1,0,1,0,0|2,0,0]=4 31191 B14R1.819 CN1CCCC1CCOCC(O)CO 7a_100011215177_100011219619 [0,1,0,1,0,0|2,0,0]=4 31192 B14R1.819 CN1CCCC1CCOC[C@@H](O)CO 34a_100011215177_100009815848 [0,1,0,1,0,0|2,0,0]=4 31193 B14R1.819 CN1CCCC1CCOC[C@@H](O)CO 7a_100011215177_100009815848 [0,1,0,1,0,0|2,0,0]=4 31194 B14R1.819 CN1CCCC1CCSCC(O)CO 62a_100000005710_100011219619 [0,1,0,1,0,0|2,0,0]=4 31195 B14R1.819 CN1CCCC1CCSCC(O)CO 62a_100011219619_100000005710 [0,1,0,1,0,0|2,0,0]=4 31196 B14R1.819 CN1CCCC1CCSC[C@@H](O)CO 62a_100000005710_100009815848 [0,1,0,1,0,0|2,0,0]=4 31197 B14R1.819 CN1CCCC1CCSC[C@@H](O)CO 62a_100009815848_100000005710 [0,1,0,1,0,0|2,0,0]=4 31198 B14R1.819 C[C@@H](CO)COCCC1CCCN1C 34a_100011215177_100000059175 [0,1,0,1,0,0|2,0,0]=4 31199 B14R1.819 C[C@@H](CO)COCCC1CCCN1C 7a_100011215177_100000059175 [0,1,0,1,0,0|2,0,0]=4 31200 B14R1.819 C[C@@H](CO)CSCCC1CCCN1C 62a_100000005710_100000059175 [0,1,0,1,0,0|2,0,0]=4 31201 B14R1.819 C[C@@H](CO)CSCCC1CCCN1C 62a_100000059175_100000005710 [0,1,0,1,0,0|2,0,0]=4 31202 B14R1.827 CCC(C)CCCCCOCC1CC1 7a_200000035636_100000742324 [0,1,0,1,0,0|2,0,0]=4 31203 B14R1.827 CCC(C)CCCCCOCC1CO1 7a_200000035636_102125554688 [0,1,0,1,0,0|1,0,0]=3 31204 B14R1.827 CCC(C)CCCCCOCC1CS1 7a_200000035636_100000031435 [0,1,0,1,0,0|1,1,0]=4 31205 B14R1.827 CCC(C)CCCCCOC[C@@H]1CO1 7a_200000035636_100000745022 [0,1,0,1,0,0|1,0,0]=3 31206 B14R1.827 CCC(C)CCCOCCCC1CO1 7a_100011216074_100000733510 [0,1,0,1,0,0|1,0,0]=3 31207 B14R1.827 CCC(C)OCCCCOCC1CO1 34a_100010889290_100011215416 [0,1,0,1,0,0|2,0,0]=4 31208 B14R1.827 CCC(C)OCCCCOCC1CO1 7a_100010889290_100000758301 [0,1,0,1,0,0|2,0,0]=4 31209 B14R1.827 CCN(C)CCCSCCCC1CO1 62a_100000733510_100015186262 [0,1,0,1,0,0|2,0,0]=4 31210 B14R1.827 C[C@@H](CN)CCCOCCCC1CO1 34a_100160569302_100000733510 [0,1,0,1,0,0|2,0,0]=4 31211 B14R1.837 CC(CO)CCNC1CCCCC1C 269862a_106354213184_100000210921 [0,1,0,1,0,0|1,0,0]=3 31212 B14R1.837 CC(CO)CCNC1CCCCC1C 270004a_106354213184_100000210921 [0,1,0,1,0,0|1,0,0]=3 31213 B14R1.837 CC(CO)CCNC1CCCCC1F 34a_106354213184_100015423560 [0,1,0,1,0,0|2,0,0]=4 31214 B14R1.837 CC(CO)CCNC1CCCCC1O 34a_106354213184_100000038908 [0,1,0,1,0,0|2,0,0]=4 31215 B14R1.837 CC(CO)CCNC1CCNCC1C 270004a_106354213184_100000703950 [0,1,0,1,0,0|2,0,0]=4 31216 B14R1.837 CC(CO)CCNC1CCOCC1C 270004a_106354213184_100000755695 [0,1,0,1,0,0|2,0,0]=4 31217 B14R1.837 CC(CO)CNCC1CCCCN1C 34a_100000744482_100015186950 [0,1,0,1,0,0|2,0,0]=4 31218 B14R1.837 CC(CO)NCCN1CCCCC1C 2230a_100000739827_100012180447 [0,1,0,1,0,0|2,0,0]=4 31219 B14R1.837 CC(CO)NCCN1CCCCC1C 34a_100000739827_100012180447 [0,1,0,1,0,0|2,0,0]=4 31220 B14R1.837 CC(CO)OCCN1CCCCC1C 34a_100011305533_100012180447 [0,1,0,1,0,0|2,0,0]=4 31221 B14R1.837 CC(CO)SCCC1CCCCN1C 62a_100012180447_100000211948 [0,1,0,1,0,0|2,0,0]=4 31222 B14R1.837 CCC(C)CCNC1CCCCC1C 269862a_100020591266_100000210921 [0,1,0,1,0,0|2,0,0]=4 31223 B14R1.837 CCC(C)CCNC1CCCCC1C 270004a_100020591266_100000210921 [0,1,0,1,0,0|2,0,0]=4 31224 B14R1.837 CCC(C)CNCC1CCCCC1O 270004a_100011216029_100000243153 [0,1,0,1,0,0|1,0,0]=3 31225 B14R1.837 CCC(C)CNCC1CCCCC1O 34a_100011216029_100000748023 [0,1,0,1,0,0|1,0,0]=3 31226 B14R1.837 CCC(O)CNCC1CCCCC1O 34a_100011216029_100011218378 [0,1,0,1,0,0|1,0,0]=3 31227 B14R1.837 CC[C@H](C)CNCC1CCCCC1O 34a_100011216029_100009816398 [0,1,0,1,0,0|1,0,0]=3 31228 B14R1.837 CN1CCCCC1CNCC(O)CO 34a_100011228421_100011219619 [0,1,0,1,0,0|2,0,0]=4 31229 B14R1.837 CN1CCCCC1CNC[C@@H](F)CO 34a_100015665980_100015186950 [0,1,0,1,0,0|2,0,0]=4 31230 B14R1.837 CN1CCCCC1CNC[C@@H](O)CO 34a_100011228421_100009815848 [0,1,0,1,0,0|2,0,0]=4 31231 B14R1.837 CN1CCCCC1COCC(O)CO 34a_100000225079_100011219619 [0,1,0,1,0,0|2,0,0]=4 31232 B14R1.837 CN1CCCCC1COC[C@@H](O)CO 34a_100000225079_100009815848 [0,1,0,1,0,0|2,0,0]=4 31233 B14R1.837 CN1CCCCC1CSCC(O)CO 62a_100011219619_100015185383 [0,1,0,1,0,0|2,0,0]=4 31234 B14R1.837 CN1CCCCC1CSCC(O)CO 62a_100015185383_100011219619 [0,1,0,1,0,0|2,0,0]=4 31235 B14R1.837 CN1CCCCC1CSC[C@@H](O)CO 62a_100009815848_100015185383 [0,1,0,1,0,0|2,0,0]=4 31236 B14R1.837 CN1CCCCC1CSC[C@@H](O)CO 62a_100015185383_100009815848 [0,1,0,1,0,0|2,0,0]=4 31237 B14R1.837 C[C@@H](CO)CNCC1CCCCC1O 34a_100011216029_100000059175 [0,1,0,1,0,0|2,0,0]=4 31238 B14R1.837 C[C@@H](CO)CNCC1CCCCN1C 34a_100011228421_100000059175 [0,1,0,1,0,0|2,0,0]=4 31239 B14R1.837 C[C@@H](CO)COCC1CCCCN1C 34a_100000225079_100000059175 [0,1,0,1,0,0|2,0,0]=4 31240 B14R1.837 C[C@@H](CO)CSCC1CCCCN1C 62a_100000059175_100015185383 [0,1,0,1,0,0|2,0,0]=4 31241 B14R1.837 C[C@@H](CO)CSCC1CCCCN1C 62a_100015185383_100000059175 [0,1,0,1,0,0|2,0,0]=4 31242 B14R1.837 C[C@H](CO)NCCC1CCCCN1C 2230a_100000737577_100000211948 [0,1,0,1,0,0|2,0,0]=4 31243 B14R1.837 C[C@H](CO)SCCC1CCCCN1C 62a_100000211948_100016084084 [0,1,0,1,0,0|2,0,0]=4 31244 B14R1.837 C[C@H](CO)SCCC1CCCCN1C 62a_100016084084_100000211948 [0,1,0,1,0,0|2,0,0]=4 31245 B14R1.837 OC1CCCCC1CNC[C@@H](O)CF 34a_100011216029_100015614560 [0,1,0,1,0,0|2,0,0]=4 31246 B14R1.837 OCC(O)CNCC1CCCCC1O 34a_100011216029_100011219619 [0,1,0,1,0,0|2,0,0]=4 31247 B14R1.837 OC[C@H](O)CNCC1CCCCC1O 34a_100011216029_100009815848 [0,1,0,1,0,0|2,0,0]=4 31248 B14R1.845 CNC1CCCCCCCCCCC1 2230a_100011194316_200000210301 [0,1,0,1,0,0|1,0,0]=3 31249 B14R1.845 CNC1CCCCCCCCCCC1 270004a_106832991635_100000210130 [0,1,0,1,0,0|1,0,0]=3 31250 B14R1.845 CNC1CCCCCCCCCCC1 34a_100011194316_200000210301 [0,1,0,1,0,0|1,0,0]=3 31251 B14R1.845 COC1CCCCCCCCCCC1 34a_100000211378_200000210301 [0,1,0,1,0,0|0,0,0]=2 31252 B14R1.845 COC1CCCCCCCCCCC1 7a_100000211378_200000210301 [0,1,0,1,0,0|0,0,0]=2 31253 B14R1.845 [13CH3]NC1CCCCCCCCCCC1 2230a_100011194316_200025704644 [0,1,0,1,0,0|1,0,0]=3 31254 B14R1.845 [13CH3]NC1CCCCCCCCCCC1 34a_100011194316_200025704644 [0,1,0,1,0,0|1,0,0]=3 31255 B14R1.845 [13CH3]OC1CCCCCCCCCCC1 34a_100000211378_200025704644 [0,1,0,1,0,0|0,0,0]=2 31256 B14R1.845 [13CH3]OC1CCCCCCCCCCC1 7a_100000211378_200025704644 [0,1,0,1,0,0|0,0,0]=2 31257 B14R1.863 CCC(C)CNC1CCCCC1CC 269862a_100020588543_100000757040 [0,1,0,1,0,0|2,0,0]=4 31258 B14R1.863 CCC(C)CNC1CCCCC1CC 270004a_100020588543_100000757040 [0,1,0,1,0,0|2,0,0]=4 31259 B14R1.863 CCC(C)CNC1CCCCC1CO 270004a_100020588543_100009861125 [0,1,0,1,0,0|1,0,0]=3 31260 B14R1.863 CCC(C)CNC1CCOCC1CO 2230a_214813039666_100000748023 [0,1,0,1,0,0|2,0,0]=4 31261 B14R1.863 CCC(C)CNC1CCOCC1CO 270004a_214813039666_100000243153 [0,1,0,1,0,0|2,0,0]=4 31262 B14R1.863 CCC(C)CNC1CCOCC1CO 34a_214813039666_100000748023 [0,1,0,1,0,0|2,0,0]=4 31263 B14R1.863 CCC(C)COC1CCCCC1CC 34a_100000210738_100000748023 [0,1,0,1,0,0|2,0,0]=4 31264 B14R1.863 CCC(C)COC1CCCCC1CC 7a_100000210738_100000748023 [0,1,0,1,0,0|2,0,0]=4 31265 B14R1.863 CCC(C)COC1CCCCC1CN 34a_100011216029_100000748023 [0,1,0,1,0,0|2,0,0]=4 31266 B14R1.863 CCC(O)CNC1CCCCC1CC 269862a_100011218483_100000757040 [0,1,0,1,0,0|2,0,0]=4 31267 B14R1.863 CCC(O)CNC1CCCCC1CC 270004a_100011218483_100000757040 [0,1,0,1,0,0|2,0,0]=4 31268 B14R1.863 CCC(O)CNC1CCCCC1CO 270004a_100011218483_100009861125 [0,1,0,1,0,0|1,0,0]=3 31269 B14R1.863 CCC(O)CNC1CCOCC1CO 2230a_214813039666_100011218378 [0,1,0,1,0,0|2,0,0]=4 31270 B14R1.863 CCC(O)CNC1CCOCC1CO 34a_214813039666_100011218378 [0,1,0,1,0,0|2,0,0]=4 31271 B14R1.863 CCC(O)COC1CCCCC1CC 34a_100000210738_100011218378 [0,1,0,1,0,0|2,0,0]=4 31272 B14R1.863 CCC(O)COC1CCCCC1CC 7a_100000210738_100011218378 [0,1,0,1,0,0|2,0,0]=4 31273 B14R1.863 CCC(O)COC1CCCCC1CN 34a_100011216029_100011218378 [0,1,0,1,0,0|2,0,0]=4 31274 B14R1.863 CCC1CCCCC1NCC(C)CO 269862a_100000744482_100000757040 [0,1,0,1,0,0|1,0,0]=3 31275 B14R1.863 CCC1CCCCC1NC[C@@H](F)CO 269862a_100015665980_100000757040 [0,1,0,1,0,0|1,0,0]=3 31276 B14R1.863 CCC1CCCCC1NC[C@@H](F)CO 270004a_100015665980_100000757040 [0,1,0,1,0,0|1,0,0]=3 31277 B14R1.863 CCC1CCCCC1NC[C@H](O)CO 269862a_100020644852_100000757040 [0,1,0,1,0,0|1,0,0]=3 31278 B14R1.863 CCC1CCCCC1OCC(O)CO 34a_100000210738_100011219619 [0,1,0,1,0,0|1,0,0]=3 31279 B14R1.863 CCC1CCCCC1OCC(O)CO 7a_100000210738_100011219619 [0,1,0,1,0,0|1,0,0]=3 31280 B14R1.863 CCC1CCCCC1OC[C@@H](C)CC 34a_100000210738_100009816398 [0,1,0,1,0,0|2,0,0]=4 31281 B14R1.863 CCC1CCCCC1OC[C@@H](C)CC 7a_100000210738_100009816398 [0,1,0,1,0,0|2,0,0]=4 31282 B14R1.863 CCC1CCCCC1OC[C@@H](C)CO 34a_100000210738_100000059175 [0,1,0,1,0,0|1,0,0]=3 31283 B14R1.863 CCC1CCCCC1OC[C@@H](C)CO 7a_100000210738_100000059175 [0,1,0,1,0,0|1,0,0]=3 31284 B14R1.863 CCC1CCCCC1OC[C@@H](O)CF 34a_100000210738_100015614560 [0,1,0,1,0,0|2,0,0]=4 31285 B14R1.863 CCC1CCCCC1OC[C@@H](O)CF 7a_100000210738_100015614560 [0,1,0,1,0,0|2,0,0]=4 31286 B14R1.863 CCC1CCCCC1OC[C@@H](O)CO 34a_100000210738_100009815848 [0,1,0,1,0,0|1,0,0]=3 31287 B14R1.863 CCC1CCCCC1OC[C@@H](O)CO 7a_100000210738_100009815848 [0,1,0,1,0,0|1,0,0]=3 31288 B14R1.863 CCN1CCCCC1CNC(C)CO 2230a_100000754393_100012180447 [0,1,0,1,0,0|2,0,0]=4 31289 B14R1.863 CCN1CCCCC1CNC(C)CO 34a_100000754393_100012180447 [0,1,0,1,0,0|2,0,0]=4 31290 B14R1.863 CCN1CCCCC1COC(C)CO 34a_100000225091_100012180447 [0,1,0,1,0,0|2,0,0]=4 31291 B14R1.863 CCN1CCCCC1COC(C)CO 7a_100000225091_100012180447 [0,1,0,1,0,0|2,0,0]=4 31292 B14R1.863 CC[C@H](C)CNC1CCOCC1CO 2230a_214813039666_100009816398 [0,1,0,1,0,0|2,0,0]=4 31293 B14R1.863 CC[C@H](C)CNC1CCOCC1CO 34a_214813039666_100009816398 [0,1,0,1,0,0|2,0,0]=4 31294 B14R1.863 CC[C@H](C)COC1CCCCC1CN 34a_100011216029_100009816398 [0,1,0,1,0,0|2,0,0]=4 31295 B14R1.863 CN[C@@H]1CCCC[C@H]1OCC(O)CO 34a_100000708425_100011219619 [0,1,0,1,0,0|2,0,0]=4 31296 B14R1.863 CN[C@@H]1CCCC[C@H]1OC[C@@H](C)CO 34a_100000708425_100000059175 [0,1,0,1,0,0|2,0,0]=4 31297 B14R1.863 CN[C@@H]1CCCC[C@H]1OC[C@@H](O)CO 34a_100000708425_100009815848 [0,1,0,1,0,0|2,0,0]=4 31298 B14R1.863 COC1CCCCC1NCC(O)CO 34a_100011208099_100011219619 [0,1,0,1,0,0|2,0,0]=4 31299 B14R1.863 COC1CCCCC1NC[C@@H](C)CO 34a_100011208099_100000059175 [0,1,0,1,0,0|2,0,0]=4 31300 B14R1.863 COC1CCCCC1NC[C@@H](F)CO 270004a_100015665980_100000740605 [0,1,0,1,0,0|2,0,0]=4 31301 B14R1.863 COC1CCCCC1NC[C@@H](O)CO 34a_100011208099_100009815848 [0,1,0,1,0,0|2,0,0]=4 31302 B14R1.863 CO[C@H](C)CNC1CCCCC1CO 270004a_100020591295_100009861125 [0,1,0,1,0,0|2,0,0]=4 31303 B14R1.863 CO[C@H]1CCCC[C@@H]1OCC(O)CO 34a_200009815850_100011219619 [0,1,0,1,0,0|2,0,0]=4 31304 B14R1.863 CO[C@H]1CCCC[C@@H]1OCC(O)CO 7a_200009815850_100011219619 [0,1,0,1,0,0|2,0,0]=4 31305 B14R1.863 CO[C@H]1CCCC[C@@H]1OC[C@@H](C)CO 34a_200009815850_100000059175 [0,1,0,1,0,0|2,0,0]=4 31306 B14R1.863 CO[C@H]1CCCC[C@@H]1OC[C@@H](C)CO 7a_200009815850_100000059175 [0,1,0,1,0,0|2,0,0]=4 31307 B14R1.863 CO[C@H]1CCCC[C@@H]1OC[C@@H](O)CO 34a_200009815850_100009815848 [0,1,0,1,0,0|2,0,0]=4 31308 B14R1.863 CO[C@H]1CCCC[C@@H]1OC[C@@H](O)CO 7a_200009815850_100009815848 [0,1,0,1,0,0|2,0,0]=4 31309 B14R1.863 C[C@@H](CO)COC1CCCCC1CN 34a_100011216029_100000059175 [0,1,0,1,0,0|2,0,0]=4 31310 B14R1.863 NCC1CCCCC1OCC(O)CO 34a_100011216029_100011219619 [0,1,0,1,0,0|2,0,0]=4 31311 B14R1.863 NCC1CCCCC1OC[C@@H](O)CO 34a_100011216029_100009815848 [0,1,0,1,0,0|2,0,0]=4 31312 B14R1.863 OCC1CCCCC1NC[C@@H](F)CO 270004a_100015665980_100009861125 [0,1,0,1,0,0|2,0,0]=4 31313 B14R1.891 BrCCCCCCCCOC1CCC1 34a_100009813846_100000749161 [0,1,0,1,0,0|1,0,0]=3 31314 B14R1.891 BrCCCCCCCCOC1COC1 34a_100009813846_100009818527 [0,1,0,1,0,0|2,0,0]=4 31315 B14R1.891 BrCCCCCCCCOC1COC1 7a_100009813846_100009818527 [0,1,0,1,0,0|2,0,0]=4 31316 B14R1.891 BrCCCCCCCOCC1CCC1 34a_100000760002_100000763275 [0,1,0,1,0,0|1,0,0]=3 31317 B14R1.891 BrCCCCCCCOCC1CCC1 7a_100000760002_100000763275 [0,1,0,1,0,0|1,0,0]=3 31318 B14R1.891 BrCCCCCCCOCC1CCO1 34a_100000760002_100000103362 [0,1,0,1,0,0|1,0,0]=3 31319 B14R1.891 BrCCCCCCCOCC1CCO1 7a_100000760002_100000103362 [0,1,0,1,0,0|1,0,0]=3 31320 B14R1.891 BrCCCCCCCOCC1COC1 34a_100000760002_100010264016 [0,1,0,1,0,0|2,0,0]=4 31321 B14R1.891 BrCCCCCCCOCC1COC1 7a_100000760002_100010264016 [0,1,0,1,0,0|2,0,0]=4 31322 B14R1.891 C#CCCCCCCCNC1CCC1 2230a_100000749019_100153394163 [0,1,0,1,0,0|1,0,1]=4 31323 B14R1.891 C#CCCCCCCCNC1CCC1 34a_100000749019_100153394163 [0,1,0,1,0,0|1,0,1]=4 31324 B14R1.891 C#CCCCCCCCOC1CCC1 34a_100000054614_100000749161 [0,1,0,1,0,0|1,0,1]=4 31325 B14R1.891 C#CCCCCCCCOC1CCC1 34a_100000748187_100153394163 [0,1,0,1,0,0|1,0,1]=4 31326 B14R1.891 C#CCCCCCCCSC1CCC1 62a_100153394163_100000749161 [0,1,0,1,0,0|1,0,1]=4 31327 B14R1.891 C#CCCCCCCNCC1CCC1 2230a_100000738700_100012276617 [0,1,0,1,0,0|1,0,1]=4 31328 B14R1.891 C#CCCCCCCNCC1CCC1 34a_100000738700_100012276617 [0,1,0,1,0,0|1,0,1]=4 31329 B14R1.891 C#CCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100012276617 [0,1,0,1,0,0|0,0,2]=4 31330 B14R1.891 C#CCCCCCCNC[C@@H]1CCO1 34a_100020831831_100012276617 [0,1,0,1,0,0|0,0,2]=4 31331 B14R1.891 C#CCCCCCCOCC1CCC1 34a_100000760304_100012276617 [0,1,0,1,0,0|1,0,1]=4 31332 B14R1.891 C#CCCCCCCOCC1CCC1 34a_100011217361_100000763275 [0,1,0,1,0,0|1,0,1]=4 31333 B14R1.891 C#CCCCCCCOCC1CCC1 7a_100011217361_100000763275 [0,1,0,1,0,0|1,0,1]=4 31334 B14R1.891 C#CCCCCCCOCC1CCO1 34a_100000039022_100012276617 [0,1,0,1,0,0|0,0,2]=4 31335 B14R1.891 C#CCCCCCCOCC1CCO1 34a_100011217361_100000103362 [0,1,0,1,0,0|0,0,2]=4 31336 B14R1.891 C#CCCCCCCOCC1CCO1 7a_100011217361_100000103362 [0,1,0,1,0,0|0,0,2]=4 31337 B14R1.891 C#CCCCCCCSCC1CCC1 62a_100000763275_100012276617 [0,1,0,1,0,0|1,0,1]=4 31338 B14R1.891 C#CCCCCCCSCC1CCC1 62a_100012276617_100000763275 [0,1,0,1,0,0|1,0,1]=4 31339 B14R1.891 C#CCCCCCCSCC1CCO1 62a_100000103362_100012276617 [0,1,0,1,0,0|0,0,2]=4 31340 B14R1.891 C#CCCCCCCSCC1CCO1 62a_100012276617_100000103362 [0,1,0,1,0,0|0,0,2]=4 31341 B14R1.891 C=CCCCCCCCCN1CCC1 269982a_100000754969_100011933949 [0,1,0,1,0,0|1,0,1]=4 31342 B14R1.891 C=CCCCCCCCNC1CCC1 2230a_100000749019_100012355270 [0,1,0,1,0,0|1,0,1]=4 31343 B14R1.891 C=CCCCCCCCNC1CCC1 34a_100000749019_100012355270 [0,1,0,1,0,0|1,0,1]=4 31344 B14R1.891 C=CCCCCCCCOC1CCC1 34a_100000730831_100000749161 [0,1,0,1,0,0|1,0,1]=4 31345 B14R1.891 C=CCCCCCCCOC1CCC1 34a_100000748187_100012355270 [0,1,0,1,0,0|1,0,1]=4 31346 B14R1.891 C=CCCCCCCCSC1CCC1 62a_100012355270_100000749161 [0,1,0,1,0,0|1,0,1]=4 31347 B14R1.891 C=CCCCCCCNCC1CCC1 2230a_100000738700_100011215473 [0,1,0,1,0,0|1,0,1]=4 31348 B14R1.891 C=CCCCCCCNCC1CCC1 34a_100000738700_100011215473 [0,1,0,1,0,0|1,0,1]=4 31349 B14R1.891 C=CCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100011215473 [0,1,0,1,0,0|0,0,2]=4 31350 B14R1.891 C=CCCCCCCNC[C@@H]1CCO1 34a_100020831831_100011215473 [0,1,0,1,0,0|0,0,2]=4 31351 B14R1.891 C=CCCCCCCOCC1CCC1 34a_100000760304_100011215473 [0,1,0,1,0,0|1,0,1]=4 31352 B14R1.891 C=CCCCCCCOCC1CCC1 34a_200011216477_100000763275 [0,1,0,1,0,0|1,0,1]=4 31353 B14R1.891 C=CCCCCCCOCC1CCC1 7a_200011216477_100000763275 [0,1,0,1,0,0|1,0,1]=4 31354 B14R1.891 C=CCCCCCCOCC1CCO1 34a_100000039022_100011215473 [0,1,0,1,0,0|0,0,2]=4 31355 B14R1.891 C=CCCCCCCOCC1CCO1 34a_200011216477_100000103362 [0,1,0,1,0,0|0,0,2]=4 31356 B14R1.891 C=CCCCCCCOCC1CCO1 7a_200011216477_100000103362 [0,1,0,1,0,0|0,0,2]=4 31357 B14R1.891 C=CCCCCCCSCC1CCC1 62a_100000763275_100011215473 [0,1,0,1,0,0|1,0,1]=4 31358 B14R1.891 C=CCCCCCCSCC1CCC1 62a_100011215473_100000763275 [0,1,0,1,0,0|1,0,1]=4 31359 B14R1.891 C=CCCCCCCSCC1CCO1 62a_100000103362_100011215473 [0,1,0,1,0,0|0,0,2]=4 31360 B14R1.891 C=CCCCCCCSCC1CCO1 62a_100011215473_100000103362 [0,1,0,1,0,0|0,0,2]=4 31361 B14R1.891 CC/C=C\CCCCOCC1CCO1 34a_100016287862_100000103362 [0,1,0,1,0,0|0,0,2]=4 31362 B14R1.891 CC/C=C\CCCCOCC1CCO1 7a_100016287862_100000103362 [0,1,0,1,0,0|0,0,2]=4 31363 B14R1.891 CCCC/C=C\CCOCC1CCO1 34a_200016286491_100000103362 [0,1,0,1,0,0|0,0,2]=4 31364 B14R1.891 CCCC/C=C\CCOCC1CCO1 7a_200016286491_100000103362 [0,1,0,1,0,0|0,0,2]=4 31365 B14R1.891 CCCCC#CCCOCC1CCO1 34a_100000037610_100000103362 [0,1,0,1,0,0|0,0,2]=4 31366 B14R1.891 CCCCC#CCCOCC1CCO1 7a_100000037610_100000103362 [0,1,0,1,0,0|0,0,2]=4 31367 B14R1.891 CCCCC/C=C/COCC1CCO1 34a_100016258190_100000103362 [0,1,0,1,0,0|0,0,2]=4 31368 B14R1.891 CCCCC/C=C/COCC1CCO1 7a_100016258190_100000103362 [0,1,0,1,0,0|0,0,2]=4 31369 B14R1.891 CCCCCC#CCNC[C@@H]1CCO1 2230a_100020831831_100009816472 [0,1,0,1,0,0|0,0,2]=4 31370 B14R1.891 CCCCCC#CCNC[C@@H]1CCO1 34a_100020831831_100009816472 [0,1,0,1,0,0|0,0,2]=4 31371 B14R1.891 CCCCCC#CCOCC1CCO1 34a_100000039022_100009816472 [0,1,0,1,0,0|0,0,2]=4 31372 B14R1.891 CCCCCC#CCOCC1CCO1 34a_200000033628_100000103362 [0,1,0,1,0,0|0,0,2]=4 31373 B14R1.891 CCCCCC#CCOCC1CCO1 7a_200000033628_100000103362 [0,1,0,1,0,0|0,0,2]=4 31374 B14R1.891 CCCCCC#CCSCC1CCO1 62a_100000103362_100009816472 [0,1,0,1,0,0|0,0,2]=4 31375 B14R1.891 CCCCCC#CCSCC1CCO1 62a_100009816472_100000103362 [0,1,0,1,0,0|0,0,2]=4 31376 B14R1.891 CCCCCCCCCCN1CCC1 269982a_100000754969_100000210320 [0,1,0,1,0,0|1,0,0]=3 31377 B14R1.891 CCCCCCCCCNC1CCC1 2230a_100000749019_100011214924 [0,1,0,1,0,0|1,0,0]=3 31378 B14R1.891 CCCCCCCCCNC1CCC1 270004a_100000212291_100000241760 [0,1,0,1,0,0|1,0,0]=3 31379 B14R1.891 CCCCCCCCCNC1CCC1 34a_100000212291_100000749161 [0,1,0,1,0,0|1,0,0]=3 31380 B14R1.891 CCCCCCCCCNC1CCC1 34a_100000749019_100011214924 [0,1,0,1,0,0|1,0,0]=3 31381 B14R1.891 CCCCCCCCCNC1COC1 2230a_100016991112_100011214924 [0,1,0,1,0,0|1,0,0]=3 31382 B14R1.891 CCCCCCCCCNC1COC1 34a_100000212291_100009818527 [0,1,0,1,0,0|1,0,0]=3 31383 B14R1.891 CCCCCCCCCOC1CCC1 34a_100000210712_100000749161 [0,1,0,1,0,0|1,0,0]=3 31384 B14R1.891 CCCCCCCCCOC1CCC1 34a_100000748187_100011214924 [0,1,0,1,0,0|1,0,0]=3 31385 B14R1.891 CCCCCCCCCOC1COC1 34a_100000210712_100009818527 [0,1,0,1,0,0|1,0,0]=3 31386 B14R1.891 CCCCCCCCCOC1COC1 7a_100000210712_100009818527 [0,1,0,1,0,0|1,0,0]=3 31387 B14R1.891 CCCCCCCCCOC1CSC1 7a_100000072292_100000210328 [0,1,0,1,0,0|1,1,0]=4 31388 B14R1.891 CCCCCCCCNCC1CCC1 2230a_100000229939_100000763275 [0,1,0,1,0,0|1,0,0]=3 31389 B14R1.891 CCCCCCCCNCC1CCC1 2230a_100000738700_100000210759 [0,1,0,1,0,0|1,0,0]=3 31390 B14R1.891 CCCCCCCCNCC1CCC1 269862a_100000229939_100000753134 [0,1,0,1,0,0|1,0,0]=3 31391 B14R1.891 CCCCCCCCNCC1CCC1 34a_100000229939_100000763275 [0,1,0,1,0,0|1,0,0]=3 31392 B14R1.891 CCCCCCCCNCC1CCC1 34a_100000738700_100000210759 [0,1,0,1,0,0|1,0,0]=3 31393 B14R1.891 CCCCCCCCNCC1CCO1 2230a_100000229939_100000103362 [0,1,0,1,0,0|0,0,0]=2 31394 B14R1.891 CCCCCCCCNCC1CCO1 34a_100000229939_100000103362 [0,1,0,1,0,0|0,0,0]=2 31395 B14R1.891 CCCCCCCCNCC1COC1 2230a_100000229939_100010264016 [0,1,0,1,0,0|1,0,0]=3 31396 B14R1.891 CCCCCCCCNCC1COC1 2230a_100015281925_100000210759 [0,1,0,1,0,0|1,0,0]=3 31397 B14R1.891 CCCCCCCCNCC1COC1 34a_100000229939_100010264016 [0,1,0,1,0,0|1,0,0]=3 31398 B14R1.891 CCCCCCCCNCC1COC1 34a_100015281925_100000210759 [0,1,0,1,0,0|1,0,0]=3 31399 B14R1.891 CCCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100000210759 [0,1,0,1,0,0|0,0,0]=2 31400 B14R1.891 CCCCCCCCNC[C@@H]1CCO1 34a_100020831831_100000210759 [0,1,0,1,0,0|0,0,0]=2 31401 B14R1.891 CCCCCCCCOCC1CCC1 34a_100000210232_100000763275 [0,1,0,1,0,0|1,0,0]=3 31402 B14R1.891 CCCCCCCCOCC1CCC1 34a_100000760304_100000210759 [0,1,0,1,0,0|1,0,0]=3 31403 B14R1.891 CCCCCCCCOCC1CCC1 7a_100000210232_100000763275 [0,1,0,1,0,0|1,0,0]=3 31404 B14R1.891 CCCCCCCCOCC1CCO1 34a_100000039022_100000210759 [0,1,0,1,0,0|0,0,0]=2 31405 B14R1.891 CCCCCCCCOCC1CCO1 34a_100000210232_100000103362 [0,1,0,1,0,0|0,0,0]=2 31406 B14R1.891 CCCCCCCCOCC1CCO1 7a_100000210232_100000103362 [0,1,0,1,0,0|0,0,0]=2 31407 B14R1.891 CCCCCCCCOCC1CNC1 34a_100016987283_100000210759 [0,1,0,1,0,0|2,0,0]=4 31408 B14R1.891 CCCCCCCCOCC1COC1 34a_100000060846_100000210759 [0,1,0,1,0,0|1,0,0]=3 31409 B14R1.891 CCCCCCCCOCC1COC1 34a_100000210232_100010264016 [0,1,0,1,0,0|1,0,0]=3 31410 B14R1.891 CCCCCCCCOCC1COC1 7a_100000210232_100010264016 [0,1,0,1,0,0|1,0,0]=3 31411 B14R1.891 CCCCCCCCSCC1CCC1 62a_100000210759_100000763275 [0,1,0,1,0,0|1,0,0]=3 31412 B14R1.891 CCCCCCCCSCC1CCC1 62a_100000763275_100000210317 [0,1,0,1,0,0|1,0,0]=3 31413 B14R1.891 CCCCCCCCSCC1CCO1 62a_100000103362_100000210317 [0,1,0,1,0,0|0,0,0]=2 31414 B14R1.891 CCCCCCCCSCC1CCO1 62a_100000210759_100000103362 [0,1,0,1,0,0|0,0,0]=2 31415 B14R1.891 CCCCCCCCSCC1COC1 62a_100000210759_100010264016 [0,1,0,1,0,0|1,0,0]=3 31416 B14R1.891 CCCCCCCCSCC1COC1 62a_100010264016_100000210317 [0,1,0,1,0,0|1,0,0]=3 31417 B14R1.891 CCCCCCCOCCC1COC1 34a_100009855314_100000210614 [0,1,0,1,0,0|1,0,0]=3 31418 B14R1.891 CCCCCCOCCOC1CCC1 34a_100000691444_100000749161 [0,1,0,1,0,0|2,0,0]=4 31419 B14R1.891 CCCCCCOCCOC1COC1 34a_100000691444_100009818527 [0,1,0,1,0,0|2,0,0]=4 31420 B14R1.891 CCCCCCOCCOC1COC1 7a_100000691444_100009818527 [0,1,0,1,0,0|2,0,0]=4 31421 B14R1.891 CCCCCNCCOCC1CCC1 34a_100000224656_100000763275 [0,1,0,1,0,0|2,0,0]=4 31422 B14R1.891 CCCCCNCCOCC1CCO1 34a_100000224656_100000103362 [0,1,0,1,0,0|1,0,0]=3 31423 B14R1.891 CCCCCNCCOCC1COC1 34a_100000224656_100010264016 [0,1,0,1,0,0|2,0,0]=4 31424 B14R1.891 CCCCCOCCOCC1CCC1 34a_100011215259_100000763275 [0,1,0,1,0,0|2,0,0]=4 31425 B14R1.891 CCCCCOCCOCC1CCC1 7a_100011215259_100000763275 [0,1,0,1,0,0|2,0,0]=4 31426 B14R1.891 CCCCCOCCOCC1CCO1 34a_100011215259_100000103362 [0,1,0,1,0,0|1,0,0]=3 31427 B14R1.891 CCCCCOCCOCC1CCO1 7a_100011215259_100000103362 [0,1,0,1,0,0|1,0,0]=3 31428 B14R1.891 CCCCCOCCOCC1COC1 34a_100011215259_100010264016 [0,1,0,1,0,0|2,0,0]=4 31429 B14R1.891 CCCCCOCCOCC1COC1 7a_100011215259_100010264016 [0,1,0,1,0,0|2,0,0]=4 31430 B14R1.891 CCCCNCCCCOC1CCC1 34a_200011216965_100000749161 [0,1,0,1,0,0|2,0,0]=4 31431 B14R1.891 CCCCNCCCCOC1COC1 34a_200011216965_100009818527 [0,1,0,1,0,0|2,0,0]=4 31432 B14R1.891 CCCCOCCCCOC1CCC1 34a_200000760531_100000749161 [0,1,0,1,0,0|2,0,0]=4 31433 B14R1.891 CCCCOCCCCOC1COC1 34a_200000760531_100009818527 [0,1,0,1,0,0|2,0,0]=4 31434 B14R1.891 CCCCOCCCCOC1COC1 7a_200000760531_100009818527 [0,1,0,1,0,0|2,0,0]=4 31435 B14R1.891 CCCCOCCCNCC1CCC1 2230a_200000211371_100000763275 [0,1,0,1,0,0|2,0,0]=4 31436 B14R1.891 CCCCOCCCNCC1CCC1 269862a_200000211371_100000753134 [0,1,0,1,0,0|2,0,0]=4 31437 B14R1.891 CCCCOCCCNCC1CCC1 34a_200000211371_100000763275 [0,1,0,1,0,0|2,0,0]=4 31438 B14R1.891 CCCCOCCCNCC1CCO1 2230a_200000211371_100000103362 [0,1,0,1,0,0|1,0,0]=3 31439 B14R1.891 CCCCOCCCNCC1CCO1 34a_200000211371_100000103362 [0,1,0,1,0,0|1,0,0]=3 31440 B14R1.891 CCCCOCCCNCC1COC1 2230a_200000211371_100010264016 [0,1,0,1,0,0|2,0,0]=4 31441 B14R1.891 CCCCOCCCNCC1COC1 34a_200000211371_100010264016 [0,1,0,1,0,0|2,0,0]=4 31442 B14R1.891 CCCCOCCCOCC1CCC1 34a_200011215613_100000763275 [0,1,0,1,0,0|2,0,0]=4 31443 B14R1.891 CCCCOCCCOCC1CCC1 7a_200011215613_100000763275 [0,1,0,1,0,0|2,0,0]=4 31444 B14R1.891 CCCCOCCCOCC1CCO1 34a_200011215613_100000103362 [0,1,0,1,0,0|1,0,0]=3 31445 B14R1.891 CCCCOCCCOCC1CCO1 7a_200011215613_100000103362 [0,1,0,1,0,0|1,0,0]=3 31446 B14R1.891 CCCCOCCCOCC1COC1 34a_200011215613_100010264016 [0,1,0,1,0,0|2,0,0]=4 31447 B14R1.891 CCCCOCCCOCC1COC1 7a_200011215613_100010264016 [0,1,0,1,0,0|2,0,0]=4 31448 B14R1.891 CCCCOCCOCCC1COC1 34a_100009855314_100000743108 [0,1,0,1,0,0|2,0,0]=4 31449 B14R1.891 CCOCCOCCNCC1CCO1 2230a_100102712874_100000103362 [0,1,0,1,0,0|2,0,0]=4 31450 B14R1.891 CCOCCOCCNCC1CCO1 34a_100102712874_100000103362 [0,1,0,1,0,0|2,0,0]=4 31451 B14R1.891 CCOCCOCCNC[C@@H]1CCO1 2230a_100020831831_100011211534 [0,1,0,1,0,0|2,0,0]=4 31452 B14R1.891 CCOCCOCCNC[C@@H]1CCO1 34a_100020831831_100011211534 [0,1,0,1,0,0|2,0,0]=4 31453 B14R1.891 CCOCCOCCOCC1CCO1 34a_100000039022_100011211534 [0,1,0,1,0,0|2,0,0]=4 31454 B14R1.891 CCOCCOCCOCC1CCO1 34a_100000210240_100000103362 [0,1,0,1,0,0|2,0,0]=4 31455 B14R1.891 CCOCCOCCOCC1CCO1 7a_100000210240_100000103362 [0,1,0,1,0,0|2,0,0]=4 31456 B14R1.891 CCOCCOCCSCC1CCO1 62a_100000103362_100011211534 [0,1,0,1,0,0|2,0,0]=4 31457 B14R1.891 CCOCCOCCSCC1CCO1 62a_100011211534_100000103362 [0,1,0,1,0,0|2,0,0]=4 31458 B14R1.891 COCCCCCCNCC1CCC1 2230a_100000738700_100011998445 [0,1,0,1,0,0|1,0,0]=3 31459 B14R1.891 COCCCCCCNCC1CCC1 34a_100000738700_100011998445 [0,1,0,1,0,0|1,0,0]=3 31460 B14R1.891 COCCCCCCNCC1COC1 2230a_100015281925_100011998445 [0,1,0,1,0,0|2,0,0]=4 31461 B14R1.891 COCCCCCCNCC1COC1 34a_100015281925_100011998445 [0,1,0,1,0,0|2,0,0]=4 31462 B14R1.891 COCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100011998445 [0,1,0,1,0,0|1,0,0]=3 31463 B14R1.891 COCCCCCCNC[C@@H]1CCO1 34a_100020831831_100011998445 [0,1,0,1,0,0|1,0,0]=3 31464 B14R1.891 COCCCCCCOCC1CCC1 34a_100000760304_100011998445 [0,1,0,1,0,0|1,0,0]=3 31465 B14R1.891 COCCCCCCOCC1CCC1 34a_200012092642_100000763275 [0,1,0,1,0,0|1,0,0]=3 31466 B14R1.891 COCCCCCCOCC1CCC1 7a_200012092642_100000763275 [0,1,0,1,0,0|1,0,0]=3 31467 B14R1.891 COCCCCCCOCC1CCO1 34a_100000039022_100011998445 [0,1,0,1,0,0|1,0,0]=3 31468 B14R1.891 COCCCCCCOCC1CCO1 34a_200012092642_100000103362 [0,1,0,1,0,0|1,0,0]=3 31469 B14R1.891 COCCCCCCOCC1CCO1 7a_200012092642_100000103362 [0,1,0,1,0,0|1,0,0]=3 31470 B14R1.891 COCCCCCCOCC1CNC1 34a_100016987283_100011998445 [0,1,0,1,0,0|2,0,0]=4 31471 B14R1.891 COCCCCCCOCC1COC1 34a_100000060846_100011998445 [0,1,0,1,0,0|2,0,0]=4 31472 B14R1.891 COCCCCCCOCC1COC1 34a_200012092642_100010264016 [0,1,0,1,0,0|2,0,0]=4 31473 B14R1.891 COCCCCCCOCC1COC1 7a_200012092642_100010264016 [0,1,0,1,0,0|2,0,0]=4 31474 B14R1.891 COCCCCCCSCC1CCC1 62a_100000763275_100011998445 [0,1,0,1,0,0|1,0,0]=3 31475 B14R1.891 COCCCCCCSCC1CCC1 62a_100011998445_100000763275 [0,1,0,1,0,0|1,0,0]=3 31476 B14R1.891 COCCCCCCSCC1CCO1 62a_100000103362_100011998445 [0,1,0,1,0,0|1,0,0]=3 31477 B14R1.891 COCCCCCCSCC1CCO1 62a_100011998445_100000103362 [0,1,0,1,0,0|1,0,0]=3 31478 B14R1.891 COCCCCCCSCC1COC1 62a_100010264016_100011998445 [0,1,0,1,0,0|2,0,0]=4 31479 B14R1.891 COCCCCCCSCC1COC1 62a_100011998445_100010264016 [0,1,0,1,0,0|2,0,0]=4 31480 B14R1.891 COCCCOCCCOC1CCC1 34a_200011215475_100000749161 [0,1,0,1,0,0|2,0,0]=4 31481 B14R1.891 COCCOCCCNCC1CCC1 2230a_100000206027_100000763275 [0,1,0,1,0,0|2,0,0]=4 31482 B14R1.891 COCCOCCCNCC1CCC1 2230a_100000738700_100011216529 [0,1,0,1,0,0|2,0,0]=4 31483 B14R1.891 COCCOCCCNCC1CCC1 269862a_100000206027_100000753134 [0,1,0,1,0,0|2,0,0]=4 31484 B14R1.891 COCCOCCCNCC1CCC1 34a_100000206027_100000763275 [0,1,0,1,0,0|2,0,0]=4 31485 B14R1.891 COCCOCCCNCC1CCC1 34a_100000738700_100011216529 [0,1,0,1,0,0|2,0,0]=4 31486 B14R1.891 COCCOCCCNCC1CCO1 2230a_100000206027_100000103362 [0,1,0,1,0,0|2,0,0]=4 31487 B14R1.891 COCCOCCCNCC1CCO1 34a_100000206027_100000103362 [0,1,0,1,0,0|2,0,0]=4 31488 B14R1.891 COCCOCCCNC[C@@H]1CCO1 2230a_100020831831_100011216529 [0,1,0,1,0,0|2,0,0]=4 31489 B14R1.891 COCCOCCCNC[C@@H]1CCO1 34a_100020831831_100011216529 [0,1,0,1,0,0|2,0,0]=4 31490 B14R1.891 COCCOCCCOCC1CCC1 34a_100000760304_100011216529 [0,1,0,1,0,0|2,0,0]=4 31491 B14R1.891 COCCOCCCOCC1CCO1 34a_100000039022_100011216529 [0,1,0,1,0,0|2,0,0]=4 31492 B14R1.891 COCCOCCCSCC1CCC1 62a_100000763275_100011216529 [0,1,0,1,0,0|2,0,0]=4 31493 B14R1.891 COCCOCCCSCC1CCC1 62a_100011216529_100000763275 [0,1,0,1,0,0|2,0,0]=4 31494 B14R1.891 COCCOCCCSCC1CCO1 62a_100000103362_100011216529 [0,1,0,1,0,0|2,0,0]=4 31495 B14R1.891 COCCOCCCSCC1CCO1 62a_100011216529_100000103362 [0,1,0,1,0,0|2,0,0]=4 31496 B14R1.891 ClCCCCCCCCOC1CCC1 34a_100000033203_100000749161 [0,1,0,1,0,0|1,0,0]=3 31497 B14R1.891 ClCCCCCCCCOC1COC1 34a_100000033203_100009818527 [0,1,0,1,0,0|2,0,0]=4 31498 B14R1.891 ClCCCCCCCCOC1COC1 7a_100000033203_100009818527 [0,1,0,1,0,0|2,0,0]=4 31499 B14R1.891 FCCCCCCOCCC1COC1 34a_100009855314_100015922095 [0,1,0,1,0,0|2,0,0]=4 31500 B14R1.891 N#CCCCCCCNCC1CCC1 2230a_100000738700_100009813337 [0,1,0,1,0,0|1,0,1]=4 31501 B14R1.891 N#CCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100009813337 [0,1,0,1,0,0|1,0,1]=4 31502 B14R1.891 N#CCCCCCCSCC1CCC1 62a_100000763275_100009813337 [0,1,0,1,0,0|1,0,1]=4 31503 B14R1.891 N#CCCCCCCSCC1CCC1 62a_100009813337_100000763275 [0,1,0,1,0,0|1,0,1]=4 31504 B14R1.891 N#CCCCCCCSCC1CCO1 62a_100000103362_100009813337 [0,1,0,1,0,0|1,0,1]=4 31505 B14R1.891 N#CCCCCCCSCC1CCO1 62a_100009813337_100000103362 [0,1,0,1,0,0|1,0,1]=4 31506 B14R1.891 NCCCCCCCCOC1CCC1 34a_102515433106_100000749161 [0,1,0,1,0,0|1,0,0]=3 31507 B14R1.891 NCCCCCCCCOC1COC1 34a_102515433106_100009818527 [0,1,0,1,0,0|2,0,0]=4 31508 B14R1.891 NCCCCCCCOCC1CCC1 34a_100011996573_100000763275 [0,1,0,1,0,0|1,0,0]=3 31509 B14R1.891 NCCCCCCCOCC1CCO1 34a_100011996573_100000103362 [0,1,0,1,0,0|1,0,0]=3 31510 B14R1.891 NCCCCCCCOCC1COC1 34a_100011996573_100010264016 [0,1,0,1,0,0|2,0,0]=4 31511 B14R1.891 NCCCOCCCOCC1CCC1 34a_100011310245_100000763275 [0,1,0,1,0,0|2,0,0]=4 31512 B14R1.891 NCCCOCCCOCC1CCO1 34a_100011310245_100000103362 [0,1,0,1,0,0|2,0,0]=4 31513 B14R1.891 NCCNCCCCCOC1CCC1 34a_103619048469_100000749161 [0,1,0,1,0,0|2,0,0]=4 31514 B14R1.891 OCCCCCCCCCN1CCC1 269982a_100000754969_100009813782 [0,1,0,1,0,0|0,0,0]=2 31515 B14R1.891 OCCCCCCCCNC1CCC1 2230a_100000749019_100000033203 [0,1,0,1,0,0|0,0,0]=2 31516 B14R1.891 OCCCCCCCCNC1CCC1 270004a_102515433106_100000241760 [0,1,0,1,0,0|0,0,0]=2 31517 B14R1.891 OCCCCCCCCNC1CCC1 34a_100000749019_100000033203 [0,1,0,1,0,0|0,0,0]=2 31518 B14R1.891 OCCCCCCCCNC1CCC1 34a_102515433106_100000749161 [0,1,0,1,0,0|0,0,0]=2 31519 B14R1.891 OCCCCCCCCNC1COC1 2230a_100016991112_100000033203 [0,1,0,1,0,0|1,0,0]=3 31520 B14R1.891 OCCCCCCCCNC1COC1 34a_102515433106_100009818527 [0,1,0,1,0,0|1,0,0]=3 31521 B14R1.891 OCCCCCCCCOC1CCC1 34a_100000748187_100000033203 [0,1,0,1,0,0|0,0,0]=2 31522 B14R1.891 OCCCCCCCCOC1CSC1 7a_100000072292_100000033203 [0,1,0,1,0,0|1,0,0]=3 31523 B14R1.891 OCCCCCCCCSC1CCC1 62a_100000033203_100000749161 [0,1,0,1,0,0|0,0,0]=2 31524 B14R1.891 OCCCCCCCCSC1COC1 62a_100000033203_100009818527 [0,1,0,1,0,0|1,0,0]=3 31525 B14R1.891 OCCCCCCCNCC1CCC1 2230a_100000738700_100000760002 [0,1,0,1,0,0|0,0,0]=2 31526 B14R1.891 OCCCCCCCNCC1CCC1 2230a_100011996573_100000763275 [0,1,0,1,0,0|0,0,0]=2 31527 B14R1.891 OCCCCCCCNCC1CCC1 269862a_100011996573_100000753134 [0,1,0,1,0,0|0,0,0]=2 31528 B14R1.891 OCCCCCCCNCC1CCC1 34a_100000738700_100000760002 [0,1,0,1,0,0|0,0,0]=2 31529 B14R1.891 OCCCCCCCNCC1CCC1 34a_100011996573_100000763275 [0,1,0,1,0,0|0,0,0]=2 31530 B14R1.891 OCCCCCCCNCC1CCO1 2230a_100011996573_100000103362 [0,1,0,1,0,0|1,0,0]=3 31531 B14R1.891 OCCCCCCCNCC1CCO1 34a_100011996573_100000103362 [0,1,0,1,0,0|1,0,0]=3 31532 B14R1.891 OCCCCCCCNCC1COC1 2230a_100011996573_100010264016 [0,1,0,1,0,0|1,0,0]=3 31533 B14R1.891 OCCCCCCCNCC1COC1 2230a_100015281925_100000760002 [0,1,0,1,0,0|1,0,0]=3 31534 B14R1.891 OCCCCCCCNCC1COC1 34a_100011996573_100010264016 [0,1,0,1,0,0|1,0,0]=3 31535 B14R1.891 OCCCCCCCNCC1COC1 34a_100015281925_100000760002 [0,1,0,1,0,0|1,0,0]=3 31536 B14R1.891 OCCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100000760002 [0,1,0,1,0,0|1,0,0]=3 31537 B14R1.891 OCCCCCCCNC[C@@H]1CCO1 34a_100020831831_100000760002 [0,1,0,1,0,0|1,0,0]=3 31538 B14R1.891 OCCCCCCCOCC1CCC1 34a_100000760304_100000760002 [0,1,0,1,0,0|0,0,0]=2 31539 B14R1.891 OCCCCCCCOCC1CCO1 34a_100000039022_100000760002 [0,1,0,1,0,0|1,0,0]=3 31540 B14R1.891 OCCCCCCCOCC1CNC1 34a_100016987283_100000760002 [0,1,0,1,0,0|1,0,0]=3 31541 B14R1.891 OCCCCCCCOCC1COC1 34a_100000060846_100000760002 [0,1,0,1,0,0|1,0,0]=3 31542 B14R1.891 OCCCCCCCSCC1CCC1 62a_100000760002_100000763275 [0,1,0,1,0,0|0,0,0]=2 31543 B14R1.891 OCCCCCCCSCC1CCC1 62a_100000763275_100000760002 [0,1,0,1,0,0|0,0,0]=2 31544 B14R1.891 OCCCCCCCSCC1CCO1 62a_100000103362_100000760002 [0,1,0,1,0,0|1,0,0]=3 31545 B14R1.891 OCCCCCCCSCC1CCO1 62a_100000760002_100000103362 [0,1,0,1,0,0|1,0,0]=3 31546 B14R1.891 OCCCCCCCSCC1COC1 62a_100000760002_100010264016 [0,1,0,1,0,0|1,0,0]=3 31547 B14R1.891 OCCCCCCCSCC1COC1 62a_100010264016_100000760002 [0,1,0,1,0,0|1,0,0]=3 31548 B14R1.891 OCCCCCCOCCC1COC1 34a_100009855314_100000766143 [0,1,0,1,0,0|1,0,0]=3 31549 B14R1.891 OCCCOCCCNCC1CCC1 2230a_100011310245_100000763275 [0,1,0,1,0,0|1,0,0]=3 31550 B14R1.891 OCCCOCCCNCC1CCC1 269862a_100011310245_100000753134 [0,1,0,1,0,0|1,0,0]=3 31551 B14R1.891 OCCCOCCCNCC1CCC1 34a_100011310245_100000763275 [0,1,0,1,0,0|1,0,0]=3 31552 B14R1.891 OCCCOCCCNCC1CCO1 2230a_100011310245_100000103362 [0,1,0,1,0,0|2,0,0]=4 31553 B14R1.891 OCCCOCCCNCC1CCO1 34a_100011310245_100000103362 [0,1,0,1,0,0|2,0,0]=4 31554 B14R1.891 OCCCOCCCNCC1COC1 2230a_100011310245_100010264016 [0,1,0,1,0,0|2,0,0]=4 31555 B14R1.891 OCCCOCCCNCC1COC1 34a_100011310245_100010264016 [0,1,0,1,0,0|2,0,0]=4 31556 B14R1.891 OCCOCCOCCNC1CCC1 2230a_100000749019_100000032323 [0,1,0,1,0,0|2,0,0]=4 31557 B14R1.891 OCCOCCOCCNC1CCC1 270004a_100011998139_100000241760 [0,1,0,1,0,0|2,0,0]=4 31558 B14R1.891 OCCOCCOCCNC1CCC1 34a_100000749019_100000032323 [0,1,0,1,0,0|2,0,0]=4 31559 B14R1.891 OCCOCCOCCNC1CCC1 34a_100011998139_100000749161 [0,1,0,1,0,0|2,0,0]=4 31560 B14R1.891 OCCOCCOCCOC1CCC1 34a_100000748187_100000032323 [0,1,0,1,0,0|2,0,0]=4 31561 B14R1.891 OCCOCCOCCSC1CCC1 62a_100000032323_100000749161 [0,1,0,1,0,0|2,0,0]=4 31562 B14R1.1224 CCC(C)CN1CCCCCCCC1 2230a_100000039187_100000748023 [0,1,0,1,0,0|2,0,0]=4 31563 B14R1.1224 CCC(C)CN1CCCCCCCC1 269982a_100000039187_100000748023 [0,1,0,1,0,0|2,0,0]=4 31564 B14R1.1224 CCC(C)CN1CCCCCCCC1 270004a_100000039187_100000243153 [0,1,0,1,0,0|2,0,0]=4 31565 B14R1.1224 CCC(C)CN1CCCCCCCC1 34a_100000039187_100000748023 [0,1,0,1,0,0|2,0,0]=4 31566 B14R1.1224 CCC(C)NC1CCCCCCCC1 270004a_100000209981_100000038600 [0,1,0,1,0,0|2,0,0]=4 31567 B14R1.1224 CCC(O)CN1CCCCCCCC1 2230a_100000039187_100011218378 [0,1,0,1,0,0|2,0,0]=4 31568 B14R1.1224 CCC(O)CN1CCCCCCCC1 269982a_100000039187_100011218378 [0,1,0,1,0,0|2,0,0]=4 31569 B14R1.1224 CCC(O)CN1CCCCCCCC1 34a_100000039187_100011218378 [0,1,0,1,0,0|2,0,0]=4 31570 B14R1.1224 CC[C@H](C)CN1CCCCCCCC1 2230a_100000039187_100009816398 [0,1,0,1,0,0|2,0,0]=4 31571 B14R1.1224 CC[C@H](C)CN1CCCCCCCC1 269982a_100000039187_100009816398 [0,1,0,1,0,0|2,0,0]=4 31572 B14R1.1224 CC[C@H](C)CN1CCCCCCCC1 34a_100000039187_100009816398 [0,1,0,1,0,0|2,0,0]=4 31573 B14R1.1224 C[C@@H](CO)CN1CCCCCCCC1 2230a_100000039187_100000059175 [0,1,0,1,0,0|1,0,0]=3 31574 B14R1.1224 C[C@@H](CO)CN1CCCCCCCC1 269982a_100000039187_100000059175 [0,1,0,1,0,0|1,0,0]=3 31575 B14R1.1224 C[C@@H](CO)CN1CCCCCCCC1 34a_100000039187_100000059175 [0,1,0,1,0,0|1,0,0]=3 31576 B14R1.1224 C[C@H](CF)NC1CCCCCCCC1 270004a_100102880703_100000038600 [0,1,0,1,0,0|2,0,0]=4 31577 B14R1.1224 C[C@H](CO)NC1CCCCCCCC1 270004a_100000737577_100000038600 [0,1,0,1,0,0|1,0,0]=3 31578 B14R1.1224 OCC(O)CN1CCCCCCCC1 2230a_100000039187_100011219619 [0,1,0,1,0,0|1,0,0]=3 31579 B14R1.1224 OCC(O)CN1CCCCCCCC1 34a_100000039187_100011219619 [0,1,0,1,0,0|1,0,0]=3 31580 B14R1.1224 OC[C@H](O)CN1CCCCCCCC1 2230a_100000039187_100009815848 [0,1,0,1,0,0|1,0,0]=3 31581 B14R1.1224 OC[C@H](O)CN1CCCCCCCC1 34a_100000039187_100009815848 [0,1,0,1,0,0|1,0,0]=3 31582 B14R1.1224 O[C@@H](CF)CN1CCCCCCCC1 2230a_100000039187_100015614560 [0,1,0,1,0,0|2,0,0]=4 31583 B14R1.1224 O[C@@H](CF)CN1CCCCCCCC1 34a_100000039187_100015614560 [0,1,0,1,0,0|2,0,0]=4 31584 B14R1.1586 CC(CN)COCC1CCCCCC1 34a_100000744482_200000696569 [0,1,0,1,0,0|2,0,0]=4 31585 B14R1.1586 CC(CO)CCNC1CCCCCC1 270004a_106354213184_100000210131 [0,1,0,1,0,0|1,0,0]=3 31586 B14R1.1586 CC(CO)CCNC1CCCCCC1 34a_106354213184_100011217769 [0,1,0,1,0,0|1,0,0]=3 31587 B14R1.1586 CC(CO)CCNC1CCCNCC1 270004a_106354213184_100015187895 [0,1,0,1,0,0|2,0,0]=4 31588 B14R1.1586 CC(CO)CNCC1CCCCCC1 269862a_100000744482_200000763224 [0,1,0,1,0,0|1,0,0]=3 31589 B14R1.1586 CC(CO)CNCC1CCCCCC1 34a_100000744482_200000696569 [0,1,0,1,0,0|1,0,0]=3 31590 B14R1.1586 CC(CO)NCCC1CCCCCC1 2230a_100011532351_100012180447 [0,1,0,1,0,0|1,0,0]=3 31591 B14R1.1586 CC(CO)NCCC1CCCCCC1 34a_100011532351_100012180447 [0,1,0,1,0,0|1,0,0]=3 31592 B14R1.1586 CC(CO)OCCN1CCCCCC1 34a_100000238007_100012180447 [0,1,0,1,0,0|2,0,0]=4 31593 B14R1.1586 CC(CO)SCCN1CCCCCC1 62a_100012180447_100000722644 [0,1,0,1,0,0|2,0,0]=4 31594 B14R1.1586 CCC(C)CCNC1CCCCCC1 270004a_100020591266_100000210131 [0,1,0,1,0,0|2,0,0]=4 31595 B14R1.1586 CCC(C)CNCC1CCCCCC1 2230a_100015204231_100000748023 [0,1,0,1,0,0|2,0,0]=4 31596 B14R1.1586 CCC(C)CNCC1CCCCCC1 2230a_100020588543_200000696569 [0,1,0,1,0,0|2,0,0]=4 31597 B14R1.1586 CCC(C)CNCC1CCCCCC1 269862a_100020588543_200000763224 [0,1,0,1,0,0|2,0,0]=4 31598 B14R1.1586 CCC(C)CNCC1CCCCCC1 270004a_100015204231_100000243153 [0,1,0,1,0,0|2,0,0]=4 31599 B14R1.1586 CCC(C)CNCC1CCCCCC1 34a_100015204231_100000748023 [0,1,0,1,0,0|2,0,0]=4 31600 B14R1.1586 CCC(C)COCC1CCCCCC1 34a_100000699130_100000748023 [0,1,0,1,0,0|2,0,0]=4 31601 B14R1.1586 CCC(C)COCC1CCCCCC1 7a_100000699130_100000748023 [0,1,0,1,0,0|2,0,0]=4 31602 B14R1.1586 CCC(C)CSCC1CCCCCC1 62a_100000748023_200000696569 [0,1,0,1,0,0|2,0,0]=4 31603 B14R1.1586 CCC(C)CSCC1CCCCCC1 62a_200000696569_100000748023 [0,1,0,1,0,0|2,0,0]=4 31604 B14R1.1586 CCC(C)NCCC1CCCCCC1 2230a_100011532351_100000758301 [0,1,0,1,0,0|2,0,0]=4 31605 B14R1.1586 CCC(C)NCCC1CCCCCC1 34a_100011532351_100011215416 [0,1,0,1,0,0|2,0,0]=4 31606 B14R1.1586 CCC(O)CNCC1CCCCCC1 2230a_100011218483_200000696569 [0,1,0,1,0,0|2,0,0]=4 31607 B14R1.1586 CCC(O)CNCC1CCCCCC1 2230a_100015204231_100011218378 [0,1,0,1,0,0|2,0,0]=4 31608 B14R1.1586 CCC(O)CNCC1CCCCCC1 269862a_100011218483_200000763224 [0,1,0,1,0,0|2,0,0]=4 31609 B14R1.1586 CCC(O)CNCC1CCCCCC1 34a_100015204231_100011218378 [0,1,0,1,0,0|2,0,0]=4 31610 B14R1.1586 CCC(O)COCC1CCCCCC1 34a_100000699130_100011218378 [0,1,0,1,0,0|2,0,0]=4 31611 B14R1.1586 CCC(O)COCC1CCCCCC1 7a_100000699130_100011218378 [0,1,0,1,0,0|2,0,0]=4 31612 B14R1.1586 CCC(O)CSCC1CCCCCC1 62a_100011218378_200000696569 [0,1,0,1,0,0|2,0,0]=4 31613 B14R1.1586 CCC(O)CSCC1CCCCCC1 62a_200000696569_100011218378 [0,1,0,1,0,0|2,0,0]=4 31614 B14R1.1586 CC[C@H](C)CNCC1CCCCCC1 2230a_100015204231_100009816398 [0,1,0,1,0,0|2,0,0]=4 31615 B14R1.1586 CC[C@H](C)CNCC1CCCCCC1 34a_100015204231_100009816398 [0,1,0,1,0,0|2,0,0]=4 31616 B14R1.1586 CC[C@H](C)COCC1CCCCCC1 34a_100000699130_100009816398 [0,1,0,1,0,0|2,0,0]=4 31617 B14R1.1586 CC[C@H](C)COCC1CCCCCC1 7a_100000699130_100009816398 [0,1,0,1,0,0|2,0,0]=4 31618 B14R1.1586 CC[C@H](C)COCC1CCCCCC1 7a_100009816381_200000696569 [0,1,0,1,0,0|2,0,0]=4 31619 B14R1.1586 CC[C@H](C)CSCC1CCCCCC1 62a_100009816398_200000696569 [0,1,0,1,0,0|2,0,0]=4 31620 B14R1.1586 CC[C@H](C)CSCC1CCCCCC1 62a_200000696569_100009816398 [0,1,0,1,0,0|2,0,0]=4 31621 B14R1.1586 C[C@@H](CO)CNCC1CCCCCC1 2230a_100015204231_100000059175 [0,1,0,1,0,0|1,0,0]=3 31622 B14R1.1586 C[C@@H](CO)CNCC1CCCCCC1 34a_100015204231_100000059175 [0,1,0,1,0,0|1,0,0]=3 31623 B14R1.1586 C[C@@H](CO)COCC1CCCCCC1 34a_100000699130_100000059175 [0,1,0,1,0,0|1,0,0]=3 31624 B14R1.1586 C[C@@H](CO)COCC1CCCCCC1 7a_100000699130_100000059175 [0,1,0,1,0,0|1,0,0]=3 31625 B14R1.1586 C[C@@H](CO)CSCC1CCCCCC1 62a_100000059175_200000696569 [0,1,0,1,0,0|1,0,0]=3 31626 B14R1.1586 C[C@@H](CO)CSCC1CCCCCC1 62a_200000696569_100000059175 [0,1,0,1,0,0|1,0,0]=3 31627 B14R1.1586 C[C@H](CO)SCCN1CCCCCC1 62a_100000722644_100016084084 [0,1,0,1,0,0|2,0,0]=4 31628 B14R1.1586 C[C@H](CO)SCCN1CCCCCC1 62a_100016084084_100000722644 [0,1,0,1,0,0|2,0,0]=4 31629 B14R1.1586 ClCC(Cl)COCC1CCCCCC1 34a_100000033668_200000696569 [0,1,0,1,0,0|2,0,0]=4 31630 B14R1.1586 NC[C@@H](F)COCC1CCCCCC1 34a_100015665980_200000696569 [0,1,0,1,0,0|2,0,0]=4 31631 B14R1.1586 O=C(CO)NCCC1CCCCCC1 240690a_100011532351_100000210174 [0,1,0,1,0,0|1,0,1]=4 31632 B14R1.1586 O=C(CO)NCCC1CCCCCC1 527a_100011532351_100000210174 [0,1,0,1,0,0|1,0,1]=4 31633 B14R1.1586 OCC(O)CNCC1CCCCCC1 2230a_100015204231_100011219619 [0,1,0,1,0,0|1,0,0]=3 31634 B14R1.1586 OCC(O)CNCC1CCCCCC1 34a_100015204231_100011219619 [0,1,0,1,0,0|1,0,0]=3 31635 B14R1.1586 OCC(O)COCC1CCCCCC1 34a_100000699130_100011219619 [0,1,0,1,0,0|1,0,0]=3 31636 B14R1.1586 OCC(O)COCC1CCCCCC1 7a_100000699130_100011219619 [0,1,0,1,0,0|1,0,0]=3 31637 B14R1.1586 OCC(O)CSCC1CCCCCC1 62a_100011219619_200000696569 [0,1,0,1,0,0|1,0,0]=3 31638 B14R1.1586 OCC(O)CSCC1CCCCCC1 62a_200000696569_100011219619 [0,1,0,1,0,0|1,0,0]=3 31639 B14R1.1586 OC[C@@H](O)CNCC1CCCCCC1 2230a_100020644852_200000696569 [0,1,0,1,0,0|1,0,0]=3 31640 B14R1.1586 OC[C@@H](O)CNCC1CCCCCC1 269862a_100020644852_200000763224 [0,1,0,1,0,0|1,0,0]=3 31641 B14R1.1586 OC[C@H](F)CNCC1CCCCCC1 269862a_100015665980_200000763224 [0,1,0,1,0,0|1,0,0]=3 31642 B14R1.1586 OC[C@H](F)CNCC1CCCCCC1 34a_100015665980_200000696569 [0,1,0,1,0,0|1,0,0]=3 31643 B14R1.1586 OC[C@H](O)CNCC1CCCCCC1 2230a_100015204231_100009815848 [0,1,0,1,0,0|1,0,0]=3 31644 B14R1.1586 OC[C@H](O)CNCC1CCCCCC1 34a_100015204231_100009815848 [0,1,0,1,0,0|1,0,0]=3 31645 B14R1.1586 OC[C@H](O)COCC1CCCCCC1 34a_100000699130_100009815848 [0,1,0,1,0,0|1,0,0]=3 31646 B14R1.1586 OC[C@H](O)COCC1CCCCCC1 7a_100000699130_100009815848 [0,1,0,1,0,0|1,0,0]=3 31647 B14R1.1586 OC[C@H](O)CSCC1CCCCCC1 62a_100009815848_200000696569 [0,1,0,1,0,0|1,0,0]=3 31648 B14R1.1586 OC[C@H](O)CSCC1CCCCCC1 62a_200000696569_100009815848 [0,1,0,1,0,0|1,0,0]=3 31649 B14R1.1586 O[C@@H](CF)CNCC1CCCCCC1 2230a_100015204231_100015614560 [0,1,0,1,0,0|2,0,0]=4 31650 B14R1.1586 O[C@@H](CF)CNCC1CCCCCC1 34a_100015204231_100015614560 [0,1,0,1,0,0|2,0,0]=4 31651 B14R1.1586 O[C@@H](CF)COCC1CCCCCC1 34a_100000699130_100015614560 [0,1,0,1,0,0|2,0,0]=4 31652 B14R1.1586 O[C@@H](CF)COCC1CCCCCC1 7a_100000699130_100015614560 [0,1,0,1,0,0|2,0,0]=4 31653 B14R1.1586 O[C@@H](CF)CSCC1CCCCCC1 62a_100015614560_200000696569 [0,1,0,1,0,0|2,0,0]=4 31654 B14R1.1586 O[C@@H](CF)CSCC1CCCCCC1 62a_200000696569_100015614560 [0,1,0,1,0,0|2,0,0]=4 31655 B14R1.2392 CCCCCN1CCOCC(C1)CO 2230a_100103147999_100000210326 [0,1,0,1,0,0|2,0,0]=4 31656 B14R1.2392 CCCCCN1CCOCC(C1)CO 269982a_100103147999_100000210215 [0,1,0,1,0,0|2,0,0]=4 31657 B14R1.2392 CCCCCN1CCOCC(C1)CO 34a_100103147999_100000718602 [0,1,0,1,0,0|2,0,0]=4 31658 B14R1.3454 CCC1CCC(C1)NCCCCCO 270004a_100000762737_100011218773 [0,1,0,1,0,0|1,0,0]=3 31659 B14R1.3454 CCC1CCC(C1)NCCOCCO 270004a_100000211614_100011218773 [0,1,0,1,0,0|2,0,0]=4 31660 B14R1.3454 CCC1CCC(C1)NCCSCCO 270004a_100011219999_100011218773 [0,1,0,1,0,0|2,0,0]=4 31661 B14R1.3454 CCCCCCCN1CCC(C1)CO 2230a_100000748654_100000210681 [0,1,0,1,0,0|1,0,0]=3 31662 B14R1.3454 CCCCCCCN1CCC(C1)CO 269982a_100000748654_100000210681 [0,1,0,1,0,0|1,0,0]=3 31663 B14R1.3454 CCCCCCCN1CCC(C1)CO 34a_100000748654_100000210614 [0,1,0,1,0,0|1,0,0]=3 31664 B14R1.3454 CCCCCCNC1CCC(C1)CC 270004a_100000210581_100011218773 [0,1,0,1,0,0|2,0,0]=4 31665 B14R1.3454 CCCCCNC[C@@H]1CC[C@@H](C1)CO 34a_206354213956_100000718602 [0,1,0,1,0,0|1,0,0]=3 31666 B14R1.3454 CCCCCOC[C@H]1CC[C@H](C1)CN 34a_206354213956_100000718602 [0,1,0,1,0,0|2,0,0]=4 31667 B14R1.3454 CCCCOCCN1CCC(C1)CO 2230a_100000748654_100000743108 [0,1,0,1,0,0|2,0,0]=4 31668 B14R1.3454 CCCCOCCN1CCC(C1)CO 269982a_100000748654_100000743108 [0,1,0,1,0,0|2,0,0]=4 31669 B14R1.3454 CCCCOCCN1CCC(C1)CO 34a_100000748654_100000743108 [0,1,0,1,0,0|2,0,0]=4 31670 B14R1.3454 CCN1CCC(C1)CNCCCCO 2230a_100000750430_100015184589 [0,1,0,1,0,0|2,0,0]=4 31671 B14R1.3454 CCN1CCC(C1)CNCCCCO 2230a_100011224064_100000210776 [0,1,0,1,0,0|2,0,0]=4 31672 B14R1.3454 CCN1CCC(C1)CSCCCCO 62a_100000210776_100015184589 [0,1,0,1,0,0|2,0,0]=4 31673 B14R1.3454 CCN1CCC(C1)CSCCCCO 62a_100015184589_100000210776 [0,1,0,1,0,0|2,0,0]=4 31674 B14R1.3454 CCN1CCC(C1)NCCCCCO 2230a_100015188829_100000746330 [0,1,0,1,0,0|2,0,0]=4 31675 B14R1.3454 CCN1CCC(C1)SCCCCCO 62a_100000746330_200011861547 [0,1,0,1,0,0|2,0,0]=4 31676 B14R1.3454 CCOCCNC[C@@H]1CC[C@@H](C1)CO 34a_206354213956_100000210147 [0,1,0,1,0,0|2,0,0]=4 31677 B14R1.3454 CCSCCNC[C@@H]1CC[C@@H](C1)CO 34a_206354213956_100000757381 [0,1,0,1,0,0|2,0,0]=4 31678 B14R1.3454 COCCCNC[C@@H]1CC[C@@H](C1)CO 34a_206354213956_100000740836 [0,1,0,1,0,0|2,0,0]=4 31679 B14R1.3454 CO[C@@H]1CCN(C1)CCCCCCO 2230a_100000766984_100000766143 [0,1,0,1,0,0|2,0,0]=4 31680 B14R1.3454 CO[C@@H]1CCN(C1)CCCCCCO 269982a_100000766984_100000766143 [0,1,0,1,0,0|2,0,0]=4 31681 B14R1.3454 NC[C@@H]1CC[C@@H](C1)COCCCCO 34a_206354213956_100011216708 [0,1,0,1,0,0|2,0,0]=4 31682 B14R1.3454 OCC1CCN(C1)CCCCCCF 2230a_100000748654_100015922095 [0,1,0,1,0,0|2,0,0]=4 31683 B14R1.3454 OCC1CCN(C1)CCCCCCF 269982a_100000748654_100015922095 [0,1,0,1,0,0|2,0,0]=4 31684 B14R1.3454 OCC1CCN(C1)CCCCCCF 34a_100000748654_100015922095 [0,1,0,1,0,0|2,0,0]=4 31685 B14R1.3454 OCCCCCCN1CCC(C1)CO 2230a_100000748654_100000766143 [0,1,0,1,0,0|2,0,0]=4 31686 B14R1.3454 OCCCCCCN1CCC(C1)CO 269982a_100000748654_100000766143 [0,1,0,1,0,0|2,0,0]=4 31687 B14R1.3454 OCCCCCCN1CCC(C1)CO 34a_100000748654_100000766143 [0,1,0,1,0,0|2,0,0]=4 31688 B14R1.3454 OCCCCNC[C@@H]1CC[C@@H](C1)CO 34a_206354213956_100011216708 [0,1,0,1,0,0|2,0,0]=4 31689 B14R1.3454 OC[C@H]1CC[C@H](C1)CNCCCCF 34a_206354213956_100000729493 [0,1,0,1,0,0|2,0,0]=4 31690 B14R1.4732 CCCCCCCCN1C[C@@H]([C@@H]1C)O 2230a_206633788156_100000210759 [0,1,0,1,0,0|2,0,0]=4 31691 B14R1.4732 CCCCCCCCN1C[C@@H]([C@@H]1C)O 269982a_206633788156_100000210759 [0,1,0,1,0,0|2,0,0]=4 31692 B14R1.4732 C[C@H]1[C@H](CN1CCCCCCCO)O 2230a_206633788156_100000760002 [0,1,0,1,0,0|1,0,0]=3 31693 B14R1.4732 C[C@H]1[C@H](CN1CCCCCCCO)O 269982a_206633788156_100000760002 [0,1,0,1,0,0|1,0,0]=3 31694 B14R1.6522 CC1(CC1)CNCCCCCCCO 2230a_100000766693_100000760002 [0,1,0,1,0,0|1,0,0]=3 31695 B14R1.6522 CC1(CC1)COCCCCCCCO 7a_100000698024_100000760002 [0,1,0,1,0,0|1,0,0]=3 31696 B14R1.6522 CC1(CC1)NCCCCCCCCO 2230a_100000757604_100000033203 [0,1,0,1,0,0|1,0,0]=3 31697 B14R1.6522 CC1(CC1)OCCCCCCCCO 7a_100011725673_100000033203 [0,1,0,1,0,0|1,0,0]=3 31698 B14R1.6522 CC1(CO1)CNCCCCCCCO 34a_100011996573_100000760498 [0,1,0,1,0,0|2,0,0]=4 31699 B14R1.6522 CC1(CO1)COCCCCCCCBr 34a_100000760002_100000760498 [0,1,0,1,0,0|2,0,0]=4 31700 B14R1.6522 CC1(CO1)COCCCCCCCN 34a_100011996573_100000760498 [0,1,0,1,0,0|2,0,0]=4 31701 B14R1.6522 CC1(CO1)CSCCCCCCCO 62a_100000760002_100000760498 [0,1,0,1,0,0|2,0,0]=4 31702 B14R1.6522 CC1(CO1)CSCCCCCCCO 62a_100000760498_100000760002 [0,1,0,1,0,0|2,0,0]=4 31703 B14R1.6522 CCCCCCCCCNC1(CC1)C 2230a_100000757604_100011214924 [0,1,0,1,0,0|2,0,0]=4 31704 B14R1.6522 CCCCCCCCCOC1(CC1)C 7a_100011725673_100000210328 [0,1,0,1,0,0|2,0,0]=4 31705 B14R1.6522 CCCCCCCCNCC1(CC1)C 2230a_100000766693_100000210759 [0,1,0,1,0,0|2,0,0]=4 31706 B14R1.6522 CCCCCCCCNCC1(CC1)O 2230a_100011936951_100000210759 [0,1,0,1,0,0|2,0,0]=4 31707 B14R1.6522 CCCCCCCCNCC1(CO1)C 34a_100000229939_100000760498 [0,1,0,1,0,0|1,0,0]=3 31708 B14R1.6522 CCCCCCCCOCC1(CC1)C 7a_100000698024_100000210759 [0,1,0,1,0,0|2,0,0]=4 31709 B14R1.6522 CCCCCCCCOCC1(CC1)F 34a_200000703853_100000210759 [0,1,0,1,0,0|2,0,0]=4 31710 B14R1.6522 CCCCCCCCOCC1(CC1)F 7a_200000703853_100000210759 [0,1,0,1,0,0|2,0,0]=4 31711 B14R1.6522 CCCCCCCCOCC1(CO1)C 34a_100000210232_100000760498 [0,1,0,1,0,0|1,0,0]=3 31712 B14R1.6522 CCCCCCCCSCC1(CO1)C 62a_100000210759_100000760498 [0,1,0,1,0,0|1,0,0]=3 31713 B14R1.6522 CCCCCCCCSCC1(CO1)C 62a_100000760498_100000210317 [0,1,0,1,0,0|1,0,0]=3 31714 B14R1.6522 CCCCCNCCOCC1(CO1)C 34a_100000224656_100000760498 [0,1,0,1,0,0|2,0,0]=4 31715 B14R1.6522 CCCCCOCCOCC1(CO1)C 34a_100011215259_100000760498 [0,1,0,1,0,0|2,0,0]=4 31716 B14R1.6522 CCCCOCCCNCC1(CO1)C 34a_200000211371_100000760498 [0,1,0,1,0,0|2,0,0]=4 31717 B14R1.6522 CCCCOCCCOCC1(CO1)C 34a_200011215613_100000760498 [0,1,0,1,0,0|2,0,0]=4 31718 B14R1.6522 COCCCCCCOCC1(CO1)C 34a_200012092642_100000760498 [0,1,0,1,0,0|2,0,0]=4 31719 B14R1.6522 COCCCCCCSCC1(CO1)C 62a_100000760498_100011998445 [0,1,0,1,0,0|2,0,0]=4 31720 B14R1.6522 COCCCCCCSCC1(CO1)C 62a_100011998445_100000760498 [0,1,0,1,0,0|2,0,0]=4 31721 B14R1.6522 OCCCCCCCNCC1(CC1)O 2230a_100011936951_100000760002 [0,1,0,1,0,0|1,0,0]=3 31722 B14R1.6522 OCCCCCCCOCC1(CC1)F 34a_200000703853_100000760002 [0,1,0,1,0,0|1,0,0]=3 31723 B14R1.6522 OCCCCCCCOCC1(CC1)F 7a_200000703853_100000760002 [0,1,0,1,0,0|1,0,0]=3 31724 B14R1.7684 CC(CO)OCC1CCCCCCC1 34a_100011216312_100012180447 [0,1,0,1,0,0|1,0,0]=3 31725 B14R1.7684 CC(CO)OCC1CCCCCCC1 7a_100011216312_100012180447 [0,1,0,1,0,0|1,0,0]=3 31726 B14R1.7684 CCC(C)CNC1CCCCCCC1 2230a_100000211152_100000748023 [0,1,0,1,0,0|2,0,0]=4 31727 B14R1.7684 CCC(C)CNC1CCCCCCC1 270004a_100000211152_100000243153 [0,1,0,1,0,0|2,0,0]=4 31728 B14R1.7684 CCC(C)CNC1CCCCCCC1 270004a_100020588543_100000210524 [0,1,0,1,0,0|2,0,0]=4 31729 B14R1.7684 CCC(C)CNC1CCCCCCC1 34a_100000211152_100000748023 [0,1,0,1,0,0|2,0,0]=4 31730 B14R1.7684 CCC(C)COC1CCCCCCC1 34a_100000210054_100000748023 [0,1,0,1,0,0|2,0,0]=4 31731 B14R1.7684 CCC(C)COC1CCCCCCC1 7a_100000210054_100000748023 [0,1,0,1,0,0|2,0,0]=4 31732 B14R1.7684 CCC(C)OCC1CCCCCCC1 34a_100011216312_100011215416 [0,1,0,1,0,0|2,0,0]=4 31733 B14R1.7684 CCC(C)OCC1CCCCCCC1 7a_100011216312_100000758301 [0,1,0,1,0,0|2,0,0]=4 31734 B14R1.7684 CCC(O)CNC1CCCCCCC1 2230a_100000211152_100011218378 [0,1,0,1,0,0|2,0,0]=4 31735 B14R1.7684 CCC(O)CNC1CCCCCCC1 270004a_100011218483_100000210524 [0,1,0,1,0,0|2,0,0]=4 31736 B14R1.7684 CCC(O)CNC1CCCCCCC1 34a_100000211152_100011218378 [0,1,0,1,0,0|2,0,0]=4 31737 B14R1.7684 CCC(O)COC1CCCCCCC1 34a_100000210054_100011218378 [0,1,0,1,0,0|2,0,0]=4 31738 B14R1.7684 CCC(O)COC1CCCCCCC1 7a_100000210054_100011218378 [0,1,0,1,0,0|2,0,0]=4 31739 B14R1.7684 CC[C@H](C)CNC1CCCCCCC1 2230a_100000211152_100009816398 [0,1,0,1,0,0|2,0,0]=4 31740 B14R1.7684 CC[C@H](C)CNC1CCCCCCC1 34a_100000211152_100009816398 [0,1,0,1,0,0|2,0,0]=4 31741 B14R1.7684 CC[C@H](C)COC1CCCCCCC1 34a_100000210054_100009816398 [0,1,0,1,0,0|2,0,0]=4 31742 B14R1.7684 CC[C@H](C)COC1CCCCCCC1 7a_100000210054_100009816398 [0,1,0,1,0,0|2,0,0]=4 31743 B14R1.7684 C[C@@H](CO)CNC1CCCCCCC1 2230a_100000211152_100000059175 [0,1,0,1,0,0|1,0,0]=3 31744 B14R1.7684 C[C@@H](CO)CNC1CCCCCCC1 34a_100000211152_100000059175 [0,1,0,1,0,0|1,0,0]=3 31745 B14R1.7684 C[C@@H](CO)COC1CCCCCCC1 34a_100000210054_100000059175 [0,1,0,1,0,0|1,0,0]=3 31746 B14R1.7684 C[C@@H](CO)COC1CCCCCCC1 7a_100000210054_100000059175 [0,1,0,1,0,0|1,0,0]=3 31747 B14R1.7684 OCC(O)CNC1CCCCCCC1 2230a_100000211152_100011219619 [0,1,0,1,0,0|1,0,0]=3 31748 B14R1.7684 OCC(O)CNC1CCCCCCC1 34a_100000211152_100011219619 [0,1,0,1,0,0|1,0,0]=3 31749 B14R1.7684 OCC(O)COC1CCCCCCC1 34a_100000210054_100011219619 [0,1,0,1,0,0|1,0,0]=3 31750 B14R1.7684 OCC(O)COC1CCCCCCC1 7a_100000210054_100011219619 [0,1,0,1,0,0|1,0,0]=3 31751 B14R1.7684 OC[C@H](F)CNC1CCCCCCC1 270004a_100015665980_100000210524 [0,1,0,1,0,0|1,0,0]=3 31752 B14R1.7684 OC[C@H](O)CNC1CCCCCCC1 2230a_100000211152_100009815848 [0,1,0,1,0,0|1,0,0]=3 31753 B14R1.7684 OC[C@H](O)CNC1CCCCCCC1 34a_100000211152_100009815848 [0,1,0,1,0,0|1,0,0]=3 31754 B14R1.7684 OC[C@H](O)COC1CCCCCCC1 34a_100000210054_100009815848 [0,1,0,1,0,0|1,0,0]=3 31755 B14R1.7684 OC[C@H](O)COC1CCCCCCC1 7a_100000210054_100009815848 [0,1,0,1,0,0|1,0,0]=3 31756 B14R1.7684 O[C@@H](CF)CNC1CCCCCCC1 2230a_100000211152_100015614560 [0,1,0,1,0,0|2,0,0]=4 31757 B14R1.7684 O[C@@H](CF)CNC1CCCCCCC1 34a_100000211152_100015614560 [0,1,0,1,0,0|2,0,0]=4 31758 B14R1.7684 O[C@@H](CF)COC1CCCCCCC1 34a_100000210054_100015614560 [0,1,0,1,0,0|2,0,0]=4 31759 B14R1.7684 O[C@@H](CF)COC1CCCCCCC1 7a_100000210054_100015614560 [0,1,0,1,0,0|2,0,0]=4 31760 B14R1.38 CC(NCCCCO)C1CCCCC1 269862a_100000750430_100000210989 [0,1,0,1,0,0|1,0,0]=3 31761 B14R1.38 CC(NCCCCO)C1CCCCN1 269862a_100000750430_200011997754 [0,1,0,1,0,0|2,0,0]=4 31762 B14R1.38 CC(NCCCCO)C1CCCNC1 269862a_100000750430_100011320585 [0,1,0,1,0,0|2,0,0]=4 31763 B14R1.38 CC(NCCCCO)C1CCNCC1 269862a_100000750430_100015204191 [0,1,0,1,0,0|2,0,0]=4 31764 B14R1.38 CC(NCCCCO)C1CCOCC1 269862a_100000750430_100000759496 [0,1,0,1,0,0|2,0,0]=4 31765 B14R1.38 CC(OCCCCF)C1CCCCC1 34a_100011216961_100000729493 [0,1,0,1,0,0|2,0,0]=4 31766 B14R1.38 CC(OCCCCF)C1CCCCC1 7a_100011216961_100000729493 [0,1,0,1,0,0|2,0,0]=4 31767 B14R1.38 CC(OCCCCO)C1CCCCC1 34a_100011216961_100011216708 [0,1,0,1,0,0|1,0,0]=3 31768 B14R1.38 CC(OCCCCO)C1CCCCC1 7a_100011216961_100000210776 [0,1,0,1,0,0|1,0,0]=3 31769 B14R1.38 CC(OCCCCO)C1CCCNC1 34a_100000740858_100011216708 [0,1,0,1,0,0|2,0,0]=4 31770 B14R1.38 CC(OCCCCO)C1CCNCC1 34a_100011728446_100011216708 [0,1,0,1,0,0|2,0,0]=4 31771 B14R1.38 CCCCCCC(=O)C1CCCCC1 1458a_100000210647_100000210757 [0,1,0,1,0,0|1,0,1]=4 31772 B14R1.38 CCCCCCC(=O)C1CCCCC1 1458a_100102632555_100000210327 [0,1,0,1,0,0|1,0,1]=4 31773 B14R1.38 CCCCCCC(=O)C1CCCCO1 1458a_100000748299_100000210757 [0,1,0,1,0,0|0,0,1]=3 31774 B14R1.38 CCCCCCC(=O)C1COCCO1 1458a_100000045528_100000210757 [0,1,0,1,0,0|1,0,1]=4 31775 B14R1.38 CCCCCCN(C)C1CCCCC1 2230a_100000207522_100000210314 [0,1,0,1,0,0|2,0,0]=4 31776 B14R1.38 CCCCCCN(C)C1CCCCC1 269982a_100000207522_100000210757 [0,1,0,1,0,0|2,0,0]=4 31777 B14R1.38 CCCCCCN(C)C1CCCCC1 269982a_106256046315_100000210327 [0,1,0,1,0,0|2,0,0]=4 31778 B14R1.38 CCCCCCN(C)C1CCCCC1 270004a_106256046315_100000210434 [0,1,0,1,0,0|2,0,0]=4 31779 B14R1.38 CCCCCCN(C)C1CCCCC1 34a_100000207522_100000210314 [0,1,0,1,0,0|2,0,0]=4 31780 B14R1.38 CCCCCNC(=O)C1CCCCO1 11a_100000209983_100000748299 [0,1,0,1,0,0|1,0,1]=4 31781 B14R1.38 CCCCCNC(=O)C1CCCCO1 1626a_100000209983_100000748299 [0,1,0,1,0,0|1,0,1]=4 31782 B14R1.38 CCCCCNC(=O)C1CCCCO1 240690a_100000209983_100000748299 [0,1,0,1,0,0|1,0,1]=4 31783 B14R1.38 CCCCCNC(=O)C1CCCCO1 527a_100000209983_100000748299 [0,1,0,1,0,0|1,0,1]=4 31784 B14R1.38 CCCCCNC(C)C1CCCCC1 269862a_100000209983_100000210989 [0,1,0,1,0,0|2,0,0]=4 31785 B14R1.38 CCCCCNC(C)C1CCCCN1 269862a_100000209983_200011997754 [0,1,0,1,0,0|2,0,0]=4 31786 B14R1.38 CCCCCN[C@H](C)C1CCCCC1 2230a_100025707633_100000210326 [0,1,0,1,0,0|2,0,0]=4 31787 B14R1.38 CCCCCN[C@H](C)C1CCCCC1 34a_100025707633_100000718602 [0,1,0,1,0,0|2,0,0]=4 31788 B14R1.38 CCCCCOC(C)C1CCCCC1 34a_100011216961_100000718602 [0,1,0,1,0,0|2,0,0]=4 31789 B14R1.38 CCCCCOC(C)C1CCCCC1 7a_100011216961_100000210326 [0,1,0,1,0,0|2,0,0]=4 31790 B14R1.38 CCCCOCC(=O)C1CCCCO1 1458a_100000748299_100011995733 [0,1,0,1,0,0|1,0,1]=4 31791 B14R1.38 CCCCOC[C@H](N)C1CCCCC1 34a_100009817630_100000210210 [0,1,0,1,0,0|2,0,0]=4 31792 B14R1.38 CCCOCCC(=O)C1CCCCO1 1458a_100000748299_100011215938 [0,1,0,1,0,0|1,0,1]=4 31793 B14R1.38 CCCOCCC(N)C1CCCCC1 34a_200020622111_100000210303 [0,1,0,1,0,0|2,0,0]=4 31794 B14R1.38 CCOCCCC(=O)C1CCCCO1 1458a_100000748299_100012232248 [0,1,0,1,0,0|1,0,1]=4 31795 B14R1.38 CN(CCCCCF)C1CCCCC1 2230a_100000207522_100000729378 [0,1,0,1,0,0|2,0,0]=4 31796 B14R1.38 CN(CCCCCF)C1CCCCC1 269982a_100000207522_100000729378 [0,1,0,1,0,0|2,0,0]=4 31797 B14R1.38 CN(CCCCCF)C1CCCCC1 34a_100000207522_100000729378 [0,1,0,1,0,0|2,0,0]=4 31798 B14R1.38 CN(CCCCCO)C1CCCCC1 2230a_100000207522_100000746330 [0,1,0,1,0,0|1,0,0]=3 31799 B14R1.38 CN(CCCCCO)C1CCCCC1 269982a_100000207522_100000746330 [0,1,0,1,0,0|1,0,0]=3 31800 B14R1.38 CN(CCCCCO)C1CCCCC1 269982a_100000722520_100000210327 [0,1,0,1,0,0|1,0,0]=3 31801 B14R1.38 CN(CCCCCO)C1CCCCC1 270004a_100000722520_100000210434 [0,1,0,1,0,0|1,0,0]=3 31802 B14R1.38 CN(CCCCCO)C1CCCCC1 34a_100000207522_100000746330 [0,1,0,1,0,0|1,0,0]=3 31803 B14R1.38 CN(CCCCCO)C1CCCOC1 269982a_100000722520_100000693364 [0,1,0,1,0,0|2,0,0]=4 31804 B14R1.38 CN(CCCCCO)C1CCCOC1 270004a_100000722520_100000753404 [0,1,0,1,0,0|2,0,0]=4 31805 B14R1.38 CN(CCCCCO)C1CCCSC1 270004a_100000722520_100000057913 [0,1,0,1,0,0|2,0,0]=4 31806 B14R1.38 CN(CCCCCO)C1CCNCC1 270004a_100000722520_100015192401 [0,1,0,1,0,0|2,0,0]=4 31807 B14R1.38 CN(CCCCCO)C1CCOCC1 2230a_100020587155_100000746330 [0,1,0,1,0,0|2,0,0]=4 31808 B14R1.38 CN(CCCCCO)C1CCOCC1 269982a_100000722520_100011324220 [0,1,0,1,0,0|2,0,0]=4 31809 B14R1.38 CN(CCCCCO)C1CCOCC1 269982a_100020587155_100000746330 [0,1,0,1,0,0|2,0,0]=4 31810 B14R1.38 CN(CCCCCO)C1CCOCC1 270004a_100000722520_100011217826 [0,1,0,1,0,0|2,0,0]=4 31811 B14R1.38 CN(CCCCCO)C1CCOCC1 34a_100020587155_100000746330 [0,1,0,1,0,0|2,0,0]=4 31812 B14R1.38 CN(CCCCCO)C1CCSCC1 2230a_100015184757_100000746330 [0,1,0,1,0,0|2,0,0]=4 31813 B14R1.38 CN(CCCCCO)C1CCSCC1 269982a_100000722520_100000069128 [0,1,0,1,0,0|2,0,0]=4 31814 B14R1.38 CN(CCCCCO)C1CCSCC1 269982a_100015184757_100000746330 [0,1,0,1,0,0|2,0,0]=4 31815 B14R1.38 CN(CCCCCO)C1CCSCC1 270004a_100000722520_100000203788 [0,1,0,1,0,0|2,0,0]=4 31816 B14R1.38 CN(CCCCCO)C1CCSCC1 34a_100015184757_100000746330 [0,1,0,1,0,0|2,0,0]=4 31817 B14R1.38 CN(CCOCCO)C1CCCCC1 2230a_100000207522_100011215305 [0,1,0,1,0,0|2,0,0]=4 31818 B14R1.38 CN(CCOCCO)C1CCCCC1 269982a_100000207522_100011215305 [0,1,0,1,0,0|2,0,0]=4 31819 B14R1.38 CN(CCOCCO)C1CCCCC1 269982a_100000228057_100000210327 [0,1,0,1,0,0|2,0,0]=4 31820 B14R1.38 CN(CCOCCO)C1CCCCC1 270004a_100000228057_100000210434 [0,1,0,1,0,0|2,0,0]=4 31821 B14R1.38 CN(CCOCCO)C1CCCCC1 34a_100000207522_100000692535 [0,1,0,1,0,0|2,0,0]=4 31822 B14R1.38 COCCCCC(=O)C1CCCCO1 1458a_100000748299_100000755781 [0,1,0,1,0,0|1,0,1]=4 31823 B14R1.38 C[C@@H](NCCCCF)C1CCCCC1 2230a_100025707633_100000729493 [0,1,0,1,0,0|2,0,0]=4 31824 B14R1.38 C[C@@H](NCCCCF)C1CCCCC1 34a_100025707633_100000729493 [0,1,0,1,0,0|2,0,0]=4 31825 B14R1.38 C[C@@H](NCCCCO)C1CCCCC1 2230a_100025707633_100000210776 [0,1,0,1,0,0|1,0,0]=3 31826 B14R1.38 C[C@@H](NCCCCO)C1CCCCC1 34a_100025707633_100011216708 [0,1,0,1,0,0|1,0,0]=3 31827 B14R1.38 C[C@@H](OCCCCO)C1CCOCC1 34a_100000703848_100011216708 [0,1,0,1,0,0|2,0,0]=4 31828 B14R1.38 C[C@@H](OCCCCO)C1CCOCC1 7a_100000703848_100000210776 [0,1,0,1,0,0|2,0,0]=4 31829 B14R1.38 NC(CCOCCF)C1CCCCC1 34a_200020622111_100011217306 [0,1,0,1,0,0|2,0,0]=4 31830 B14R1.38 NC(CCOCCO)C1CCCCC1 34a_200020622111_100000211926 [0,1,0,1,0,0|1,0,0]=3 31831 B14R1.38 N[C@@H](COCCCF)C1CCCCC1 34a_100009817630_100011934791 [0,1,0,1,0,0|2,0,0]=4 31832 B14R1.38 N[C@@H](COCCCO)C1CCCCC1 34a_100009817630_100000230001 [0,1,0,1,0,0|1,0,0]=3 31833 B14R1.38 O=C(CCCCCF)C1CCCCC1 1458a_100000210647_100000729378 [0,1,0,1,0,0|1,0,1]=4 31834 B14R1.38 O=C(CCCCCF)C1CCCCO1 1458a_100000748299_100000729378 [0,1,0,1,0,0|1,0,1]=4 31835 B14R1.38 O=C(CCCCCO)C1CCCCC1 1458a_100000210647_100000746330 [0,1,0,1,0,0|0,0,1]=3 31836 B14R1.38 O=C(CCCCCO)C1CCCCC1 1458a_100102619762_100000210327 [0,1,0,1,0,0|0,0,1]=3 31837 B14R1.38 O=C(CCCCCO)C1CCCCO1 1458a_100000748299_100000746330 [0,1,0,1,0,0|1,0,1]=4 31838 B14R1.38 O=C(CCCCCO)C1CCCOC1 1458a_100000741522_100000746330 [0,1,0,1,0,0|1,0,1]=4 31839 B14R1.38 O=C(CCCCCO)C1CCCOC1 1458a_100102619762_100000693364 [0,1,0,1,0,0|1,0,1]=4 31840 B14R1.38 O=C(CCCCCO)C1CCOCC1 1458a_100000195482_100000746330 [0,1,0,1,0,0|1,0,1]=4 31841 B14R1.38 O=C(CCCCCO)C1CCOCC1 1458a_100102619762_100011324220 [0,1,0,1,0,0|1,0,1]=4 31842 B14R1.38 O=C(CCCCCO)C1CCSCC1 1458a_100000755232_100000746330 [0,1,0,1,0,0|1,0,1]=4 31843 B14R1.38 O=C(CCOCCO)C1CCCCC1 1458a_100000210647_100011215305 [0,1,0,1,0,0|1,0,1]=4 31844 B14R1.38 O=C(CCOCCO)C1CCCCC1 1458a_100011229844_100000210327 [0,1,0,1,0,0|1,0,1]=4 31845 B14R1.38 O=C(CSCCCO)C1CCCCC1 62a_100000241979_100011215043 [0,1,0,1,0,0|1,0,1]=4 31846 B14R1.38 O=C(CSCCCO)C1CCCCC1 62a_100011215043_100000241979 [0,1,0,1,0,0|1,0,1]=4 31847 B14R1.38 O=C(NCCCCO)C1CCCCC1 240690a_100000750430_100000210647 [0,1,0,1,0,0|1,0,1]=4 31848 B14R1.38 O=C(NCCCCO)C1CCCCC1 527a_100000750430_100000210647 [0,1,0,1,0,0|1,0,1]=4 31849 B14R1.92 CC(CC1CCCC1)NCCCCO 270004a_100000750430_100000692464 [0,1,0,1,0,0|1,0,0]=3 31850 B14R1.92 CC(COCCCO)CN1CCCC1 7a_200011934648_100011215043 [0,1,0,1,0,0|2,0,0]=4 31851 B14R1.92 CCCCCCC(=O)CC1CCCC1 1458a_100000210891_100000210757 [0,1,0,1,0,0|1,0,1]=4 31852 B14R1.92 CCCCCCC(=O)CC1CCCC1 1458a_100102632555_100000740388 [0,1,0,1,0,0|1,0,1]=4 31853 B14R1.92 CCCCCCC(=O)CC1CCCO1 1458a_100102632555_100000203698 [0,1,0,1,0,0|0,0,1]=3 31854 B14R1.92 CCCCCCC(=O)CC1OCCO1 1458a_100102632555_100000755774 [0,1,0,1,0,0|1,0,1]=4 31855 B14R1.92 CCCCCCC(C)NC1CCCC1 2230a_100000210919_100000179811 [0,1,0,1,0,0|2,0,0]=4 31856 B14R1.92 CCCCCCC(C)NC1CCCC1 2230a_100000211070_100011215978 [0,1,0,1,0,0|2,0,0]=4 31857 B14R1.92 CCCCCCC(C)NC1CCCC1 270004a_100000210919_100000210133 [0,1,0,1,0,0|2,0,0]=4 31858 B14R1.92 CCCCCCC(C)NC1CCCC1 270004a_100000211070_100000210826 [0,1,0,1,0,0|2,0,0]=4 31859 B14R1.92 CCCCCCC(C)NC1CCCC1 34a_100000210919_100000179811 [0,1,0,1,0,0|2,0,0]=4 31860 B14R1.92 CCCCCCC(C)NC1CCCC1 34a_100000211070_100011215978 [0,1,0,1,0,0|2,0,0]=4 31861 B14R1.92 CCCCCCC(C)OC1CCCC1 34a_100000210265_100000179811 [0,1,0,1,0,0|2,0,0]=4 31862 B14R1.92 CCCCCCC(C)OC1CCCC1 34a_100000210269_100011215978 [0,1,0,1,0,0|2,0,0]=4 31863 B14R1.92 CCCCCCC(C)OC1CCCC1 7a_100000210265_100000179811 [0,1,0,1,0,0|2,0,0]=4 31864 B14R1.92 CCCCCCC(C)OC1CCCC1 7a_100000210269_100011215978 [0,1,0,1,0,0|2,0,0]=4 31865 B14R1.92 CCCCCCC(C)OC1CCCO1 34a_100000085407_100011215978 [0,1,0,1,0,0|1,0,0]=3 31866 B14R1.92 CCCCCCC(C)SC1CCCC1 62a_100011215978_100000179811 [0,1,0,1,0,0|2,0,0]=4 31867 B14R1.92 CCCCCCC(C)SC1CCCC1 62a_100011217020_100011215978 [0,1,0,1,0,0|2,0,0]=4 31868 B14R1.92 CCCCCCN(C)CC1CCCC1 2230a_106256046315_100000740388 [0,1,0,1,0,0|2,0,0]=4 31869 B14R1.92 CCCCCCN(C)CC1CCCC1 269982a_106256046315_100000740388 [0,1,0,1,0,0|2,0,0]=4 31870 B14R1.92 CCCCCCN(C)CC1CCCO1 2230a_100102946541_100000210314 [0,1,0,1,0,0|1,0,0]=3 31871 B14R1.92 CCCCCCN(C)CC1CCCO1 2230a_106256046315_100000203698 [0,1,0,1,0,0|1,0,0]=3 31872 B14R1.92 CCCCCCN(C)CC1CCCO1 269982a_100102946541_100000210757 [0,1,0,1,0,0|1,0,0]=3 31873 B14R1.92 CCCCCCN(C)CC1CCCO1 269982a_106256046315_100000183445 [0,1,0,1,0,0|1,0,0]=3 31874 B14R1.92 CCCCCCN(C)CC1CCCO1 34a_100102946541_100000210314 [0,1,0,1,0,0|1,0,0]=3 31875 B14R1.92 CCCCCCN(C)CC1OCCO1 2230a_106256046315_100000755774 [0,1,0,1,0,0|2,0,0]=4 31876 B14R1.92 CCCCCCN(C)CC1OCCO1 2230a_200000032744_100000210314 [0,1,0,1,0,0|2,0,0]=4 31877 B14R1.92 CCCCCCN(C)CC1OCCO1 269982a_106256046315_100000755774 [0,1,0,1,0,0|2,0,0]=4 31878 B14R1.92 CCCCCCN(C)CC1OCCO1 269982a_200000032744_100000210757 [0,1,0,1,0,0|2,0,0]=4 31879 B14R1.92 CCCCCCN(C)CC1OCCO1 34a_200000032744_100000210314 [0,1,0,1,0,0|2,0,0]=4 31880 B14R1.92 CCCCCNC(C)CC1CCCC1 270004a_100000209983_100000692464 [0,1,0,1,0,0|2,0,0]=4 31881 B14R1.92 CCCCOCC(=O)CC1CCCO1 1458a_100000757543_100000203698 [0,1,0,1,0,0|1,0,1]=4 31882 B14R1.92 CCCCOCN(C)CC1CCCO1 2230a_100102946541_100011995733 [0,1,0,1,0,0|2,0,0]=4 31883 B14R1.92 CCCCOCN(C)CC1CCCO1 269982a_100102946541_100011995733 [0,1,0,1,0,0|2,0,0]=4 31884 B14R1.92 CCCCOCN(C)CC1CCCO1 34a_100102946541_100011995733 [0,1,0,1,0,0|2,0,0]=4 31885 B14R1.92 CCCCSCC(=O)CC1CCCO1 1458a_100000191162_100000203698 [0,1,0,1,0,0|1,0,1]=4 31886 B14R1.92 CCCOCCN(C)CC1CCCO1 2230a_100102946541_100011215938 [0,1,0,1,0,0|2,0,0]=4 31887 B14R1.92 CCCOCCN(C)CC1CCCO1 269982a_100102946541_100011215938 [0,1,0,1,0,0|2,0,0]=4 31888 B14R1.92 CCCOCCN(C)CC1CCCO1 34a_100102946541_100011215938 [0,1,0,1,0,0|2,0,0]=4 31889 B14R1.92 CCOCCCN(C)CC1CCCO1 2230a_100102946541_100012232248 [0,1,0,1,0,0|2,0,0]=4 31890 B14R1.92 CCOCCCN(C)CC1CCCO1 269982a_100102946541_100012232248 [0,1,0,1,0,0|2,0,0]=4 31891 B14R1.92 CCOCCCN(C)CC1CCCO1 34a_100102946541_100012232248 [0,1,0,1,0,0|2,0,0]=4 31892 B14R1.92 CN(CCCCCF)CC1CCCO1 2230a_100102946541_100000729378 [0,1,0,1,0,0|2,0,0]=4 31893 B14R1.92 CN(CCCCCF)CC1CCCO1 269982a_100102946541_100000729378 [0,1,0,1,0,0|2,0,0]=4 31894 B14R1.92 CN(CCCCCF)CC1CCCO1 34a_100102946541_100000729378 [0,1,0,1,0,0|2,0,0]=4 31895 B14R1.92 CN(CCCCCO)CC1CCCC1 2230a_100000722520_100000740388 [0,1,0,1,0,0|1,0,0]=3 31896 B14R1.92 CN(CCCCCO)CC1CCCC1 269982a_100000722520_100000740388 [0,1,0,1,0,0|1,0,0]=3 31897 B14R1.92 CN(CCCCCO)CC1CCCO1 2230a_100000722520_100000203698 [0,1,0,1,0,0|2,0,0]=4 31898 B14R1.92 CN(CCCCCO)CC1CCCO1 2230a_100102946541_100000746330 [0,1,0,1,0,0|2,0,0]=4 31899 B14R1.92 CN(CCCCCO)CC1CCCO1 269982a_100000722520_100000183445 [0,1,0,1,0,0|2,0,0]=4 31900 B14R1.92 CN(CCCCCO)CC1CCCO1 269982a_100102946541_100000746330 [0,1,0,1,0,0|2,0,0]=4 31901 B14R1.92 CN(CCCCCO)CC1CCCO1 34a_100102946541_100000746330 [0,1,0,1,0,0|2,0,0]=4 31902 B14R1.92 CN(CCCCCO)CC1CCOC1 2230a_100000684583_100000746330 [0,1,0,1,0,0|2,0,0]=4 31903 B14R1.92 CN(CCCCCO)CC1CCOC1 2230a_100000722520_100000702531 [0,1,0,1,0,0|2,0,0]=4 31904 B14R1.92 CN(CCCCCO)CC1CCOC1 269982a_100000684583_100000746330 [0,1,0,1,0,0|2,0,0]=4 31905 B14R1.92 CN(CCCCCO)CC1CCOC1 269982a_100000722520_100000702531 [0,1,0,1,0,0|2,0,0]=4 31906 B14R1.92 CN(CCCCCO)CC1CCOC1 34a_100000684583_100000746330 [0,1,0,1,0,0|2,0,0]=4 31907 B14R1.92 CN(CCOCCO)CC1CCCC1 2230a_100000228057_100000740388 [0,1,0,1,0,0|2,0,0]=4 31908 B14R1.92 CN(CCOCCO)CC1CCCC1 269982a_100000228057_100000740388 [0,1,0,1,0,0|2,0,0]=4 31909 B14R1.92 COCCCCN(C)CC1CCCO1 2230a_100102946541_100000730899 [0,1,0,1,0,0|2,0,0]=4 31910 B14R1.92 COCCCCN(C)CC1CCCO1 269982a_100102946541_100000730899 [0,1,0,1,0,0|2,0,0]=4 31911 B14R1.92 COCCCCN(C)CC1CCCO1 34a_100102946541_100000755781 [0,1,0,1,0,0|2,0,0]=4 31912 B14R1.92 O=C(CC1CCCC1)NCCCCO 240690a_100000750430_100000210891 [0,1,0,1,0,0|1,0,1]=4 31913 B14R1.92 O=C(CC1CCCC1)NCCCCO 527a_100000750430_100000210891 [0,1,0,1,0,0|1,0,1]=4 31914 B14R1.92 O=C(CCCCCF)CC1CCCC1 1458a_100000210891_100000729378 [0,1,0,1,0,0|1,0,1]=4 31915 B14R1.92 O=C(CCCCCO)CC1CCCC1 1458a_100000210891_100000746330 [0,1,0,1,0,0|0,0,1]=3 31916 B14R1.92 O=C(CCCCCO)CC1CCCC1 1458a_100102619762_100000740388 [0,1,0,1,0,0|0,0,1]=3 31917 B14R1.92 O=C(CCCCCO)CC1CCCO1 1458a_100102619762_100000203698 [0,1,0,1,0,0|1,0,1]=4 31918 B14R1.92 O=C(CCCCCO)CC1CCOC1 1458a_100011218419_100000746330 [0,1,0,1,0,0|1,0,1]=4 31919 B14R1.92 O=C(CCCCCO)CC1CCOC1 1458a_100102619762_100000702531 [0,1,0,1,0,0|1,0,1]=4 31920 B14R1.92 O=C(CCCCCO)CN1CCCC1 1458a_100000740243_100000746330 [0,1,0,1,0,0|1,0,1]=4 31921 B14R1.92 O=C(CCCCCO)NC1CCCC1 240690a_100000211070_100102619762 [0,1,0,1,0,0|1,0,1]=4 31922 B14R1.92 O=C(CCOCCO)CC1CCCC1 1458a_100000210891_100011215305 [0,1,0,1,0,0|1,0,1]=4 31923 B14R1.92 O=C(CCOCCO)CC1CCCC1 1458a_100011229844_100000740388 [0,1,0,1,0,0|1,0,1]=4 31924 B14R1.1254 C#CCCCCN1CCCCCCC1 2230a_100000211400_100010269958 [0,1,0,1,0,0|1,0,1]=4 31925 B14R1.1254 C#CCCCCN1CCCCCCC1 269982a_100000211400_100010269958 [0,1,0,1,0,0|1,0,1]=4 31926 B14R1.1254 C#CCCCCN1CCCCCCC1 34a_100000211400_100010269958 [0,1,0,1,0,0|1,0,1]=4 31927 B14R1.1254 C#CCCCNC1CCCCCCC1 2230a_100000211152_100000731252 [0,1,0,1,0,0|1,0,1]=4 31928 B14R1.1254 C#CCCCNC1CCCCCCC1 270004a_100000718082_100000210524 [0,1,0,1,0,0|1,0,1]=4 31929 B14R1.1254 C#CCCCNC1CCCCCCC1 34a_100000211152_100000695029 [0,1,0,1,0,0|1,0,1]=4 31930 B14R1.1254 C#CCCCOC1CCCCCCC1 34a_100000210054_100000695029 [0,1,0,1,0,0|1,0,1]=4 31931 B14R1.1254 C#CCCCOC1CCCCCCC1 7a_100000210054_100011215417 [0,1,0,1,0,0|1,0,1]=4 31932 B14R1.1254 C#CCCOCC1CCCCCCC1 34a_100011216312_100000688953 [0,1,0,1,0,0|1,0,1]=4 31933 B14R1.1254 C#CCCOCC1CCCCCCC1 7a_100011216312_100000688953 [0,1,0,1,0,0|1,0,1]=4 31934 B14R1.1254 C#CCNCCC1CCCCCCC1 2230a_100011532352_100000038162 [0,1,0,1,0,0|1,0,1]=4 31935 B14R1.1254 C#CCNCCC1CCCCCCC1 34a_100011532352_100000184674 [0,1,0,1,0,0|1,0,1]=4 31936 B14R1.1254 C=CCCCCN1CCCCCCC1 2230a_100000211400_100011215482 [0,1,0,1,0,0|1,0,1]=4 31937 B14R1.1254 C=CCCCCN1CCCCCCC1 269982a_100000211400_100011215482 [0,1,0,1,0,0|1,0,1]=4 31938 B14R1.1254 C=CCCCCN1CCCCCCC1 34a_100000211400_100011215482 [0,1,0,1,0,0|1,0,1]=4 31939 B14R1.1254 C=CCCCNC1CCCCCCC1 2230a_100000211152_100011713584 [0,1,0,1,0,0|1,0,1]=4 31940 B14R1.1254 C=CCCCNC1CCCCCCC1 270004a_100000700776_100000210524 [0,1,0,1,0,0|1,0,1]=4 31941 B14R1.1254 C=CCCCNC1CCCCCCC1 34a_100000211152_100000757094 [0,1,0,1,0,0|1,0,1]=4 31942 B14R1.1254 C=CCCCOC1CCCCCCC1 34a_100000210054_100000757094 [0,1,0,1,0,0|1,0,1]=4 31943 B14R1.1254 C=CCCCOC1CCCCCCC1 7a_100000210054_100000757094 [0,1,0,1,0,0|1,0,1]=4 31944 B14R1.1254 C=CCCOCC1CCCCCCC1 34a_100011216312_100000754431 [0,1,0,1,0,0|1,0,1]=4 31945 B14R1.1254 C=CCCOCC1CCCCCCC1 7a_100011216312_100000754431 [0,1,0,1,0,0|1,0,1]=4 31946 B14R1.1254 C=CCNCCC1CCCCCCC1 2230a_100011532352_100000210623 [0,1,0,1,0,0|1,0,1]=4 31947 B14R1.1254 C=CCNCCC1CCCCCCC1 34a_100011532352_100015514636 [0,1,0,1,0,0|1,0,1]=4 31948 B14R1.1254 CCCCCCN1CCCCCCC1 2230a_100000211400_100000210314 [0,1,0,1,0,0|1,0,0]=3 31949 B14R1.1254 CCCCCCN1CCCCCCC1 269982a_100000211400_100000210757 [0,1,0,1,0,0|1,0,0]=3 31950 B14R1.1254 CCCCCCN1CCCCCCC1 34a_100000211400_100000210314 [0,1,0,1,0,0|1,0,0]=3 31951 B14R1.1254 CCCCCNC1CCCCCCC1 2230a_100000211152_100000210326 [0,1,0,1,0,0|1,0,0]=3 31952 B14R1.1254 CCCCCNC1CCCCCCC1 270004a_100000209983_100000210524 [0,1,0,1,0,0|1,0,0]=3 31953 B14R1.1254 CCCCCNC1CCCCCCC1 34a_100000211152_100000718602 [0,1,0,1,0,0|1,0,0]=3 31954 B14R1.1254 CCCCCOC1C=CCCCCC1 34a_100000688657_100000718602 [0,1,0,1,0,0|1,0,1]=4 31955 B14R1.1254 CCCCCOC1CCCCCCC1 34a_100000210054_100000718602 [0,1,0,1,0,0|1,0,0]=3 31956 B14R1.1254 CCCCCOC1CCCCCCC1 7a_100000210054_100000210326 [0,1,0,1,0,0|1,0,0]=3 31957 B14R1.1254 CCCCOCC1CCCCCCC1 34a_100011216312_100000210210 [0,1,0,1,0,0|1,0,0]=3 31958 B14R1.1254 CCCCOCC1CCCCCCC1 7a_100011216312_100000210211 [0,1,0,1,0,0|1,0,0]=3 31959 B14R1.1254 CCCCOCN1CCCCCCC1 2230a_100000211400_100011995733 [0,1,0,1,0,0|2,0,0]=4 31960 B14R1.1254 CCCCOCN1CCCCCCC1 269982a_100000211400_100011995733 [0,1,0,1,0,0|2,0,0]=4 31961 B14R1.1254 CCCCOCN1CCCCCCC1 34a_100000211400_100011995733 [0,1,0,1,0,0|2,0,0]=4 31962 B14R1.1254 CCCNCCC1CCCCCCC1 2230a_100011532352_100000210303 [0,1,0,1,0,0|1,0,0]=3 31963 B14R1.1254 CCCNCCC1CCCCCCC1 34a_100011532352_100000210303 [0,1,0,1,0,0|1,0,0]=3 31964 B14R1.1254 CCCOCCN1CCCCCCC1 2230a_100000211400_100011215938 [0,1,0,1,0,0|2,0,0]=4 31965 B14R1.1254 CCCOCCN1CCCCCCC1 269982a_100000211400_100011215938 [0,1,0,1,0,0|2,0,0]=4 31966 B14R1.1254 CCCOCCN1CCCCCCC1 34a_100000211400_100011215938 [0,1,0,1,0,0|2,0,0]=4 31967 B14R1.1254 CCOCCCN1CCCCCCC1 2230a_100000211400_100012232248 [0,1,0,1,0,0|2,0,0]=4 31968 B14R1.1254 CCOCCCN1CCCCCCC1 269982a_100000211400_100012232248 [0,1,0,1,0,0|2,0,0]=4 31969 B14R1.1254 CCOCCCN1CCCCCCC1 34a_100000211400_100012232248 [0,1,0,1,0,0|2,0,0]=4 31970 B14R1.1254 CCOCCNC1CCCCCCC1 2230a_100000211152_100011215890 [0,1,0,1,0,0|2,0,0]=4 31971 B14R1.1254 CCOCCNC1CCCCCCC1 270004a_102516460346_100000210524 [0,1,0,1,0,0|2,0,0]=4 31972 B14R1.1254 CCOCCNC1CCCCCCC1 34a_100000211152_100000210147 [0,1,0,1,0,0|2,0,0]=4 31973 B14R1.1254 CCOCCOC1CCCCCCC1 34a_100000210054_100000210147 [0,1,0,1,0,0|2,0,0]=4 31974 B14R1.1254 CCOCCOC1CCCCCCC1 7a_100000210054_100011215890 [0,1,0,1,0,0|2,0,0]=4 31975 B14R1.1254 CCSCCNC1CCCCCCC1 2230a_100000211152_100000757381 [0,1,0,1,0,0|2,0,0]=4 31976 B14R1.1254 CCSCCNC1CCCCCCC1 270004a_100000106463_100000210524 [0,1,0,1,0,0|2,0,0]=4 31977 B14R1.1254 CCSCCNC1CCCCCCC1 34a_100000211152_100000757381 [0,1,0,1,0,0|2,0,0]=4 31978 B14R1.1254 CCSCCOC1CCCCCCC1 34a_100000210054_100000757381 [0,1,0,1,0,0|2,0,0]=4 31979 B14R1.1254 CCSCCOC1CCCCCCC1 7a_100000210054_100000757381 [0,1,0,1,0,0|2,0,0]=4 31980 B14R1.1254 COCCCCN1CCCCCCC1 2230a_100000211400_100000730899 [0,1,0,1,0,0|1,0,0]=3 31981 B14R1.1254 COCCCCN1CCCCCCC1 269982a_100000211400_100000730899 [0,1,0,1,0,0|1,0,0]=3 31982 B14R1.1254 COCCCCN1CCCCCCC1 34a_100000211400_100000755781 [0,1,0,1,0,0|1,0,0]=3 31983 B14R1.1254 COCCCNC1CCCCCCC1 2230a_100000211152_100000740836 [0,1,0,1,0,0|1,0,0]=3 31984 B14R1.1254 COCCCNC1CCCCCCC1 270004a_100150723488_100000210524 [0,1,0,1,0,0|1,0,0]=3 31985 B14R1.1254 COCCCNC1CCCCCCC1 34a_100000211152_100000740836 [0,1,0,1,0,0|1,0,0]=3 31986 B14R1.1254 COCCCOC1CCCCCCC1 34a_100000210054_100000740836 [0,1,0,1,0,0|1,0,0]=3 31987 B14R1.1254 COCCCOC1CCCCCCC1 7a_100000210054_100000740836 [0,1,0,1,0,0|1,0,0]=3 31988 B14R1.1254 COCCOCC1CCCCCCC1 34a_100011216312_100011201679 [0,1,0,1,0,0|1,0,0]=3 31989 B14R1.1254 COCCOCC1CCCCCCC1 7a_100011216312_100000233755 [0,1,0,1,0,0|1,0,0]=3 31990 B14R1.1254 COCCOCN1CCCCCCC1 2230a_100000211400_100000231047 [0,1,0,1,0,0|2,0,0]=4 31991 B14R1.1254 COCCOCN1CCCCCCC1 269982a_100000211400_100000231047 [0,1,0,1,0,0|2,0,0]=4 31992 B14R1.1254 COCNCCC1CCCCCCC1 2230a_100011532352_100000766300 [0,1,0,1,0,0|1,0,0]=3 31993 B14R1.1254 CSCCCNC1CCCCCCC1 270004a_100000749238_100000210524 [0,1,0,1,0,0|1,1,0]=4 31994 B14R1.1254 CSCCOCC1CCCCCCC1 34a_100011216312_100000212216 [0,1,0,1,0,0|1,1,0]=4 31995 B14R1.1254 CSCCOCC1CCCCCCC1 7a_100011216312_100000212216 [0,1,0,1,0,0|1,1,0]=4 31996 B14R1.1254 CSCNCCC1CCCCCCC1 2230a_100011532352_100011218213 [0,1,0,1,0,0|1,1,0]=4 31997 B14R1.1254 CSCNCCC1CCCCCCC1 34a_100011532352_100011218213 [0,1,0,1,0,0|1,1,0]=4 31998 B14R1.1254 FCCCCCN1CCCCCCC1 2230a_100000211400_100000729378 [0,1,0,1,0,0|1,0,0]=3 31999 B14R1.1254 FCCCCCN1CCCCCCC1 269982a_100000211400_100000729378 [0,1,0,1,0,0|1,0,0]=3 32000 B14R1.1254 FCCCCCN1CCCCCCC1 34a_100000211400_100000729378 [0,1,0,1,0,0|1,0,0]=3 32001 B14R1.1254 FCCCCNC1CCCCCCC1 2230a_100000211152_100000729493 [0,1,0,1,0,0|1,0,0]=3 32002 B14R1.1254 FCCCCNC1CCCCCCC1 34a_100000211152_100000729493 [0,1,0,1,0,0|1,0,0]=3 32003 B14R1.1254 FCCCCOC1CCCCCCC1 34a_100000210054_100000729493 [0,1,0,1,0,0|1,0,0]=3 32004 B14R1.1254 FCCCCOC1CCCCCCC1 7a_100000210054_100000729493 [0,1,0,1,0,0|1,0,0]=3 32005 B14R1.1254 FCCCOCC1CCCCCCC1 34a_100011216312_100011934791 [0,1,0,1,0,0|1,0,0]=3 32006 B14R1.1254 FCCCOCC1CCCCCCC1 7a_100011216312_100011934791 [0,1,0,1,0,0|1,0,0]=3 32007 B14R1.1254 FCCNCCC1CCCCCCC1 2230a_100011532352_100011217306 [0,1,0,1,0,0|1,0,0]=3 32008 B14R1.1254 FCCNCCC1CCCCCCC1 34a_100011532352_100011217306 [0,1,0,1,0,0|1,0,0]=3 32009 B14R1.1254 N#CCCCCN1CCCCCCC1 2230a_100000211400_100000211819 [0,1,0,1,0,0|1,0,1]=4 32010 B14R1.1254 N#CCCCCN1CCCCCCC1 269982a_100000211400_100011219923 [0,1,0,1,0,0|1,0,1]=4 32011 B14R1.1254 N#CCCCNC1CCCCCCC1 2230a_100000211152_100000687738 [0,1,0,1,0,0|1,0,1]=4 32012 B14R1.1254 N#CCCCOC1CCCCCCC1 7a_100000210054_100000687738 [0,1,0,1,0,0|1,0,1]=4 32013 B14R1.1254 N#CCCOCC1CCCCCCC1 7a_100011216312_100000184422 [0,1,0,1,0,0|1,0,1]=4 32014 B14R1.1254 N#CCNCCC1CCCCCCC1 2230a_100011532352_100011215382 [0,1,0,1,0,0|1,0,1]=4 32015 B14R1.1254 O=CCCCCN1CCCCCCC1 2230a_100000211400_100000139335 [0,1,0,1,0,0|0,0,2]=4 32016 B14R1.1254 O=CCCCCN1CCCCCCC1 269982a_100000211400_100000139335 [0,1,0,1,0,0|0,0,2]=4 32017 B14R1.1254 O=CCCCNC1CCCCCCC1 2230a_100000211152_200011292268 [0,1,0,1,0,0|0,0,2]=4 32018 B14R1.1254 O=CCCCOC1CCCCCCC1 7a_100000210054_200011292268 [0,1,0,1,0,0|0,0,2]=4 32019 B14R1.1254 O=CCNCCC1CCCCCCC1 2230a_100011532352_200015260668 [0,1,0,1,0,0|0,0,2]=4 32020 B14R1.1254 O=CCNCCC1CCCCCCC1 34a_100011532352_200009817547 [0,1,0,1,0,0|0,0,2]=4 32021 B14R1.1254 OCC#CCNC1CCCCCCC1 2230a_100000211152_200000047223 [0,1,0,1,0,0|0,0,2]=4 32022 B14R1.1254 OCC#CCNC1CCCCCCC1 34a_100000211152_200000047223 [0,1,0,1,0,0|0,0,2]=4 32023 B14R1.1254 OCC#CCOC1CCCCCCC1 34a_100000210054_200000047223 [0,1,0,1,0,0|0,0,2]=4 32024 B14R1.1254 OCC#CCOC1CCCCCCC1 7a_100000210054_200000047223 [0,1,0,1,0,0|0,0,2]=4 32025 B14R1.1254 OCCCCCN1CCCCCCC1 2230a_100000211400_100000746330 [0,1,0,1,0,0|0,0,0]=2 32026 B14R1.1254 OCCCCCN1CCCCCCC1 269982a_100000211400_100000746330 [0,1,0,1,0,0|0,0,0]=2 32027 B14R1.1254 OCCCCCN1CCCCCCC1 34a_100000211400_100000746330 [0,1,0,1,0,0|0,0,0]=2 32028 B14R1.1254 OCCCCNC1CC/C=C\CCC1 34a_100000750430_100021000466 [0,1,0,1,0,0|0,0,2]=4 32029 B14R1.1254 OCCCCNC1CCCCCCC1 2230a_100000211152_100000210776 [0,1,0,1,0,0|0,0,0]=2 32030 B14R1.1254 OCCCCNC1CCCCCCC1 270004a_100000750430_100000210524 [0,1,0,1,0,0|0,0,0]=2 32031 B14R1.1254 OCCCCNC1CCCCCCC1 34a_100000211152_100011216708 [0,1,0,1,0,0|0,0,0]=2 32032 B14R1.1254 OCCCCOC1C=CCCCCC1 34a_100000688657_100011216708 [0,1,0,1,0,0|0,0,2]=4 32033 B14R1.1254 OCCCCOC1CC/C=C\CCC1 34a_100016989180_100011216708 [0,1,0,1,0,0|0,0,2]=4 32034 B14R1.1254 OCCCCOC1CCCCCCC1 34a_100000210054_100011216708 [0,1,0,1,0,0|0,0,0]=2 32035 B14R1.1254 OCCCCOC1CCCCCCC1 7a_100000210054_100000210776 [0,1,0,1,0,0|0,0,0]=2 32036 B14R1.1254 OCCCCSC1CC/C=C\CCC1 62a_100000210776_100021000466 [0,1,0,1,0,0|0,0,2]=4 32037 B14R1.1254 OCCCCSC1CC/C=C\CCC1 62a_100021000466_100000210776 [0,1,0,1,0,0|0,0,2]=4 32038 B14R1.1254 OCCCNCC1CC/C=C\CCC1 2230a_100102730862_100000230001 [0,1,0,1,0,0|0,0,2]=4 32039 B14R1.1254 OCCCNCC1CC/C=C\CCC1 34a_100102730862_100000230001 [0,1,0,1,0,0|0,0,2]=4 32040 B14R1.1254 OCCCOCC1CCCCCCC1 34a_100011216312_100000230001 [0,1,0,1,0,0|0,0,0]=2 32041 B14R1.1254 OCCCOCC1CCCCCCC1 7a_100011216312_100011215043 [0,1,0,1,0,0|0,0,0]=2 32042 B14R1.1254 OCCNCCC1CCCCCCC1 2230a_100011532352_100000211926 [0,1,0,1,0,0|0,0,0]=2 32043 B14R1.1254 OCCNCCC1CCCCCCC1 34a_100011532352_100000211926 [0,1,0,1,0,0|0,0,0]=2 32044 B14R1.1254 OCCNN=CC1CCCCCCC1 4a_100000210001_100000765718 [0,1,0,1,0,0|1,0,1]=4 32045 B14R1.1254 OCCOCCN1CCCCCCC1 2230a_100000211400_100011215305 [0,1,0,1,0,0|1,0,0]=3 32046 B14R1.1254 OCCOCCN1CCCCCCC1 269982a_100000211400_100011215305 [0,1,0,1,0,0|1,0,0]=3 32047 B14R1.1254 OCCOCCN1CCCCCCC1 34a_100000211400_100000692535 [0,1,0,1,0,0|1,0,0]=3 32048 B14R1.3360 CC1CCCC1C(=O)CCCCCF 1458a_100000690547_100000729378 [0,1,0,1,0,0|1,0,1]=4 32049 B14R1.3360 CC1CCCC1C(=O)CCCCCO 1458a_100000690547_100000746330 [0,1,0,1,0,0|0,0,1]=3 32050 B14R1.3360 CC1CCCC1C(=O)CCOCCO 1458a_100000690547_100011215305 [0,1,0,1,0,0|1,0,1]=4 32051 B14R1.3360 CC1CCCC1C(=O)NCCCCO 240690a_100000750430_100000690547 [0,1,0,1,0,0|1,0,1]=4 32052 B14R1.3360 CC1CCCC1C(=O)NCCCCO 527a_100000750430_100000690547 [0,1,0,1,0,0|1,0,1]=4 32053 B14R1.3360 CC1OCCC1N(C)CCCCCO 270004a_100000722520_100000691750 [0,1,0,1,0,0|2,0,0]=4 32054 B14R1.3360 CCCCCCC(=O)C1CCCC1C 1458a_100000690547_100000210757 [0,1,0,1,0,0|1,0,1]=4 32055 B14R1.3360 CCCCCCC(C)N1CCC[C@@H]1C 2230a_100020605311_100011215978 [0,1,0,1,0,0|2,0,0]=4 32056 B14R1.3360 CCCCCCC(C)N1CCC[C@@H]1C 269982a_100020605311_100011215978 [0,1,0,1,0,0|2,0,0]=4 32057 B14R1.3360 CCCCCCC(C)N1CCC[C@@H]1C 270004a_100020605311_100000210826 [0,1,0,1,0,0|2,0,0]=4 32058 B14R1.3360 CCCCCCC(C)N1CCC[C@H]1C 2230a_100015189458_100011215978 [0,1,0,1,0,0|2,0,0]=4 32059 B14R1.3360 CCCCCCC(C)N1CCC[C@H]1C 269982a_100015189458_100011215978 [0,1,0,1,0,0|2,0,0]=4 32060 B14R1.3360 CCCCCCC(C)N1CCC[C@H]1C 270004a_100015189458_100000210826 [0,1,0,1,0,0|2,0,0]=4 32061 B14R1.3360 CCCCCCC(C)N1CCC[C@H]1C 34a_100015189458_100011215978 [0,1,0,1,0,0|2,0,0]=4 32062 B14R1.3360 CCCCCCN(C)[C@@H]1CCC[C@H]1O 269982a_106256046315_200016002552 [0,1,0,1,0,0|1,0,0]=3 32063 B14R1.3360 CN(CCCCCO)[C@@H]1CCC[C@H]1O 269982a_100000722520_200016002552 [0,1,0,1,0,0|2,0,0]=4 32064 B14R1.3360 CN1CCC[C@H]1C(=O)CCCCCO 1458a_100009816429_100000746330 [0,1,0,1,0,0|1,0,1]=4 32065 B14R1.3360 C[C@@H]1CCCN1C(=O)CCCCCO 240690a_100015189458_100102619762 [0,1,0,1,0,0|1,0,1]=4 32066 B14R1.3360 C[C@H](OCCCCO)[C@@H]1CCCN1C 34a_100160487421_100011216708 [0,1,0,1,0,0|2,0,0]=4 32067 B14R1.3360 C[C@H]1CCCN1C(=O)CCCCCO 240690a_100020605311_100102619762 [0,1,0,1,0,0|1,0,1]=4 32068 B14R1.3683 CCCCCCC(C)OCC1CC1C 34a_100000744939_100011215978 [0,1,0,1,0,0|2,0,0]=4 32069 B14R1.3683 CCCCCCC(C)OCC1CC1C 7a_100000744939_100011215978 [0,1,0,1,0,0|2,0,0]=4 32070 B14R1.3684 CCCCCCC(=O)NC[C@@H]1CCO1 11a_100020831831_100102632555 [0,1,0,1,0,0|1,0,1]=4 32071 B14R1.3684 CCCCCCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100102632555 [0,1,0,1,0,0|1,0,1]=4 32072 B14R1.3684 CCCCCCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100102632555 [0,1,0,1,0,0|1,0,1]=4 32073 B14R1.3684 CCCCCCC(=O)NC[C@@H]1CCO1 527a_100020831831_100102632555 [0,1,0,1,0,0|1,0,1]=4 32074 B14R1.3684 CCCCCCC(C)NCC1CCC1 2230a_100000210919_100000763275 [0,1,0,1,0,0|2,0,0]=4 32075 B14R1.3684 CCCCCCC(C)NCC1CCC1 2230a_100000738700_100011215978 [0,1,0,1,0,0|2,0,0]=4 32076 B14R1.3684 CCCCCCC(C)NCC1CCC1 269862a_100000210919_100000753134 [0,1,0,1,0,0|2,0,0]=4 32077 B14R1.3684 CCCCCCC(C)NCC1CCC1 270004a_100000738700_100000210826 [0,1,0,1,0,0|2,0,0]=4 32078 B14R1.3684 CCCCCCC(C)NCC1CCC1 34a_100000210919_100000763275 [0,1,0,1,0,0|2,0,0]=4 32079 B14R1.3684 CCCCCCC(C)NCC1CCC1 34a_100000738700_100011215978 [0,1,0,1,0,0|2,0,0]=4 32080 B14R1.3684 CCCCCCC(C)NCC1CCO1 2230a_100000210919_100000103362 [0,1,0,1,0,0|1,0,0]=3 32081 B14R1.3684 CCCCCCC(C)NCC1CCO1 34a_100000210919_100000103362 [0,1,0,1,0,0|1,0,0]=3 32082 B14R1.3684 CCCCCCC(C)NC[C@@H]1CCO1 2230a_100020831831_100011215978 [0,1,0,1,0,0|1,0,0]=3 32083 B14R1.3684 CCCCCCC(C)NC[C@@H]1CCO1 270004a_100020831831_100000210826 [0,1,0,1,0,0|1,0,0]=3 32084 B14R1.3684 CCCCCCC(C)NC[C@@H]1CCO1 34a_100020831831_100011215978 [0,1,0,1,0,0|1,0,0]=3 32085 B14R1.3684 CCCCCCC(C)OCC1CCC1 34a_100000210265_100000763275 [0,1,0,1,0,0|2,0,0]=4 32086 B14R1.3684 CCCCCCC(C)OCC1CCC1 34a_100000760304_100011215978 [0,1,0,1,0,0|2,0,0]=4 32087 B14R1.3684 CCCCCCC(C)OCC1CCC1 7a_100000210265_100000763275 [0,1,0,1,0,0|2,0,0]=4 32088 B14R1.3684 CCCCCCC(C)OCC1CCO1 34a_100000039022_100011215978 [0,1,0,1,0,0|1,0,0]=3 32089 B14R1.3684 CCCCCCC(C)OCC1CCO1 34a_100000210265_100000103362 [0,1,0,1,0,0|1,0,0]=3 32090 B14R1.3684 CCCCCCC(C)OCC1CCO1 7a_100000210265_100000103362 [0,1,0,1,0,0|1,0,0]=3 32091 B14R1.3684 CCCCCCC(C)SCC1CCC1 62a_100000763275_100011215978 [0,1,0,1,0,0|2,0,0]=4 32092 B14R1.3684 CCCCCCC(C)SCC1CCC1 62a_100011215978_100000763275 [0,1,0,1,0,0|2,0,0]=4 32093 B14R1.3684 CCCCCCC(C)SCC1CCO1 62a_100000103362_100011215978 [0,1,0,1,0,0|1,0,0]=3 32094 B14R1.3684 CCCCCCC(C)SCC1CCO1 62a_100011215978_100000103362 [0,1,0,1,0,0|1,0,0]=3 32095 B14R1.3684 CCCCOCC(C)OCC1CCO1 34a_100011217071_100000103362 [0,1,0,1,0,0|2,0,0]=4 32096 B14R1.3684 CCCCOCC(C)OCC1CCO1 7a_100011217071_100000103362 [0,1,0,1,0,0|2,0,0]=4 32097 B14R1.3684 O=C(CCCCCO)NCC1CCC1 240690a_100000738700_100102619762 [0,1,0,1,0,0|1,0,1]=4 32098 B14R1.3685 CCCCCCC(=O)CCCC1CO1 1458a_100102632555_100000733510 [0,1,0,1,0,0|0,0,1]=3 32099 B14R1.3685 CCCCCCC(C)CCOC1CC1 34a_200011024964_100000211595 [0,1,0,1,0,0|2,0,0]=4 32100 B14R1.3685 CCCCCCC(C)NCCC1CC1 2230a_100000210919_100000694398 [0,1,0,1,0,0|2,0,0]=4 32101 B14R1.3685 CCCCCCC(C)NCCC1CC1 270004a_100000764129_100000210826 [0,1,0,1,0,0|2,0,0]=4 32102 B14R1.3685 CCCCCCC(C)NCCC1CC1 34a_100000210919_100000694398 [0,1,0,1,0,0|2,0,0]=4 32103 B14R1.3685 CCCCCCC(C)NCCC1CC1 34a_100000764129_100011215978 [0,1,0,1,0,0|2,0,0]=4 32104 B14R1.3685 CCCCCCC(C)NCCC1CO1 2230a_100000210919_100000732470 [0,1,0,1,0,0|1,0,0]=3 32105 B14R1.3685 CCCCCCC(C)NCCC1CO1 34a_100000210919_100000732470 [0,1,0,1,0,0|1,0,0]=3 32106 B14R1.3685 CCCCCCC(C)OCCC1CC1 34a_100000210265_100000694398 [0,1,0,1,0,0|2,0,0]=4 32107 B14R1.3685 CCCCCCC(C)OCCC1CC1 34a_100000754188_100011215978 [0,1,0,1,0,0|2,0,0]=4 32108 B14R1.3685 CCCCCCC(C)OCCC1CC1 7a_100000210265_100000764125 [0,1,0,1,0,0|2,0,0]=4 32109 B14R1.3685 CCCCCCC(C)OCCC1CC1 7a_100000754188_100011215978 [0,1,0,1,0,0|2,0,0]=4 32110 B14R1.3685 CCCCCCC(C)OCCC1CO1 34a_100000210265_100000732470 [0,1,0,1,0,0|1,0,0]=3 32111 B14R1.3685 CCCCCCC(C)OCCC1CO1 7a_100000210265_100000732470 [0,1,0,1,0,0|1,0,0]=3 32112 B14R1.3685 CCCCCCC(C)OCC[C@@H]1CO1 34a_100009820653_100011215978 [0,1,0,1,0,0|1,0,0]=3 32113 B14R1.3685 CCCCCCC(C)SCCC1CC1 62a_100000764125_100011215978 [0,1,0,1,0,0|2,0,0]=4 32114 B14R1.3685 CCCCCCC(C)SCCC1CC1 62a_100011215978_100000764125 [0,1,0,1,0,0|2,0,0]=4 32115 B14R1.3685 CCCCCCC(C)SCCC1CO1 62a_100000732470_100011215978 [0,1,0,1,0,0|1,0,0]=3 32116 B14R1.3685 CCCCCCC(C)SCCC1CO1 62a_100011215978_100000732470 [0,1,0,1,0,0|1,0,0]=3 32117 B14R1.3685 CCCCCCN(C)CCCC1CO1 2230a_106256046315_100000733510 [0,1,0,1,0,0|1,0,0]=3 32118 B14R1.3685 CCCCCCN(C)CCCC1CO1 269982a_106256046315_100000733510 [0,1,0,1,0,0|1,0,0]=3 32119 B14R1.3685 CCCCOCC(=O)CCCC1CO1 1458a_100000757543_100000733510 [0,1,0,1,0,0|1,0,1]=4 32120 B14R1.3685 CCCCOCC(C)OCCC1CO1 34a_100011217071_100000732470 [0,1,0,1,0,0|2,0,0]=4 32121 B14R1.3685 CCCCOCC(C)OCCC1CO1 7a_100011217071_100000732470 [0,1,0,1,0,0|2,0,0]=4 32122 B14R1.3685 CCCCSCC(=O)CCCC1CO1 1458a_100000191162_100000733510 [0,1,0,1,0,0|1,0,1]=4 32123 B14R1.3685 CN(CCCCCO)CCCC1CO1 2230a_100000722520_100000733510 [0,1,0,1,0,0|2,0,0]=4 32124 B14R1.3685 CN(CCCCCO)CCCC1CO1 269982a_100000722520_100000733510 [0,1,0,1,0,0|2,0,0]=4 32125 B14R1.3685 O=C(CCCCCO)CCCC1CO1 1458a_100102619762_100000733510 [0,1,0,1,0,0|1,0,1]=4 32126 B14R1.3685 O=C(CCCCCO)CSCC1CC1 1458a_200011316215_100000746330 [0,1,0,1,0,0|1,0,1]=4 32127 B14R1.3685 O=C(CCCCCO)NCCC1CC1 240690a_100000764129_100102619762 [0,1,0,1,0,0|1,0,1]=4 32128 B14R1.4760 CC1(CCCCCC1)NCCCCF 2230a_100000704638_100000729493 [0,1,0,1,0,0|2,0,0]=4 32129 B14R1.4760 CC1(CCCCCC1)NCCCCF 34a_100000704638_100000729493 [0,1,0,1,0,0|2,0,0]=4 32130 B14R1.4760 CC1(CCCCCC1)NCCCCO 2230a_100000704638_100000210776 [0,1,0,1,0,0|1,0,0]=3 32131 B14R1.4760 CC1(CCCCCC1)NCCCCO 34a_100000704638_100011216708 [0,1,0,1,0,0|1,0,0]=3 32132 B14R1.4760 CC1(CCCCCC1)OCCCCF 34a_100000708895_100000729493 [0,1,0,1,0,0|2,0,0]=4 32133 B14R1.4760 CC1(CCCCCC1)OCCCCF 7a_100000708895_100000729493 [0,1,0,1,0,0|2,0,0]=4 32134 B14R1.4760 CC1(CCCCCC1)OCCCCO 34a_100000708895_100011216708 [0,1,0,1,0,0|1,0,0]=3 32135 B14R1.4760 CC1(CCCCCC1)OCCCCO 7a_100000708895_100000210776 [0,1,0,1,0,0|1,0,0]=3 32136 B14R1.4760 CC1(CCCNCC1)OCCCCO 34a_100000723723_100011216708 [0,1,0,1,0,0|2,0,0]=4 32137 B14R1.4760 CCCCCNC1(CCCCCC1)C 2230a_100000704638_100000210326 [0,1,0,1,0,0|2,0,0]=4 32138 B14R1.4760 CCCCCNC1(CCCCCC1)C 34a_100000704638_100000718602 [0,1,0,1,0,0|2,0,0]=4 32139 B14R1.4760 CCCCCOC1(CCCCCC1)C 34a_100000708895_100000718602 [0,1,0,1,0,0|2,0,0]=4 32140 B14R1.4760 CCCCCOC1(CCCCCC1)C 7a_100000708895_100000210326 [0,1,0,1,0,0|2,0,0]=4 32141 B14R1.62 C#CCCCCCN1CCCC1CC 2230a_100000754278_100012094781 [0,1,0,1,0,0|1,0,1]=4 32142 B14R1.62 C#CCCCCCN1CCCC1CC 269982a_100000754278_100012094781 [0,1,0,1,0,0|1,0,1]=4 32143 B14R1.62 C#CCCCCCN1CCCC1CC 34a_100000754278_100012094781 [0,1,0,1,0,0|1,0,1]=4 32144 B14R1.62 C#CCCCCCN1CCC[C@@H]1CO 2230a_100000745186_100012094781 [0,1,0,1,0,0|0,0,2]=4 32145 B14R1.62 C#CCCCCCN1CCC[C@@H]1CO 269982a_100000745186_100012094781 [0,1,0,1,0,0|0,0,2]=4 32146 B14R1.62 C#CCCCCCN1CCC[C@@H]1CO 34a_100000745186_100012094781 [0,1,0,1,0,0|0,0,2]=4 32147 B14R1.62 C=CCCCCCN1CCCC1CC 2230a_100000754278_100000700193 [0,1,0,1,0,0|1,0,1]=4 32148 B14R1.62 C=CCCCCCN1CCCC1CC 269982a_100000754278_100000700193 [0,1,0,1,0,0|1,0,1]=4 32149 B14R1.62 C=CCCCCCN1CCCC1CC 34a_100000754278_100000700193 [0,1,0,1,0,0|1,0,1]=4 32150 B14R1.62 C=CCCCCCN1CCC[C@@H]1CO 2230a_100000745186_100000700193 [0,1,0,1,0,0|0,0,2]=4 32151 B14R1.62 C=CCCCCCN1CCC[C@@H]1CO 269982a_100000745186_100000700193 [0,1,0,1,0,0|0,0,2]=4 32152 B14R1.62 C=CCCCCCN1CCC[C@@H]1CO 34a_100000745186_100000700193 [0,1,0,1,0,0|0,0,2]=4 32153 B14R1.62 C=CCCCCNC1CCCC1CC 269862a_100000703577_100000749056 [0,1,0,1,0,0|1,0,1]=4 32154 B14R1.62 C=CCCCCNC1CCCC1CC 270004a_100000703577_100000749056 [0,1,0,1,0,0|1,0,1]=4 32155 B14R1.62 CCC1C=CCN1CCCCCCO 2230a_100000730860_100000766143 [0,1,0,1,0,0|0,0,2]=4 32156 B14R1.62 CCC1C=CCN1CCCCCCO 269982a_100000730860_100000766143 [0,1,0,1,0,0|0,0,2]=4 32157 B14R1.62 CCC1C=CCN1CCCCCCO 34a_100000730860_100000766143 [0,1,0,1,0,0|0,0,2]=4 32158 B14R1.62 CCC1CCCC1NCCCCC#N 270004a_100000751965_100000749056 [0,1,0,1,0,0|1,0,1]=4 32159 B14R1.62 CCC1CCCC1NCCCCCO 269862a_100000762737_100000749056 [0,1,0,1,0,0|0,0,0]=2 32160 B14R1.62 CCC1CCCC1NCCCCCO 270004a_100000762737_100000749056 [0,1,0,1,0,0|0,0,0]=2 32161 B14R1.62 CCC1CCCC1NCCOCCO 269862a_100000211614_100000749056 [0,1,0,1,0,0|1,0,0]=3 32162 B14R1.62 CCC1CCCC1NCCOCCO 270004a_100000211614_100000749056 [0,1,0,1,0,0|1,0,0]=3 32163 B14R1.62 CCC1CCCC1NCCSCCO 269862a_100011219999_100000749056 [0,1,0,1,0,0|1,0,0]=3 32164 B14R1.62 CCC1CCCC1NCCSCCO 270004a_100011219999_100000749056 [0,1,0,1,0,0|1,0,0]=3 32165 B14R1.62 CCC1CCCN1CCCCCC#N 2230a_100000754278_100009813376 [0,1,0,1,0,0|1,0,1]=4 32166 B14R1.62 CCC1CCCN1CCCCCC#N 269982a_100000754278_100009813376 [0,1,0,1,0,0|1,0,1]=4 32167 B14R1.62 CCC1CCCN1CCCCCC=O 2230a_100000754278_100000139337 [0,1,0,1,0,0|0,0,2]=4 32168 B14R1.62 CCC1CCCN1CCCCCC=O 269982a_100000754278_100000139337 [0,1,0,1,0,0|0,0,2]=4 32169 B14R1.62 CCC1CCCN1CCCCCCF 2230a_100000754278_100015922095 [0,1,0,1,0,0|1,0,0]=3 32170 B14R1.62 CCC1CCCN1CCCCCCF 269982a_100000754278_100015922095 [0,1,0,1,0,0|1,0,0]=3 32171 B14R1.62 CCC1CCCN1CCCCCCF 34a_100000754278_100015922095 [0,1,0,1,0,0|1,0,0]=3 32172 B14R1.62 CCC1CCCN1CCCCCCO 2230a_100000754278_100000766143 [0,1,0,1,0,0|0,0,0]=2 32173 B14R1.62 CCC1CCCN1CCCCCCO 269982a_100000754278_100000766143 [0,1,0,1,0,0|0,0,0]=2 32174 B14R1.62 CCC1CCCN1CCCCCCO 34a_100000754278_100000766143 [0,1,0,1,0,0|0,0,0]=2 32175 B14R1.62 CCC1CCCN1CCOCCOC 2230a_100000754278_100000695917 [0,1,0,1,0,0|2,0,0]=4 32176 B14R1.62 CCC1CCCN1CCOCCOC 269982a_100000754278_100000695917 [0,1,0,1,0,0|2,0,0]=4 32177 B14R1.62 CCC1CCCN1CCOCCOC 34a_100000754278_100000695917 [0,1,0,1,0,0|2,0,0]=4 32178 B14R1.62 CCCCCCCC1CCCC1NC 269862a_106832991636_200011216720 [0,1,0,1,0,0|1,0,0]=3 32179 B14R1.62 CCCCCCCC1CCCC1NC 270004a_106832991635_200011216720 [0,1,0,1,0,0|1,0,0]=3 32180 B14R1.62 CCCCCCCN1CCCC1C#N 2230a_100000701862_100000210681 [0,1,0,1,0,0|1,0,1]=4 32181 B14R1.62 CCCCCCCN1CCCC1CC 2230a_100000754278_100000210681 [0,1,0,1,0,0|1,0,0]=3 32182 B14R1.62 CCCCCCCN1CCCC1CC 269982a_100000754278_100000210681 [0,1,0,1,0,0|1,0,0]=3 32183 B14R1.62 CCCCCCCN1CCCC1CC 34a_100000754278_100000210614 [0,1,0,1,0,0|1,0,0]=3 32184 B14R1.62 CCCCCCCN1CCC[C@@H]1C#N 2230a_106645074975_100000210681 [0,1,0,1,0,0|1,0,1]=4 32185 B14R1.62 CCCCCCCN1CCC[C@@H]1C#N 269982a_106645074975_100000210681 [0,1,0,1,0,0|1,0,1]=4 32186 B14R1.62 CCCCCCCN1CCC[C@@H]1CO 2230a_100000745186_100000210681 [0,1,0,1,0,0|0,0,0]=2 32187 B14R1.62 CCCCCCCN1CCC[C@@H]1CO 269982a_100000745186_100000210681 [0,1,0,1,0,0|0,0,0]=2 32188 B14R1.62 CCCCCCCN1CCC[C@@H]1CO 34a_100000745186_100000210614 [0,1,0,1,0,0|0,0,0]=2 32189 B14R1.62 CCCCCCNC1CCCC1CC 269862a_100000210581_100000749056 [0,1,0,1,0,0|1,0,0]=3 32190 B14R1.62 CCCCCCNC1CCCC1CC 270004a_100000210581_100000749056 [0,1,0,1,0,0|1,0,0]=3 32191 B14R1.62 CCCCCCO[C@@H]1CCC[C@H]1C#N 34a_100011907464_100000210314 [0,1,0,1,0,0|1,0,1]=4 32192 B14R1.62 CCCCCCO[C@@H]1CCC[C@H]1C#N 7a_100011907464_100000210314 [0,1,0,1,0,0|1,0,1]=4 32193 B14R1.62 CCCCCNCC1CCCN1CC 2230a_100000211693_100000210326 [0,1,0,1,0,0|2,0,0]=4 32194 B14R1.62 CCCCCOC[C@H]1CCCN1CC 34a_100011739246_100000718602 [0,1,0,1,0,0|2,0,0]=4 32195 B14R1.62 CCCCCOC[C@H]1CCCN1CC 7a_100011739246_100000210326 [0,1,0,1,0,0|2,0,0]=4 32196 B14R1.62 CCCCOCCN1CCCC1CC 2230a_100000754278_100000743108 [0,1,0,1,0,0|2,0,0]=4 32197 B14R1.62 CCCCOCCN1CCCC1CC 269982a_100000754278_100000743108 [0,1,0,1,0,0|2,0,0]=4 32198 B14R1.62 CCCCOCCN1CCCC1CC 34a_100000754278_100000743108 [0,1,0,1,0,0|2,0,0]=4 32199 B14R1.62 CCCCOCCN1CCC[C@@H]1CO 2230a_100000745186_100000743108 [0,1,0,1,0,0|1,0,0]=3 32200 B14R1.62 CCCCOCCN1CCC[C@@H]1CO 269982a_100000745186_100000743108 [0,1,0,1,0,0|1,0,0]=3 32201 B14R1.62 CCCCOCCN1CCC[C@@H]1CO 34a_100000745186_100000743108 [0,1,0,1,0,0|1,0,0]=3 32202 B14R1.62 CCCOCCNC1CCCC1CC 269862a_100161115042_100000749056 [0,1,0,1,0,0|2,0,0]=4 32203 B14R1.62 CCCOCCNC1CCCC1CC 270004a_100161115042_100000749056 [0,1,0,1,0,0|2,0,0]=4 32204 B14R1.62 CCCSCCNC1CCCC1CC 269862a_100020603323_100000749056 [0,1,0,1,0,0|2,0,0]=4 32205 B14R1.62 CCCSCCNC1CCCC1CC 270004a_100020603323_100000749056 [0,1,0,1,0,0|2,0,0]=4 32206 B14R1.62 CCN1CCCC1CNCCCCF 2230a_100000211693_100000729493 [0,1,0,1,0,0|2,0,0]=4 32207 B14R1.62 CCN1CCCC1CNCCCCO 2230a_100000211693_100000210776 [0,1,0,1,0,0|1,0,0]=3 32208 B14R1.62 CCN1CCCC1CNCCCOC 2230a_100000211693_100000740836 [0,1,0,1,0,0|2,0,0]=4 32209 B14R1.62 CCN1CCC[C@@H]1COCCCCF 34a_100011739246_100000729493 [0,1,0,1,0,0|2,0,0]=4 32210 B14R1.62 CCN1CCC[C@@H]1COCCCCF 7a_100011739246_100000729493 [0,1,0,1,0,0|2,0,0]=4 32211 B14R1.62 CCN1CCC[C@@H]1COCCCCO 34a_100011739246_100011216708 [0,1,0,1,0,0|1,0,0]=3 32212 B14R1.62 CCN1CCC[C@@H]1COCCCCO 7a_100011739246_100000210776 [0,1,0,1,0,0|1,0,0]=3 32213 B14R1.62 CCN1CCC[C@@H]1COCCCOC 34a_100011739246_100000740836 [0,1,0,1,0,0|2,0,0]=4 32214 B14R1.62 CCN1CCC[C@@H]1COCCCOC 7a_100011739246_100000740836 [0,1,0,1,0,0|2,0,0]=4 32215 B14R1.62 CCOCCCNC1CCCC1CC 269862a_100000210961_100000749056 [0,1,0,1,0,0|2,0,0]=4 32216 B14R1.62 CCOCCCNC1CCCC1CC 270004a_100000210961_100000749056 [0,1,0,1,0,0|2,0,0]=4 32217 B14R1.62 COCCOCCN1CCC[C@@H]1CO 2230a_100000745186_100000695917 [0,1,0,1,0,0|2,0,0]=4 32218 B14R1.62 COCCOCCN1CCC[C@@H]1CO 269982a_100000745186_100000695917 [0,1,0,1,0,0|2,0,0]=4 32219 B14R1.62 COCCOCCN1CCC[C@@H]1CO 34a_100000745186_100000695917 [0,1,0,1,0,0|2,0,0]=4 32220 B14R1.62 N#CC1CCCN1CCCCCCO 2230a_100000701862_100000766143 [0,1,0,1,0,0|1,0,1]=4 32221 B14R1.62 N#CCCCCCN1CCC[C@@H]1CO 2230a_100000745186_100009813376 [0,1,0,1,0,0|1,0,1]=4 32222 B14R1.62 N#CCCCCCN1CCC[C@@H]1CO 269982a_100000745186_100009813376 [0,1,0,1,0,0|1,0,1]=4 32223 B14R1.62 N#C[C@@H]1CCC[C@H]1OCCCCCO 34a_100011907464_100000746330 [0,1,0,1,0,0|1,0,1]=4 32224 B14R1.62 N#C[C@@H]1CCC[C@H]1OCCCCCO 7a_100011907464_100000746330 [0,1,0,1,0,0|1,0,1]=4 32225 B14R1.62 N#C[C@H]1CCCN1CCCCCCO 2230a_106645074975_100000766143 [0,1,0,1,0,0|1,0,1]=4 32226 B14R1.62 N#C[C@H]1CCCN1CCCCCCO 269982a_106645074975_100000766143 [0,1,0,1,0,0|1,0,1]=4 32227 B14R1.62 O=CCCCCCN1CCC[C@@H]1CO 2230a_100000745186_100000139337 [0,1,0,1,0,0|1,0,1]=4 32228 B14R1.62 O=CCCCCCN1CCC[C@@H]1CO 269982a_100000745186_100000139337 [0,1,0,1,0,0|1,0,1]=4 32229 B14R1.62 OCCCCCCN1CCC[C@@H]1CO 2230a_100000745186_100000766143 [0,1,0,1,0,0|1,0,0]=3 32230 B14R1.62 OCCCCCCN1CCC[C@@H]1CO 269982a_100000745186_100000766143 [0,1,0,1,0,0|1,0,0]=3 32231 B14R1.62 OCCCCCCN1CCC[C@@H]1CO 34a_100000745186_100000766143 [0,1,0,1,0,0|1,0,0]=3 32232 B14R1.62 OC[C@H]1CCCN1CCCCCCF 2230a_100000745186_100015922095 [0,1,0,1,0,0|1,0,0]=3 32233 B14R1.62 OC[C@H]1CCCN1CCCCCCF 269982a_100000745186_100015922095 [0,1,0,1,0,0|1,0,0]=3 32234 B14R1.62 OC[C@H]1CCCN1CCCCCCF 34a_100000745186_100015922095 [0,1,0,1,0,0|1,0,0]=3 32235 B14R1.138 CCCCCOC1CCCCCC1=O 7a_100000210253_100000243696 [0,1,0,1,0,0|0,0,2]=4 32236 B14R1.138 CCCCCSC1CCCCCC1=O 62a_100000210326_100000243696 [0,1,0,1,0,0|0,0,2]=4 32237 B14R1.138 CCCCCSC1CCCCCC1=O 62a_100000243696_100000210326 [0,1,0,1,0,0|0,0,2]=4 32238 B14R1.138 O=C1CCCCCC1SCCCCO 62a_100000210776_100000243696 [0,1,0,1,0,0|1,0,1]=4 32239 B14R1.138 O=C1CCCCCC1SCCCCO 62a_100000243696_100000210776 [0,1,0,1,0,0|1,0,1]=4 32240 B14R1.234 C#CCCCNC1CCCC1CCC 270004a_100000718082_100000723119 [0,1,0,1,0,0|1,0,1]=4 32241 B14R1.234 C=CCCCNC1CCCC1CCC 269862a_100000700776_100000723119 [0,1,0,1,0,0|1,0,1]=4 32242 B14R1.234 C=CCCCNC1CCCC1CCC 270004a_100000700776_100000723119 [0,1,0,1,0,0|1,0,1]=4 32243 B14R1.234 CCCC1CCCC1NCCCCO 269862a_100000750430_100000723119 [0,1,0,1,0,0|0,0,0]=2 32244 B14R1.234 CCCC1CCCC1NCCCCO 270004a_100000750430_100000723119 [0,1,0,1,0,0|0,0,0]=2 32245 B14R1.234 CCCC1CCCC1NCCCOC 269862a_100150723488_100000723119 [0,1,0,1,0,0|1,0,0]=3 32246 B14R1.234 CCCC1CCCC1NCCCOC 270004a_100150723488_100000723119 [0,1,0,1,0,0|1,0,0]=3 32247 B14R1.234 CCCC1CCCC1NCCCSC 269862a_100000749238_100000723119 [0,1,0,1,0,0|1,1,0]=4 32248 B14R1.234 CCCC1CCCC1NCCCSC 270004a_100000749238_100000723119 [0,1,0,1,0,0|1,1,0]=4 32249 B14R1.234 CCCC1CCCC1NCCOCC 269862a_100011200944_100000723119 [0,1,0,1,0,0|2,0,0]=4 32250 B14R1.234 CCCC1CCCC1NCCOCC 270004a_102516460346_100000723119 [0,1,0,1,0,0|2,0,0]=4 32251 B14R1.234 CCCC1CCCC1NCCSCC 269862a_100000106463_100000723119 [0,1,0,1,0,0|2,0,0]=4 32252 B14R1.234 CCCC1CCCC1NCCSCC 270004a_100000106463_100000723119 [0,1,0,1,0,0|2,0,0]=4 32253 B14R1.234 CCCCCCC1CCCC1NCC 269862a_100015525214_100000189428 [0,1,0,1,0,0|1,0,0]=3 32254 B14R1.234 CCCCCCC1CCCC1NCC 270004a_100015525214_100000189428 [0,1,0,1,0,0|1,0,0]=3 32255 B14R1.234 CCCCCCN1CCC[C@H]1COC 2230a_100020646714_100000210314 [0,1,0,1,0,0|1,0,0]=3 32256 B14R1.234 CCCCCCN1CCC[C@H]1COC 269982a_100020646714_100000210757 [0,1,0,1,0,0|1,0,0]=3 32257 B14R1.234 CCCCCCN1CCC[C@H]1COC 34a_100020646714_100000210314 [0,1,0,1,0,0|1,0,0]=3 32258 B14R1.234 CCCCCNC1CCCC1CCC 269862a_100000209983_100000723119 [0,1,0,1,0,0|1,0,0]=3 32259 B14R1.234 CCCCCNC1CCCC1CCC 270004a_100000209983_100000723119 [0,1,0,1,0,0|1,0,0]=3 32260 B14R1.234 CCCCOCC1CCCN1CCC 34a_200000694710_100000210210 [0,1,0,1,0,0|2,0,0]=4 32261 B14R1.234 CCCCOCC1CCCN1CCC 7a_200000694710_100000210211 [0,1,0,1,0,0|2,0,0]=4 32262 B14R1.234 CCCCOCN1CCC[C@H]1COC 2230a_100020646714_100011995733 [0,1,0,1,0,0|2,0,0]=4 32263 B14R1.234 CCCCOCN1CCC[C@H]1COC 269982a_100020646714_100011995733 [0,1,0,1,0,0|2,0,0]=4 32264 B14R1.234 CCCCOCN1CCC[C@H]1COC 34a_100020646714_100011995733 [0,1,0,1,0,0|2,0,0]=4 32265 B14R1.234 CCCN1CCCC1COCCCF 34a_200000694710_100011934791 [0,1,0,1,0,0|2,0,0]=4 32266 B14R1.234 CCCN1CCCC1COCCCF 7a_200000694710_100011934791 [0,1,0,1,0,0|2,0,0]=4 32267 B14R1.234 CCCN1CCCC1COCCCO 34a_200000694710_100000230001 [0,1,0,1,0,0|1,0,0]=3 32268 B14R1.234 CCCN1CCCC1COCCCO 7a_200000694710_100011215043 [0,1,0,1,0,0|1,0,0]=3 32269 B14R1.234 CCCN1CCCC1COCCOC 34a_200000694710_100011201679 [0,1,0,1,0,0|2,0,0]=4 32270 B14R1.234 CCCN1CCCC1COCCOC 7a_200000694710_100000233755 [0,1,0,1,0,0|2,0,0]=4 32271 B14R1.234 CCCOCCN1CCC[C@H]1COC 2230a_100020646714_100011215938 [0,1,0,1,0,0|2,0,0]=4 32272 B14R1.234 CCCOCCN1CCC[C@H]1COC 269982a_100020646714_100011215938 [0,1,0,1,0,0|2,0,0]=4 32273 B14R1.234 CCCOCCN1CCC[C@H]1COC 34a_100020646714_100011215938 [0,1,0,1,0,0|2,0,0]=4 32274 B14R1.234 CCOCCCN1CCC[C@H]1COC 2230a_100020646714_100012232248 [0,1,0,1,0,0|2,0,0]=4 32275 B14R1.234 CCOCCCN1CCC[C@H]1COC 269982a_100020646714_100012232248 [0,1,0,1,0,0|2,0,0]=4 32276 B14R1.234 CCOCCCN1CCC[C@H]1COC 34a_100020646714_100012232248 [0,1,0,1,0,0|2,0,0]=4 32277 B14R1.234 COCCCCN1CCC[C@H]1COC 2230a_100020646714_100000730899 [0,1,0,1,0,0|2,0,0]=4 32278 B14R1.234 COCCCCN1CCC[C@H]1COC 269982a_100020646714_100000730899 [0,1,0,1,0,0|2,0,0]=4 32279 B14R1.234 COCCCCN1CCC[C@H]1COC 34a_100020646714_100000755781 [0,1,0,1,0,0|2,0,0]=4 32280 B14R1.234 COC[C@@H]1CCCN1CCCCCF 2230a_100020646714_100000729378 [0,1,0,1,0,0|2,0,0]=4 32281 B14R1.234 COC[C@@H]1CCCN1CCCCCF 269982a_100020646714_100000729378 [0,1,0,1,0,0|2,0,0]=4 32282 B14R1.234 COC[C@@H]1CCCN1CCCCCF 34a_100020646714_100000729378 [0,1,0,1,0,0|2,0,0]=4 32283 B14R1.234 COC[C@@H]1CCCN1CCCCCO 2230a_100020646714_100000746330 [0,1,0,1,0,0|1,0,0]=3 32284 B14R1.234 COC[C@@H]1CCCN1CCCCCO 269982a_100020646714_100000746330 [0,1,0,1,0,0|1,0,0]=3 32285 B14R1.234 COC[C@@H]1CCCN1CCCCCO 34a_100020646714_100000746330 [0,1,0,1,0,0|1,0,0]=3 32286 B14R1.234 COC[C@@H]1CCCN1CCOCCO 2230a_100020646714_100011215305 [0,1,0,1,0,0|2,0,0]=4 32287 B14R1.234 COC[C@@H]1CCCN1CCOCCO 269982a_100020646714_100011215305 [0,1,0,1,0,0|2,0,0]=4 32288 B14R1.234 COC[C@@H]1CCCN1CCOCCO 34a_100020646714_100000692535 [0,1,0,1,0,0|2,0,0]=4 32289 B14R1.476 C#CC1CCCCN1CCCCCC 2230a_200020621307_100000210314 [0,1,0,1,0,0|1,0,1]=4 32290 B14R1.476 C#CC1CCCCN1CCCCCC 269982a_200020621307_100000210757 [0,1,0,1,0,0|1,0,1]=4 32291 B14R1.476 C#CC1CCCCN1CCCCCC 34a_200020621307_100000210314 [0,1,0,1,0,0|1,0,1]=4 32292 B14R1.476 C#CC1CCCCN1CCCCCO 2230a_200020621307_100000746330 [0,1,0,1,0,0|0,0,2]=4 32293 B14R1.476 C#CC1CCCCN1CCCCCO 269982a_200020621307_100000746330 [0,1,0,1,0,0|0,0,2]=4 32294 B14R1.476 C#CC1CCCCN1CCCCCO 34a_200020621307_100000746330 [0,1,0,1,0,0|0,0,2]=4 32295 B14R1.476 C#CCCCCN1CCCCC1CC 2230a_100000210034_100010269958 [0,1,0,1,0,0|1,0,1]=4 32296 B14R1.476 C#CCCCCN1CCCCC1CC 269982a_100000210034_100010269958 [0,1,0,1,0,0|1,0,1]=4 32297 B14R1.476 C#CCCCCN1CCCCC1CC 34a_100000210034_100010269958 [0,1,0,1,0,0|1,0,1]=4 32298 B14R1.476 C#CCCCCN1CCCCC1CO 2230a_100000210821_100010269958 [0,1,0,1,0,0|0,0,2]=4 32299 B14R1.476 C#CCCCCN1CCCCC1CO 269982a_100000210821_100010269958 [0,1,0,1,0,0|0,0,2]=4 32300 B14R1.476 C#CCCCCN1CCCCC1CO 34a_100000210821_100010269958 [0,1,0,1,0,0|0,0,2]=4 32301 B14R1.476 C#CCCCNC1CCCCC1CC 270004a_100000718082_100000757040 [0,1,0,1,0,0|1,0,1]=4 32302 B14R1.476 C#CCCCNC1CCCCC1CO 270004a_100000718082_100009861125 [0,1,0,1,0,0|0,0,2]=4 32303 B14R1.476 C#CCCCOC1CCCCC1CC 34a_100000210738_100000695029 [0,1,0,1,0,0|1,0,1]=4 32304 B14R1.476 C#CCCCOC1CCCCC1CC 7a_100000210738_100011215417 [0,1,0,1,0,0|1,0,1]=4 32305 B14R1.476 C=CCCCCN1CCCCC1CC 2230a_100000210034_100011215482 [0,1,0,1,0,0|1,0,1]=4 32306 B14R1.476 C=CCCCCN1CCCCC1CC 269982a_100000210034_100011215482 [0,1,0,1,0,0|1,0,1]=4 32307 B14R1.476 C=CCCCCN1CCCCC1CC 34a_100000210034_100011215482 [0,1,0,1,0,0|1,0,1]=4 32308 B14R1.476 C=CCCCCN1CCCCC1CO 2230a_100000210821_100011215482 [0,1,0,1,0,0|0,0,2]=4 32309 B14R1.476 C=CCCCCN1CCCCC1CO 269982a_100000210821_100011215482 [0,1,0,1,0,0|0,0,2]=4 32310 B14R1.476 C=CCCCCN1CCCCC1CO 34a_100000210821_100011215482 [0,1,0,1,0,0|0,0,2]=4 32311 B14R1.476 C=CCCCNC1CCCCC1CC 269862a_100000700776_100000757040 [0,1,0,1,0,0|1,0,1]=4 32312 B14R1.476 C=CCCCNC1CCCCC1CC 270004a_100000700776_100000757040 [0,1,0,1,0,0|1,0,1]=4 32313 B14R1.476 C=CCCCNC1CCCCC1CO 270004a_100000700776_100009861125 [0,1,0,1,0,0|0,0,2]=4 32314 B14R1.476 C=CCCCOC1CCCCC1CC 34a_100000210738_100000757094 [0,1,0,1,0,0|1,0,1]=4 32315 B14R1.476 C=CCCCOC1CCCCC1CC 7a_100000210738_100000757094 [0,1,0,1,0,0|1,0,1]=4 32316 B14R1.476 CC/C=C\CCN1CCCCC1CO 2230a_100000210821_100015370543 [0,1,0,1,0,0|0,0,2]=4 32317 B14R1.476 CC/C=C\CCN1CCCCC1CO 269982a_100000210821_100015370543 [0,1,0,1,0,0|0,0,2]=4 32318 B14R1.476 CC/C=C\CCN1CCCCC1CO 34a_100000210821_100015370543 [0,1,0,1,0,0|0,0,2]=4 32319 B14R1.476 CCC1CCCCC1NCCCCO 269862a_100000750430_100000757040 [0,1,0,1,0,0|0,0,0]=2 32320 B14R1.476 CCC1CCCCC1NCCCCO 270004a_100000750430_100000757040 [0,1,0,1,0,0|0,0,0]=2 32321 B14R1.476 CCC1CCCCC1NCCCOC 269862a_100150723488_100000757040 [0,1,0,1,0,0|1,0,0]=3 32322 B14R1.476 CCC1CCCCC1NCCCOC 270004a_100150723488_100000757040 [0,1,0,1,0,0|1,0,0]=3 32323 B14R1.476 CCC1CCCCC1NCCCSC 269862a_100000749238_100000757040 [0,1,0,1,0,0|1,1,0]=4 32324 B14R1.476 CCC1CCCCC1NCCCSC 270004a_100000749238_100000757040 [0,1,0,1,0,0|1,1,0]=4 32325 B14R1.476 CCC1CCCCC1OCC#CCO 34a_100000210738_200000047223 [0,1,0,1,0,0|0,0,2]=4 32326 B14R1.476 CCC1CCCCC1OCC#CCO 7a_100000210738_200000047223 [0,1,0,1,0,0|0,0,2]=4 32327 B14R1.476 CCC1CCCCC1OCCCC#N 7a_100000210738_100000687738 [0,1,0,1,0,0|1,0,1]=4 32328 B14R1.476 CCC1CCCCC1OCCCC=O 7a_100000210738_200011292268 [0,1,0,1,0,0|0,0,2]=4 32329 B14R1.476 CCC1CCCCC1OCCCCF 34a_100000210738_100000729493 [0,1,0,1,0,0|1,0,0]=3 32330 B14R1.476 CCC1CCCCC1OCCCCF 7a_100000210738_100000729493 [0,1,0,1,0,0|1,0,0]=3 32331 B14R1.476 CCC1CCCCC1OCCCCO 34a_100000210738_100011216708 [0,1,0,1,0,0|0,0,0]=2 32332 B14R1.476 CCC1CCCCC1OCCCCO 7a_100000210738_100000210776 [0,1,0,1,0,0|0,0,0]=2 32333 B14R1.476 CCC1CCCCC1OCCCOC 34a_100000210738_100000740836 [0,1,0,1,0,0|1,0,0]=3 32334 B14R1.476 CCC1CCCCC1OCCCOC 7a_100000210738_100000740836 [0,1,0,1,0,0|1,0,0]=3 32335 B14R1.476 CCC1CCCCN1CCCCC#N 2230a_100000210034_100000211819 [0,1,0,1,0,0|1,0,1]=4 32336 B14R1.476 CCC1CCCCN1CCCCC#N 269982a_100000210034_100011219923 [0,1,0,1,0,0|1,0,1]=4 32337 B14R1.476 CCC1CCCCN1CCCCC=O 2230a_100000210034_100000139335 [0,1,0,1,0,0|0,0,2]=4 32338 B14R1.476 CCC1CCCCN1CCCCC=O 269982a_100000210034_100000139335 [0,1,0,1,0,0|0,0,2]=4 32339 B14R1.476 CCC1CCCCN1CCCCCF 2230a_100000210034_100000729378 [0,1,0,1,0,0|1,0,0]=3 32340 B14R1.476 CCC1CCCCN1CCCCCF 269982a_100000210034_100000729378 [0,1,0,1,0,0|1,0,0]=3 32341 B14R1.476 CCC1CCCCN1CCCCCF 34a_100000210034_100000729378 [0,1,0,1,0,0|1,0,0]=3 32342 B14R1.476 CCC1CCCCN1CCCCCO 2230a_100000210034_100000746330 [0,1,0,1,0,0|0,0,0]=2 32343 B14R1.476 CCC1CCCCN1CCCCCO 269982a_100000210034_100000746330 [0,1,0,1,0,0|0,0,0]=2 32344 B14R1.476 CCC1CCCCN1CCCCCO 34a_100000210034_100000746330 [0,1,0,1,0,0|0,0,0]=2 32345 B14R1.476 CCC1CCCCN1CCCCOC 2230a_100000210034_100000730899 [0,1,0,1,0,0|1,0,0]=3 32346 B14R1.476 CCC1CCCCN1CCCCOC 269982a_100000210034_100000730899 [0,1,0,1,0,0|1,0,0]=3 32347 B14R1.476 CCC1CCCCN1CCCCOC 34a_100000210034_100000755781 [0,1,0,1,0,0|1,0,0]=3 32348 B14R1.476 CCC1CCCCN1CCCNCF 34a_100011191702_100015361967 [0,1,0,1,0,0|2,0,0]=4 32349 B14R1.476 CCC1CCCCN1CCNCCF 2230a_100000755458_100011217306 [0,1,0,1,0,0|2,0,0]=4 32350 B14R1.476 CCC1CCCCN1CCNCCF 34a_100000755458_100011217306 [0,1,0,1,0,0|2,0,0]=4 32351 B14R1.476 CCC1CCCCN1CCNCCO 2230a_100000755458_100000211926 [0,1,0,1,0,0|1,0,0]=3 32352 B14R1.476 CCC1CCCCN1CCNCCO 34a_100000755458_100000211926 [0,1,0,1,0,0|1,0,0]=3 32353 B14R1.476 CCC1CCCCN1CCNCOC 2230a_100000755458_100000766300 [0,1,0,1,0,0|2,0,0]=4 32354 B14R1.476 CCC1CCCCN1CCOCCO 2230a_100000210034_100011215305 [0,1,0,1,0,0|1,0,0]=3 32355 B14R1.476 CCC1CCCCN1CCOCCO 269982a_100000210034_100011215305 [0,1,0,1,0,0|1,0,0]=3 32356 B14R1.476 CCC1CCCCN1CCOCCO 34a_100000210034_100000692535 [0,1,0,1,0,0|1,0,0]=3 32357 B14R1.476 CCC1CCCCN1COCCOC 2230a_100000210034_100000231047 [0,1,0,1,0,0|2,0,0]=4 32358 B14R1.476 CCC1CCCCN1COCCOC 269982a_100000210034_100000231047 [0,1,0,1,0,0|2,0,0]=4 32359 B14R1.476 CCCCCCN1CCCCC1C#N 34a_100016989756_100000210314 [0,1,0,1,0,0|1,0,1]=4 32360 B14R1.476 CCCCCCN1CCCCC1CC 2230a_100000210034_100000210314 [0,1,0,1,0,0|1,0,0]=3 32361 B14R1.476 CCCCCCN1CCCCC1CC 269982a_100000210034_100000210757 [0,1,0,1,0,0|1,0,0]=3 32362 B14R1.476 CCCCCCN1CCCCC1CC 34a_100000210034_100000210314 [0,1,0,1,0,0|1,0,0]=3 32363 B14R1.476 CCCCCCN1CCCCC1CO 2230a_100000210821_100000210314 [0,1,0,1,0,0|0,0,0]=2 32364 B14R1.476 CCCCCCN1CCCCC1CO 269982a_100000210821_100000210757 [0,1,0,1,0,0|0,0,0]=2 32365 B14R1.476 CCCCCCN1CCCCC1CO 34a_100000210821_100000210314 [0,1,0,1,0,0|0,0,0]=2 32366 B14R1.476 CCCCCCN1CCOC[C@@H]1CC 2230a_100016988097_100000210314 [0,1,0,1,0,0|2,0,0]=4 32367 B14R1.476 CCCCCCN1CCOC[C@@H]1CC 269982a_100016988097_100000210757 [0,1,0,1,0,0|2,0,0]=4 32368 B14R1.476 CCCCCCN1CCOC[C@@H]1CC 34a_100016988097_100000210314 [0,1,0,1,0,0|2,0,0]=4 32369 B14R1.476 CCCCCCN1CCOC[C@H]1CO 2230a_100000717676_100000210314 [0,1,0,1,0,0|1,0,0]=3 32370 B14R1.476 CCCCCCN1CCOC[C@H]1CO 269982a_100000717676_100000210757 [0,1,0,1,0,0|1,0,0]=3 32371 B14R1.476 CCCCCCN1CCOC[C@H]1CO 34a_100000717676_100000210314 [0,1,0,1,0,0|1,0,0]=3 32372 B14R1.476 CCCCCNC1CCCCC1CC 269862a_100000209983_100000757040 [0,1,0,1,0,0|1,0,0]=3 32373 B14R1.476 CCCCCNC1CCCCC1CC 270004a_100000209983_100000757040 [0,1,0,1,0,0|1,0,0]=3 32374 B14R1.476 CCCCCNC1CCCCC1CO 270004a_100000209983_100009861125 [0,1,0,1,0,0|0,0,0]=2 32375 B14R1.476 CCCCCNC1CCCCC1OC 270004a_100000209983_100000740605 [0,1,0,1,0,0|1,0,0]=3 32376 B14R1.476 CCCCCNC1CCCCC1OC 34a_100011208099_100000718602 [0,1,0,1,0,0|1,0,0]=3 32377 B14R1.476 CCCCCNC1CCOCC1CO 2230a_214813039666_100000210326 [0,1,0,1,0,0|1,0,0]=3 32378 B14R1.476 CCCCCNC1CCOCC1CO 34a_214813039666_100000718602 [0,1,0,1,0,0|1,0,0]=3 32379 B14R1.476 CCCCCNC1CCOCC1OC 270004a_100000209983_100000095984 [0,1,0,1,0,0|2,0,0]=4 32380 B14R1.476 CCCCCOC1CCCCC1CC 34a_100000210738_100000718602 [0,1,0,1,0,0|1,0,0]=3 32381 B14R1.476 CCCCCOC1CCCCC1CC 7a_100000210738_100000210326 [0,1,0,1,0,0|1,0,0]=3 32382 B14R1.476 CCCCCOC1CCCCC1CN 34a_100011216029_100000718602 [0,1,0,1,0,0|1,0,0]=3 32383 B14R1.476 CCCCCO[C@@H]1CCCC[C@H]1NC 34a_100000708425_100000718602 [0,1,0,1,0,0|2,0,0]=4 32384 B14R1.476 CCCCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000718602 [0,1,0,1,0,0|1,0,0]=3 32385 B14R1.476 CCCCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000210326 [0,1,0,1,0,0|1,0,0]=3 32386 B14R1.476 CCCCNCC1CCCCN1CC 2230a_100000754393_100000210211 [0,1,0,1,0,0|2,0,0]=4 32387 B14R1.476 CCCCNCC1CCCCN1CC 34a_100000754393_100000210210 [0,1,0,1,0,0|2,0,0]=4 32388 B14R1.476 CCCCNN=C1CCCCC1CO 4a_100025702795_100009861125 [0,1,0,1,0,0|1,0,1]=4 32389 B14R1.476 CCCCOCC1CCCCN1CC 34a_100000225091_100000210210 [0,1,0,1,0,0|2,0,0]=4 32390 B14R1.476 CCCCOCC1CCCCN1CC 7a_100000225091_100000210211 [0,1,0,1,0,0|2,0,0]=4 32391 B14R1.476 CCCCOCN1CCCCC1CC 2230a_100000210034_100011995733 [0,1,0,1,0,0|2,0,0]=4 32392 B14R1.476 CCCCOCN1CCCCC1CC 269982a_100000210034_100011995733 [0,1,0,1,0,0|2,0,0]=4 32393 B14R1.476 CCCCOCN1CCCCC1CC 34a_100000210034_100011995733 [0,1,0,1,0,0|2,0,0]=4 32394 B14R1.476 CCCCOCN1CCCCC1CO 2230a_100000210821_100011995733 [0,1,0,1,0,0|1,0,0]=3 32395 B14R1.476 CCCCOCN1CCCCC1CO 269982a_100000210821_100011995733 [0,1,0,1,0,0|1,0,0]=3 32396 B14R1.476 CCCCOCN1CCCCC1CO 34a_100000210821_100011995733 [0,1,0,1,0,0|1,0,0]=3 32397 B14R1.476 CCCCOCN1CCOC[C@H]1CO 2230a_100000717676_100011995733 [0,1,0,1,0,0|2,0,0]=4 32398 B14R1.476 CCCCOCN1CCOC[C@H]1CO 269982a_100000717676_100011995733 [0,1,0,1,0,0|2,0,0]=4 32399 B14R1.476 CCCCOCN1CCOC[C@H]1CO 34a_100000717676_100011995733 [0,1,0,1,0,0|2,0,0]=4 32400 B14R1.476 CCCNCCN1CCCCC1CC 2230a_100000755458_100000210303 [0,1,0,1,0,0|2,0,0]=4 32401 B14R1.476 CCCNCCN1CCCCC1CC 34a_100000755458_100000210303 [0,1,0,1,0,0|2,0,0]=4 32402 B14R1.476 CCCNCCN1CCCCC1CO 2230a_100011473795_100000210303 [0,1,0,1,0,0|1,0,0]=3 32403 B14R1.476 CCCNCCN1CCCCC1CO 34a_100011473795_100000210303 [0,1,0,1,0,0|1,0,0]=3 32404 B14R1.476 CCCOCCN1CCCCC1CC 2230a_100000210034_100011215938 [0,1,0,1,0,0|2,0,0]=4 32405 B14R1.476 CCCOCCN1CCCCC1CC 269982a_100000210034_100011215938 [0,1,0,1,0,0|2,0,0]=4 32406 B14R1.476 CCCOCCN1CCCCC1CC 34a_100000210034_100011215938 [0,1,0,1,0,0|2,0,0]=4 32407 B14R1.476 CCCOCCN1CCCCC1CO 2230a_100000210821_100011215938 [0,1,0,1,0,0|1,0,0]=3 32408 B14R1.476 CCCOCCN1CCCCC1CO 269982a_100000210821_100011215938 [0,1,0,1,0,0|1,0,0]=3 32409 B14R1.476 CCCOCCN1CCCCC1CO 34a_100000210821_100011215938 [0,1,0,1,0,0|1,0,0]=3 32410 B14R1.476 CCCOCCN1CCOC[C@H]1CO 2230a_100000717676_100011215938 [0,1,0,1,0,0|2,0,0]=4 32411 B14R1.476 CCCOCCN1CCOC[C@H]1CO 269982a_100000717676_100011215938 [0,1,0,1,0,0|2,0,0]=4 32412 B14R1.476 CCCOCCN1CCOC[C@H]1CO 34a_100000717676_100011215938 [0,1,0,1,0,0|2,0,0]=4 32413 B14R1.476 CCN1CCCCC1CNCCCF 2230a_100000754393_100011934791 [0,1,0,1,0,0|2,0,0]=4 32414 B14R1.476 CCN1CCCCC1CNCCCF 34a_100000754393_100011934791 [0,1,0,1,0,0|2,0,0]=4 32415 B14R1.476 CCN1CCCCC1CNCCCO 2230a_100000754393_100000230001 [0,1,0,1,0,0|1,0,0]=3 32416 B14R1.476 CCN1CCCCC1CNCCCO 34a_100000754393_100000230001 [0,1,0,1,0,0|1,0,0]=3 32417 B14R1.476 CCN1CCCCC1CNCCOC 2230a_100000754393_100011201679 [0,1,0,1,0,0|2,0,0]=4 32418 B14R1.476 CCN1CCCCC1CNCCOC 34a_100000754393_100011201679 [0,1,0,1,0,0|2,0,0]=4 32419 B14R1.476 CCN1CCCCC1COCCCF 34a_100000225091_100011934791 [0,1,0,1,0,0|2,0,0]=4 32420 B14R1.476 CCN1CCCCC1COCCCF 7a_100000225091_100011934791 [0,1,0,1,0,0|2,0,0]=4 32421 B14R1.476 CCN1CCCCC1COCCCO 34a_100000225091_100000230001 [0,1,0,1,0,0|1,0,0]=3 32422 B14R1.476 CCN1CCCCC1COCCCO 7a_100000225091_100011215043 [0,1,0,1,0,0|1,0,0]=3 32423 B14R1.476 CCN1CCCCC1COCCOC 34a_100000225091_100011201679 [0,1,0,1,0,0|2,0,0]=4 32424 B14R1.476 CCN1CCCCC1COCCOC 7a_100000225091_100000233755 [0,1,0,1,0,0|2,0,0]=4 32425 B14R1.476 CCNCCCN1CCCCC1CC 34a_100011191702_100000210202 [0,1,0,1,0,0|2,0,0]=4 32426 B14R1.476 CCNCCCN1CCCCC1CO 34a_200011473794_100000210202 [0,1,0,1,0,0|1,0,0]=3 32427 B14R1.476 CCOCCCN1CCCCC1CC 2230a_100000210034_100012232248 [0,1,0,1,0,0|2,0,0]=4 32428 B14R1.476 CCOCCCN1CCCCC1CC 269982a_100000210034_100012232248 [0,1,0,1,0,0|2,0,0]=4 32429 B14R1.476 CCOCCCN1CCCCC1CC 34a_100000210034_100012232248 [0,1,0,1,0,0|2,0,0]=4 32430 B14R1.476 CCOCCCN1CCCCC1CO 2230a_100000210821_100012232248 [0,1,0,1,0,0|1,0,0]=3 32431 B14R1.476 CCOCCCN1CCCCC1CO 269982a_100000210821_100012232248 [0,1,0,1,0,0|1,0,0]=3 32432 B14R1.476 CCOCCCN1CCCCC1CO 34a_100000210821_100012232248 [0,1,0,1,0,0|1,0,0]=3 32433 B14R1.476 CCOCCCN1CCOC[C@H]1CO 2230a_100000717676_100012232248 [0,1,0,1,0,0|2,0,0]=4 32434 B14R1.476 CCOCCCN1CCOC[C@H]1CO 269982a_100000717676_100012232248 [0,1,0,1,0,0|2,0,0]=4 32435 B14R1.476 CCOCCCN1CCOC[C@H]1CO 34a_100000717676_100012232248 [0,1,0,1,0,0|2,0,0]=4 32436 B14R1.476 CCOCCNC1CCCCC1CC 269862a_100011200944_100000757040 [0,1,0,1,0,0|2,0,0]=4 32437 B14R1.476 CCOCCNC1CCCCC1CC 270004a_102516460346_100000757040 [0,1,0,1,0,0|2,0,0]=4 32438 B14R1.476 CCOCCNC1CCCCC1CO 270004a_102516460346_100009861125 [0,1,0,1,0,0|1,0,0]=3 32439 B14R1.476 CCOCCNC1CCCCC1OC 270004a_102516460346_100000740605 [0,1,0,1,0,0|2,0,0]=4 32440 B14R1.476 CCOCCNC1CCCCC1OC 34a_100011208099_100000210147 [0,1,0,1,0,0|2,0,0]=4 32441 B14R1.476 CCOCCNC1CCOCC1CO 2230a_214813039666_100011215890 [0,1,0,1,0,0|2,0,0]=4 32442 B14R1.476 CCOCCNC1CCOCC1CO 34a_214813039666_100000210147 [0,1,0,1,0,0|2,0,0]=4 32443 B14R1.476 CCOCCOC1CCCCC1CC 34a_100000210738_100000210147 [0,1,0,1,0,0|2,0,0]=4 32444 B14R1.476 CCOCCOC1CCCCC1CC 7a_100000210738_100011215890 [0,1,0,1,0,0|2,0,0]=4 32445 B14R1.476 CCOCCOC1CCCCC1CN 34a_100011216029_100000210147 [0,1,0,1,0,0|2,0,0]=4 32446 B14R1.476 CCOCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000210147 [0,1,0,1,0,0|2,0,0]=4 32447 B14R1.476 CCOCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100011215890 [0,1,0,1,0,0|2,0,0]=4 32448 B14R1.476 CCSCCNC1CCCCC1CC 269862a_100000106463_100000757040 [0,1,0,1,0,0|2,0,0]=4 32449 B14R1.476 CCSCCNC1CCCCC1CC 270004a_100000106463_100000757040 [0,1,0,1,0,0|2,0,0]=4 32450 B14R1.476 CCSCCNC1CCCCC1CO 270004a_100000106463_100009861125 [0,1,0,1,0,0|1,0,0]=3 32451 B14R1.476 CCSCCNC1CCCCC1OC 270004a_100000106463_100000740605 [0,1,0,1,0,0|2,0,0]=4 32452 B14R1.476 CCSCCNC1CCCCC1OC 34a_100011208099_100000757381 [0,1,0,1,0,0|2,0,0]=4 32453 B14R1.476 CCSCCNC1CCOCC1CO 2230a_214813039666_100000757381 [0,1,0,1,0,0|2,0,0]=4 32454 B14R1.476 CCSCCNC1CCOCC1CO 34a_214813039666_100000757381 [0,1,0,1,0,0|2,0,0]=4 32455 B14R1.476 CCSCCOC1CCCCC1CC 34a_100000210738_100000757381 [0,1,0,1,0,0|2,0,0]=4 32456 B14R1.476 CCSCCOC1CCCCC1CC 7a_100000210738_100000757381 [0,1,0,1,0,0|2,0,0]=4 32457 B14R1.476 CCSCCOC1CCCCC1CN 34a_100011216029_100000757381 [0,1,0,1,0,0|2,0,0]=4 32458 B14R1.476 CCSCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000757381 [0,1,0,1,0,0|2,0,0]=4 32459 B14R1.476 CCSCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000757381 [0,1,0,1,0,0|2,0,0]=4 32460 B14R1.476 CC[C@H]1COCCN1CCCCCF 2230a_100016988097_100000729378 [0,1,0,1,0,0|2,0,0]=4 32461 B14R1.476 CC[C@H]1COCCN1CCCCCF 269982a_100016988097_100000729378 [0,1,0,1,0,0|2,0,0]=4 32462 B14R1.476 CC[C@H]1COCCN1CCCCCF 34a_100016988097_100000729378 [0,1,0,1,0,0|2,0,0]=4 32463 B14R1.476 CC[C@H]1COCCN1CCCCCO 2230a_100016988097_100000746330 [0,1,0,1,0,0|1,0,0]=3 32464 B14R1.476 CC[C@H]1COCCN1CCCCCO 269982a_100016988097_100000746330 [0,1,0,1,0,0|1,0,0]=3 32465 B14R1.476 CC[C@H]1COCCN1CCCCCO 34a_100016988097_100000746330 [0,1,0,1,0,0|1,0,0]=3 32466 B14R1.476 CC[C@H]1COCCN1CCCCOC 2230a_100016988097_100000730899 [0,1,0,1,0,0|2,0,0]=4 32467 B14R1.476 CC[C@H]1COCCN1CCCCOC 269982a_100016988097_100000730899 [0,1,0,1,0,0|2,0,0]=4 32468 B14R1.476 CC[C@H]1COCCN1CCCCOC 34a_100016988097_100000755781 [0,1,0,1,0,0|2,0,0]=4 32469 B14R1.476 CC[C@H]1COCCN1CCOCCO 2230a_100016988097_100011215305 [0,1,0,1,0,0|2,0,0]=4 32470 B14R1.476 CC[C@H]1COCCN1CCOCCO 269982a_100016988097_100011215305 [0,1,0,1,0,0|2,0,0]=4 32471 B14R1.476 CC[C@H]1COCCN1CCOCCO 34a_100016988097_100000692535 [0,1,0,1,0,0|2,0,0]=4 32472 B14R1.476 CN[C@@H]1CCCC[C@H]1OCCCCF 34a_100000708425_100000729493 [0,1,0,1,0,0|2,0,0]=4 32473 B14R1.476 CN[C@@H]1CCCC[C@H]1OCCCCO 34a_100000708425_100011216708 [0,1,0,1,0,0|1,0,0]=3 32474 B14R1.476 CN[C@@H]1CCCC[C@H]1OCCCOC 34a_100000708425_100000740836 [0,1,0,1,0,0|2,0,0]=4 32475 B14R1.476 COC1CCCCC1NCCCCF 34a_100011208099_100000729493 [0,1,0,1,0,0|2,0,0]=4 32476 B14R1.476 COC1CCCCC1NCCCCO 270004a_100000750430_100000740605 [0,1,0,1,0,0|1,0,0]=3 32477 B14R1.476 COC1CCCCC1NCCCCO 34a_100011208099_100011216708 [0,1,0,1,0,0|1,0,0]=3 32478 B14R1.476 COC1CCCCC1NCCCSC 270004a_100000749238_100000740605 [0,1,0,1,0,0|2,0,0]=4 32479 B14R1.476 COC1COCCC1NCCCCO 270004a_100000750430_100000095984 [0,1,0,1,0,0|2,0,0]=4 32480 B14R1.476 COCCCCN1CCCCC1CO 2230a_100000210821_100000730899 [0,1,0,1,0,0|1,0,0]=3 32481 B14R1.476 COCCCCN1CCCCC1CO 269982a_100000210821_100000730899 [0,1,0,1,0,0|1,0,0]=3 32482 B14R1.476 COCCCCN1CCCCC1CO 34a_100000210821_100000755781 [0,1,0,1,0,0|1,0,0]=3 32483 B14R1.476 COCCCCN1CCOC[C@H]1CO 2230a_100000717676_100000730899 [0,1,0,1,0,0|2,0,0]=4 32484 B14R1.476 COCCCCN1CCOC[C@H]1CO 269982a_100000717676_100000730899 [0,1,0,1,0,0|2,0,0]=4 32485 B14R1.476 COCCCCN1CCOC[C@H]1CO 34a_100000717676_100000755781 [0,1,0,1,0,0|2,0,0]=4 32486 B14R1.476 COCCCNC1CCCCC1CO 270004a_100150723488_100009861125 [0,1,0,1,0,0|1,0,0]=3 32487 B14R1.476 COCCCNC1CCCCC1OC 270004a_100150723488_100000740605 [0,1,0,1,0,0|2,0,0]=4 32488 B14R1.476 COCCCNC1CCCCC1OC 34a_100011208099_100000740836 [0,1,0,1,0,0|2,0,0]=4 32489 B14R1.476 COCCCNC1CCOCC1CO 2230a_214813039666_100000740836 [0,1,0,1,0,0|2,0,0]=4 32490 B14R1.476 COCCCNC1CCOCC1CO 34a_214813039666_100000740836 [0,1,0,1,0,0|2,0,0]=4 32491 B14R1.476 COCCCOC1CCCCC1CN 34a_100011216029_100000740836 [0,1,0,1,0,0|2,0,0]=4 32492 B14R1.476 COCCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000740836 [0,1,0,1,0,0|2,0,0]=4 32493 B14R1.476 COCCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000740836 [0,1,0,1,0,0|2,0,0]=4 32494 B14R1.476 COCCOCN1CCCCC1CO 2230a_100000210821_100000231047 [0,1,0,1,0,0|2,0,0]=4 32495 B14R1.476 COCCOCN1CCCCC1CO 269982a_100000210821_100000231047 [0,1,0,1,0,0|2,0,0]=4 32496 B14R1.476 COCNCCN1CCCCC1CO 2230a_100011473795_100000766300 [0,1,0,1,0,0|2,0,0]=4 32497 B14R1.476 CO[C@H]1CCCC[C@@H]1OCCCCF 34a_200009815850_100000729493 [0,1,0,1,0,0|2,0,0]=4 32498 B14R1.476 CO[C@H]1CCCC[C@@H]1OCCCCF 7a_200009815850_100000729493 [0,1,0,1,0,0|2,0,0]=4 32499 B14R1.476 CO[C@H]1CCCC[C@@H]1OCCCCO 34a_200009815850_100011216708 [0,1,0,1,0,0|1,0,0]=3 32500 B14R1.476 CO[C@H]1CCCC[C@@H]1OCCCCO 7a_200009815850_100000210776 [0,1,0,1,0,0|1,0,0]=3 32501 B14R1.476 CSCCCNC1CCCCC1CO 270004a_100000749238_100009861125 [0,1,0,1,0,0|1,0,0]=3 32502 B14R1.476 CSCNCCN1CCCCC1CO 2230a_100011473795_100011218213 [0,1,0,1,0,0|2,0,0]=4 32503 B14R1.476 CSCNCCN1CCCCC1CO 34a_100011473795_100011218213 [0,1,0,1,0,0|2,0,0]=4 32504 B14R1.476 N#CC1CCCCN1CCCCCO 34a_100016989756_100000746330 [0,1,0,1,0,0|1,0,1]=4 32505 B14R1.476 N#CCCCCN1CCCCC1CO 2230a_100000210821_100000211819 [0,1,0,1,0,0|1,0,1]=4 32506 B14R1.476 N#CCCCCN1CCCCC1CO 269982a_100000210821_100011219923 [0,1,0,1,0,0|1,0,1]=4 32507 B14R1.476 NCC1CCCCC1OCCCCF 34a_100011216029_100000729493 [0,1,0,1,0,0|2,0,0]=4 32508 B14R1.476 NCC1CCCCC1OCCCCO 34a_100011216029_100011216708 [0,1,0,1,0,0|1,0,0]=3 32509 B14R1.476 O=CCCCCN1CCCCC1CO 2230a_100000210821_100000139335 [0,1,0,1,0,0|1,0,1]=4 32510 B14R1.476 O=CCCCCN1CCCCC1CO 269982a_100000210821_100000139335 [0,1,0,1,0,0|1,0,1]=4 32511 B14R1.476 OCC1CCCCN1CCCCCF 2230a_100000210821_100000729378 [0,1,0,1,0,0|1,0,0]=3 32512 B14R1.476 OCC1CCCCN1CCCCCF 269982a_100000210821_100000729378 [0,1,0,1,0,0|1,0,0]=3 32513 B14R1.476 OCC1CCCCN1CCCCCF 34a_100000210821_100000729378 [0,1,0,1,0,0|1,0,0]=3 32514 B14R1.476 OCC1CCCCN1CCCNCF 34a_200011473794_100015361967 [0,1,0,1,0,0|2,0,0]=4 32515 B14R1.476 OCC1CCCCN1CCNCCF 2230a_100011473795_100011217306 [0,1,0,1,0,0|2,0,0]=4 32516 B14R1.476 OCC1CCCCN1CCNCCF 34a_100011473795_100011217306 [0,1,0,1,0,0|2,0,0]=4 32517 B14R1.476 OCC1COCCC1NCCCCF 2230a_214813039666_100000729493 [0,1,0,1,0,0|2,0,0]=4 32518 B14R1.476 OCC1COCCC1NCCCCF 34a_214813039666_100000729493 [0,1,0,1,0,0|2,0,0]=4 32519 B14R1.476 OCCCCCN1CCCCC1CO 2230a_100000210821_100000746330 [0,1,0,1,0,0|1,0,0]=3 32520 B14R1.476 OCCCCCN1CCCCC1CO 269982a_100000210821_100000746330 [0,1,0,1,0,0|1,0,0]=3 32521 B14R1.476 OCCCCCN1CCCCC1CO 34a_100000210821_100000746330 [0,1,0,1,0,0|1,0,0]=3 32522 B14R1.476 OCCCCCN1CCOC[C@H]1CO 2230a_100000717676_100000746330 [0,1,0,1,0,0|2,0,0]=4 32523 B14R1.476 OCCCCCN1CCOC[C@H]1CO 269982a_100000717676_100000746330 [0,1,0,1,0,0|2,0,0]=4 32524 B14R1.476 OCCCCCN1CCOC[C@H]1CO 34a_100000717676_100000746330 [0,1,0,1,0,0|2,0,0]=4 32525 B14R1.476 OCCCCNC1CCCCC1CO 270004a_100000750430_100009861125 [0,1,0,1,0,0|1,0,0]=3 32526 B14R1.476 OCCCCNC1CCOCC1CO 2230a_214813039666_100000210776 [0,1,0,1,0,0|2,0,0]=4 32527 B14R1.476 OCCCCNC1CCOCC1CO 34a_214813039666_100011216708 [0,1,0,1,0,0|2,0,0]=4 32528 B14R1.476 OCCNCCN1CCCCC1CO 2230a_100011473795_100000211926 [0,1,0,1,0,0|2,0,0]=4 32529 B14R1.476 OCCNCCN1CCCCC1CO 34a_100011473795_100000211926 [0,1,0,1,0,0|2,0,0]=4 32530 B14R1.476 OCCOCCN1CCCCC1CO 2230a_100000210821_100011215305 [0,1,0,1,0,0|2,0,0]=4 32531 B14R1.476 OCCOCCN1CCCCC1CO 269982a_100000210821_100011215305 [0,1,0,1,0,0|2,0,0]=4 32532 B14R1.476 OCCOCCN1CCCCC1CO 34a_100000210821_100000692535 [0,1,0,1,0,0|2,0,0]=4 32533 B14R1.476 OC[C@@H]1COCCN1CCCCCF 2230a_100000717676_100000729378 [0,1,0,1,0,0|2,0,0]=4 32534 B14R1.476 OC[C@@H]1COCCN1CCCCCF 269982a_100000717676_100000729378 [0,1,0,1,0,0|2,0,0]=4 32535 B14R1.476 OC[C@@H]1COCCN1CCCCCF 34a_100000717676_100000729378 [0,1,0,1,0,0|2,0,0]=4 32536 B14R1.787 C#CCCN1CCCCC1CCCO 2230a_100011934581_100000688953 [0,1,0,1,0,0|0,0,2]=4 32537 B14R1.787 C#CCCN1CCCCC1CCCO 269982a_100011934581_100000730999 [0,1,0,1,0,0|0,0,2]=4 32538 B14R1.787 C#CCCN1CCCCC1CCCO 34a_100011934581_100000688953 [0,1,0,1,0,0|0,0,2]=4 32539 B14R1.787 C/C=C/CN1CCCCC1CCCO 269982a_100011934581_100102629194 [0,1,0,1,0,0|0,0,2]=4 32540 B14R1.787 C/C=C/CN1CCCCC1CCCO 34a_100011934581_100102629194 [0,1,0,1,0,0|0,0,2]=4 32541 B14R1.787 C=CCCN1CCCCC1CCCO 2230a_100011934581_100000754431 [0,1,0,1,0,0|0,0,2]=4 32542 B14R1.787 C=CCCN1CCCCC1CCCO 269982a_100011934581_100000754431 [0,1,0,1,0,0|0,0,2]=4 32543 B14R1.787 C=CCCN1CCCCC1CCCO 34a_100011934581_100000754431 [0,1,0,1,0,0|0,0,2]=4 32544 B14R1.787 CC#CCN1CCCCC1CCCO 2230a_100011934581_100000748600 [0,1,0,1,0,0|0,0,2]=4 32545 B14R1.787 CC#CCN1CCCCC1CCCO 34a_100011934581_100000748600 [0,1,0,1,0,0|0,0,2]=4 32546 B14R1.787 CC=CCN1CCCCC1CCCO 2230a_100011934581_100000070051 [0,1,0,1,0,0|0,0,2]=4 32547 B14R1.787 CC=CCN1CCCCC1CCCO 34a_100011934581_100000070051 [0,1,0,1,0,0|0,0,2]=4 32548 B14R1.787 CCCCN1CCCCC1CCCO 2230a_100011934581_100000210211 [0,1,0,1,0,0|0,0,0]=2 32549 B14R1.787 CCCCN1CCCCC1CCCO 269982a_100011934581_100000210211 [0,1,0,1,0,0|0,0,0]=2 32550 B14R1.787 CCCCN1CCCCC1CCCO 34a_100011934581_100000210210 [0,1,0,1,0,0|0,0,0]=2 32551 B14R1.787 CCCCN1CCCCC1CCOC 2230a_100015186528_100000210211 [0,1,0,1,0,0|1,0,0]=3 32552 B14R1.787 CCCCN1CCCCC1CCOC 269982a_100015186528_100000210211 [0,1,0,1,0,0|1,0,0]=3 32553 B14R1.787 CCCCN1CCCCC1CCOC 34a_100015186528_100000210210 [0,1,0,1,0,0|1,0,0]=3 32554 B14R1.787 CCCNC1CCCCC1CCC#N 270004a_100020643023_100000034616 [0,1,0,1,0,0|1,0,1]=4 32555 B14R1.787 CCOCC1CCCCN1CCCN 34a_200011473794_100000210202 [0,1,0,1,0,0|2,0,0]=4 32556 B14R1.787 CCOCN1CCCCC1CCCO 269982a_100011934581_100000739092 [0,1,0,1,0,0|1,0,0]=3 32557 B14R1.787 CCOCN1CCCCC1CCOC 269982a_100015186528_100000739092 [0,1,0,1,0,0|2,0,0]=4 32558 B14R1.787 COCCC1CCCCN1CCCF 2230a_100015186528_100011934791 [0,1,0,1,0,0|2,0,0]=4 32559 B14R1.787 COCCC1CCCCN1CCCF 269982a_100015186528_100011934791 [0,1,0,1,0,0|2,0,0]=4 32560 B14R1.787 COCCC1CCCCN1CCCF 34a_100015186528_100011934791 [0,1,0,1,0,0|2,0,0]=4 32561 B14R1.787 COCCC1CCCCN1CCCO 2230a_100015186528_100000230001 [0,1,0,1,0,0|1,0,0]=3 32562 B14R1.787 COCCC1CCCCN1CCCO 269982a_100015186528_100011215043 [0,1,0,1,0,0|1,0,0]=3 32563 B14R1.787 COCCC1CCCCN1CCCO 34a_100015186528_100000230001 [0,1,0,1,0,0|1,0,0]=3 32564 B14R1.787 COCCC1CCCCN1CCOC 2230a_100015186528_100011201679 [0,1,0,1,0,0|2,0,0]=4 32565 B14R1.787 COCCC1CCCCN1CCOC 269982a_100015186528_100000233755 [0,1,0,1,0,0|2,0,0]=4 32566 B14R1.787 COCCC1CCCCN1CCOC 34a_100015186528_100011201679 [0,1,0,1,0,0|2,0,0]=4 32567 B14R1.787 COCCC1CCCCN1CCSC 2230a_100015186528_100000751147 [0,1,0,1,0,0|2,0,0]=4 32568 B14R1.787 COCCC1CCCCN1CCSC 269982a_100015186528_100000212216 [0,1,0,1,0,0|2,0,0]=4 32569 B14R1.787 COCCC1CCCCN1CCSC 34a_100015186528_100000212216 [0,1,0,1,0,0|2,0,0]=4 32570 B14R1.787 COCCN1CCCCC1CCCO 2230a_100011934581_100011201679 [0,1,0,1,0,0|1,0,0]=3 32571 B14R1.787 COCCN1CCCCC1CCCO 269982a_100011934581_100000233755 [0,1,0,1,0,0|1,0,0]=3 32572 B14R1.787 COCCN1CCCCC1CCCO 34a_100011934581_100011201679 [0,1,0,1,0,0|1,0,0]=3 32573 B14R1.787 CSCCN1CCCCC1CCCO 2230a_100011934581_100000751147 [0,1,0,1,0,0|1,0,0]=3 32574 B14R1.787 CSCCN1CCCCC1CCCO 269982a_100011934581_100000212216 [0,1,0,1,0,0|1,0,0]=3 32575 B14R1.787 CSCCN1CCCCC1CCCO 34a_100011934581_100000212216 [0,1,0,1,0,0|1,0,0]=3 32576 B14R1.787 N#CCCC1CCCCC1NCCO 270004a_100000210304_100000034616 [0,1,0,1,0,0|1,0,1]=4 32577 B14R1.787 N#CCCN1CCCCC1CCCO 2230a_100011934581_100011215226 [0,1,0,1,0,0|1,0,1]=4 32578 B14R1.787 N#CCCN1CCCCC1CCCO 269982a_100011934581_100011215226 [0,1,0,1,0,0|1,0,1]=4 32579 B14R1.787 OCCCC1CCCCN1CCCF 2230a_100011934581_100011934791 [0,1,0,1,0,0|1,0,0]=3 32580 B14R1.787 OCCCC1CCCCN1CCCF 269982a_100011934581_100011934791 [0,1,0,1,0,0|1,0,0]=3 32581 B14R1.787 OCCCC1CCCCN1CCCF 34a_100011934581_100011934791 [0,1,0,1,0,0|1,0,0]=3 32582 B14R1.787 OCCCC1CCCCN1CCCO 2230a_100011934581_100000230001 [0,1,0,1,0,0|1,0,0]=3 32583 B14R1.787 OCCCC1CCCCN1CCCO 269982a_100011934581_100011215043 [0,1,0,1,0,0|1,0,0]=3 32584 B14R1.787 OCCCC1CCCCN1CCCO 34a_100011934581_100000230001 [0,1,0,1,0,0|1,0,0]=3 32585 B14R1.904 C#CCCCN1CCCCC1CCC 2230a_100000701414_100000731252 [0,1,0,1,0,0|1,0,1]=4 32586 B14R1.904 C#CCCCN1CCCCC1CCC 269982a_100000701414_100011215417 [0,1,0,1,0,0|1,0,1]=4 32587 B14R1.904 C#CCCCN1CCCCC1CCC 34a_100000701414_100000695029 [0,1,0,1,0,0|1,0,1]=4 32588 B14R1.904 C#CCCCN1CCCCC1CCO 2230a_100000211664_100000731252 [0,1,0,1,0,0|0,0,2]=4 32589 B14R1.904 C#CCCCN1CCCCC1CCO 269982a_100000211664_100011215417 [0,1,0,1,0,0|0,0,2]=4 32590 B14R1.904 C#CCCCN1CCCCC1CCO 34a_100000211664_100000695029 [0,1,0,1,0,0|0,0,2]=4 32591 B14R1.904 C#CCCOC1CCCCC1CCC 34a_100011217265_100000688953 [0,1,0,1,0,0|1,0,1]=4 32592 B14R1.904 C#CCCOC1CCCCC1CCC 7a_100011217265_100000688953 [0,1,0,1,0,0|1,0,1]=4 32593 B14R1.904 C=CCC1CCCCC1NCCCC 269862a_100000102301_100011214939 [0,1,0,1,0,0|1,0,1]=4 32594 B14R1.904 C=CCC1CCCCC1NCCCC 270004a_100000102301_100011214939 [0,1,0,1,0,0|1,0,1]=4 32595 B14R1.904 C=CCC1CCCCC1NCCCO 269862a_100000182051_100011214939 [0,1,0,1,0,0|0,0,2]=4 32596 B14R1.904 C=CCC1CCCCC1NCCCO 270004a_100000182051_100011214939 [0,1,0,1,0,0|0,0,2]=4 32597 B14R1.904 C=CCCCN1CCCCC1CCC 2230a_100000701414_100011713584 [0,1,0,1,0,0|1,0,1]=4 32598 B14R1.904 C=CCCCN1CCCCC1CCC 269982a_100000701414_100000757094 [0,1,0,1,0,0|1,0,1]=4 32599 B14R1.904 C=CCCCN1CCCCC1CCC 34a_100000701414_100000757094 [0,1,0,1,0,0|1,0,1]=4 32600 B14R1.904 C=CCCCN1CCCCC1CCO 2230a_100000211664_100011713584 [0,1,0,1,0,0|0,0,2]=4 32601 B14R1.904 C=CCCCN1CCCCC1CCO 269982a_100000211664_100000757094 [0,1,0,1,0,0|0,0,2]=4 32602 B14R1.904 C=CCCCN1CCCCC1CCO 34a_100000211664_100000757094 [0,1,0,1,0,0|0,0,2]=4 32603 B14R1.904 C=CCCNC1CCCCC1CCC 269862a_100015191253_100011218038 [0,1,0,1,0,0|1,0,1]=4 32604 B14R1.904 C=CCCNC1CCCCC1CCC 270004a_100015191253_100011218038 [0,1,0,1,0,0|1,0,1]=4 32605 B14R1.904 C=CCCOC1CCCCC1CCC 34a_100011217265_100000754431 [0,1,0,1,0,0|1,0,1]=4 32606 B14R1.904 C=CCCOC1CCCCC1CCC 7a_100011217265_100000754431 [0,1,0,1,0,0|1,0,1]=4 32607 B14R1.904 CC/C=C\CN1CCCCC1CCO 2230a_100000211664_100103147603 [0,1,0,1,0,0|0,0,2]=4 32608 B14R1.904 CC/C=C\CN1CCCCC1CCO 269982a_100000211664_100103147603 [0,1,0,1,0,0|0,0,2]=4 32609 B14R1.904 CC/C=C\CN1CCCCC1CCO 34a_100000211664_100103147603 [0,1,0,1,0,0|0,0,2]=4 32610 B14R1.904 CCC#CCN1CCCCC1CCO 2230a_100000211664_100009813939 [0,1,0,1,0,0|0,0,2]=4 32611 B14R1.904 CCC#CCN1CCCCC1CCO 34a_100000211664_100009813939 [0,1,0,1,0,0|0,0,2]=4 32612 B14R1.904 CCCC1CCCCC1=NNCCO 4a_100000210001_100011218038 [0,1,0,1,0,0|1,0,1]=4 32613 B14R1.904 CCCC1CCCCC1NCCC#N 270004a_100000720768_100011218038 [0,1,0,1,0,0|1,0,1]=4 32614 B14R1.904 CCCC1CCCCC1NCCCF 269862a_100015189416_100011218038 [0,1,0,1,0,0|1,0,0]=3 32615 B14R1.904 CCCC1CCCCC1NCCCF 270004a_100015189416_100011218038 [0,1,0,1,0,0|1,0,0]=3 32616 B14R1.904 CCCC1CCCCC1NCCCO 269862a_100000182051_100011218038 [0,1,0,1,0,0|0,0,0]=2 32617 B14R1.904 CCCC1CCCCC1NCCCO 270004a_100000182051_100011218038 [0,1,0,1,0,0|0,0,0]=2 32618 B14R1.904 CCCC1CCCCC1NCCOC 269862a_100000209980_100011218038 [0,1,0,1,0,0|1,0,0]=3 32619 B14R1.904 CCCC1CCCCC1NCCOC 270004a_100000209980_100011218038 [0,1,0,1,0,0|1,0,0]=3 32620 B14R1.904 CCCC1CCCCC1NCCSC 269862a_100020590264_100011218038 [0,1,0,1,0,0|1,1,0]=4 32621 B14R1.904 CCCC1CCCCC1NCCSC 270004a_100020590264_100011218038 [0,1,0,1,0,0|1,1,0]=4 32622 B14R1.904 CCCC1CCCCC1OCCC#N 7a_100011217265_100000184422 [0,1,0,1,0,0|1,0,1]=4 32623 B14R1.904 CCCC1CCCCC1OCCCF 34a_100011217265_100011934791 [0,1,0,1,0,0|1,0,0]=3 32624 B14R1.904 CCCC1CCCCC1OCCCF 7a_100011217265_100011934791 [0,1,0,1,0,0|1,0,0]=3 32625 B14R1.904 CCCC1CCCCC1OCCCO 34a_100011217265_100000230001 [0,1,0,1,0,0|0,0,0]=2 32626 B14R1.904 CCCC1CCCCC1OCCCO 7a_100011217265_100011215043 [0,1,0,1,0,0|0,0,0]=2 32627 B14R1.904 CCCC1CCCCC1OCCOC 34a_100011217265_100011201679 [0,1,0,1,0,0|1,0,0]=3 32628 B14R1.904 CCCC1CCCCC1OCCOC 7a_100011217265_100000233755 [0,1,0,1,0,0|1,0,0]=3 32629 B14R1.904 CCCC1CCCCC1OCCSC 34a_100011217265_100000212216 [0,1,0,1,0,0|1,1,0]=4 32630 B14R1.904 CCCC1CCCCC1OCCSC 7a_100011217265_100000212216 [0,1,0,1,0,0|1,1,0]=4 32631 B14R1.904 CCCC1CCCCN1CC#CCO 2230a_100000701414_200000047223 [0,1,0,1,0,0|0,0,2]=4 32632 B14R1.904 CCCC1CCCCN1CC#CCO 34a_100000701414_200000047223 [0,1,0,1,0,0|0,0,2]=4 32633 B14R1.904 CCCC1CCCCN1CCCC#N 2230a_100000701414_100000687738 [0,1,0,1,0,0|1,0,1]=4 32634 B14R1.904 CCCC1CCCCN1CCCC#N 269982a_100000701414_100000687738 [0,1,0,1,0,0|1,0,1]=4 32635 B14R1.904 CCCC1CCCCN1CCCC=O 2230a_100000701414_200011292268 [0,1,0,1,0,0|0,0,2]=4 32636 B14R1.904 CCCC1CCCCN1CCCC=O 269982a_100000701414_200011292268 [0,1,0,1,0,0|0,0,2]=4 32637 B14R1.904 CCCC1CCCCN1CCCCF 2230a_100000701414_100000729493 [0,1,0,1,0,0|1,0,0]=3 32638 B14R1.904 CCCC1CCCCN1CCCCF 269982a_100000701414_100000729493 [0,1,0,1,0,0|1,0,0]=3 32639 B14R1.904 CCCC1CCCCN1CCCCF 34a_100000701414_100000729493 [0,1,0,1,0,0|1,0,0]=3 32640 B14R1.904 CCCC1CCCCN1CCCCO 2230a_100000701414_100000210776 [0,1,0,1,0,0|0,0,0]=2 32641 B14R1.904 CCCC1CCCCN1CCCCO 269982a_100000701414_100000210776 [0,1,0,1,0,0|0,0,0]=2 32642 B14R1.904 CCCC1CCCCN1CCCCO 34a_100000701414_100011216708 [0,1,0,1,0,0|0,0,0]=2 32643 B14R1.904 CCCC1CCCCN1CCCOC 2230a_100000701414_100000740836 [0,1,0,1,0,0|1,0,0]=3 32644 B14R1.904 CCCC1CCCCN1CCCOC 269982a_100000701414_100000740836 [0,1,0,1,0,0|1,0,0]=3 32645 B14R1.904 CCCC1CCCCN1CCCOC 34a_100000701414_100000740836 [0,1,0,1,0,0|1,0,0]=3 32646 B14R1.904 CCCC1CCCCN1CCOCC 2230a_100000701414_100011215890 [0,1,0,1,0,0|2,0,0]=4 32647 B14R1.904 CCCC1CCCCN1CCOCC 269982a_100000701414_100011215890 [0,1,0,1,0,0|2,0,0]=4 32648 B14R1.904 CCCC1CCCCN1CCOCC 34a_100000701414_100000210147 [0,1,0,1,0,0|2,0,0]=4 32649 B14R1.904 CCCC1CCCCN1CCSCC 2230a_100000701414_100000757381 [0,1,0,1,0,0|2,0,0]=4 32650 B14R1.904 CCCC1CCCCN1CCSCC 269982a_100000701414_100000757381 [0,1,0,1,0,0|2,0,0]=4 32651 B14R1.904 CCCC1CCCCN1CCSCC 34a_100000701414_100000757381 [0,1,0,1,0,0|2,0,0]=4 32652 B14R1.904 CCCC1COCCN1CCCCF 2230a_102495339903_100000729493 [0,1,0,1,0,0|2,0,0]=4 32653 B14R1.904 CCCC1COCCN1CCCCF 269982a_102495339903_100000729493 [0,1,0,1,0,0|2,0,0]=4 32654 B14R1.904 CCCC1COCCN1CCCCF 34a_102495339903_100000729493 [0,1,0,1,0,0|2,0,0]=4 32655 B14R1.904 CCCC1COCCN1CCCCO 2230a_102495339903_100000210776 [0,1,0,1,0,0|1,0,0]=3 32656 B14R1.904 CCCC1COCCN1CCCCO 269982a_102495339903_100000210776 [0,1,0,1,0,0|1,0,0]=3 32657 B14R1.904 CCCC1COCCN1CCCCO 34a_102495339903_100011216708 [0,1,0,1,0,0|1,0,0]=3 32658 B14R1.904 CCCC1COCCN1CCCOC 2230a_102495339903_100000740836 [0,1,0,1,0,0|2,0,0]=4 32659 B14R1.904 CCCC1COCCN1CCCOC 269982a_102495339903_100000740836 [0,1,0,1,0,0|2,0,0]=4 32660 B14R1.904 CCCC1COCCN1CCCOC 34a_102495339903_100000740836 [0,1,0,1,0,0|2,0,0]=4 32661 B14R1.904 CCCCCN1CCCCC1CC#N 2230a_100000133382_100000210326 [0,1,0,1,0,0|1,0,1]=4 32662 B14R1.904 CCCCCN1CCCCC1CC#N 34a_100000133382_100000718602 [0,1,0,1,0,0|1,0,1]=4 32663 B14R1.904 CCCCCN1CCCCC1CCC 2230a_100000701414_100000210326 [0,1,0,1,0,0|1,0,0]=3 32664 B14R1.904 CCCCCN1CCCCC1CCC 269982a_100000701414_100000210215 [0,1,0,1,0,0|1,0,0]=3 32665 B14R1.904 CCCCCN1CCCCC1CCC 34a_100000701414_100000718602 [0,1,0,1,0,0|1,0,0]=3 32666 B14R1.904 CCCCCN1CCCCC1CCO 2230a_100000211664_100000210326 [0,1,0,1,0,0|0,0,0]=2 32667 B14R1.904 CCCCCN1CCCCC1CCO 269982a_100000211664_100000210215 [0,1,0,1,0,0|0,0,0]=2 32668 B14R1.904 CCCCCN1CCCCC1CCO 34a_100000211664_100000718602 [0,1,0,1,0,0|0,0,0]=2 32669 B14R1.904 CCCCCN1CCCCC1COC 2230a_100015184032_100000210326 [0,1,0,1,0,0|1,0,0]=3 32670 B14R1.904 CCCCCN1CCCCC1COC 269982a_100015184032_100000210215 [0,1,0,1,0,0|1,0,0]=3 32671 B14R1.904 CCCCCN1CCCCC1COC 34a_100015184032_100000718602 [0,1,0,1,0,0|1,0,0]=3 32672 B14R1.904 CCCCCN1CCOCC1CCC 2230a_102495339903_100000210326 [0,1,0,1,0,0|2,0,0]=4 32673 B14R1.904 CCCCCN1CCOCC1CCC 269982a_102495339903_100000210215 [0,1,0,1,0,0|2,0,0]=4 32674 B14R1.904 CCCCCN1CCOCC1CCC 34a_102495339903_100000718602 [0,1,0,1,0,0|2,0,0]=4 32675 B14R1.904 CCCCCN1CCOC[C@@H]1COC 2230a_100016989928_100000210326 [0,1,0,1,0,0|2,0,0]=4 32676 B14R1.904 CCCCCN1CCOC[C@@H]1COC 269982a_100016989928_100000210215 [0,1,0,1,0,0|2,0,0]=4 32677 B14R1.904 CCCCCN1CCOC[C@@H]1COC 34a_100016989928_100000718602 [0,1,0,1,0,0|2,0,0]=4 32678 B14R1.904 CCCCNC1CCCCC1CC#N 270004a_100000102301_100009866218 [0,1,0,1,0,0|1,0,1]=4 32679 B14R1.904 CCCCNC1CCCCC1CCC 269862a_100000102301_100011218038 [0,1,0,1,0,0|1,0,0]=3 32680 B14R1.904 CCCCNC1CCCCC1CCC 270004a_100000102301_100011218038 [0,1,0,1,0,0|1,0,0]=3 32681 B14R1.904 CCCCNC1CCCCC1OCC 270004a_100000102301_200000031474 [0,1,0,1,0,0|2,0,0]=4 32682 B14R1.904 CCCCOC1CCCCC1CCC 34a_100011217265_100000210210 [0,1,0,1,0,0|1,0,0]=3 32683 B14R1.904 CCCCOC1CCCCC1CCC 7a_100011217265_100000210211 [0,1,0,1,0,0|1,0,0]=3 32684 B14R1.904 CCCN1CCCCC1CCCOC 2230a_100011804088_100000210303 [0,1,0,1,0,0|1,0,0]=3 32685 B14R1.904 CCCN1CCCCC1CCCOC 269982a_100011804088_100000210303 [0,1,0,1,0,0|1,0,0]=3 32686 B14R1.904 CCCN1CCCCC1CCCOC 34a_100011804088_100000210303 [0,1,0,1,0,0|1,0,0]=3 32687 B14R1.904 CCCOCC1CCCCN1CCN 34a_100011473795_100000210303 [0,1,0,1,0,0|2,0,0]=4 32688 B14R1.904 CCOC1CCCCC1NCCCF 270004a_100015189416_200000031474 [0,1,0,1,0,0|2,0,0]=4 32689 B14R1.904 CCOC1CCCCC1NCCCO 270004a_100000182051_200000031474 [0,1,0,1,0,0|1,0,0]=3 32690 B14R1.904 CCOC1CCCCC1NCCOC 270004a_100000209980_200000031474 [0,1,0,1,0,0|2,0,0]=4 32691 B14R1.904 CCOCCN1CCCCC1CCO 2230a_100000211664_100011215890 [0,1,0,1,0,0|1,0,0]=3 32692 B14R1.904 CCOCCN1CCCCC1CCO 269982a_100000211664_100011215890 [0,1,0,1,0,0|1,0,0]=3 32693 B14R1.904 CCOCCN1CCCCC1CCO 34a_100000211664_100000210147 [0,1,0,1,0,0|1,0,0]=3 32694 B14R1.904 CCOCCN1CCCCC1COC 2230a_100015184032_100011215890 [0,1,0,1,0,0|2,0,0]=4 32695 B14R1.904 CCOCCN1CCCCC1COC 269982a_100015184032_100011215890 [0,1,0,1,0,0|2,0,0]=4 32696 B14R1.904 CCOCCN1CCCCC1COC 34a_100015184032_100000210147 [0,1,0,1,0,0|2,0,0]=4 32697 B14R1.904 CCSCCN1CCCCC1CCO 2230a_100000211664_100000757381 [0,1,0,1,0,0|1,0,0]=3 32698 B14R1.904 CCSCCN1CCCCC1CCO 269982a_100000211664_100000757381 [0,1,0,1,0,0|1,0,0]=3 32699 B14R1.904 CCSCCN1CCCCC1CCO 34a_100000211664_100000757381 [0,1,0,1,0,0|1,0,0]=3 32700 B14R1.904 CCSCCN1CCCCC1COC 2230a_100015184032_100000757381 [0,1,0,1,0,0|2,0,0]=4 32701 B14R1.904 CCSCCN1CCCCC1COC 269982a_100015184032_100000757381 [0,1,0,1,0,0|2,0,0]=4 32702 B14R1.904 CCSCCN1CCCCC1COC 34a_100015184032_100000757381 [0,1,0,1,0,0|2,0,0]=4 32703 B14R1.904 COCC1CCCCN1CCCCF 2230a_100015184032_100000729493 [0,1,0,1,0,0|2,0,0]=4 32704 B14R1.904 COCC1CCCCN1CCCCF 269982a_100015184032_100000729493 [0,1,0,1,0,0|2,0,0]=4 32705 B14R1.904 COCC1CCCCN1CCCCF 34a_100015184032_100000729493 [0,1,0,1,0,0|2,0,0]=4 32706 B14R1.904 COCC1CCCCN1CCCCO 2230a_100015184032_100000210776 [0,1,0,1,0,0|1,0,0]=3 32707 B14R1.904 COCC1CCCCN1CCCCO 269982a_100015184032_100000210776 [0,1,0,1,0,0|1,0,0]=3 32708 B14R1.904 COCC1CCCCN1CCCCO 34a_100015184032_100011216708 [0,1,0,1,0,0|1,0,0]=3 32709 B14R1.904 COCCCC1CCCCN1CCF 2230a_100011804088_100011217306 [0,1,0,1,0,0|2,0,0]=4 32710 B14R1.904 COCCCC1CCCCN1CCF 269982a_100011804088_100011217306 [0,1,0,1,0,0|2,0,0]=4 32711 B14R1.904 COCCCC1CCCCN1CCF 34a_100011804088_100011217306 [0,1,0,1,0,0|2,0,0]=4 32712 B14R1.904 COCCCC1CCCCN1CCO 2230a_100011804088_100000211926 [0,1,0,1,0,0|1,0,0]=3 32713 B14R1.904 COCCCC1CCCCN1CCO 269982a_100011804088_100000211926 [0,1,0,1,0,0|1,0,0]=3 32714 B14R1.904 COCCCC1CCCCN1CCO 34a_100011804088_100000211926 [0,1,0,1,0,0|1,0,0]=3 32715 B14R1.904 COCCCC1CCCCN1COC 2230a_100011804088_100000766300 [0,1,0,1,0,0|2,0,0]=4 32716 B14R1.904 COCCCC1CCCCN1COC 269982a_100011804088_100000766300 [0,1,0,1,0,0|2,0,0]=4 32717 B14R1.904 COCCCC1CCCCN1CSC 2230a_100011804088_100011218213 [0,1,0,1,0,0|2,0,0]=4 32718 B14R1.904 COCCCC1CCCCN1CSC 269982a_100011804088_100011218213 [0,1,0,1,0,0|2,0,0]=4 32719 B14R1.904 COCCCC1CCCCN1CSC 34a_100011804088_100011218213 [0,1,0,1,0,0|2,0,0]=4 32720 B14R1.904 COCCCN1CCCCC1CCO 2230a_100000211664_100000740836 [0,1,0,1,0,0|1,0,0]=3 32721 B14R1.904 COCCCN1CCCCC1CCO 269982a_100000211664_100000740836 [0,1,0,1,0,0|1,0,0]=3 32722 B14R1.904 COCCCN1CCCCC1CCO 34a_100000211664_100000740836 [0,1,0,1,0,0|1,0,0]=3 32723 B14R1.904 COCCCN1CCCCC1COC 2230a_100015184032_100000740836 [0,1,0,1,0,0|2,0,0]=4 32724 B14R1.904 COCCCN1CCCCC1COC 269982a_100015184032_100000740836 [0,1,0,1,0,0|2,0,0]=4 32725 B14R1.904 COCCCN1CCCCC1COC 34a_100015184032_100000740836 [0,1,0,1,0,0|2,0,0]=4 32726 B14R1.904 COC[C@H]1COCCN1CCCCO 2230a_100016989928_100000210776 [0,1,0,1,0,0|2,0,0]=4 32727 B14R1.904 COC[C@H]1COCCN1CCCCO 269982a_100016989928_100000210776 [0,1,0,1,0,0|2,0,0]=4 32728 B14R1.904 COC[C@H]1COCCN1CCCCO 34a_100016989928_100011216708 [0,1,0,1,0,0|2,0,0]=4 32729 B14R1.904 N#CCC1CCCCC1NCCCO 270004a_100000182051_100009866218 [0,1,0,1,0,0|1,0,1]=4 32730 B14R1.904 N#CCC1CCCCN1CCCCO 2230a_100000133382_100000210776 [0,1,0,1,0,0|1,0,1]=4 32731 B14R1.904 N#CCC1CCCCN1CCCCO 34a_100000133382_100011216708 [0,1,0,1,0,0|1,0,1]=4 32732 B14R1.904 N#CCCCN1CCCCC1CCO 2230a_100000211664_100000687738 [0,1,0,1,0,0|1,0,1]=4 32733 B14R1.904 N#CCCCN1CCCCC1CCO 269982a_100000211664_100000687738 [0,1,0,1,0,0|1,0,1]=4 32734 B14R1.904 NCCN1CCCCC1COCCO 34a_100011473795_100000211926 [0,1,0,1,0,0|2,0,0]=4 32735 B14R1.904 O=CCCCN1CCCCC1CCO 2230a_100000211664_200011292268 [0,1,0,1,0,0|1,0,1]=4 32736 B14R1.904 O=CCCCN1CCCCC1CCO 269982a_100000211664_200011292268 [0,1,0,1,0,0|1,0,1]=4 32737 B14R1.904 OCCC1CCCCN1CCCCF 2230a_100000211664_100000729493 [0,1,0,1,0,0|1,0,0]=3 32738 B14R1.904 OCCC1CCCCN1CCCCF 269982a_100000211664_100000729493 [0,1,0,1,0,0|1,0,0]=3 32739 B14R1.904 OCCC1CCCCN1CCCCF 34a_100000211664_100000729493 [0,1,0,1,0,0|1,0,0]=3 32740 B14R1.904 OCCCCN1CCCCC1CCO 2230a_100000211664_100000210776 [0,1,0,1,0,0|1,0,0]=3 32741 B14R1.904 OCCCCN1CCCCC1CCO 269982a_100000211664_100000210776 [0,1,0,1,0,0|1,0,0]=3 32742 B14R1.904 OCCCCN1CCCCC1CCO 34a_100000211664_100011216708 [0,1,0,1,0,0|1,0,0]=3 32743 B14R1.911 C=CCCNC1CCCC1CCCC 269862a_100015191253_100000750825 [0,1,0,1,0,0|1,0,1]=4 32744 B14R1.911 C=CCCNC1CCCC1CCCC 270004a_100015191253_100000750825 [0,1,0,1,0,0|1,0,1]=4 32745 B14R1.911 C=CCNC1CCCC1CCCCC 270004a_100020586998_200000198059 [0,1,0,1,0,0|1,0,1]=4 32746 B14R1.911 CCCCC1C=CCN1CCCCO 2230a_100015184376_100000210776 [0,1,0,1,0,0|0,0,2]=4 32747 B14R1.911 CCCCC1C=CCN1CCCCO 269982a_100015184376_100000210776 [0,1,0,1,0,0|0,0,2]=4 32748 B14R1.911 CCCCC1C=CCN1CCCCO 34a_100015184376_100011216708 [0,1,0,1,0,0|0,0,2]=4 32749 B14R1.911 CCCCC1CCCC1=NNCCO 4a_100000210001_100000750825 [0,1,0,1,0,0|1,0,1]=4 32750 B14R1.911 CCCCC1CCCC1NCCC#N 270004a_100000720768_100000750825 [0,1,0,1,0,0|1,0,1]=4 32751 B14R1.911 CCCCC1CCCC1NCCCF 269862a_100015189416_100000750825 [0,1,0,1,0,0|1,0,0]=3 32752 B14R1.911 CCCCC1CCCC1NCCCF 270004a_100015189416_100000750825 [0,1,0,1,0,0|1,0,0]=3 32753 B14R1.911 CCCCC1CCCC1NCCCO 269862a_100000182051_100000750825 [0,1,0,1,0,0|0,0,0]=2 32754 B14R1.911 CCCCC1CCCC1NCCCO 270004a_100000182051_100000750825 [0,1,0,1,0,0|0,0,0]=2 32755 B14R1.911 CCCCC1CCCC1NCCOC 269862a_100000209980_100000750825 [0,1,0,1,0,0|1,0,0]=3 32756 B14R1.911 CCCCC1CCCC1NCCOC 270004a_100000209980_100000750825 [0,1,0,1,0,0|1,0,0]=3 32757 B14R1.911 CCCCC1CCCC1NCCSC 269862a_100020590264_100000750825 [0,1,0,1,0,0|1,1,0]=4 32758 B14R1.911 CCCCC1CCCC1NCCSC 270004a_100020590264_100000750825 [0,1,0,1,0,0|1,1,0]=4 32759 B14R1.911 CCCCCC1CCCC1NCCC 269862a_100020643023_200000198059 [0,1,0,1,0,0|1,0,0]=3 32760 B14R1.911 CCCCCC1CCCC1NCCC 270004a_100020643023_200000198059 [0,1,0,1,0,0|1,0,0]=3 32761 B14R1.911 CCCCCC1CCCC1NCCF 269862a_100000724931_200000198059 [0,1,0,1,0,0|1,0,0]=3 32762 B14R1.911 CCCCCC1CCCC1NCCO 269862a_100000210304_200000198059 [0,1,0,1,0,0|0,0,0]=2 32763 B14R1.911 CCCCCC1CCCC1NCCO 270004a_100000210304_200000198059 [0,1,0,1,0,0|0,0,0]=2 32764 B14R1.911 CCCCNC1CCCC1CCC#N 270004a_100000102301_100000073560 [0,1,0,1,0,0|1,0,1]=4 32765 B14R1.911 CCCCNC1CCCC1CCCC 269862a_100000102301_100000750825 [0,1,0,1,0,0|1,0,0]=3 32766 B14R1.911 CCCCNC1CCCC1CCCC 270004a_100000102301_100000750825 [0,1,0,1,0,0|1,0,0]=3 32767 B14R1.911 N#CCCC1CCCC1NCCCO 270004a_100000182051_100000073560 [0,1,0,1,0,0|1,0,1]=4 32768 B14R1.2352 BrCCCCCOC1CCCCCC1 34a_100000746331_100011217769 [0,1,0,1,0,0|1,0,0]=3 32769 B14R1.2352 BrCCCCOCC1CCCCCC1 34a_100011216708_200000696569 [0,1,0,1,0,0|1,0,0]=3 32770 B14R1.2352 BrCCOCCOC1CCCCCC1 34a_100000692535_100011217769 [0,1,0,1,0,0|2,0,0]=4 32771 B14R1.2352 C#CCCCCCN1CCCCCC1 2230a_100000185865_100012094781 [0,1,0,1,0,0|1,0,1]=4 32772 B14R1.2352 C#CCCCCCN1CCCCCC1 269982a_100000185865_100012094781 [0,1,0,1,0,0|1,0,1]=4 32773 B14R1.2352 C#CCCCCCN1CCCCCC1 34a_100000185865_100012094781 [0,1,0,1,0,0|1,0,1]=4 32774 B14R1.2352 C#CCCCCNC1CCCCCC1 2230a_100000210984_100010269958 [0,1,0,1,0,0|1,0,1]=4 32775 B14R1.2352 C#CCCCCNC1CCCCCC1 34a_100000210984_100010269958 [0,1,0,1,0,0|1,0,1]=4 32776 B14R1.2352 C#CCCCCNC1CCCCCC1 34a_100000706060_100011217769 [0,1,0,1,0,0|1,0,1]=4 32777 B14R1.2352 C#CCCCCOC1CCCCCC1 34a_100000210887_100010269958 [0,1,0,1,0,0|1,0,1]=4 32778 B14R1.2352 C#CCCCCOC1CCCCCC1 34a_100000766709_100011217769 [0,1,0,1,0,0|1,0,1]=4 32779 B14R1.2352 C#CCCCCOC1CCCCCC1 7a_100000210887_100010269958 [0,1,0,1,0,0|1,0,1]=4 32780 B14R1.2352 C#CCCCCSC1CCCCCC1 62a_100010269958_100011217769 [0,1,0,1,0,0|1,0,1]=4 32781 B14R1.2352 C#CCCCCSC1CCCCCC1 62a_100011217769_100010269958 [0,1,0,1,0,0|1,0,1]=4 32782 B14R1.2352 C#CCCCNCC1CCCCCC1 2230a_100015204231_100000731252 [0,1,0,1,0,0|1,0,1]=4 32783 B14R1.2352 C#CCCCNCC1CCCCCC1 34a_100000718082_200000696569 [0,1,0,1,0,0|1,0,1]=4 32784 B14R1.2352 C#CCCCNCC1CCCCCC1 34a_100015204231_100000695029 [0,1,0,1,0,0|1,0,1]=4 32785 B14R1.2352 C#CCCCOCC1CCCCCC1 34a_100000215630_200000696569 [0,1,0,1,0,0|1,0,1]=4 32786 B14R1.2352 C#CCCCOCC1CCCCCC1 34a_100000699130_100000695029 [0,1,0,1,0,0|1,0,1]=4 32787 B14R1.2352 C#CCCCOCC1CCCCCC1 7a_100000215630_200000696569 [0,1,0,1,0,0|1,0,1]=4 32788 B14R1.2352 C#CCCCOCC1CCCCCC1 7a_100000699130_100011215417 [0,1,0,1,0,0|1,0,1]=4 32789 B14R1.2352 C#CCCCSCC1CCCCCC1 62a_100011215417_200000696569 [0,1,0,1,0,0|1,0,1]=4 32790 B14R1.2352 C#CCCCSCC1CCCCCC1 62a_200000696569_100011215417 [0,1,0,1,0,0|1,0,1]=4 32791 B14R1.2352 C#CCCNCCC1CCCCCC1 2230a_100011532351_100000688953 [0,1,0,1,0,0|1,0,1]=4 32792 B14R1.2352 C#CCCNCCC1CCCCCC1 34a_100011532351_100000688953 [0,1,0,1,0,0|1,0,1]=4 32793 B14R1.2352 C=CCCCCCN1CCCCCC1 2230a_100000185865_100000700193 [0,1,0,1,0,0|1,0,1]=4 32794 B14R1.2352 C=CCCCCCN1CCCCCC1 269982a_100000185865_100000700193 [0,1,0,1,0,0|1,0,1]=4 32795 B14R1.2352 C=CCCCCCN1CCCCCC1 34a_100000185865_100000700193 [0,1,0,1,0,0|1,0,1]=4 32796 B14R1.2352 C=CCCCCNC1CCCCCC1 2230a_100000210984_100011215482 [0,1,0,1,0,0|1,0,1]=4 32797 B14R1.2352 C=CCCCCNC1CCCCCC1 270004a_100000703577_100000210131 [0,1,0,1,0,0|1,0,1]=4 32798 B14R1.2352 C=CCCCCNC1CCCCCC1 34a_100000210984_100011215482 [0,1,0,1,0,0|1,0,1]=4 32799 B14R1.2352 C=CCCCCNC1CCCCCC1 34a_100000703577_100011217769 [0,1,0,1,0,0|1,0,1]=4 32800 B14R1.2352 C=CCCCCOC1CCCCCC1 34a_100000210887_100011215482 [0,1,0,1,0,0|1,0,1]=4 32801 B14R1.2352 C=CCCCCOC1CCCCCC1 34a_100000766645_100011217769 [0,1,0,1,0,0|1,0,1]=4 32802 B14R1.2352 C=CCCCCOC1CCCCCC1 7a_100000210887_100011215482 [0,1,0,1,0,0|1,0,1]=4 32803 B14R1.2352 C=CCCCCSC1CCCCCC1 62a_100011215482_100011217769 [0,1,0,1,0,0|1,0,1]=4 32804 B14R1.2352 C=CCCCCSC1CCCCCC1 62a_100011217769_100011215482 [0,1,0,1,0,0|1,0,1]=4 32805 B14R1.2352 C=CCCCNCC1CCCCCC1 2230a_100000700776_200000696569 [0,1,0,1,0,0|1,0,1]=4 32806 B14R1.2352 C=CCCCNCC1CCCCCC1 2230a_100015204231_100011713584 [0,1,0,1,0,0|1,0,1]=4 32807 B14R1.2352 C=CCCCNCC1CCCCCC1 269862a_100000700776_200000763224 [0,1,0,1,0,0|1,0,1]=4 32808 B14R1.2352 C=CCCCNCC1CCCCCC1 34a_100000700776_200000696569 [0,1,0,1,0,0|1,0,1]=4 32809 B14R1.2352 C=CCCCNCC1CCCCCC1 34a_100015204231_100000757094 [0,1,0,1,0,0|1,0,1]=4 32810 B14R1.2352 C=CCCCOCC1CCCCCC1 34a_100000699130_100000757094 [0,1,0,1,0,0|1,0,1]=4 32811 B14R1.2352 C=CCCCOCC1CCCCCC1 34a_100000758997_200000696569 [0,1,0,1,0,0|1,0,1]=4 32812 B14R1.2352 C=CCCCOCC1CCCCCC1 7a_100000699130_100000757094 [0,1,0,1,0,0|1,0,1]=4 32813 B14R1.2352 C=CCCCOCC1CCCCCC1 7a_100000758997_200000696569 [0,1,0,1,0,0|1,0,1]=4 32814 B14R1.2352 C=CCCCSCC1CCCCCC1 62a_100011713584_200000696569 [0,1,0,1,0,0|1,0,1]=4 32815 B14R1.2352 C=CCCCSCC1CCCCCC1 62a_200000696569_100000757094 [0,1,0,1,0,0|1,0,1]=4 32816 B14R1.2352 C=CCCNCCC1CCCCCC1 2230a_100011532351_100000754431 [0,1,0,1,0,0|1,0,1]=4 32817 B14R1.2352 C=CCCNCCC1CCCCCC1 34a_100011532351_100000754431 [0,1,0,1,0,0|1,0,1]=4 32818 B14R1.2352 CCCCCCCN1CCCCCC1 2230a_100000185865_100000210681 [0,1,0,1,0,0|1,0,0]=3 32819 B14R1.2352 CCCCCCCN1CCCCCC1 269982a_100000185865_100000210681 [0,1,0,1,0,0|1,0,0]=3 32820 B14R1.2352 CCCCCCCN1CCCCCC1 34a_100000185865_100000210614 [0,1,0,1,0,0|1,0,0]=3 32821 B14R1.2352 CCCCCCCN1CCCOCC1 2230a_100000685342_100000210681 [0,1,0,1,0,0|2,0,0]=4 32822 B14R1.2352 CCCCCCCN1CCCOCC1 269982a_100000685342_100000210681 [0,1,0,1,0,0|2,0,0]=4 32823 B14R1.2352 CCCCCCCN1CCCOCC1 34a_100000685342_100000210614 [0,1,0,1,0,0|2,0,0]=4 32824 B14R1.2352 CCCCCCNC1CCCCCC1 2230a_100000210984_100000210314 [0,1,0,1,0,0|1,0,0]=3 32825 B14R1.2352 CCCCCCNC1CCCCCC1 270004a_100000210581_100000210131 [0,1,0,1,0,0|1,0,0]=3 32826 B14R1.2352 CCCCCCNC1CCCCCC1 34a_100000210984_100000210314 [0,1,0,1,0,0|1,0,0]=3 32827 B14R1.2352 CCCCCCNC1CCCNCC1 270004a_100000210581_100015187895 [0,1,0,1,0,0|2,0,0]=4 32828 B14R1.2352 CCCCCCOC1CCCCCC1 34a_100000210259_100011217769 [0,1,0,1,0,0|1,0,0]=3 32829 B14R1.2352 CCCCCCOC1CCCCCC1 34a_100000210887_100000210314 [0,1,0,1,0,0|1,0,0]=3 32830 B14R1.2352 CCCCCCOC1CCCCCC1 7a_100000210887_100000210314 [0,1,0,1,0,0|1,0,0]=3 32831 B14R1.2352 CCCCCCSC1CCCCCC1 62a_100000210314_100011217769 [0,1,0,1,0,0|1,0,0]=3 32832 B14R1.2352 CCCCCCSC1CCCCCC1 62a_100011217769_100000210757 [0,1,0,1,0,0|1,0,0]=3 32833 B14R1.2352 CCCCCNCC1CCCCCC1 2230a_100000209983_200000696569 [0,1,0,1,0,0|1,0,0]=3 32834 B14R1.2352 CCCCCNCC1CCCCCC1 2230a_100015204231_100000210326 [0,1,0,1,0,0|1,0,0]=3 32835 B14R1.2352 CCCCCNCC1CCCCCC1 269862a_100000209983_200000763224 [0,1,0,1,0,0|1,0,0]=3 32836 B14R1.2352 CCCCCNCC1CCCCCC1 34a_100015204231_100000718602 [0,1,0,1,0,0|1,0,0]=3 32837 B14R1.2352 CCCCCOCC1CCCCCC1 34a_100000210253_200000696569 [0,1,0,1,0,0|1,0,0]=3 32838 B14R1.2352 CCCCCOCC1CCCCCC1 34a_100000699130_100000718602 [0,1,0,1,0,0|1,0,0]=3 32839 B14R1.2352 CCCCCOCC1CCCCCC1 7a_100000210253_200000696569 [0,1,0,1,0,0|1,0,0]=3 32840 B14R1.2352 CCCCCOCC1CCCCCC1 7a_100000699130_100000210326 [0,1,0,1,0,0|1,0,0]=3 32841 B14R1.2352 CCCCCOCC1CNCCOC1 34a_100103147999_100000718602 [0,1,0,1,0,0|2,0,0]=4 32842 B14R1.2352 CCCCCSCC1CCCCCC1 62a_100000210326_200000696569 [0,1,0,1,0,0|1,0,0]=3 32843 B14R1.2352 CCCCCSCC1CCCCCC1 62a_200000696569_100000210326 [0,1,0,1,0,0|1,0,0]=3 32844 B14R1.2352 CCCCNCCC1CCCCCC1 2230a_100011532351_100000210211 [0,1,0,1,0,0|1,0,0]=3 32845 B14R1.2352 CCCCNCCC1CCCCCC1 34a_100011532351_100000210210 [0,1,0,1,0,0|1,0,0]=3 32846 B14R1.2352 CCCCNCCN1CCCCCC1 7a_106832991798_100000722644 [0,1,0,1,0,0|2,0,0]=4 32847 B14R1.2352 CCCCOCCN1CCCCCC1 2230a_100000185865_100000743108 [0,1,0,1,0,0|2,0,0]=4 32848 B14R1.2352 CCCCOCCN1CCCCCC1 269982a_100000185865_100000743108 [0,1,0,1,0,0|2,0,0]=4 32849 B14R1.2352 CCCCOCCN1CCCCCC1 34a_100000185865_100000743108 [0,1,0,1,0,0|2,0,0]=4 32850 B14R1.2352 CCCCOCCN1CCCCCC1 34a_100000238007_100000210210 [0,1,0,1,0,0|2,0,0]=4 32851 B14R1.2352 CCCCOCCN1CCCCCC1 7a_100000210227_100000722644 [0,1,0,1,0,0|2,0,0]=4 32852 B14R1.2352 CCCCOCNC1CCCCCC1 2230a_100000210984_100011995733 [0,1,0,1,0,0|2,0,0]=4 32853 B14R1.2352 CCCCOCNC1CCCCCC1 34a_100000210984_100011995733 [0,1,0,1,0,0|2,0,0]=4 32854 B14R1.2352 CCCCOCOC1CCCCCC1 34a_100000210887_100011995733 [0,1,0,1,0,0|2,0,0]=4 32855 B14R1.2352 CCCCOCSC1CCCCCC1 62a_100011217769_100011995733 [0,1,0,1,0,0|2,0,0]=4 32856 B14R1.2352 CCCCOCSC1CCCCCC1 62a_100011995733_100011217769 [0,1,0,1,0,0|2,0,0]=4 32857 B14R1.2352 CCCCSCCN1CCCCCC1 62a_100000210211_100000722644 [0,1,0,1,0,0|2,0,0]=4 32858 B14R1.2352 CCCCSCCN1CCCCCC1 62a_100000722644_100000210210 [0,1,0,1,0,0|2,0,0]=4 32859 B14R1.2352 CCCOCCCN1CCCCCC1 34a_100102886287_100000210303 [0,1,0,1,0,0|2,0,0]=4 32860 B14R1.2352 CCCOCCCN1CCCCCC1 7a_100102886287_100000210303 [0,1,0,1,0,0|2,0,0]=4 32861 B14R1.2352 CCCOCCNC1CCCCCC1 2230a_100000210984_100011215938 [0,1,0,1,0,0|2,0,0]=4 32862 B14R1.2352 CCCOCCNC1CCCCCC1 270004a_100161115042_100000210131 [0,1,0,1,0,0|2,0,0]=4 32863 B14R1.2352 CCCOCCNC1CCCCCC1 34a_100000210984_100011215938 [0,1,0,1,0,0|2,0,0]=4 32864 B14R1.2352 CCCOCCNC1CCCCCC1 34a_100161115042_100011217769 [0,1,0,1,0,0|2,0,0]=4 32865 B14R1.2352 CCCOCCOC1CCCCCC1 34a_100000210887_100011215938 [0,1,0,1,0,0|2,0,0]=4 32866 B14R1.2352 CCCOCCOC1CCCCCC1 34a_100000752267_100011217769 [0,1,0,1,0,0|2,0,0]=4 32867 B14R1.2352 CCCOCCOC1CCCCCC1 7a_100000210887_100011215938 [0,1,0,1,0,0|2,0,0]=4 32868 B14R1.2352 CCCOCCSC1CCCCCC1 62a_100011215938_100011217769 [0,1,0,1,0,0|2,0,0]=4 32869 B14R1.2352 CCCOCCSC1CCCCCC1 62a_100011217769_100011215938 [0,1,0,1,0,0|2,0,0]=4 32870 B14R1.2352 CCCSCCNC1CCCCCC1 270004a_100020603323_100000210131 [0,1,0,1,0,0|2,0,0]=4 32871 B14R1.2352 CCCSCCOC1CCCCCC1 34a_200000230433_100011217769 [0,1,0,1,0,0|2,0,0]=4 32872 B14R1.2352 CCOCCCCN1CCCCCC1 34a_100011305542_100000210202 [0,1,0,1,0,0|2,0,0]=4 32873 B14R1.2352 CCOCCCNC1CCCCCC1 2230a_100000210984_100012232248 [0,1,0,1,0,0|2,0,0]=4 32874 B14R1.2352 CCOCCCNC1CCCCCC1 270004a_100000210961_100000210131 [0,1,0,1,0,0|2,0,0]=4 32875 B14R1.2352 CCOCCCNC1CCCCCC1 34a_100000210961_100011217769 [0,1,0,1,0,0|2,0,0]=4 32876 B14R1.2352 CCOCCCNC1CCCCCC1 34a_100000210984_100012232248 [0,1,0,1,0,0|2,0,0]=4 32877 B14R1.2352 CCOCCCOC1CCCCCC1 34a_100000210887_100012232248 [0,1,0,1,0,0|2,0,0]=4 32878 B14R1.2352 CCOCCCOC1CCCCCC1 34a_100000757476_100011217769 [0,1,0,1,0,0|2,0,0]=4 32879 B14R1.2352 CCOCCCOC1CCCCCC1 7a_100000210887_100012232248 [0,1,0,1,0,0|2,0,0]=4 32880 B14R1.2352 CCOCCCSC1CCCCCC1 62a_100011217769_100012232248 [0,1,0,1,0,0|2,0,0]=4 32881 B14R1.2352 CCOCCCSC1CCCCCC1 62a_100012232248_100011217769 [0,1,0,1,0,0|2,0,0]=4 32882 B14R1.2352 CCOCCNCC1CCCCCC1 2230a_100015204231_100011215890 [0,1,0,1,0,0|2,0,0]=4 32883 B14R1.2352 CCOCCNCC1CCCCCC1 2230a_102516460346_200000696569 [0,1,0,1,0,0|2,0,0]=4 32884 B14R1.2352 CCOCCNCC1CCCCCC1 269862a_100011200944_200000763224 [0,1,0,1,0,0|2,0,0]=4 32885 B14R1.2352 CCOCCNCC1CCCCCC1 34a_100015204231_100000210147 [0,1,0,1,0,0|2,0,0]=4 32886 B14R1.2352 CCOCCNCC1CCCCCC1 34a_102516460346_200000696569 [0,1,0,1,0,0|2,0,0]=4 32887 B14R1.2352 CCOCCOCC1CCCCCC1 34a_100000210136_200000696569 [0,1,0,1,0,0|2,0,0]=4 32888 B14R1.2352 CCOCCOCC1CCCCCC1 34a_100000699130_100000210147 [0,1,0,1,0,0|2,0,0]=4 32889 B14R1.2352 CCOCCOCC1CCCCCC1 7a_100000210136_200000696569 [0,1,0,1,0,0|2,0,0]=4 32890 B14R1.2352 CCOCCOCC1CCCCCC1 7a_100000699130_100011215890 [0,1,0,1,0,0|2,0,0]=4 32891 B14R1.2352 CCOCCSCC1CCCCCC1 62a_100000210147_200000696569 [0,1,0,1,0,0|2,0,0]=4 32892 B14R1.2352 CCOCCSCC1CCCCCC1 62a_200000696569_100011215890 [0,1,0,1,0,0|2,0,0]=4 32893 B14R1.2352 CCSCCCOC1CCCCCC1 34a_100011216438_100011217769 [0,1,0,1,0,0|2,0,0]=4 32894 B14R1.2352 CCSCCNCC1CCCCCC1 2230a_100000106463_200000696569 [0,1,0,1,0,0|2,0,0]=4 32895 B14R1.2352 CCSCCNCC1CCCCCC1 2230a_100015204231_100000757381 [0,1,0,1,0,0|2,0,0]=4 32896 B14R1.2352 CCSCCNCC1CCCCCC1 269862a_100000106463_200000763224 [0,1,0,1,0,0|2,0,0]=4 32897 B14R1.2352 CCSCCNCC1CCCCCC1 34a_100015204231_100000757381 [0,1,0,1,0,0|2,0,0]=4 32898 B14R1.2352 CCSCCOCC1CCCCCC1 34a_100000212035_200000696569 [0,1,0,1,0,0|2,0,0]=4 32899 B14R1.2352 CCSCCOCC1CCCCCC1 34a_100000699130_100000757381 [0,1,0,1,0,0|2,0,0]=4 32900 B14R1.2352 CCSCCOCC1CCCCCC1 7a_100000212035_200000696569 [0,1,0,1,0,0|2,0,0]=4 32901 B14R1.2352 CCSCCOCC1CCCCCC1 7a_100000699130_100000757381 [0,1,0,1,0,0|2,0,0]=4 32902 B14R1.2352 CCSCCSCC1CCCCCC1 62a_100000757381_200000696569 [0,1,0,1,0,0|2,0,0]=4 32903 B14R1.2352 CCSCCSCC1CCCCCC1 62a_200000696569_100000757381 [0,1,0,1,0,0|2,0,0]=4 32904 B14R1.2352 CNCCCOCC1CCCCCC1 34a_100000213112_200000696569 [0,1,0,1,0,0|2,0,0]=4 32905 B14R1.2352 COCCCCNC1CCCCCC1 2230a_100000210984_100000730899 [0,1,0,1,0,0|1,0,0]=3 32906 B14R1.2352 COCCCCNC1CCCCCC1 34a_100000210984_100000755781 [0,1,0,1,0,0|1,0,0]=3 32907 B14R1.2352 COCCCCOC1CCCCCC1 34a_100000210887_100000755781 [0,1,0,1,0,0|1,0,0]=3 32908 B14R1.2352 COCCCCOC1CCCCCC1 34a_100000740925_100011217769 [0,1,0,1,0,0|1,0,0]=3 32909 B14R1.2352 COCCCCOC1CCCCCC1 7a_100000210887_100000730899 [0,1,0,1,0,0|1,0,0]=3 32910 B14R1.2352 COCCCCSC1CCCCCC1 62a_100000730899_100011217769 [0,1,0,1,0,0|1,0,0]=3 32911 B14R1.2352 COCCCCSC1CCCCCC1 62a_100011217769_100000730899 [0,1,0,1,0,0|1,0,0]=3 32912 B14R1.2352 COCCCNCC1CCCCCC1 2230a_100015204231_100000740836 [0,1,0,1,0,0|1,0,0]=3 32913 B14R1.2352 COCCCNCC1CCCCCC1 269862a_100150723488_200000763224 [0,1,0,1,0,0|1,0,0]=3 32914 B14R1.2352 COCCCNCC1CCCCCC1 34a_100015204231_100000740836 [0,1,0,1,0,0|1,0,0]=3 32915 B14R1.2352 COCCCNCC1CCCCCC1 34a_100150723488_200000696569 [0,1,0,1,0,0|1,0,0]=3 32916 B14R1.2352 COCCCOCC1CCCCCC1 34a_100000699130_100000740836 [0,1,0,1,0,0|1,0,0]=3 32917 B14R1.2352 COCCCOCC1CCCCCC1 34a_100000740835_200000696569 [0,1,0,1,0,0|1,0,0]=3 32918 B14R1.2352 COCCCOCC1CCCCCC1 7a_100000699130_100000740836 [0,1,0,1,0,0|1,0,0]=3 32919 B14R1.2352 COCCCSCC1CCCCCC1 62a_100000709357_200000696569 [0,1,0,1,0,0|1,0,0]=3 32920 B14R1.2352 COCCCSCC1CCCCCC1 62a_200000696569_100000709357 [0,1,0,1,0,0|1,0,0]=3 32921 B14R1.2352 COCCNCCC1CCCCCC1 2230a_100011532351_100011201679 [0,1,0,1,0,0|1,0,0]=3 32922 B14R1.2352 COCCNCCC1CCCCCC1 34a_100011532351_100011201679 [0,1,0,1,0,0|1,0,0]=3 32923 B14R1.2352 COCCOCCN1CCCCCC1 2230a_100000185865_100000695917 [0,1,0,1,0,0|2,0,0]=4 32924 B14R1.2352 COCCOCCN1CCCCCC1 269982a_100000185865_100000695917 [0,1,0,1,0,0|2,0,0]=4 32925 B14R1.2352 COCCOCCN1CCCCCC1 34a_100000185865_100000695917 [0,1,0,1,0,0|2,0,0]=4 32926 B14R1.2352 COCCOCCN1CCCCCC1 34a_100000238007_100011201679 [0,1,0,1,0,0|2,0,0]=4 32927 B14R1.2352 COCCOCNC1CCCCCC1 2230a_100000210984_100000231047 [0,1,0,1,0,0|2,0,0]=4 32928 B14R1.2352 COCCOCSC1CCCCCC1 62a_100000231047_100011217769 [0,1,0,1,0,0|2,0,0]=4 32929 B14R1.2352 COCCOCSC1CCCCCC1 62a_100011217769_100000231047 [0,1,0,1,0,0|2,0,0]=4 32930 B14R1.2352 COCCSCCN1CCCCCC1 62a_100000233755_100000722644 [0,1,0,1,0,0|2,0,0]=4 32931 B14R1.2352 COCCSCCN1CCCCCC1 62a_100000722644_100000233755 [0,1,0,1,0,0|2,0,0]=4 32932 B14R1.2352 CSCCCCOC1CCCCCC1 34a_100011217163_100011217769 [0,1,0,1,0,0|1,1,0]=4 32933 B14R1.2352 CSCCCNCC1CCCCCC1 2230a_100000749238_200000696569 [0,1,0,1,0,0|1,1,0]=4 32934 B14R1.2352 CSCCCNCC1CCCCCC1 269862a_100000749238_200000763224 [0,1,0,1,0,0|1,1,0]=4 32935 B14R1.2352 CSCCCOCC1CCCCCC1 34a_100000690336_200000696569 [0,1,0,1,0,0|1,1,0]=4 32936 B14R1.2352 CSCCCOCC1CCCCCC1 7a_100000690336_200000696569 [0,1,0,1,0,0|1,1,0]=4 32937 B14R1.2352 CSCCNCCC1CCCCCC1 2230a_100011532351_100000751147 [0,1,0,1,0,0|1,1,0]=4 32938 B14R1.2352 CSCCNCCC1CCCCCC1 34a_100011532351_100000212216 [0,1,0,1,0,0|1,1,0]=4 32939 B14R1.2352 ClCCCCCOC1CCCCCC1 34a_100000746330_100011217769 [0,1,0,1,0,0|1,0,0]=3 32940 B14R1.2352 ClCCCCOCC1CCCCCC1 34a_100000210776_200000696569 [0,1,0,1,0,0|1,0,0]=3 32941 B14R1.2352 ClCCCCOCC1CCCCCC1 7a_100000210776_200000696569 [0,1,0,1,0,0|1,0,0]=3 32942 B14R1.2352 ClCCOCCOC1CCCCCC1 34a_100011215305_100011217769 [0,1,0,1,0,0|2,0,0]=4 32943 B14R1.2352 FCCCCCCN1CCCCCC1 2230a_100000185865_100015922095 [0,1,0,1,0,0|1,0,0]=3 32944 B14R1.2352 FCCCCCCN1CCCCCC1 269982a_100000185865_100015922095 [0,1,0,1,0,0|1,0,0]=3 32945 B14R1.2352 FCCCCCCN1CCCCCC1 34a_100000185865_100015922095 [0,1,0,1,0,0|1,0,0]=3 32946 B14R1.2352 FCCCCCCN1CCCOCC1 2230a_100000685342_100015922095 [0,1,0,1,0,0|2,0,0]=4 32947 B14R1.2352 FCCCCCCN1CCCOCC1 269982a_100000685342_100015922095 [0,1,0,1,0,0|2,0,0]=4 32948 B14R1.2352 FCCCCCCN1CCCOCC1 34a_100000685342_100015922095 [0,1,0,1,0,0|2,0,0]=4 32949 B14R1.2352 FCCCCCNC1CCCCCC1 2230a_100000210984_100000729378 [0,1,0,1,0,0|1,0,0]=3 32950 B14R1.2352 FCCCCCNC1CCCCCC1 34a_100000210984_100000729378 [0,1,0,1,0,0|1,0,0]=3 32951 B14R1.2352 FCCCCCOC1CCCCCC1 34a_100000210887_100000729378 [0,1,0,1,0,0|1,0,0]=3 32952 B14R1.2352 FCCCCCOC1CCCCCC1 7a_100000210887_100000729378 [0,1,0,1,0,0|1,0,0]=3 32953 B14R1.2352 FCCCCCSC1CCCCCC1 62a_100000729378_100011217769 [0,1,0,1,0,0|1,0,0]=3 32954 B14R1.2352 FCCCCCSC1CCCCCC1 62a_100011217769_100000729378 [0,1,0,1,0,0|1,0,0]=3 32955 B14R1.2352 FCCCCNCC1CCCCCC1 2230a_100015204231_100000729493 [0,1,0,1,0,0|1,0,0]=3 32956 B14R1.2352 FCCCCNCC1CCCCCC1 34a_100015204231_100000729493 [0,1,0,1,0,0|1,0,0]=3 32957 B14R1.2352 FCCCCOCC1CCCCCC1 34a_100000699130_100000729493 [0,1,0,1,0,0|1,0,0]=3 32958 B14R1.2352 FCCCCOCC1CCCCCC1 34a_100011995726_200000696569 [0,1,0,1,0,0|1,0,0]=3 32959 B14R1.2352 FCCCCOCC1CCCCCC1 7a_100000699130_100000729493 [0,1,0,1,0,0|1,0,0]=3 32960 B14R1.2352 FCCCCOCC1CCCCCC1 7a_100011995726_200000696569 [0,1,0,1,0,0|1,0,0]=3 32961 B14R1.2352 FCCCCSCC1CCCCCC1 62a_100000729493_200000696569 [0,1,0,1,0,0|1,0,0]=3 32962 B14R1.2352 FCCCCSCC1CCCCCC1 62a_200000696569_100000729493 [0,1,0,1,0,0|1,0,0]=3 32963 B14R1.2352 FCCCNCCC1CCCCCC1 2230a_100011532351_100011934791 [0,1,0,1,0,0|1,0,0]=3 32964 B14R1.2352 FCCCNCCC1CCCCCC1 34a_100011532351_100011934791 [0,1,0,1,0,0|1,0,0]=3 32965 B14R1.2352 FCCCOCCN1CCCCCC1 34a_100000238007_100011934791 [0,1,0,1,0,0|2,0,0]=4 32966 B14R1.2352 FCCCSCCN1CCCCCC1 62a_100000722644_100011934791 [0,1,0,1,0,0|2,0,0]=4 32967 B14R1.2352 FCCCSCCN1CCCCCC1 62a_100011934791_100000722644 [0,1,0,1,0,0|2,0,0]=4 32968 B14R1.2352 FCCOCCCN1CCCCCC1 34a_100102886287_100011217306 [0,1,0,1,0,0|2,0,0]=4 32969 B14R1.2352 FCCOCCCN1CCCCCC1 7a_100102886287_100011217306 [0,1,0,1,0,0|2,0,0]=4 32970 B14R1.2352 FCCOCCOC1CCCCCC1 34a_200015357709_100011217769 [0,1,0,1,0,0|2,0,0]=4 32971 B14R1.2352 FCOCCCCN1CCCCCC1 34a_100011305542_100015361967 [0,1,0,1,0,0|2,0,0]=4 32972 B14R1.2352 ICCCCCOC1CCCCCC1 34a_200012148887_100011217769 [0,1,0,1,0,0|1,0,0]=3 32973 B14R1.2352 ICCCCOCC1CCCCCC1 34a_200012148704_200000696569 [0,1,0,1,0,0|1,0,0]=3 32974 B14R1.2352 ICCOCCOC1CCCCCC1 34a_100012149058_100011217769 [0,1,0,1,0,0|2,0,0]=4 32975 B14R1.2352 N#CCCCCCN1CCCCCC1 2230a_100000185865_100009813376 [0,1,0,1,0,0|1,0,1]=4 32976 B14R1.2352 N#CCCCCCN1CCCCCC1 269982a_100000185865_100009813376 [0,1,0,1,0,0|1,0,1]=4 32977 B14R1.2352 N#CCCCCNC1CCCCCC1 2230a_100000210984_100000211819 [0,1,0,1,0,0|1,0,1]=4 32978 B14R1.2352 N#CCCCCNC1CCCCCC1 270004a_100000751965_100000210131 [0,1,0,1,0,0|1,0,1]=4 32979 B14R1.2352 N#CCCCCOC1CCCCCC1 7a_100000210887_100000211819 [0,1,0,1,0,0|1,0,1]=4 32980 B14R1.2352 N#CCCCCSC1CCCCCC1 62a_100011217769_100000211819 [0,1,0,1,0,0|1,0,1]=4 32981 B14R1.2352 N#CCCCCSC1CCCCCC1 62a_100011219923_100011217769 [0,1,0,1,0,0|1,0,1]=4 32982 B14R1.2352 N#CCCCNCC1CCCCCC1 2230a_100015204231_100000687738 [0,1,0,1,0,0|1,0,1]=4 32983 B14R1.2352 N#CCCCOCC1CCCCCC1 7a_100000699130_100000687738 [0,1,0,1,0,0|1,0,1]=4 32984 B14R1.2352 N#CCCCSCC1CCCCCC1 62a_100000687738_200000696569 [0,1,0,1,0,0|1,0,1]=4 32985 B14R1.2352 N#CCCCSCC1CCCCCC1 62a_200000696569_100000687738 [0,1,0,1,0,0|1,0,1]=4 32986 B14R1.2352 N#CCCNCCC1CCCCCC1 2230a_100011532351_100011215226 [0,1,0,1,0,0|1,0,1]=4 32987 B14R1.2352 NCCCCCOC1CCCCCC1 34a_100000762737_100011217769 [0,1,0,1,0,0|1,0,0]=3 32988 B14R1.2352 NCCCCOCC1CCCCCC1 34a_100000750430_200000696569 [0,1,0,1,0,0|1,0,0]=3 32989 B14R1.2352 NCCOCCOC1CCCCCC1 34a_100000211614_100011217769 [0,1,0,1,0,0|2,0,0]=4 32990 B14R1.2352 O=CCCCCCN1CCCCCC1 2230a_100000185865_100000139337 [0,1,0,1,0,0|0,0,2]=4 32991 B14R1.2352 O=CCCCCCN1CCCCCC1 269982a_100000185865_100000139337 [0,1,0,1,0,0|0,0,2]=4 32992 B14R1.2352 O=CCCCCNC1CCCCCC1 2230a_100000210984_100000139335 [0,1,0,1,0,0|0,0,2]=4 32993 B14R1.2352 O=CCCCCOC1CCCCCC1 7a_100000210887_100000139335 [0,1,0,1,0,0|0,0,2]=4 32994 B14R1.2352 O=CCCCCSC1CCCCCC1 62a_100000139335_100011217769 [0,1,0,1,0,0|0,0,2]=4 32995 B14R1.2352 O=CCCCCSC1CCCCCC1 62a_100011217769_100000139335 [0,1,0,1,0,0|0,0,2]=4 32996 B14R1.2352 O=CCCCNCC1CCCCCC1 2230a_100015204231_200011292268 [0,1,0,1,0,0|0,0,2]=4 32997 B14R1.2352 O=CCCCOCC1CCCCCC1 7a_100000699130_200011292268 [0,1,0,1,0,0|0,0,2]=4 32998 B14R1.2352 O=CCCCSCC1CCCCCC1 62a_200000696569_200011292268 [0,1,0,1,0,0|0,0,2]=4 32999 B14R1.2352 O=CCCCSCC1CCCCCC1 62a_200011292268_200000696569 [0,1,0,1,0,0|0,0,2]=4 33000 B14R1.2352 OCC#CCNCC1CCCCCC1 2230a_100015204231_200000047223 [0,1,0,1,0,0|0,0,2]=4 33001 B14R1.2352 OCC#CCNCC1CCCCCC1 34a_100015204231_200000047223 [0,1,0,1,0,0|0,0,2]=4 33002 B14R1.2352 OCC#CCOCC1CCCCCC1 34a_100000699130_200000047223 [0,1,0,1,0,0|0,0,2]=4 33003 B14R1.2352 OCC#CCOCC1CCCCCC1 7a_100000699130_200000047223 [0,1,0,1,0,0|0,0,2]=4 33004 B14R1.2352 OCC#CCSCC1CCCCCC1 62a_200000047223_200000696569 [0,1,0,1,0,0|0,0,2]=4 33005 B14R1.2352 OCC#CCSCC1CCCCCC1 62a_200000696569_200000047223 [0,1,0,1,0,0|0,0,2]=4 33006 B14R1.2352 OCCCCCCN1CCCCCC1 2230a_100000185865_100000766143 [0,1,0,1,0,0|0,0,0]=2 33007 B14R1.2352 OCCCCCCN1CCCCCC1 269982a_100000185865_100000766143 [0,1,0,1,0,0|0,0,0]=2 33008 B14R1.2352 OCCCCCCN1CCCCCC1 34a_100000185865_100000766143 [0,1,0,1,0,0|0,0,0]=2 33009 B14R1.2352 OCCCCCCN1CCCOCC1 2230a_100000685342_100000766143 [0,1,0,1,0,0|1,0,0]=3 33010 B14R1.2352 OCCCCCCN1CCCOCC1 269982a_100000685342_100000766143 [0,1,0,1,0,0|1,0,0]=3 33011 B14R1.2352 OCCCCCCN1CCCOCC1 34a_100000685342_100000766143 [0,1,0,1,0,0|1,0,0]=3 33012 B14R1.2352 OCCCCCNC1CCCCCC1 2230a_100000210984_100000746330 [0,1,0,1,0,0|0,0,0]=2 33013 B14R1.2352 OCCCCCNC1CCCCCC1 270004a_100000762737_100000210131 [0,1,0,1,0,0|0,0,0]=2 33014 B14R1.2352 OCCCCCNC1CCCCCC1 34a_100000210984_100000746330 [0,1,0,1,0,0|0,0,0]=2 33015 B14R1.2352 OCCCCCNC1CCCCCC1 34a_100000762737_100011217769 [0,1,0,1,0,0|0,0,0]=2 33016 B14R1.2352 OCCCCCNC1CCCNCC1 270004a_100000762737_100015187895 [0,1,0,1,0,0|1,0,0]=3 33017 B14R1.2352 OCCCCCNC1CSCCSC1 270004a_100000762737_100000068409 [0,1,0,1,0,0|2,0,0]=4 33018 B14R1.2352 OCCCCCOC1CCCCCC1 34a_100000210887_100000746330 [0,1,0,1,0,0|0,0,0]=2 33019 B14R1.2352 OCCCCCOC1CCCCCC1 7a_100000210887_100000746330 [0,1,0,1,0,0|0,0,0]=2 33020 B14R1.2352 OCCCCCSC1CCCCCC1 62a_100000746330_100011217769 [0,1,0,1,0,0|0,0,0]=2 33021 B14R1.2352 OCCCCCSC1CCCCCC1 62a_100011217769_100000746330 [0,1,0,1,0,0|0,0,0]=2 33022 B14R1.2352 OCCCCNCC1CCCCCC1 2230a_100000750430_200000696569 [0,1,0,1,0,0|0,0,0]=2 33023 B14R1.2352 OCCCCNCC1CCCCCC1 2230a_100015204231_100000210776 [0,1,0,1,0,0|0,0,0]=2 33024 B14R1.2352 OCCCCNCC1CCCCCC1 269862a_100000750430_200000763224 [0,1,0,1,0,0|0,0,0]=2 33025 B14R1.2352 OCCCCNCC1CCCCCC1 34a_100000750430_200000696569 [0,1,0,1,0,0|0,0,0]=2 33026 B14R1.2352 OCCCCNCC1CCCCCC1 34a_100015204231_100011216708 [0,1,0,1,0,0|0,0,0]=2 33027 B14R1.2352 OCCCCOCC1CCCCCC1 34a_100000699130_100011216708 [0,1,0,1,0,0|0,0,0]=2 33028 B14R1.2352 OCCCCOCC1CCCCCC1 7a_100000699130_100000210776 [0,1,0,1,0,0|0,0,0]=2 33029 B14R1.2352 OCCCCOCC1CNCCOC1 34a_100103147999_100011216708 [0,1,0,1,0,0|2,0,0]=4 33030 B14R1.2352 OCCCCSCC1CCCCCC1 62a_100000210776_200000696569 [0,1,0,1,0,0|0,0,0]=2 33031 B14R1.2352 OCCCCSCC1CCCCCC1 62a_200000696569_100000210776 [0,1,0,1,0,0|0,0,0]=2 33032 B14R1.2352 OCCCNCCC1CCCCCC1 2230a_100011532351_100000230001 [0,1,0,1,0,0|0,0,0]=2 33033 B14R1.2352 OCCCNCCC1CCCCCC1 34a_100011532351_100000230001 [0,1,0,1,0,0|0,0,0]=2 33034 B14R1.2352 OCCCOCCN1CCCCCC1 34a_100000238007_100000230001 [0,1,0,1,0,0|1,0,0]=3 33035 B14R1.2352 OCCCSCCN1CCCCCC1 62a_100000722644_100011215043 [0,1,0,1,0,0|1,0,0]=3 33036 B14R1.2352 OCCCSCCN1CCCCCC1 62a_100011215043_100000722644 [0,1,0,1,0,0|1,0,0]=3 33037 B14R1.2352 OCCOCCCN1CCCCCC1 34a_100102886287_100000211926 [0,1,0,1,0,0|1,0,0]=3 33038 B14R1.2352 OCCOCCCN1CCCCCC1 7a_100102886287_100000211926 [0,1,0,1,0,0|1,0,0]=3 33039 B14R1.2352 OCCOCCNC1CCCCCC1 2230a_100000210984_100011215305 [0,1,0,1,0,0|1,0,0]=3 33040 B14R1.2352 OCCOCCNC1CCCCCC1 270004a_100000211614_100000210131 [0,1,0,1,0,0|1,0,0]=3 33041 B14R1.2352 OCCOCCNC1CCCCCC1 34a_100000210984_100000692535 [0,1,0,1,0,0|1,0,0]=3 33042 B14R1.2352 OCCOCCNC1CCCCCC1 34a_100000211614_100011217769 [0,1,0,1,0,0|1,0,0]=3 33043 B14R1.2352 OCCOCCNC1CCCNCC1 270004a_100000211614_100015187895 [0,1,0,1,0,0|2,0,0]=4 33044 B14R1.2352 OCCOCCOC1CCCCCC1 34a_100000210887_100000692535 [0,1,0,1,0,0|1,0,0]=3 33045 B14R1.2352 OCCOCCOC1CCCCCC1 7a_100000210887_100011215305 [0,1,0,1,0,0|1,0,0]=3 33046 B14R1.2352 OCCOCCSC1CCCCCC1 62a_100011215305_100011217769 [0,1,0,1,0,0|1,0,0]=3 33047 B14R1.2352 OCCOCCSC1CCCCCC1 62a_100011217769_100011215305 [0,1,0,1,0,0|1,0,0]=3 33048 B14R1.2352 OCCSCCNC1CCCCCC1 270004a_100011219999_100000210131 [0,1,0,1,0,0|1,0,0]=3 33049 B14R1.2352 OCCSCCNC1CCCNCC1 270004a_100011219999_100015187895 [0,1,0,1,0,0|2,0,0]=4 33050 B14R1.3128 CCCCCCCN1CCC1COC 2230a_100015195929_100000210681 [0,1,0,1,0,0|1,0,0]=3 33051 B14R1.3128 CCCCCCCN1CCC1COC 269982a_100015195929_100000210681 [0,1,0,1,0,0|1,0,0]=3 33052 B14R1.3128 CCCCCCCN1CCC1COC 34a_100015195929_100000210614 [0,1,0,1,0,0|1,0,0]=3 33053 B14R1.3128 CCCCOCCN1CCC1COC 2230a_100015195929_100000743108 [0,1,0,1,0,0|2,0,0]=4 33054 B14R1.3128 CCCCOCCN1CCC1COC 269982a_100015195929_100000743108 [0,1,0,1,0,0|2,0,0]=4 33055 B14R1.3128 CCCCOCCN1CCC1COC 34a_100015195929_100000743108 [0,1,0,1,0,0|2,0,0]=4 33056 B14R1.3128 COCC1CCN1CCCCCCF 2230a_100015195929_100015922095 [0,1,0,1,0,0|2,0,0]=4 33057 B14R1.3128 COCC1CCN1CCCCCCF 269982a_100015195929_100015922095 [0,1,0,1,0,0|2,0,0]=4 33058 B14R1.3128 COCC1CCN1CCCCCCF 34a_100015195929_100015922095 [0,1,0,1,0,0|2,0,0]=4 33059 B14R1.3128 COCC1CCN1CCCCCCO 2230a_100015195929_100000766143 [0,1,0,1,0,0|1,0,0]=3 33060 B14R1.3128 COCC1CCN1CCCCCCO 269982a_100015195929_100000766143 [0,1,0,1,0,0|1,0,0]=3 33061 B14R1.3128 COCC1CCN1CCCCCCO 34a_100015195929_100000766143 [0,1,0,1,0,0|1,0,0]=3 33062 B14R1.6533 C#CCCCN1CCCCCCCC1 2230a_100000039187_100000731252 [0,1,0,1,0,0|1,0,1]=4 33063 B14R1.6533 C#CCCCN1CCCCCCCC1 269982a_100000039187_100011215417 [0,1,0,1,0,0|1,0,1]=4 33064 B14R1.6533 C#CCCCN1CCCCCCCC1 34a_100000039187_100000695029 [0,1,0,1,0,0|1,0,1]=4 33065 B14R1.6533 C=CCCCN1CCCCCCCC1 2230a_100000039187_100011713584 [0,1,0,1,0,0|1,0,1]=4 33066 B14R1.6533 C=CCCCN1CCCCCCCC1 269982a_100000039187_100000757094 [0,1,0,1,0,0|1,0,1]=4 33067 B14R1.6533 C=CCCCN1CCCCCCCC1 34a_100000039187_100000757094 [0,1,0,1,0,0|1,0,1]=4 33068 B14R1.6533 C=CCCNC1CCCCCCCC1 270004a_100015191253_100000038600 [0,1,0,1,0,0|1,0,1]=4 33069 B14R1.6533 CCCCCN1CCCCCCCC1 2230a_100000039187_100000210326 [0,1,0,1,0,0|1,0,0]=3 33070 B14R1.6533 CCCCCN1CCCCCCCC1 269982a_100000039187_100000210215 [0,1,0,1,0,0|1,0,0]=3 33071 B14R1.6533 CCCCCN1CCCCCCCC1 34a_100000039187_100000718602 [0,1,0,1,0,0|1,0,0]=3 33072 B14R1.6533 CCCCNC1CCCCCCCC1 270004a_100000102301_100000038600 [0,1,0,1,0,0|1,0,0]=3 33073 B14R1.6533 CCOCCN1CCCCCCCC1 2230a_100000039187_100011215890 [0,1,0,1,0,0|2,0,0]=4 33074 B14R1.6533 CCOCCN1CCCCCCCC1 269982a_100000039187_100011215890 [0,1,0,1,0,0|2,0,0]=4 33075 B14R1.6533 CCOCCN1CCCCCCCC1 34a_100000039187_100000210147 [0,1,0,1,0,0|2,0,0]=4 33076 B14R1.6533 CCSCCN1CCCCCCCC1 2230a_100000039187_100000757381 [0,1,0,1,0,0|2,0,0]=4 33077 B14R1.6533 CCSCCN1CCCCCCCC1 269982a_100000039187_100000757381 [0,1,0,1,0,0|2,0,0]=4 33078 B14R1.6533 CCSCCN1CCCCCCCC1 34a_100000039187_100000757381 [0,1,0,1,0,0|2,0,0]=4 33079 B14R1.6533 COCCCN1CCCCCCCC1 2230a_100000039187_100000740836 [0,1,0,1,0,0|1,0,0]=3 33080 B14R1.6533 COCCCN1CCCCCCCC1 269982a_100000039187_100000740836 [0,1,0,1,0,0|1,0,0]=3 33081 B14R1.6533 COCCCN1CCCCCCCC1 34a_100000039187_100000740836 [0,1,0,1,0,0|1,0,0]=3 33082 B14R1.6533 COCCNC1CCCCCCCC1 270004a_100000209980_100000038600 [0,1,0,1,0,0|1,0,0]=3 33083 B14R1.6533 CSCCNC1CCCCCCCC1 270004a_100020590264_100000038600 [0,1,0,1,0,0|1,1,0]=4 33084 B14R1.6533 FCCCCN1CCCCCCCC1 2230a_100000039187_100000729493 [0,1,0,1,0,0|1,0,0]=3 33085 B14R1.6533 FCCCCN1CCCCCCCC1 269982a_100000039187_100000729493 [0,1,0,1,0,0|1,0,0]=3 33086 B14R1.6533 FCCCCN1CCCCCCCC1 34a_100000039187_100000729493 [0,1,0,1,0,0|1,0,0]=3 33087 B14R1.6533 FCCCNC1CCCCCCCC1 270004a_100015189416_100000038600 [0,1,0,1,0,0|1,0,0]=3 33088 B14R1.6533 N#CCCCN1CCCCCCCC1 2230a_100000039187_100000687738 [0,1,0,1,0,0|1,0,1]=4 33089 B14R1.6533 N#CCCCN1CCCCCCCC1 269982a_100000039187_100000687738 [0,1,0,1,0,0|1,0,1]=4 33090 B14R1.6533 N#CCCNC1CCCCCCCC1 270004a_100000720768_100000038600 [0,1,0,1,0,0|1,0,1]=4 33091 B14R1.6533 O=CCCCN1CCCCCCCC1 2230a_100000039187_200011292268 [0,1,0,1,0,0|0,0,2]=4 33092 B14R1.6533 O=CCCCN1CCCCCCCC1 269982a_100000039187_200011292268 [0,1,0,1,0,0|0,0,2]=4 33093 B14R1.6533 OCC#CCN1CCCCCCCC1 2230a_100000039187_200000047223 [0,1,0,1,0,0|0,0,2]=4 33094 B14R1.6533 OCC#CCN1CCCCCCCC1 34a_100000039187_200000047223 [0,1,0,1,0,0|0,0,2]=4 33095 B14R1.6533 OCCCCN1CCCCCCCC1 2230a_100000039187_100000210776 [0,1,0,1,0,0|0,0,0]=2 33096 B14R1.6533 OCCCCN1CCCCCCCC1 269982a_100000039187_100000210776 [0,1,0,1,0,0|0,0,0]=2 33097 B14R1.6533 OCCCCN1CCCCCCCC1 34a_100000039187_100011216708 [0,1,0,1,0,0|0,0,0]=2 33098 B14R1.6533 OCCCNC1CCCCCCCC1 270004a_100000182051_100000038600 [0,1,0,1,0,0|0,0,0]=2 33099 B14R1.6533 OCCNN=C1CCCCCCCC1 4a_100000210001_100000038600 [0,1,0,1,0,0|1,0,1]=4 33100 B14R1.86 CCCCCC(=O)CCC1CCCC1 1458a_100000211120_100000210326 [0,1,0,1,0,0|1,0,1]=4 33101 B14R1.86 CCCCCC(=O)CCC1CCCC1 1458a_100000212188_100000760354 [0,1,0,1,0,0|1,0,1]=4 33102 B14R1.86 CCCCCC(=O)CCC1CCCO1 1458a_100011247709_100000210326 [0,1,0,1,0,0|0,0,1]=3 33103 B14R1.86 CCCCCC(=O)CCC1OCCO1 1458a_100000082924_100000210326 [0,1,0,1,0,0|1,0,1]=4 33104 B14R1.86 CCCCCC(=O)CCC1OCCO1 1458a_100000212188_100000740749 [0,1,0,1,0,0|1,0,1]=4 33105 B14R1.86 CCCCCC(=O)CCN1CCCO1 1458a_200015187630_100000210326 [0,1,0,1,0,0|1,0,1]=4 33106 B14R1.86 CCCCCC(=O)COC1CCCO1 34a_100000085407_200012276598 [0,1,0,1,0,0|1,0,1]=4 33107 B14R1.86 CCCCCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000212188 [0,1,0,1,0,0|1,0,1]=4 33108 B14R1.86 CCCCCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000212188 [0,1,0,1,0,0|1,0,1]=4 33109 B14R1.86 CCCCCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000212188 [0,1,0,1,0,0|1,0,1]=4 33110 B14R1.86 CCCCCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000212188 [0,1,0,1,0,0|1,0,1]=4 33111 B14R1.86 CCCCCC(C)NCC1CCCC1 2230a_100000211957_100000740388 [0,1,0,1,0,0|2,0,0]=4 33112 B14R1.86 CCCCCC(C)NCC1CCCC1 2230a_100000737975_200011218191 [0,1,0,1,0,0|2,0,0]=4 33113 B14R1.86 CCCCCC(C)NCC1CCCC1 269862a_100000211957_100000746403 [0,1,0,1,0,0|2,0,0]=4 33114 B14R1.86 CCCCCC(C)NCC1CCCC1 270004a_100000737975_100000211708 [0,1,0,1,0,0|2,0,0]=4 33115 B14R1.86 CCCCCC(C)NCC1CCCC1 34a_100000737975_200011218191 [0,1,0,1,0,0|2,0,0]=4 33116 B14R1.86 CCCCCC(C)NCC1CCCO1 2230a_100000211957_100000203698 [0,1,0,1,0,0|1,0,0]=3 33117 B14R1.86 CCCCCC(C)NCC1OCCO1 2230a_100000036311_200011218191 [0,1,0,1,0,0|2,0,0]=4 33118 B14R1.86 CCCCCC(C)NCC1OCCO1 2230a_100000211957_100000755774 [0,1,0,1,0,0|2,0,0]=4 33119 B14R1.86 CCCCCC(C)NCC1OCCO1 270004a_100000036311_100000211708 [0,1,0,1,0,0|2,0,0]=4 33120 B14R1.86 CCCCCC(C)NCC1OCCO1 34a_100000036311_200011218191 [0,1,0,1,0,0|2,0,0]=4 33121 B14R1.86 CCCCCC(C)NC[C@@H]1CCCO1 2230a_100020590478_200011218191 [0,1,0,1,0,0|1,0,0]=3 33122 B14R1.86 CCCCCC(C)NC[C@@H]1CCCO1 270004a_100020590478_100000211708 [0,1,0,1,0,0|1,0,0]=3 33123 B14R1.86 CCCCCC(C)NC[C@@H]1CCCO1 34a_100020590478_200011218191 [0,1,0,1,0,0|1,0,0]=3 33124 B14R1.86 CCCCCC(C)OCC1CCCC1 34a_100000742336_200011218191 [0,1,0,1,0,0|2,0,0]=4 33125 B14R1.86 CCCCCC(C)OCC1CCCC1 34a_100011215632_100000740388 [0,1,0,1,0,0|2,0,0]=4 33126 B14R1.86 CCCCCC(C)OCC1CCCC1 7a_100000742336_200011218191 [0,1,0,1,0,0|2,0,0]=4 33127 B14R1.86 CCCCCC(C)OCC1CCCC1 7a_100011215632_100000740388 [0,1,0,1,0,0|2,0,0]=4 33128 B14R1.86 CCCCCC(C)OCC1CCCO1 34a_100000210270_200011218191 [0,1,0,1,0,0|1,0,0]=3 33129 B14R1.86 CCCCCC(C)OCC1CCCO1 7a_100000210270_200011218191 [0,1,0,1,0,0|1,0,0]=3 33130 B14R1.86 CCCCCC(C)OCC1CCCO1 7a_100011215632_100000203698 [0,1,0,1,0,0|1,0,0]=3 33131 B14R1.86 CCCCCC(C)OCC1COCO1 34a_100011216627_200011218191 [0,1,0,1,0,0|2,0,0]=4 33132 B14R1.86 CCCCCC(C)OCC1OCCO1 34a_100000087154_200011218191 [0,1,0,1,0,0|2,0,0]=4 33133 B14R1.86 CCCCCC(C)OCC1OCCO1 34a_100011215632_100000755774 [0,1,0,1,0,0|2,0,0]=4 33134 B14R1.86 CCCCCC(C)OCC1OCCO1 7a_100011215632_100000755774 [0,1,0,1,0,0|2,0,0]=4 33135 B14R1.86 CCCCCC(C)OC[C@H]1CCCN1 34a_100000745186_200011218191 [0,1,0,1,0,0|2,0,0]=4 33136 B14R1.86 CCCCCC(C)SCC1CCCC1 62a_100000740388_200011218191 [0,1,0,1,0,0|2,0,0]=4 33137 B14R1.86 CCCCCC(C)SCC1CCCC1 62a_200011218191_100000740388 [0,1,0,1,0,0|2,0,0]=4 33138 B14R1.86 CCCCCC(C)SCC1CCCO1 62a_100000203698_200011218191 [0,1,0,1,0,0|1,0,0]=3 33139 B14R1.86 CCCCCC(C)SCC1CCCO1 62a_200011218191_100000203698 [0,1,0,1,0,0|1,0,0]=3 33140 B14R1.86 CCCCCC(C)SCC1OCCO1 62a_100000755774_200011218191 [0,1,0,1,0,0|2,0,0]=4 33141 B14R1.86 CCCCCC(C)SCC1OCCO1 62a_200011218191_100000755774 [0,1,0,1,0,0|2,0,0]=4 33142 B14R1.86 CCCCCN(C)CCC1CCCC1 2230a_100000223495_100000760354 [0,1,0,1,0,0|2,0,0]=4 33143 B14R1.86 CCCCCN(C)CCC1CCCC1 269982a_100000223495_100000760354 [0,1,0,1,0,0|2,0,0]=4 33144 B14R1.86 CCCCCN(C)CCC1OCCO1 2230a_100000223495_100000740749 [0,1,0,1,0,0|2,0,0]=4 33145 B14R1.86 CCCCCN(C)CCC1OCCO1 269982a_100000223495_100000740749 [0,1,0,1,0,0|2,0,0]=4 33146 B14R1.86 CCCCNC(=O)CCC1CCCO1 11a_100000102301_100011247709 [0,1,0,1,0,0|1,0,1]=4 33147 B14R1.86 CCCCNC(=O)CCC1CCCO1 1626a_100000102301_100011247709 [0,1,0,1,0,0|1,0,1]=4 33148 B14R1.86 CCCCNC(=O)CCC1CCCO1 240690a_100000102301_100011247709 [0,1,0,1,0,0|1,0,1]=4 33149 B14R1.86 CCCCNC(=O)CCC1CCCO1 527a_100000102301_100011247709 [0,1,0,1,0,0|1,0,1]=4 33150 B14R1.86 CCCSCC(C)NC[C@@H]1CCCO1 270004a_100020590478_100011343953 [0,1,0,1,0,0|2,0,0]=4 33151 B14R1.86 CCOCCC(=O)CCC1CCCO1 1458a_100011247709_100011215890 [0,1,0,1,0,0|1,0,1]=4 33152 B14R1.86 CCOCCC(C)NC[C@@H]1CCCO1 270004a_100020590478_200011216536 [0,1,0,1,0,0|2,0,0]=4 33153 B14R1.86 CCSCCC(=O)CCC1CCCO1 1458a_100011247709_100000757381 [0,1,0,1,0,0|1,0,1]=4 33154 B14R1.86 CN(CCCCO)CCC1CCCC1 2230a_100000717598_100000760354 [0,1,0,1,0,0|1,0,0]=3 33155 B14R1.86 CN(CCCCO)CCC1CCCC1 269982a_100000717598_100000760354 [0,1,0,1,0,0|1,0,0]=3 33156 B14R1.86 CN(CCCCO)CCN1CCCC1 2230a_100000225677_100000210776 [0,1,0,1,0,0|2,0,0]=4 33157 B14R1.86 CN(CCCCO)CCN1CCCC1 269982a_100000225677_100000210776 [0,1,0,1,0,0|2,0,0]=4 33158 B14R1.86 CN(CCCCO)CCN1CCCC1 269982a_100000717598_100000004467 [0,1,0,1,0,0|2,0,0]=4 33159 B14R1.86 COCCCC(=O)CCC1CCCO1 1458a_100011247709_100000740836 [0,1,0,1,0,0|1,0,1]=4 33160 B14R1.86 COCCCC(C)OCC1CCCO1 7a_200011539412_100000203698 [0,1,0,1,0,0|2,0,0]=4 33161 B14R1.86 CSCCCC(C)NC[C@@H]1CCCO1 270004a_100020590478_100011399439 [0,1,0,1,0,0|2,0,0]=4 33162 B14R1.86 NCCCC[C@H](N)COC1CCCC1 34a_100016993712_100000179811 [0,1,0,1,0,0|2,0,0]=4 33163 B14R1.86 O=C(CCC1CCCC1)COCCO 1458a_100000708028_100000760354 [0,1,0,1,0,0|1,0,1]=4 33164 B14R1.86 O=C(CCC1CCCC1)NCCCO 240690a_100000182051_100000211120 [0,1,0,1,0,0|1,0,1]=4 33165 B14R1.86 O=C(CCC1CCCC1)NCCCO 527a_100000182051_100000211120 [0,1,0,1,0,0|1,0,1]=4 33166 B14R1.86 O=C(CCCCF)CCC1CCCC1 1458a_100000211120_100000729493 [0,1,0,1,0,0|1,0,1]=4 33167 B14R1.86 O=C(CCCCF)CCC1CCCO1 1458a_100011247709_100000729493 [0,1,0,1,0,0|1,0,1]=4 33168 B14R1.86 O=C(CCCCO)CCC1CCCC1 1458a_100000211120_100000210776 [0,1,0,1,0,0|0,0,1]=3 33169 B14R1.86 O=C(CCCCO)CCC1CCCC1 1458a_100000695505_100000760354 [0,1,0,1,0,0|0,0,1]=3 33170 B14R1.86 O=C(CCCCO)CCC1CCCO1 1458a_100011247709_100000210776 [0,1,0,1,0,0|1,0,1]=4 33171 B14R1.86 O=C(CCCCO)CCN1CCCC1 1458a_100000695505_100000004467 [0,1,0,1,0,0|1,0,1]=4 33172 B14R1.86 O=C(CCCCO)CCN1CCCC1 1458a_100000738983_100000210776 [0,1,0,1,0,0|1,0,1]=4 33173 B14R1.86 O=C(CCCCO)COC1CCCC1 1458a_100000741352_100000210776 [0,1,0,1,0,0|1,0,1]=4 33174 B14R1.86 O=C(CCCCO)NCC1CCCC1 1626a_100000737975_100000695505 [0,1,0,1,0,0|1,0,1]=4 33175 B14R1.158 CC(CC1CCCCC1)NCCCF 270004a_100015189416_100011215996 [0,1,0,1,0,0|2,0,0]=4 33176 B14R1.158 CC(CC1CCCCC1)NCCCO 270004a_100000182051_100011215996 [0,1,0,1,0,0|1,0,0]=3 33177 B14R1.158 CC(CN1CCCCC1)NCCCO 2230a_100000738326_100000230001 [0,1,0,1,0,0|2,0,0]=4 33178 B14R1.158 CC(CN1CCCCC1)SCCCO 62a_100009831500_100011215043 [0,1,0,1,0,0|2,0,0]=4 33179 B14R1.158 CC(CN1CCCCC1)SCCCO 62a_100011215043_100009831500 [0,1,0,1,0,0|2,0,0]=4 33180 B14R1.158 CC(COCCO)CN1CCCCC1 34a_200011934647_100000211926 [0,1,0,1,0,0|2,0,0]=4 33181 B14R1.158 CCCCCC(=O)CC1CCCCC1 1458a_100000211666_100000210326 [0,1,0,1,0,0|1,0,1]=4 33182 B14R1.158 CCCCCC(=O)CC1CCCCC1 1458a_100000212188_100000211423 [0,1,0,1,0,0|1,0,1]=4 33183 B14R1.158 CCCCCC(=O)CC1CCCCO1 1458a_100000212188_100000211543 [0,1,0,1,0,0|0,0,1]=3 33184 B14R1.158 CCCCCC(=O)CC1CCCCO1 1458a_100000238585_100000210326 [0,1,0,1,0,0|0,0,1]=3 33185 B14R1.158 CCCCCC(C)NC1CCCCC1 2230a_100000182618_200011218191 [0,1,0,1,0,0|2,0,0]=4 33186 B14R1.158 CCCCCC(C)NC1CCCCC1 270004a_100000182618_100000211708 [0,1,0,1,0,0|2,0,0]=4 33187 B14R1.158 CCCCCC(C)NC1CCCCC1 270004a_100000211957_100000210434 [0,1,0,1,0,0|2,0,0]=4 33188 B14R1.158 CCCCCC(C)NC1CCCCC1 34a_100000182618_200011218191 [0,1,0,1,0,0|2,0,0]=4 33189 B14R1.158 CCCCCC(C)OC1CCCCC1 34a_100000210231_200011218191 [0,1,0,1,0,0|2,0,0]=4 33190 B14R1.158 CCCCCC(C)OC1CCCCC1 34a_100011215632_100000210327 [0,1,0,1,0,0|2,0,0]=4 33191 B14R1.158 CCCCCC(C)OC1CCCCC1 7a_100000210231_200011218191 [0,1,0,1,0,0|2,0,0]=4 33192 B14R1.158 CCCCCC(C)OC1CCCCC1 7a_100011215632_100000210327 [0,1,0,1,0,0|2,0,0]=4 33193 B14R1.158 CCCCCC(C)OC1CCCCO1 34a_100000033831_200011218191 [0,1,0,1,0,0|1,0,0]=3 33194 B14R1.158 CCCCCC(C)SC1CCCCC1 62a_100000210327_200011218191 [0,1,0,1,0,0|2,0,0]=4 33195 B14R1.158 CCCCCC(C)SC1CCCCC1 62a_200011218191_100000210327 [0,1,0,1,0,0|2,0,0]=4 33196 B14R1.158 CCCCCN(C)CC1CCCCC1 2230a_100000223495_100000211423 [0,1,0,1,0,0|2,0,0]=4 33197 B14R1.158 CCCCCN(C)CC1CCCCC1 2230a_100000736448_100000210326 [0,1,0,1,0,0|2,0,0]=4 33198 B14R1.158 CCCCCN(C)CC1CCCCC1 269982a_100000223495_100000211423 [0,1,0,1,0,0|2,0,0]=4 33199 B14R1.158 CCCCCN(C)CC1CCCCC1 269982a_100000736448_100000210215 [0,1,0,1,0,0|2,0,0]=4 33200 B14R1.158 CCCCCN(C)CC1CCCCC1 34a_100000736448_100000718602 [0,1,0,1,0,0|2,0,0]=4 33201 B14R1.158 CCCCCN(C)CC1CCCCO1 2230a_100000223495_100000211543 [0,1,0,1,0,0|1,0,0]=3 33202 B14R1.158 CCCCCN(C)CC1CCCCO1 2230a_100000225654_100000210326 [0,1,0,1,0,0|1,0,0]=3 33203 B14R1.158 CCCCCN(C)CC1CCCCO1 269982a_100000223495_100000211543 [0,1,0,1,0,0|1,0,0]=3 33204 B14R1.158 CCCCCN(C)CC1CCCCO1 269982a_100000225654_100000210215 [0,1,0,1,0,0|1,0,0]=3 33205 B14R1.158 CCCCCN(C)CC1CCCCO1 34a_100000225654_100000718602 [0,1,0,1,0,0|1,0,0]=3 33206 B14R1.158 CCCCCN(C)CC1COCCO1 2230a_100011398995_100000210326 [0,1,0,1,0,0|2,0,0]=4 33207 B14R1.158 CCCCCN(C)CC1COCCO1 269982a_100011398995_100000210215 [0,1,0,1,0,0|2,0,0]=4 33208 B14R1.158 CCCCCN(C)CC1COCCO1 34a_100011398995_100000718602 [0,1,0,1,0,0|2,0,0]=4 33209 B14R1.158 CCCCNC(=O)CC1CCCCO1 11a_100000102301_100000238585 [0,1,0,1,0,0|1,0,1]=4 33210 B14R1.158 CCCCNC(=O)CC1CCCCO1 1626a_100000102301_100000238585 [0,1,0,1,0,0|1,0,1]=4 33211 B14R1.158 CCCCNC(=O)CC1CCCCO1 240690a_100000102301_100000238585 [0,1,0,1,0,0|1,0,1]=4 33212 B14R1.158 CCCCNC(=O)CC1CCCCO1 527a_100000102301_100000238585 [0,1,0,1,0,0|1,0,1]=4 33213 B14R1.158 CCCCNC(C)CC1CCCCC1 270004a_100000102301_100011215996 [0,1,0,1,0,0|2,0,0]=4 33214 B14R1.158 CCCOCC(=O)CC1CCCCO1 1458a_100000745993_100000211543 [0,1,0,1,0,0|1,0,1]=4 33215 B14R1.158 CCCOC[C@@H](N)CC1CCCCC1 34a_100015184289_100000210303 [0,1,0,1,0,0|2,0,0]=4 33216 B14R1.158 CCCSCC(=O)CC1CCCCO1 1458a_100000217233_100000211543 [0,1,0,1,0,0|1,0,1]=4 33217 B14R1.158 CCOCCC(=O)CC1CCCCO1 1458a_100000238585_100011215890 [0,1,0,1,0,0|1,0,1]=4 33218 B14R1.158 CCOCCC(=O)CC1CCCCO1 1458a_100000749530_100000211543 [0,1,0,1,0,0|1,0,1]=4 33219 B14R1.158 CCOCCN(C)CC1CCCCO1 2230a_100000225654_100011215890 [0,1,0,1,0,0|2,0,0]=4 33220 B14R1.158 CCOCCN(C)CC1CCCCO1 269982a_100000225654_100011215890 [0,1,0,1,0,0|2,0,0]=4 33221 B14R1.158 CCOCCN(C)CC1CCCCO1 34a_100000225654_100000210147 [0,1,0,1,0,0|2,0,0]=4 33222 B14R1.158 CCSCCC(=O)CC1CCCCO1 1458a_100000230768_100000211543 [0,1,0,1,0,0|1,0,1]=4 33223 B14R1.158 CCSCCC(=O)CC1CCCCO1 1458a_100000238585_100000757381 [0,1,0,1,0,0|1,0,1]=4 33224 B14R1.158 CCSCCN(C)CC1CCCCO1 2230a_100000225654_100000757381 [0,1,0,1,0,0|2,0,0]=4 33225 B14R1.158 CCSCCN(C)CC1CCCCO1 269982a_100000225654_100000757381 [0,1,0,1,0,0|2,0,0]=4 33226 B14R1.158 CCSCCN(C)CC1CCCCO1 34a_100000225654_100000757381 [0,1,0,1,0,0|2,0,0]=4 33227 B14R1.158 CN(CCCCF)CC1CCCCC1 2230a_100000736448_100000729493 [0,1,0,1,0,0|2,0,0]=4 33228 B14R1.158 CN(CCCCF)CC1CCCCC1 269982a_100000736448_100000729493 [0,1,0,1,0,0|2,0,0]=4 33229 B14R1.158 CN(CCCCF)CC1CCCCC1 34a_100000736448_100000729493 [0,1,0,1,0,0|2,0,0]=4 33230 B14R1.158 CN(CCCCF)CC1CCCCO1 2230a_100000225654_100000729493 [0,1,0,1,0,0|2,0,0]=4 33231 B14R1.158 CN(CCCCF)CC1CCCCO1 269982a_100000225654_100000729493 [0,1,0,1,0,0|2,0,0]=4 33232 B14R1.158 CN(CCCCF)CC1CCCCO1 34a_100000225654_100000729493 [0,1,0,1,0,0|2,0,0]=4 33233 B14R1.158 CN(CCCCO)CC1CCCCC1 2230a_100000717598_100000211423 [0,1,0,1,0,0|1,0,0]=3 33234 B14R1.158 CN(CCCCO)CC1CCCCC1 2230a_100000736448_100000210776 [0,1,0,1,0,0|1,0,0]=3 33235 B14R1.158 CN(CCCCO)CC1CCCCC1 269982a_100000717598_100000211423 [0,1,0,1,0,0|1,0,0]=3 33236 B14R1.158 CN(CCCCO)CC1CCCCC1 269982a_100000736448_100000210776 [0,1,0,1,0,0|1,0,0]=3 33237 B14R1.158 CN(CCCCO)CC1CCCCC1 34a_100000736448_100011216708 [0,1,0,1,0,0|1,0,0]=3 33238 B14R1.158 CN(CCCCO)CC1CCCCO1 2230a_100000225654_100000210776 [0,1,0,1,0,0|2,0,0]=4 33239 B14R1.158 CN(CCCCO)CC1CCCCO1 2230a_100000717598_100000211543 [0,1,0,1,0,0|2,0,0]=4 33240 B14R1.158 CN(CCCCO)CC1CCCCO1 269982a_100000225654_100000210776 [0,1,0,1,0,0|2,0,0]=4 33241 B14R1.158 CN(CCCCO)CC1CCCCO1 269982a_100000717598_100000211543 [0,1,0,1,0,0|2,0,0]=4 33242 B14R1.158 CN(CCCCO)CC1CCCCO1 34a_100000225654_100011216708 [0,1,0,1,0,0|2,0,0]=4 33243 B14R1.158 CN(CCCCO)CC1CCCOC1 2230a_100000717598_100000741521 [0,1,0,1,0,0|2,0,0]=4 33244 B14R1.158 CN(CCCCO)CC1CCCOC1 269982a_100000717598_100000741521 [0,1,0,1,0,0|2,0,0]=4 33245 B14R1.158 CN(CCCCO)CC1CCOCC1 2230a_100000717598_100000754603 [0,1,0,1,0,0|2,0,0]=4 33246 B14R1.158 CN(CCCCO)CC1CCOCC1 2230a_100025706683_100000210776 [0,1,0,1,0,0|2,0,0]=4 33247 B14R1.158 CN(CCCCO)CC1CCOCC1 269982a_100000717598_100000754603 [0,1,0,1,0,0|2,0,0]=4 33248 B14R1.158 CN(CCCCO)CC1CCOCC1 269982a_100025706683_100000210776 [0,1,0,1,0,0|2,0,0]=4 33249 B14R1.158 CN(CCCCO)CC1CCOCC1 34a_100025706683_100011216708 [0,1,0,1,0,0|2,0,0]=4 33250 B14R1.158 CN(CCCCO)CC1CCSCC1 2230a_100011935259_100000210776 [0,1,0,1,0,0|2,0,0]=4 33251 B14R1.158 CN(CCCCO)CC1CCSCC1 269982a_100011935259_100000210776 [0,1,0,1,0,0|2,0,0]=4 33252 B14R1.158 CN(CCCCO)CC1CCSCC1 270004a_100000717598_100000067145 [0,1,0,1,0,0|2,0,0]=4 33253 B14R1.158 CN(CCCCO)CC1CCSCC1 34a_100011935259_100011216708 [0,1,0,1,0,0|2,0,0]=4 33254 B14R1.158 COCCCC(=O)CC1CCCCO1 1458a_100000238585_100000740836 [0,1,0,1,0,0|1,0,1]=4 33255 B14R1.158 COCCCC(=O)CC1CCCCO1 1458a_100000741012_100000211543 [0,1,0,1,0,0|1,0,1]=4 33256 B14R1.158 COCCCN(C)CC1CCCCO1 2230a_100000224831_100000211543 [0,1,0,1,0,0|2,0,0]=4 33257 B14R1.158 COCCCN(C)CC1CCCCO1 2230a_100000225654_100000740836 [0,1,0,1,0,0|2,0,0]=4 33258 B14R1.158 COCCCN(C)CC1CCCCO1 269982a_100000224831_100000211543 [0,1,0,1,0,0|2,0,0]=4 33259 B14R1.158 COCCCN(C)CC1CCCCO1 269982a_100000225654_100000740836 [0,1,0,1,0,0|2,0,0]=4 33260 B14R1.158 COCCCN(C)CC1CCCCO1 34a_100000225654_100000740836 [0,1,0,1,0,0|2,0,0]=4 33261 B14R1.158 CSCCCC(=O)CC1CCCCO1 1458a_100000173376_100000211543 [0,1,0,1,0,0|1,0,1]=4 33262 B14R1.158 N[C@H](COCCF)CC1CCCCC1 34a_100015184289_100011217306 [0,1,0,1,0,0|2,0,0]=4 33263 B14R1.158 N[C@H](COCCO)CC1CCCCC1 34a_100015184289_100000211926 [0,1,0,1,0,0|1,0,0]=3 33264 B14R1.158 O=C(CC1CCCCC1)NCCCO 240690a_100000182051_100000211666 [0,1,0,1,0,0|1,0,1]=4 33265 B14R1.158 O=C(CC1CCCCC1)NCCCO 527a_100000182051_100000211666 [0,1,0,1,0,0|1,0,1]=4 33266 B14R1.158 O=C(CCCCF)CC1CCCCC1 1458a_100000211666_100000729493 [0,1,0,1,0,0|1,0,1]=4 33267 B14R1.158 O=C(CCCCF)CC1CCCCO1 1458a_100000238585_100000729493 [0,1,0,1,0,0|1,0,1]=4 33268 B14R1.158 O=C(CCCCO)CC1CCCCC1 1458a_100000211666_100000210776 [0,1,0,1,0,0|0,0,1]=3 33269 B14R1.158 O=C(CCCCO)CC1CCCCC1 1458a_100000695505_100000211423 [0,1,0,1,0,0|0,0,1]=3 33270 B14R1.158 O=C(CCCCO)CC1CCCCO1 1458a_100000238585_100000210776 [0,1,0,1,0,0|1,0,1]=4 33271 B14R1.158 O=C(CCCCO)CC1CCCCO1 1458a_100000695505_100000211543 [0,1,0,1,0,0|1,0,1]=4 33272 B14R1.158 O=C(CCCCO)CC1CCCOC1 1458a_100000695505_100000741521 [0,1,0,1,0,0|1,0,1]=4 33273 B14R1.158 O=C(CCCCO)CC1CCCOC1 1458a_100000741523_100000210776 [0,1,0,1,0,0|1,0,1]=4 33274 B14R1.158 O=C(CCCCO)CC1CCOCC1 1458a_100000695505_100000754603 [0,1,0,1,0,0|1,0,1]=4 33275 B14R1.158 O=C(CCCCO)CC1CCOCC1 1458a_100000757261_100000210776 [0,1,0,1,0,0|1,0,1]=4 33276 B14R1.158 O=C(CCCCO)CN1CCCCC1 1458a_100000740322_100000210776 [0,1,0,1,0,0|1,0,1]=4 33277 B14R1.158 O=C(CCCCO)NC1CCCCC1 1626a_100000182618_100000695505 [0,1,0,1,0,0|1,0,1]=4 33278 B14R1.158 O=C(COCCO)CC1CCCCC1 1458a_100000708028_100000211423 [0,1,0,1,0,0|1,0,1]=4 33279 B14R1.158 OCCNC[C@H](O)CN1CCCCC1 2230a_100015205997_100000211926 [0,1,0,1,0,0|2,0,0]=4 33280 B14R1.169 CC(CCOCCCO)N1CCCC1 34a_100011935070_100000230001 [0,1,0,1,0,0|2,0,0]=4 33281 B14R1.169 CC(CCOCCCO)N1CCCC1 7a_100011935070_100011215043 [0,1,0,1,0,0|2,0,0]=4 33282 B14R1.169 CC(CSCCCCO)N1CCCC1 62a_100000210776_200015187269 [0,1,0,1,0,0|2,0,0]=4 33283 B14R1.169 CC(CSCCCCO)N1CCCC1 62a_200015187269_100000210776 [0,1,0,1,0,0|2,0,0]=4 33284 B14R1.169 CC(NCCCCCF)C1CCCC1 2230a_100015185923_100000729378 [0,1,0,1,0,0|2,0,0]=4 33285 B14R1.169 CC(NCCCCCF)C1CCCC1 34a_100015185923_100000729378 [0,1,0,1,0,0|2,0,0]=4 33286 B14R1.169 CC(NCCCCCF)C1CCCO1 2230a_100025754208_100000729378 [0,1,0,1,0,0|2,0,0]=4 33287 B14R1.169 CC(NCCCCCF)C1CCCO1 34a_100025754208_100000729378 [0,1,0,1,0,0|2,0,0]=4 33288 B14R1.169 CC(NCCCCCO)C1CCCC1 2230a_100015185923_100000746330 [0,1,0,1,0,0|1,0,0]=3 33289 B14R1.169 CC(NCCCCCO)C1CCCC1 269862a_100000762737_100000749594 [0,1,0,1,0,0|1,0,0]=3 33290 B14R1.169 CC(NCCCCCO)C1CCCC1 270004a_100000762737_100000749594 [0,1,0,1,0,0|1,0,0]=3 33291 B14R1.169 CC(NCCCCCO)C1CCCC1 34a_100015185923_100000746330 [0,1,0,1,0,0|1,0,0]=3 33292 B14R1.169 CC(NCCCCCO)C1CCCO1 2230a_100025754208_100000746330 [0,1,0,1,0,0|2,0,0]=4 33293 B14R1.169 CC(NCCCCCO)C1CCCO1 34a_100025754208_100000746330 [0,1,0,1,0,0|2,0,0]=4 33294 B14R1.169 CC(NCCOCCO)C1CCCC1 2230a_100015185923_100011215305 [0,1,0,1,0,0|2,0,0]=4 33295 B14R1.169 CC(NCCOCCO)C1CCCC1 269862a_100000211614_100000749594 [0,1,0,1,0,0|2,0,0]=4 33296 B14R1.169 CC(NCCOCCO)C1CCCC1 270004a_100000211614_100000749594 [0,1,0,1,0,0|2,0,0]=4 33297 B14R1.169 CC(NCCOCCO)C1CCCC1 34a_100015185923_100000692535 [0,1,0,1,0,0|2,0,0]=4 33298 B14R1.169 CC(NCCSCCO)C1CCCC1 269862a_100011219999_100000749594 [0,1,0,1,0,0|2,0,0]=4 33299 B14R1.169 CC(NCCSCCO)C1CCCC1 270004a_100011219999_100000749594 [0,1,0,1,0,0|2,0,0]=4 33300 B14R1.169 CC(OCCCCCF)C1CCCC1 34a_100011216366_100000729378 [0,1,0,1,0,0|2,0,0]=4 33301 B14R1.169 CC(OCCCCCF)C1CCCC1 7a_100011216366_100000729378 [0,1,0,1,0,0|2,0,0]=4 33302 B14R1.169 CC(OCCCCCO)C1CCCC1 34a_100011216366_100000746330 [0,1,0,1,0,0|1,0,0]=3 33303 B14R1.169 CC(OCCCCCO)C1CCCC1 7a_100011216366_100000746330 [0,1,0,1,0,0|1,0,0]=3 33304 B14R1.169 CC(OCCOCCO)C1CCCC1 34a_100011216366_100000692535 [0,1,0,1,0,0|2,0,0]=4 33305 B14R1.169 CC(OCCOCCO)C1CCCC1 7a_100011216366_100011215305 [0,1,0,1,0,0|2,0,0]=4 33306 B14R1.169 CCCCCCCC(=O)C1CCCC1 1458a_100000210718_100000210614 [0,1,0,1,0,0|1,0,1]=4 33307 B14R1.169 CCCCCCCC(=O)C1CCCC1 1458a_100000211969_100000179811 [0,1,0,1,0,0|1,0,1]=4 33308 B14R1.169 CCCCCCCC(=O)C1CCCS1 1458a_100012002731_100000210614 [0,1,0,1,0,0|0,1,1]=4 33309 B14R1.169 CCCCCCCC(=O)[C@@H]1CCCO1 1458a_100000686382_100000210614 [0,1,0,1,0,0|0,0,1]=3 33310 B14R1.169 CCCCCCCC(C)N1CCCC1 2230a_100000188435_200011218727 [0,1,0,1,0,0|2,0,0]=4 33311 B14R1.169 CCCCCCCC(C)N1CCCC1 269982a_100000188435_200011218727 [0,1,0,1,0,0|2,0,0]=4 33312 B14R1.169 CCCCCCCC(C)N1CCCC1 270004a_100000188435_100000210596 [0,1,0,1,0,0|2,0,0]=4 33313 B14R1.169 CCCCCCCN(C)C1CCCC1 2230a_100000207505_100000210681 [0,1,0,1,0,0|2,0,0]=4 33314 B14R1.169 CCCCCCCN(C)C1CCCC1 2230a_100000228206_100000179811 [0,1,0,1,0,0|2,0,0]=4 33315 B14R1.169 CCCCCCCN(C)C1CCCC1 269982a_100000207505_100000210681 [0,1,0,1,0,0|2,0,0]=4 33316 B14R1.169 CCCCCCCN(C)C1CCCC1 269982a_100000228206_100000179811 [0,1,0,1,0,0|2,0,0]=4 33317 B14R1.169 CCCCCCCN(C)C1CCCC1 270004a_100000228206_100000210133 [0,1,0,1,0,0|2,0,0]=4 33318 B14R1.169 CCCCCCCN(C)C1CCCC1 34a_100000207505_100000210614 [0,1,0,1,0,0|2,0,0]=4 33319 B14R1.169 CCCCCCNC(=O)[C@@H]1CCCO1 11a_100000210581_100000686382 [0,1,0,1,0,0|1,0,1]=4 33320 B14R1.169 CCCCCCNC(=O)[C@@H]1CCCO1 1626a_100000210581_100000686382 [0,1,0,1,0,0|1,0,1]=4 33321 B14R1.169 CCCCCCNC(=O)[C@@H]1CCCO1 240690a_100000210581_100000686382 [0,1,0,1,0,0|1,0,1]=4 33322 B14R1.169 CCCCCCNC(=O)[C@@H]1CCCO1 527a_100000210581_100000686382 [0,1,0,1,0,0|1,0,1]=4 33323 B14R1.169 CCCCCCNC(C)C1CCCC1 2230a_100015185923_100000210314 [0,1,0,1,0,0|2,0,0]=4 33324 B14R1.169 CCCCCCNC(C)C1CCCC1 269862a_100000210581_100000749594 [0,1,0,1,0,0|2,0,0]=4 33325 B14R1.169 CCCCCCNC(C)C1CCCC1 270004a_100000210581_100000749594 [0,1,0,1,0,0|2,0,0]=4 33326 B14R1.169 CCCCCCNC(C)C1CCCC1 34a_100015185923_100000210314 [0,1,0,1,0,0|2,0,0]=4 33327 B14R1.169 CCCCCCNC(C)C1CCCO1 2230a_100025754208_100000210314 [0,1,0,1,0,0|1,0,0]=3 33328 B14R1.169 CCCCCCNC(C)C1CCCO1 34a_100025754208_100000210314 [0,1,0,1,0,0|1,0,0]=3 33329 B14R1.169 CCCCCCOC(C)C1CCCC1 34a_100011216366_100000210314 [0,1,0,1,0,0|2,0,0]=4 33330 B14R1.169 CCCCCCOC(C)C1CCCC1 7a_100011216366_100000210314 [0,1,0,1,0,0|2,0,0]=4 33331 B14R1.169 CCCCOCCC(=O)[C@@H]1CCCO1 1458a_100000686382_100000743108 [0,1,0,1,0,0|1,0,1]=4 33332 B14R1.169 CCCCOCNC(C)C1CCCO1 2230a_100025754208_100011995733 [0,1,0,1,0,0|2,0,0]=4 33333 B14R1.169 CCCCOCNC(C)C1CCCO1 34a_100025754208_100011995733 [0,1,0,1,0,0|2,0,0]=4 33334 B14R1.169 CCCOCCNC(C)C1CCCO1 2230a_100025754208_100011215938 [0,1,0,1,0,0|2,0,0]=4 33335 B14R1.169 CCCOCCNC(C)C1CCCO1 34a_100025754208_100011215938 [0,1,0,1,0,0|2,0,0]=4 33336 B14R1.169 CCOCCCNC(C)C1CCCO1 2230a_100025754208_100012232248 [0,1,0,1,0,0|2,0,0]=4 33337 B14R1.169 CCOCCCNC(C)C1CCCO1 34a_100025754208_100012232248 [0,1,0,1,0,0|2,0,0]=4 33338 B14R1.169 CN(CCCCCCF)C1CCCC1 2230a_100000207505_100015922095 [0,1,0,1,0,0|2,0,0]=4 33339 B14R1.169 CN(CCCCCCF)C1CCCC1 269982a_100000207505_100015922095 [0,1,0,1,0,0|2,0,0]=4 33340 B14R1.169 CN(CCCCCCF)C1CCCC1 34a_100000207505_100015922095 [0,1,0,1,0,0|2,0,0]=4 33341 B14R1.169 CN(CCCCCCO)C1CCCC1 2230a_100000207505_100000766143 [0,1,0,1,0,0|1,0,0]=3 33342 B14R1.169 CN(CCCCCCO)C1CCCC1 269982a_100000207505_100000766143 [0,1,0,1,0,0|1,0,0]=3 33343 B14R1.169 CN(CCCCCCO)C1CCCC1 34a_100000207505_100000766143 [0,1,0,1,0,0|1,0,0]=3 33344 B14R1.169 CN(CCCCCCO)C1CCOC1 2230a_100016988252_100000766143 [0,1,0,1,0,0|2,0,0]=4 33345 B14R1.169 CN(CCCCCCO)C1CCOC1 269982a_100016988252_100000766143 [0,1,0,1,0,0|2,0,0]=4 33346 B14R1.169 CN(CCCCCCO)C1CCOC1 34a_100016988252_100000766143 [0,1,0,1,0,0|2,0,0]=4 33347 B14R1.169 COCCCCNC(C)C1CCCO1 2230a_100025754208_100000730899 [0,1,0,1,0,0|2,0,0]=4 33348 B14R1.169 COCCCCNC(C)C1CCCO1 34a_100025754208_100000755781 [0,1,0,1,0,0|2,0,0]=4 33349 B14R1.169 O=C(CCCCCCF)C1CCCC1 1458a_100000210718_100015922095 [0,1,0,1,0,0|1,0,1]=4 33350 B14R1.169 O=C(CCCCCCF)[C@@H]1CCCO1 1458a_100000686382_100015922095 [0,1,0,1,0,0|1,0,1]=4 33351 B14R1.169 O=C(CCCCCCO)C1CCCC1 1458a_100000210718_100000766143 [0,1,0,1,0,0|0,0,1]=3 33352 B14R1.169 O=C(CCCCCCO)C1CCCC1 1458a_100011996774_100000179811 [0,1,0,1,0,0|0,0,1]=3 33353 B14R1.169 O=C(CCCCCCO)C1CCCS1 1458a_100012002731_100000766143 [0,1,0,1,0,0|1,0,1]=4 33354 B14R1.169 O=C(CCCCCCO)C1CCOC1 1458a_100011219752_100000766143 [0,1,0,1,0,0|1,0,1]=4 33355 B14R1.169 O=C(CCCCCCO)C1CCOC1 1458a_100011996774_100000690089 [0,1,0,1,0,0|1,0,1]=4 33356 B14R1.169 O=C(CCCCCCO)N1CCCC1 240690a_100000188435_100011996774 [0,1,0,1,0,0|1,0,1]=4 33357 B14R1.169 O=C(CCCCCCO)[C@@H]1CCCO1 1458a_100000686382_100000766143 [0,1,0,1,0,0|1,0,1]=4 33358 B14R1.169 O=C(NCCCCCO)C1CCCC1 240690a_100000762737_100000210718 [0,1,0,1,0,0|1,0,1]=4 33359 B14R1.1035 CC1CCCCC1C(=O)CCCCF 1458a_100011215568_100000729493 [0,1,0,1,0,0|1,0,1]=4 33360 B14R1.1035 CC1CCCCC1C(=O)CCCCO 1458a_100011215568_100000210776 [0,1,0,1,0,0|0,0,1]=3 33361 B14R1.1035 CC1CCCCC1C(=O)NCCCO 240690a_100000182051_100011215568 [0,1,0,1,0,0|1,0,1]=4 33362 B14R1.1035 CC1CCCCC1C(=O)NCCCO 527a_100000182051_100011215568 [0,1,0,1,0,0|1,0,1]=4 33363 B14R1.1035 CC1CCCCC1N(C)CCCCO 270004a_100000717598_100000210921 [0,1,0,1,0,0|1,0,0]=3 33364 B14R1.1035 CC1CCCCN1C(=O)CCCCO 1626a_100000211376_100000695505 [0,1,0,1,0,0|1,0,1]=4 33365 B14R1.1035 CC1CCCCN1C(C)COCCO 34a_200011934825_100000211926 [0,1,0,1,0,0|2,0,0]=4 33366 B14R1.1035 CC1CCCCN1C(C)COCCO 7a_200011934825_100000211926 [0,1,0,1,0,0|2,0,0]=4 33367 B14R1.1035 CC1CNCCC1N(C)CCCCO 270004a_100000717598_100000703950 [0,1,0,1,0,0|2,0,0]=4 33368 B14R1.1035 CC1COCCC1N(C)CCCCO 270004a_100000717598_100000755695 [0,1,0,1,0,0|2,0,0]=4 33369 B14R1.1035 CCCCCC(=O)C1CCCCC1C 1458a_100011215568_100000210326 [0,1,0,1,0,0|1,0,1]=4 33370 B14R1.1035 CCCCCC(=O)C1CCCCC1O 1458a_100011803323_100000210326 [0,1,0,1,0,0|0,0,1]=3 33371 B14R1.1035 CCCCCC(C)N1CCCCC1C 2230a_100000211376_200011218191 [0,1,0,1,0,0|2,0,0]=4 33372 B14R1.1035 CCCCCC(C)N1CCCCC1C 269982a_100000211376_200011218191 [0,1,0,1,0,0|2,0,0]=4 33373 B14R1.1035 CCCCCC(C)N1CCCCC1C 270004a_100000211376_100000211708 [0,1,0,1,0,0|2,0,0]=4 33374 B14R1.1035 CCCCCC(C)N1CCCCC1C 34a_100000211376_200011218191 [0,1,0,1,0,0|2,0,0]=4 33375 B14R1.1035 CCCCCN(C)C1CCCCC1C 2230a_200000199946_200000210301 [0,1,0,1,0,0|2,0,0]=4 33376 B14R1.1035 CCCCCN(C)C1CCCCC1C 269982a_200000199946_200000210301 [0,1,0,1,0,0|2,0,0]=4 33377 B14R1.1035 CCCCCN(C)C1CCCCC1C 270004a_100000223495_100000210921 [0,1,0,1,0,0|2,0,0]=4 33378 B14R1.1035 CCCCCN(C)C1CCCCC1C 34a_200000199946_200000210301 [0,1,0,1,0,0|2,0,0]=4 33379 B14R1.1035 CCCCCN(C)C1CCCCC1F 269982a_100000223495_100015423560 [0,1,0,1,0,0|2,0,0]=4 33380 B14R1.1035 CCCCCN(C)C1CCCCC1O 269982a_100000223495_100000038908 [0,1,0,1,0,0|1,0,0]=3 33381 B14R1.1035 CCCCCN(C)[C@@H]1CCCC[C@H]1O 269982a_100000708425_100000210215 [0,1,0,1,0,0|1,0,0]=3 33382 B14R1.1035 CCCCCN([13CH3])C1CCCCC1C 2230a_200000199946_200025704644 [0,1,0,1,0,0|2,0,0]=4 33383 B14R1.1035 CCCCCN([13CH3])C1CCCCC1C 269982a_200000199946_200025704644 [0,1,0,1,0,0|2,0,0]=4 33384 B14R1.1035 CCCCCN([13CH3])C1CCCCC1C 34a_200000199946_200025704644 [0,1,0,1,0,0|2,0,0]=4 33385 B14R1.1035 CCOCCC(=O)C1CCCCC1O 1458a_100011803323_100011215890 [0,1,0,1,0,0|1,0,1]=4 33386 B14R1.1035 CCOCCN(C)[C@@H]1CCCC[C@H]1O 269982a_100000708425_100011215890 [0,1,0,1,0,0|2,0,0]=4 33387 B14R1.1035 CCSCCC(=O)C1CCCCC1O 1458a_100011803323_100000757381 [0,1,0,1,0,0|1,0,1]=4 33388 B14R1.1035 CCSCCN(C)[C@@H]1CCCC[C@H]1O 269982a_100000708425_100000757381 [0,1,0,1,0,0|2,0,0]=4 33389 B14R1.1035 CN(CCCCF)[C@@H]1CCCC[C@H]1O 269982a_100000708425_100000729493 [0,1,0,1,0,0|2,0,0]=4 33390 B14R1.1035 CN(CCCCO)C1CCCCC1F 269982a_100000717598_100015423560 [0,1,0,1,0,0|2,0,0]=4 33391 B14R1.1035 CN(CCCCO)C1CCCCC1O 269982a_100000717598_100000038908 [0,1,0,1,0,0|2,0,0]=4 33392 B14R1.1035 CN(CCCCO)[C@@H]1CCCC[C@H]1O 269982a_100000708425_100000210776 [0,1,0,1,0,0|2,0,0]=4 33393 B14R1.1035 CN1CCCC[C@@H]1C(=O)CCCCO 1458a_100000767060_100000210776 [0,1,0,1,0,0|1,0,1]=4 33394 B14R1.1035 COCCCC(=O)C1CCCCC1O 1458a_100011803323_100000740836 [0,1,0,1,0,0|1,0,1]=4 33395 B14R1.1035 COCCCN(C)C1CCCCC1O 269982a_100000224831_100000038908 [0,1,0,1,0,0|2,0,0]=4 33396 B14R1.1035 COCCCN(C)[C@@H]1CCCC[C@H]1O 269982a_100000708425_100000740836 [0,1,0,1,0,0|2,0,0]=4 33397 B14R1.1035 O=C(CCCCF)C1CCCCC1O 1458a_100011803323_100000729493 [0,1,0,1,0,0|1,0,1]=4 33398 B14R1.1035 O=C(CCCCO)C1CCCCC1O 1458a_100011803323_100000210776 [0,1,0,1,0,0|1,0,1]=4 33399 B14R1.1037 CCCCCC(=O)COCC[C@@H]1CO1 34a_100009820653_200012276598 [0,1,0,1,0,0|1,0,1]=4 33400 B14R1.1037 CCCCCC(=O)CSCCC1CO1 62a_100000732470_200012276598 [0,1,0,1,0,0|1,0,1]=4 33401 B14R1.1037 CCCCCC(=O)CSCCC1CO1 62a_200012276598_100000732470 [0,1,0,1,0,0|1,0,1]=4 33402 B14R1.1037 CCCCCC(C)NCCCC1CO1 2230a_100000211957_100000733510 [0,1,0,1,0,0|1,0,0]=3 33403 B14R1.1037 CCCCCC(C)OCCCC1CO1 34a_100011215632_100000733510 [0,1,0,1,0,0|1,0,0]=3 33404 B14R1.1037 CCCCCC(C)OCCCC1CO1 7a_100011215632_100000733510 [0,1,0,1,0,0|1,0,0]=3 33405 B14R1.1037 CCCCCC(C)SCCCC1CO1 62a_100000733510_200011218191 [0,1,0,1,0,0|1,0,0]=3 33406 B14R1.1037 CCCCCC(C)SCCCC1CO1 62a_200011218191_100000733510 [0,1,0,1,0,0|1,0,0]=3 33407 B14R1.1037 COCCCC(C)OCCCC1CO1 34a_200011539412_100000733510 [0,1,0,1,0,0|2,0,0]=4 33408 B14R1.1037 COCCCC(C)OCCCC1CO1 7a_200011539412_100000733510 [0,1,0,1,0,0|2,0,0]=4 33409 B14R1.1037 NCCCC[C@H](N)COCCC1CC1 34a_100016993712_100000694398 [0,1,0,1,0,0|2,0,0]=4 33410 B14R1.1037 NCCCC[C@H](N)COCCC1CO1 34a_100016993712_100000732470 [0,1,0,1,0,0|2,0,0]=4 33411 B14R1.1044 CCCCCC(=O)CNC[C@@H]1CCO1 2230a_100020831831_200012276598 [0,1,0,1,0,0|1,0,1]=4 33412 B14R1.1044 CCCCCC(=O)CNC[C@@H]1CCO1 34a_100020831831_200012276598 [0,1,0,1,0,0|1,0,1]=4 33413 B14R1.1044 CCCCCC(=O)COCC1CCO1 34a_100000039022_200012276598 [0,1,0,1,0,0|1,0,1]=4 33414 B14R1.1044 CCCCCC(=O)CSCC1CCO1 62a_100000103362_200012276598 [0,1,0,1,0,0|1,0,1]=4 33415 B14R1.1044 CCCCCC(=O)CSCC1CCO1 62a_200012276598_100000103362 [0,1,0,1,0,0|1,0,1]=4 33416 B14R1.1044 NCCCC[C@H](N)COCC1CCC1 34a_100016993712_100000763275 [0,1,0,1,0,0|2,0,0]=4 33417 B14R1.1044 NCCCC[C@H](N)COCC1CCO1 34a_100016993712_100000103362 [0,1,0,1,0,0|2,0,0]=4 33418 B14R1.1045 CCC1CCCC1N(C)CCCCO 270004a_100000717598_100000749056 [0,1,0,1,0,0|1,0,0]=3 33419 B14R1.1045 CCC1CCCN1C(=O)CCCCO 1626a_100000754278_100000695505 [0,1,0,1,0,0|1,0,1]=4 33420 B14R1.1045 CCCCCC(=O)N1CCC[C@@H]1CO 240690a_100000745186_100000212188 [0,1,0,1,0,0|1,0,1]=4 33421 B14R1.1045 CCCCCC(=O)N1CCC[C@@H]1CO 527a_100000745186_100000212188 [0,1,0,1,0,0|1,0,1]=4 33422 B14R1.1045 CCCCCC(C)N1CCCC1CC 2230a_100000754278_200011218191 [0,1,0,1,0,0|2,0,0]=4 33423 B14R1.1045 CCCCCC(C)N1CCCC1CC 269982a_100000754278_200011218191 [0,1,0,1,0,0|2,0,0]=4 33424 B14R1.1045 CCCCCC(C)N1CCCC1CC 270004a_100000754278_100000211708 [0,1,0,1,0,0|2,0,0]=4 33425 B14R1.1045 CCCCCC(C)N1CCCC1CC 34a_100000754278_200011218191 [0,1,0,1,0,0|2,0,0]=4 33426 B14R1.1045 CCCCCC(C)N1CCC[C@@H]1CO 2230a_100000745186_200011218191 [0,1,0,1,0,0|1,0,0]=3 33427 B14R1.1045 CCCCCC(C)N1CCC[C@@H]1CO 269982a_100000745186_200011218191 [0,1,0,1,0,0|1,0,0]=3 33428 B14R1.1045 CCCCCC(C)N1CCC[C@@H]1CO 270004a_100000745186_100000211708 [0,1,0,1,0,0|1,0,0]=3 33429 B14R1.1045 CCCCCC(C)N1CCC[C@@H]1CO 34a_100000745186_200011218191 [0,1,0,1,0,0|1,0,0]=3 33430 B14R1.1045 CCCCCN(C)C1CCCC1CC 270004a_100000223495_100000749056 [0,1,0,1,0,0|2,0,0]=4 33431 B14R1.1045 CCCSCC(C)N1CCC[C@@H]1CO 270004a_100000745186_100011343953 [0,1,0,1,0,0|2,0,0]=4 33432 B14R1.1045 CCN1CCCC1C(=O)CCCCO 1458a_106256033941_100000210776 [0,1,0,1,0,0|1,0,1]=4 33433 B14R1.1045 CCOCCC(C)N1CCC[C@@H]1CO 270004a_100000745186_200011216536 [0,1,0,1,0,0|2,0,0]=4 33434 B14R1.1045 CSCCCC(C)N1CCC[C@@H]1CO 270004a_100000745186_100011399439 [0,1,0,1,0,0|2,0,0]=4 33435 B14R1.1047 CCCCCC(=O)N[C@H]1CCC[C@@H]1O 11a_100000748460_100000212188 [0,1,0,1,0,0|1,0,1]=4 33436 B14R1.1047 CCCCCC(=O)N[C@H]1CCC[C@@H]1O 240690a_100000748460_100000212188 [0,1,0,1,0,0|1,0,1]=4 33437 B14R1.1047 CCCCCC(C)NC1CCCC1C 269862a_100000211957_100000752053 [0,1,0,1,0,0|2,0,0]=4 33438 B14R1.1047 CCCCCC(C)N[C@H]1CCC[C@@H]1O 270004a_100000748460_100000211708 [0,1,0,1,0,0|1,0,0]=3 33439 B14R1.1047 CCCCCC(C)N[C@H]1COC[C@@H]1O 2230a_100015191717_200011218191 [0,1,0,1,0,0|2,0,0]=4 33440 B14R1.1047 CCCCCC(C)N[C@H]1COC[C@@H]1O 270004a_100015191717_100000211708 [0,1,0,1,0,0|2,0,0]=4 33441 B14R1.1047 CCCCCC(C)OC1CCCC1C 34a_100011216460_200011218191 [0,1,0,1,0,0|2,0,0]=4 33442 B14R1.1047 CCCCCC(C)OC1CCCC1C 7a_100011216460_200011218191 [0,1,0,1,0,0|2,0,0]=4 33443 B14R1.1047 CCCCCC(C)OC1COCC1O 34a_100011215632_200000725654 [0,1,0,1,0,0|2,0,0]=4 33444 B14R1.1047 CCCCCC(C)OC1COCC1O 7a_100011215632_200000725654 [0,1,0,1,0,0|2,0,0]=4 33445 B14R1.1047 CCCCCC(C)O[C@@H]1CCC[C@H]1Cl 34a_200016002552_200011218191 [0,1,0,1,0,0|2,0,0]=4 33446 B14R1.1047 CCCCCC(C)O[C@H]1CCC[C@@H]1N 34a_100000748460_200011218191 [0,1,0,1,0,0|2,0,0]=4 33447 B14R1.1047 CCCCCC(C)SC1COCC1O 62a_200000725654_200011218191 [0,1,0,1,0,0|2,0,0]=4 33448 B14R1.1047 CCCCCC(C)SC1COCC1O 62a_200011218191_200000725654 [0,1,0,1,0,0|2,0,0]=4 33449 B14R1.1047 CCCCCC(C)S[C@@H]1CCC[C@H]1O 62a_200011218191_200016002552 [0,1,0,1,0,0|1,0,0]=3 33450 B14R1.1047 CCCCCC(C)S[C@@H]1CCC[C@H]1O 62a_200016002552_200011218191 [0,1,0,1,0,0|1,0,0]=3 33451 B14R1.1047 CCCSCC(C)N[C@H]1CCC[C@@H]1O 270004a_100000748460_100011343953 [0,1,0,1,0,0|2,0,0]=4 33452 B14R1.1047 CCOCCC(C)N[C@H]1CCC[C@@H]1O 270004a_100000748460_200011216536 [0,1,0,1,0,0|2,0,0]=4 33453 B14R1.1047 CSCCCC(C)N[C@H]1CCC[C@@H]1O 270004a_100000748460_100011399439 [0,1,0,1,0,0|2,0,0]=4 33454 B14R1.3001 CCCCCC(=O)C1CCCCCC1 1458a_100000212188_100011217769 [0,1,0,1,0,0|1,0,1]=4 33455 B14R1.3001 CCCCCC(=O)C1CCCCCC1 1458a_100000749507_100000210326 [0,1,0,1,0,0|1,0,1]=4 33456 B14R1.3001 CCCCCC(C)N1CCCCCC1 2230a_100000185865_200011218191 [0,1,0,1,0,0|2,0,0]=4 33457 B14R1.3001 CCCCCC(C)N1CCCCCC1 269982a_100000185865_200011218191 [0,1,0,1,0,0|2,0,0]=4 33458 B14R1.3001 CCCCCC(C)N1CCCCCC1 270004a_100000185865_100000211708 [0,1,0,1,0,0|2,0,0]=4 33459 B14R1.3001 CCCCCC(C)N1CCCCCC1 34a_100000185865_200011218191 [0,1,0,1,0,0|2,0,0]=4 33460 B14R1.3001 CCCCCN(C)C1CCCCCC1 2230a_100015185097_100000210326 [0,1,0,1,0,0|2,0,0]=4 33461 B14R1.3001 CCCCCN(C)C1CCCCCC1 269982a_100000223495_100011217769 [0,1,0,1,0,0|2,0,0]=4 33462 B14R1.3001 CCCCCN(C)C1CCCCCC1 269982a_100015185097_100000210215 [0,1,0,1,0,0|2,0,0]=4 33463 B14R1.3001 CCCCCN(C)C1CCCCCC1 270004a_100000223495_100000210131 [0,1,0,1,0,0|2,0,0]=4 33464 B14R1.3001 CCCCCN(C)C1CCCCCC1 34a_100015185097_100000718602 [0,1,0,1,0,0|2,0,0]=4 33465 B14R1.3001 CN(CCCCF)C1CCCCCC1 2230a_100015185097_100000729493 [0,1,0,1,0,0|2,0,0]=4 33466 B14R1.3001 CN(CCCCF)C1CCCCCC1 269982a_100015185097_100000729493 [0,1,0,1,0,0|2,0,0]=4 33467 B14R1.3001 CN(CCCCF)C1CCCCCC1 34a_100015185097_100000729493 [0,1,0,1,0,0|2,0,0]=4 33468 B14R1.3001 CN(CCCCO)C1CCCCCC1 2230a_100015185097_100000210776 [0,1,0,1,0,0|1,0,0]=3 33469 B14R1.3001 CN(CCCCO)C1CCCCCC1 269982a_100000717598_100011217769 [0,1,0,1,0,0|1,0,0]=3 33470 B14R1.3001 CN(CCCCO)C1CCCCCC1 269982a_100015185097_100000210776 [0,1,0,1,0,0|1,0,0]=3 33471 B14R1.3001 CN(CCCCO)C1CCCCCC1 270004a_100000717598_100000210131 [0,1,0,1,0,0|1,0,0]=3 33472 B14R1.3001 CN(CCCCO)C1CCCCCC1 34a_100015185097_100011216708 [0,1,0,1,0,0|1,0,0]=3 33473 B14R1.3001 CN(CCCCO)C1CCCNCC1 270004a_100000717598_100015187895 [0,1,0,1,0,0|2,0,0]=4 33474 B14R1.3001 O=C(CCCCF)C1CCCCCC1 1458a_100000749507_100000729493 [0,1,0,1,0,0|1,0,1]=4 33475 B14R1.3001 O=C(CCCCO)C1CCCCCC1 1458a_100000695505_100011217769 [0,1,0,1,0,0|0,0,1]=3 33476 B14R1.3001 O=C(CCCCO)C1CCCCCC1 1458a_100000749507_100000210776 [0,1,0,1,0,0|0,0,1]=3 33477 B14R1.3001 O=C(CCCCO)N1CCCCCC1 1626a_100000185865_100000695505 [0,1,0,1,0,0|1,0,1]=4 33478 B14R1.3001 O=C(COCCO)C1CCCCCC1 1458a_100000708028_100011217769 [0,1,0,1,0,0|1,0,1]=4 33479 B14R1.3001 O=C(NCCCO)C1CCCCCC1 240690a_100000182051_100000749507 [0,1,0,1,0,0|1,0,1]=4 33480 B14R1.3001 O=C(NCCCO)C1CCCCCC1 527a_100000182051_100000749507 [0,1,0,1,0,0|1,0,1]=4 33481 B14R1.4515 CCC1CC1C(=O)CCCCCCF 1458a_200011661523_100015922095 [0,1,0,1,0,0|1,0,1]=4 33482 B14R1.4515 CCC1CC1C(=O)CCCCCCO 1458a_200011661523_100000766143 [0,1,0,1,0,0|0,0,1]=3 33483 B14R1.4515 CCC1CC1C(=O)NCCCCCO 240690a_100000762737_200011661523 [0,1,0,1,0,0|1,0,1]=4 33484 B14R1.4515 CCCCCCCC(=O)C1CC1CC 1458a_200011661523_100000210614 [0,1,0,1,0,0|1,0,1]=4 33485 B14R1.4516 CCCCCCCC(C)N[C@@H]1C[C@@H]1F 2230a_100015190264_200011218727 [0,1,0,1,0,0|2,0,0]=4 33486 B14R1.4516 CCCCCCCC(C)N[C@@H]1C[C@H]1F 2230a_100025746932_200011218727 [0,1,0,1,0,0|2,0,0]=4 33487 B14R1.4516 CCCCCCCC(C)N[C@@H]1C[C@H]1F 34a_100025746932_200011218727 [0,1,0,1,0,0|2,0,0]=4 33488 B14R1.4517 CCCCCCCC(=O)CC1CCC1 1458a_100000211969_100000763275 [0,1,0,1,0,0|1,0,1]=4 33489 B14R1.4517 CCCCCCCC(=O)CC1CCC1 1458a_100000763092_100000210614 [0,1,0,1,0,0|1,0,1]=4 33490 B14R1.4517 CCCCCCCC(=O)CC1CCO1 1458a_100000211969_100000103362 [0,1,0,1,0,0|0,0,1]=3 33491 B14R1.4517 CCCCCCCC(C)NC1CCC1 2230a_100000749019_200011218727 [0,1,0,1,0,0|2,0,0]=4 33492 B14R1.4517 CCCCCCCC(C)NC1CCC1 34a_100000749019_200011218727 [0,1,0,1,0,0|2,0,0]=4 33493 B14R1.4517 CCCCCCCC(C)OC1CCC1 34a_100000748187_200011218727 [0,1,0,1,0,0|2,0,0]=4 33494 B14R1.4517 CCCCCCCC(C)OC1CCC1 34a_200011215852_100000749161 [0,1,0,1,0,0|2,0,0]=4 33495 B14R1.4517 CCCCCCCC(C)SC1CCC1 62a_200011218727_100000749161 [0,1,0,1,0,0|2,0,0]=4 33496 B14R1.4517 CCCCCCCN(C)CC1CCC1 2230a_100000228206_100000763275 [0,1,0,1,0,0|2,0,0]=4 33497 B14R1.4517 CCCCCCCN(C)CC1CCC1 2230a_200000750244_100000210681 [0,1,0,1,0,0|2,0,0]=4 33498 B14R1.4517 CCCCCCCN(C)CC1CCC1 269982a_100000228206_100000763275 [0,1,0,1,0,0|2,0,0]=4 33499 B14R1.4517 CCCCCCCN(C)CC1CCC1 269982a_200000750244_100000210681 [0,1,0,1,0,0|2,0,0]=4 33500 B14R1.4517 CCCCCCCN(C)CC1CCC1 34a_200000750244_100000210614 [0,1,0,1,0,0|2,0,0]=4 33501 B14R1.4517 CCCCCCCN(C)CC1CCO1 2230a_100000228206_100000103362 [0,1,0,1,0,0|1,0,0]=3 33502 B14R1.4517 CCCCCCCN(C)CC1CCO1 269982a_100000228206_100000103362 [0,1,0,1,0,0|1,0,0]=3 33503 B14R1.4517 CN(CCCCCCF)CC1CCC1 2230a_200000750244_100015922095 [0,1,0,1,0,0|2,0,0]=4 33504 B14R1.4517 CN(CCCCCCF)CC1CCC1 269982a_200000750244_100015922095 [0,1,0,1,0,0|2,0,0]=4 33505 B14R1.4517 CN(CCCCCCF)CC1CCC1 34a_200000750244_100015922095 [0,1,0,1,0,0|2,0,0]=4 33506 B14R1.4517 CN(CCCCCCO)CC1CCC1 2230a_200000750244_100000766143 [0,1,0,1,0,0|1,0,0]=3 33507 B14R1.4517 CN(CCCCCCO)CC1CCC1 269982a_200000750244_100000766143 [0,1,0,1,0,0|1,0,0]=3 33508 B14R1.4517 CN(CCCCCCO)CC1CCC1 34a_200000750244_100000766143 [0,1,0,1,0,0|1,0,0]=3 33509 B14R1.4517 COCCCCCC(=O)CC1CCO1 1458a_100011935119_100000103362 [0,1,0,1,0,0|1,0,1]=4 33510 B14R1.4517 O=C(CC1CCC1)NCCCCCO 240690a_100000762737_100000763092 [0,1,0,1,0,0|1,0,1]=4 33511 B14R1.4517 O=C(CCCCCCF)CC1CCC1 1458a_100000763092_100015922095 [0,1,0,1,0,0|1,0,1]=4 33512 B14R1.4517 O=C(CCCCCCO)CC1CCC1 1458a_100000763092_100000766143 [0,1,0,1,0,0|0,0,1]=3 33513 B14R1.4517 O=C(CCCCCCO)CC1CCC1 1458a_100011996774_100000763275 [0,1,0,1,0,0|0,0,1]=3 33514 B14R1.4517 O=C(CCCCCCO)CC1CCO1 1458a_100011996774_100000103362 [0,1,0,1,0,0|1,0,1]=4 33515 B14R1.4517 O=C(CCCCCCO)CC1COC1 1458a_100000687760_100000766143 [0,1,0,1,0,0|1,0,1]=4 33516 B14R1.4517 O=C(CCCCCCO)CC1COC1 1458a_100011996774_100010264016 [0,1,0,1,0,0|1,0,1]=4 33517 B14R1.4517 O=C(CCCCCCO)NC1CCC1 240690a_100000749019_100011996774 [0,1,0,1,0,0|1,0,1]=4 33518 B14R1.4518 CCCCCCCC(=O)CCC1CC1 1458a_100000211969_100000694398 [0,1,0,1,0,0|1,0,1]=4 33519 B14R1.4518 CCCCCCCC(=O)CCC1CC1 1458a_100000756386_100000210614 [0,1,0,1,0,0|1,0,1]=4 33520 B14R1.4518 CCCCCCCC(=O)CCC1CO1 1458a_100000211969_100000732470 [0,1,0,1,0,0|0,0,1]=3 33521 B14R1.4518 CCCCCCCC(C)NCC1CC1 2230a_100000735609_200011218727 [0,1,0,1,0,0|2,0,0]=4 33522 B14R1.4518 CCCCCCCC(C)NCC1CC1 270004a_100000735609_100000210596 [0,1,0,1,0,0|2,0,0]=4 33523 B14R1.4518 CCCCCCCC(C)NCC1CC1 34a_100000735609_200011218727 [0,1,0,1,0,0|2,0,0]=4 33524 B14R1.4518 CCCCCCCC(C)OCC1CC1 34a_100000211283_200011218727 [0,1,0,1,0,0|2,0,0]=4 33525 B14R1.4518 CCCCCCCC(C)OCC1CC1 34a_200011215852_100000742324 [0,1,0,1,0,0|2,0,0]=4 33526 B14R1.4518 CCCCCCCC(C)OCC1CC1 7a_200011215852_100000742324 [0,1,0,1,0,0|2,0,0]=4 33527 B14R1.4518 CCCCCCCC(C)OCC1CO1 34a_200011215852_102125554688 [0,1,0,1,0,0|1,0,0]=3 33528 B14R1.4518 CCCCCCCC(C)OCC1CO1 7a_200011215852_102125554688 [0,1,0,1,0,0|1,0,0]=3 33529 B14R1.4518 CCCCCCCC(C)OCC1CS1 7a_200011215852_100000031435 [0,1,0,1,0,0|1,1,0]=4 33530 B14R1.4518 CCCCCCCC(C)OC[C@@H]1CO1 34a_100000757423_200011218727 [0,1,0,1,0,0|1,0,0]=3 33531 B14R1.4518 CCCCCCCC(C)OC[C@@H]1CO1 7a_200011215852_100000745022 [0,1,0,1,0,0|1,0,0]=3 33532 B14R1.4518 CCCCCCCC(C)SCC1CC1 62a_100000756562_200011218727 [0,1,0,1,0,0|2,0,0]=4 33533 B14R1.4518 CCCCCCCC(C)SCC1CC1 62a_200011218727_100000742324 [0,1,0,1,0,0|2,0,0]=4 33534 B14R1.4518 CCCCCCCC(C)SCC1CO1 62a_102125554688_200011218727 [0,1,0,1,0,0|1,0,0]=3 33535 B14R1.4518 CCCCCCCC(C)SCC1CO1 62a_200011218727_102125554688 [0,1,0,1,0,0|1,0,0]=3 33536 B14R1.4518 CCCCCCCC(C)SCC1CS1 62a_100000031435_200011218727 [0,1,0,1,0,0|1,1,0]=4 33537 B14R1.4518 CCCCCCCC(C)SCC1CS1 62a_200011218727_100000031435 [0,1,0,1,0,0|1,1,0]=4 33538 B14R1.4518 CCCCCCCC(C)SC[C@@H]1CO1 62a_100000745022_200011218727 [0,1,0,1,0,0|1,0,0]=3 33539 B14R1.4518 CCCCCCCC(C)SC[C@@H]1CO1 62a_200011218727_100000745022 [0,1,0,1,0,0|1,0,0]=3 33540 B14R1.4518 CCCCCCCN(C)CCC1CC1 2230a_100000228206_100000694398 [0,1,0,1,0,0|2,0,0]=4 33541 B14R1.4518 CCCCCCCN(C)CCC1CC1 269982a_100000228206_100000694398 [0,1,0,1,0,0|2,0,0]=4 33542 B14R1.4518 CCCCCCCN(C)CCC1CO1 2230a_100000228206_100000732470 [0,1,0,1,0,0|1,0,0]=3 33543 B14R1.4518 CCCCCCCN(C)CCC1CO1 269982a_100000228206_100000732470 [0,1,0,1,0,0|1,0,0]=3 33544 B14R1.4518 COCCCCCC(=O)CCC1CO1 1458a_100011935119_100000732470 [0,1,0,1,0,0|1,0,1]=4 33545 B14R1.4518 O=C(CCC1CC1)NCCCCCO 240690a_100000762737_100000756386 [0,1,0,1,0,0|1,0,1]=4 33546 B14R1.4518 O=C(CCCCCCF)CCC1CC1 1458a_100000756386_100015922095 [0,1,0,1,0,0|1,0,1]=4 33547 B14R1.4518 O=C(CCCCCCO)CCC1CC1 1458a_100000756386_100000766143 [0,1,0,1,0,0|0,0,1]=3 33548 B14R1.4518 O=C(CCCCCCO)CCC1CC1 1458a_100011996774_100000694398 [0,1,0,1,0,0|0,0,1]=3 33549 B14R1.4518 O=C(CCCCCCO)CCC1CO1 1458a_100011996774_100000732470 [0,1,0,1,0,0|1,0,1]=4 33550 B14R1.4518 O=C(CCCCCCO)NCC1CC1 240690a_100000735609_100011996774 [0,1,0,1,0,0|1,0,1]=4 33551 B14R1.4519 CC1CCN1C(=O)CCCCCCO 240690a_100000755817_100011996774 [0,1,0,1,0,0|1,0,1]=4 33552 B14R1.4519 CCCCCCCC(C)N1CCC1C 269982a_100000755817_200011218727 [0,1,0,1,0,0|2,0,0]=4 33553 B14R1.4519 CCCCCCCC(C)N1CCC1C 34a_100000755817_200011218727 [0,1,0,1,0,0|2,0,0]=4 33554 B14R1.8088 CC1(CCCCC1)CNCCCCF 2230a_100000706052_100000729493 [0,1,0,1,0,0|2,0,0]=4 33555 B14R1.8088 CC1(CCCCC1)CNCCCCF 34a_100000706052_100000729493 [0,1,0,1,0,0|2,0,0]=4 33556 B14R1.8088 CC1(CCCCC1)CNCCCCO 2230a_100000706052_100000210776 [0,1,0,1,0,0|1,0,0]=3 33557 B14R1.8088 CC1(CCCCC1)CNCCCCO 269862a_100000750430_100011935227 [0,1,0,1,0,0|1,0,0]=3 33558 B14R1.8088 CC1(CCCCC1)CNCCCCO 34a_100000706052_100011216708 [0,1,0,1,0,0|1,0,0]=3 33559 B14R1.8088 CC1(CCCCC1)COCCCCF 34a_100000688186_100000729493 [0,1,0,1,0,0|2,0,0]=4 33560 B14R1.8088 CC1(CCCCC1)COCCCCF 7a_100000688186_100000729493 [0,1,0,1,0,0|2,0,0]=4 33561 B14R1.8088 CC1(CCCCC1)COCCCCO 34a_100000688186_100011216708 [0,1,0,1,0,0|1,0,0]=3 33562 B14R1.8088 CC1(CCCCC1)COCCCCO 7a_100000688186_100000210776 [0,1,0,1,0,0|1,0,0]=3 33563 B14R1.8088 CC1(CCCCC1)NCCCCCF 2230a_100000741114_100000729378 [0,1,0,1,0,0|2,0,0]=4 33564 B14R1.8088 CC1(CCCCC1)NCCCCCF 34a_100000741114_100000729378 [0,1,0,1,0,0|2,0,0]=4 33565 B14R1.8088 CC1(CCCCC1)NCCCCCO 2230a_100000741114_100000746330 [0,1,0,1,0,0|1,0,0]=3 33566 B14R1.8088 CC1(CCCCC1)NCCCCCO 34a_100000741114_100000746330 [0,1,0,1,0,0|1,0,0]=3 33567 B14R1.8088 CC1(CCCCC1)NCCOCCO 2230a_100000741114_100011215305 [0,1,0,1,0,0|2,0,0]=4 33568 B14R1.8088 CC1(CCCCC1)NCCOCCO 34a_100000741114_100000692535 [0,1,0,1,0,0|2,0,0]=4 33569 B14R1.8088 CC1(CCCCC1)OCCCCCF 34a_100011215885_100000729378 [0,1,0,1,0,0|2,0,0]=4 33570 B14R1.8088 CC1(CCCCC1)OCCCCCF 7a_100011215885_100000729378 [0,1,0,1,0,0|2,0,0]=4 33571 B14R1.8088 CC1(CCCCC1)OCCCCCO 34a_100011215885_100000746330 [0,1,0,1,0,0|1,0,0]=3 33572 B14R1.8088 CC1(CCCCC1)OCCCCCO 7a_100011215885_100000746330 [0,1,0,1,0,0|1,0,0]=3 33573 B14R1.8088 CC1(CCCCC1)OCCOCCO 34a_100011215885_100000692535 [0,1,0,1,0,0|2,0,0]=4 33574 B14R1.8088 CC1(CCCCC1)OCCOCCO 7a_100011215885_100011215305 [0,1,0,1,0,0|2,0,0]=4 33575 B14R1.8088 CC1(CCOCC1)CNCCCCO 2230a_100000695556_100000210776 [0,1,0,1,0,0|2,0,0]=4 33576 B14R1.8088 CC1(CCOCC1)CNCCCCO 269862a_100000750430_100000701351 [0,1,0,1,0,0|2,0,0]=4 33577 B14R1.8088 CC1(CCOCC1)CNCCCCO 34a_100000695556_100011216708 [0,1,0,1,0,0|2,0,0]=4 33578 B14R1.8088 CC1(CCOCC1)COCCCCO 34a_100000704393_100011216708 [0,1,0,1,0,0|2,0,0]=4 33579 B14R1.8088 CC1(CCOCC1)COCCCCO 7a_100000704393_100000210776 [0,1,0,1,0,0|2,0,0]=4 33580 B14R1.8088 CC1(CCOCC1)NCCCCCO 2230a_100000692449_100000746330 [0,1,0,1,0,0|2,0,0]=4 33581 B14R1.8088 CC1(CCOCC1)NCCCCCO 34a_100000692449_100000746330 [0,1,0,1,0,0|2,0,0]=4 33582 B14R1.8088 CC1(CCOCC1)OCCCCCO 34a_100011827762_100000746330 [0,1,0,1,0,0|2,0,0]=4 33583 B14R1.8088 CC1(CCOCC1)OCCCCCO 7a_100011827762_100000746330 [0,1,0,1,0,0|2,0,0]=4 33584 B14R1.8088 CC1(CCSCC1)OCCCCCO 34a_200011004327_100000746330 [0,1,0,1,0,0|2,0,0]=4 33585 B14R1.8088 CC1(CCSCC1)OCCCCCO 7a_200011004327_100000746330 [0,1,0,1,0,0|2,0,0]=4 33586 B14R1.8088 CCCCCCNC1(CCCCC1)C 2230a_100000741114_100000210314 [0,1,0,1,0,0|2,0,0]=4 33587 B14R1.8088 CCCCCCNC1(CCCCC1)C 34a_100000741114_100000210314 [0,1,0,1,0,0|2,0,0]=4 33588 B14R1.8088 CCCCCCOC1(CCCCC1)C 34a_100011215885_100000210314 [0,1,0,1,0,0|2,0,0]=4 33589 B14R1.8088 CCCCCCOC1(CCCCC1)C 7a_100011215885_100000210314 [0,1,0,1,0,0|2,0,0]=4 33590 B14R1.8088 CCCCCNCC1(CCCCC1)C 2230a_100000706052_100000210326 [0,1,0,1,0,0|2,0,0]=4 33591 B14R1.8088 CCCCCNCC1(CCCCC1)C 269862a_100000209983_100011935227 [0,1,0,1,0,0|2,0,0]=4 33592 B14R1.8088 CCCCCNCC1(CCCCC1)C 34a_100000706052_100000718602 [0,1,0,1,0,0|2,0,0]=4 33593 B14R1.8088 CCCCCNCC1(CCCCC1)O 2230a_100000748649_100000210326 [0,1,0,1,0,0|2,0,0]=4 33594 B14R1.8088 CCCCCNCC1(CCCCC1)O 34a_100000748649_100000718602 [0,1,0,1,0,0|2,0,0]=4 33595 B14R1.8088 CCCCCOCC1(CCCCC1)C 34a_100000688186_100000718602 [0,1,0,1,0,0|2,0,0]=4 33596 B14R1.8088 CCCCCOCC1(CCCCC1)C 7a_100000688186_100000210326 [0,1,0,1,0,0|2,0,0]=4 33597 B14R1.8088 CCCCCOCC1(CCCCC1)F 34a_100000090305_100000718602 [0,1,0,1,0,0|2,0,0]=4 33598 B14R1.8088 CCCCCOCC1(CCCCC1)F 7a_100000090305_100000210326 [0,1,0,1,0,0|2,0,0]=4 33599 B14R1.8088 CCCCCOCC1(CCCCC1)N 34a_100000740034_100000718602 [0,1,0,1,0,0|2,0,0]=4 33600 B14R1.8088 CCCCNCCC1(CCCCC1)O 2230a_100102740465_100000210211 [0,1,0,1,0,0|2,0,0]=4 33601 B14R1.8088 CCCCNCCC1(CCCCC1)O 34a_100102740465_100000210210 [0,1,0,1,0,0|2,0,0]=4 33602 B14R1.8088 FCCCCOCC1(CCCCC1)F 34a_100000090305_100000729493 [0,1,0,1,0,0|2,0,0]=4 33603 B14R1.8088 FCCCCOCC1(CCCCC1)F 7a_100000090305_100000729493 [0,1,0,1,0,0|2,0,0]=4 33604 B14R1.8088 NC1(CCCCC1)COCCCCF 34a_100000740034_100000729493 [0,1,0,1,0,0|2,0,0]=4 33605 B14R1.8088 NC1(CCCCC1)COCCCCO 34a_100000740034_100011216708 [0,1,0,1,0,0|1,0,0]=3 33606 B14R1.8088 NC1(CCOCC1)COCCCCO 34a_100000751404_100011216708 [0,1,0,1,0,0|2,0,0]=4 33607 B14R1.8088 OC1(CCCCC1)CCNCCCF 2230a_100102740465_100011934791 [0,1,0,1,0,0|2,0,0]=4 33608 B14R1.8088 OC1(CCCCC1)CCNCCCF 34a_100102740465_100011934791 [0,1,0,1,0,0|2,0,0]=4 33609 B14R1.8088 OC1(CCCCC1)CNCCCCF 2230a_100000748649_100000729493 [0,1,0,1,0,0|2,0,0]=4 33610 B14R1.8088 OC1(CCCCC1)CNCCCCF 34a_100000748649_100000729493 [0,1,0,1,0,0|2,0,0]=4 33611 B14R1.8088 OCCCCNCC1(CCCCC1)O 2230a_100000748649_100000210776 [0,1,0,1,0,0|1,0,0]=3 33612 B14R1.8088 OCCCCNCC1(CCCCC1)O 34a_100000748649_100011216708 [0,1,0,1,0,0|1,0,0]=3 33613 B14R1.8088 OCCCCNCC1(CCOCC1)F 2230a_100016991512_100000210776 [0,1,0,1,0,0|2,0,0]=4 33614 B14R1.8088 OCCCCNCC1(CCOCC1)F 34a_100016991512_100011216708 [0,1,0,1,0,0|2,0,0]=4 33615 B14R1.8088 OCCCCNCC1(CCOCC1)O 2230a_100000704115_100000210776 [0,1,0,1,0,0|2,0,0]=4 33616 B14R1.8088 OCCCCNCC1(CCOCC1)O 34a_100000704115_100011216708 [0,1,0,1,0,0|2,0,0]=4 33617 B14R1.8088 OCCCCNCC1(CCSCC1)O 2230a_100000758141_100000210776 [0,1,0,1,0,0|2,0,0]=4 33618 B14R1.8088 OCCCCOCC1(CCCCC1)F 34a_100000090305_100011216708 [0,1,0,1,0,0|1,0,0]=3 33619 B14R1.8088 OCCCCOCC1(CCCCC1)F 7a_100000090305_100000210776 [0,1,0,1,0,0|1,0,0]=3 33620 B14R1.8088 OCCCCOCC1(CCNCC1)F 34a_100016990393_100011216708 [0,1,0,1,0,0|2,0,0]=4 33621 B14R1.8088 OCCCNCCC1(CCCCC1)O 2230a_100102740465_100000230001 [0,1,0,1,0,0|1,0,0]=3 33622 B14R1.8088 OCCCNCCC1(CCCCC1)O 34a_100102740465_100000230001 [0,1,0,1,0,0|1,0,0]=3 33623 B14R1.8094 CCCCCCO[C@@]1(CCC[C@H]1N)C 34a_100015977457_100000210314 [0,1,0,1,0,0|2,0,0]=4 33624 B14R1.8094 C[C@]1(CCC[C@H]1N)OCCCCCO 34a_100015977457_100000746330 [0,1,0,1,0,0|2,0,0]=4 33625 B14R1.20339 CC1CCCC(C1NCCCCO)C 269862a_100000750430_100000211995 [0,1,0,1,0,0|1,0,0]=3 33626 B14R1.20339 CC1CCCC(C1OCCCCF)C 34a_100011218088_100000729493 [0,1,0,1,0,0|2,0,0]=4 33627 B14R1.20339 CC1CCCC(C1OCCCCF)C 7a_100011218088_100000729493 [0,1,0,1,0,0|2,0,0]=4 33628 B14R1.20339 CC1CCCC(C1OCCCCO)C 34a_100011218088_100011216708 [0,1,0,1,0,0|1,0,0]=3 33629 B14R1.20339 CC1CCCC(C1OCCCCO)C 7a_100011218088_100000210776 [0,1,0,1,0,0|1,0,0]=3 33630 B14R1.20339 CC1CCCC(N1CCCCCF)C 2230a_100000210447_100000729378 [0,1,0,1,0,0|2,0,0]=4 33631 B14R1.20339 CC1CCCC(N1CCCCCF)C 269982a_100000210447_100000729378 [0,1,0,1,0,0|2,0,0]=4 33632 B14R1.20339 CC1CCCC(N1CCCCCF)C 34a_100000210447_100000729378 [0,1,0,1,0,0|2,0,0]=4 33633 B14R1.20339 CC1CCCC(N1CCCCCO)C 2230a_100000210447_100000746330 [0,1,0,1,0,0|1,0,0]=3 33634 B14R1.20339 CC1CCCC(N1CCCCCO)C 269982a_100000210447_100000746330 [0,1,0,1,0,0|1,0,0]=3 33635 B14R1.20339 CC1CCCC(N1CCCCCO)C 34a_100000210447_100000746330 [0,1,0,1,0,0|1,0,0]=3 33636 B14R1.20339 CC1CCCC(N1CCNCCO)C 2230a_100000749955_100000211926 [0,1,0,1,0,0|2,0,0]=4 33637 B14R1.20339 CC1CCCC(N1CCNCCO)C 34a_100000749955_100000211926 [0,1,0,1,0,0|2,0,0]=4 33638 B14R1.20339 CC1CCCC(N1CCOCCO)C 2230a_100000210447_100011215305 [0,1,0,1,0,0|2,0,0]=4 33639 B14R1.20339 CC1CCCC(N1CCOCCO)C 269982a_100000210447_100011215305 [0,1,0,1,0,0|2,0,0]=4 33640 B14R1.20339 CC1CCCC(N1CCOCCO)C 34a_100000210447_100000692535 [0,1,0,1,0,0|2,0,0]=4 33641 B14R1.20339 CC1CCCC(N1CCOCCO)C 34a_100011305576_100000211926 [0,1,0,1,0,0|2,0,0]=4 33642 B14R1.20339 CC1CCCC(N1CCOCCO)C 7a_100011305576_100000211926 [0,1,0,1,0,0|2,0,0]=4 33643 B14R1.20339 CCCCCCN1C(CCCC1C)C 2230a_100000210447_100000210314 [0,1,0,1,0,0|2,0,0]=4 33644 B14R1.20339 CCCCCCN1C(CCCC1C)C 269982a_100000210447_100000210757 [0,1,0,1,0,0|2,0,0]=4 33645 B14R1.20339 CCCCCCN1C(CCCC1C)C 34a_100000210447_100000210314 [0,1,0,1,0,0|2,0,0]=4 33646 B14R1.20339 CCCCCNC1C(CCCC1C)C 269862a_100000209983_100000211995 [0,1,0,1,0,0|2,0,0]=4 33647 B14R1.20339 CCCCCOC1C(CCCC1C)C 34a_100011218088_100000718602 [0,1,0,1,0,0|2,0,0]=4 33648 B14R1.20339 CCCCCOC1C(CCCC1C)C 7a_100011218088_100000210326 [0,1,0,1,0,0|2,0,0]=4 33649 B14R1.20339 C[C@@H]1COC[C@@H](N1CCCCCO)C 2230a_100103153222_100000746330 [0,1,0,1,0,0|2,0,0]=4 33650 B14R1.20339 C[C@@H]1COC[C@@H](N1CCCCCO)C 269982a_100103153222_100000746330 [0,1,0,1,0,0|2,0,0]=4 33651 B14R1.20339 C[C@@H]1COC[C@@H](N1CCCCCO)C 34a_100103153222_100000746330 [0,1,0,1,0,0|2,0,0]=4 33652 B14R2.6 C1CCC(CC1)NC2CCCCC2 270004a_100000182618_100000210434 [0,0,0,2,0,0|2,0,0]=4 33653 B14R2.6 C1CCC(CC1)NC2CCCCC2 34a_100000182618_100000210327 [0,0,0,2,0,0|2,0,0]=4 33654 B14R2.6 C1CCC(CC1)OC2CCCCC2 34a_100000210231_100000210327 [0,0,0,2,0,0|2,0,0]=4 33655 B14R2.6 C1CCC(CC1)OC2CCCCC2 7a_100000210231_100000210327 [0,0,0,2,0,0|2,0,0]=4 33656 B14R2.6 C1CCC(CC1)OC2CCCCO2 34a_100000033831_100000210327 [0,0,0,2,0,0|1,0,0]=3 33657 B14R2.6 C1CCC(CC1)SC2CCCCC2 62a_100000210327_100000210327 [0,0,0,2,0,0|2,0,0]=4 33658 B14R2.6 C1CCC(OC1)CN2CCCOC2 2230a_100000131196_100000211543 [0,0,0,2,0,0|2,0,0]=4 33659 B14R2.6 C1CCC(OC1)CN2CCCOC2 269982a_100000131196_100000211543 [0,0,0,2,0,0|2,0,0]=4 33660 B14R2.6 C1CCC(OC1)CN2CCCOC2 34a_100000131196_100000211543 [0,0,0,2,0,0|2,0,0]=4 33661 B14R2.6 C1CCC(OC1)CN2CCOCC2 2230a_100015191051_100000211543 [0,0,0,2,0,0|2,0,0]=4 33662 B14R2.6 C1CCC(OC1)CN2CCOCC2 269982a_100015191051_100000211543 [0,0,0,2,0,0|2,0,0]=4 33663 B14R2.6 C1CCC(OC1)CN2CCOCC2 34a_100015191051_100000211543 [0,0,0,2,0,0|2,0,0]=4 33664 B14R2.6 C1CCC(OC1)CN2CCSCC2 2230a_100000737611_100000211543 [0,0,0,2,0,0|2,0,0]=4 33665 B14R2.6 C1CCC(OC1)CN2CCSCC2 269982a_100000737611_100000211543 [0,0,0,2,0,0|2,0,0]=4 33666 B14R2.6 C1CCC(OC1)OC2CCCOC2 34a_100000033831_100000693364 [0,0,0,2,0,0|2,0,0]=4 33667 B14R2.6 C1CCC(OC1)OC2CCSCC2 34a_100000033831_100000069128 [0,0,0,2,0,0|2,0,0]=4 33668 B14R2.14 CCC1CCCN1C2CCCCC2 269982a_100000754278_100000210327 [0,0,0,2,0,0|2,0,0]=4 33669 B14R2.14 CCC1CCCN1C2CCCCC2 270004a_100000754278_100000210434 [0,0,0,2,0,0|2,0,0]=4 33670 B14R2.14 CCC1CCCN1C2CCCCC2 34a_100000754278_100000210327 [0,0,0,2,0,0|2,0,0]=4 33671 B14R2.14 CCN1CCCC1C2CCCCC2 2230a_100011206067_100000210202 [0,0,0,2,0,0|2,0,0]=4 33672 B14R2.14 CCN1CCCC1C2CCCCC2 269982a_100011206067_100000204670 [0,0,0,2,0,0|2,0,0]=4 33673 B14R2.14 CCN1CCCC1C2CCCCC2 34a_100011206067_100000210202 [0,0,0,2,0,0|2,0,0]=4 33674 B14R2.14 FCN1CCCC1C2CCCCC2 269982a_100011206067_100015361967 [0,0,0,2,0,0|2,0,0]=4 33675 B14R2.14 FCN1CCCC1C2CCCCC2 34a_100011206067_100015361967 [0,0,0,2,0,0|2,0,0]=4 33676 B14R2.14 OC[C@H]1CCCN1C2CCCCC2 269982a_100000745186_100000210327 [0,0,0,2,0,0|1,0,0]=3 33677 B14R2.14 OC[C@H]1CCCN1C2CCCCC2 270004a_100000745186_100000210434 [0,0,0,2,0,0|1,0,0]=3 33678 B14R2.14 OC[C@H]1CCCN1C2CCCCC2 34a_100000745186_100000210327 [0,0,0,2,0,0|1,0,0]=3 33679 B14R2.14 OC[C@H]1CCCN1C2CCCOC2 269982a_100000745186_100000693364 [0,0,0,2,0,0|2,0,0]=4 33680 B14R2.14 OC[C@H]1CCCN1C2CCCOC2 270004a_100000745186_100000753404 [0,0,0,2,0,0|2,0,0]=4 33681 B14R2.14 OC[C@H]1CCCN1C2CCCOC2 34a_100000745186_100000693364 [0,0,0,2,0,0|2,0,0]=4 33682 B14R2.14 OC[C@H]1CCCN1C2CCCSC2 270004a_100000745186_100000057913 [0,0,0,2,0,0|2,0,0]=4 33683 B14R2.14 OC[C@H]1CCCN1C2CCNCC2 270004a_100000745186_100015192401 [0,0,0,2,0,0|2,0,0]=4 33684 B14R2.14 OC[C@H]1CCCN1C2CCOCC2 269982a_100000745186_100011324220 [0,0,0,2,0,0|2,0,0]=4 33685 B14R2.14 OC[C@H]1CCCN1C2CCOCC2 270004a_100000745186_100011217826 [0,0,0,2,0,0|2,0,0]=4 33686 B14R2.14 OC[C@H]1CCCN1C2CCSCC2 269982a_100000745186_100000069128 [0,0,0,2,0,0|2,0,0]=4 33687 B14R2.14 OC[C@H]1CCCN1C2CCSCC2 270004a_100000745186_100000203788 [0,0,0,2,0,0|2,0,0]=4 33688 B14R2.14 OC[C@H]1CCCN1C2CCSCC2 34a_100000745186_100000069128 [0,0,0,2,0,0|2,0,0]=4 33689 B14R2.24 CC1CCCCN1C2CCCCC2 269982a_100000211376_100000210327 [0,0,0,2,0,0|2,0,0]=4 33690 B14R2.24 CC1CCCCN1C2CCCCC2 270004a_100000211376_100000210434 [0,0,0,2,0,0|2,0,0]=4 33691 B14R2.24 CC1CCCCN1C2CCCCC2 34a_100000211376_100000210327 [0,0,0,2,0,0|2,0,0]=4 33692 B14R2.24 CN1CCCCC1C2CCCCC2 2230a_100011219272_200000210301 [0,0,0,2,0,0|2,0,0]=4 33693 B14R2.24 CN1CCCCC1C2CCCCC2 269982a_100011219272_200000210301 [0,0,0,2,0,0|2,0,0]=4 33694 B14R2.24 CN1CCCCC1C2CCCCC2 34a_100011219272_200000210301 [0,0,0,2,0,0|2,0,0]=4 33695 B14R2.24 OC1CCCCC1N2CCCOC2 269982a_100000131196_100000038908 [0,0,0,2,0,0|2,0,0]=4 33696 B14R2.24 OC1CCCCC1N2CCCOC2 34a_100000131196_100000038908 [0,0,0,2,0,0|2,0,0]=4 33697 B14R2.24 OC1CCCCC1N2CCOCC2 269982a_100015191051_100000038908 [0,0,0,2,0,0|2,0,0]=4 33698 B14R2.24 OC1CCCCC1N2CCOCC2 34a_100015191051_100000038908 [0,0,0,2,0,0|2,0,0]=4 33699 B14R2.24 OC1CCCCC1N2CCSCC2 269982a_100000737611_100000038908 [0,0,0,2,0,0|2,0,0]=4 33700 B14R2.24 [13CH3]N1CCCCC1C2CCCCC2 2230a_100011219272_200025704644 [0,0,0,2,0,0|2,0,0]=4 33701 B14R2.24 [13CH3]N1CCCCC1C2CCCCC2 269982a_100011219272_200025704644 [0,0,0,2,0,0|2,0,0]=4 33702 B14R2.24 [13CH3]N1CCCCC1C2CCCCC2 34a_100011219272_200025704644 [0,0,0,2,0,0|2,0,0]=4 33703 B14R2.30 CC1CCCC1NC2CCCCC2 269862a_100000182618_100000752053 [0,0,0,2,0,0|2,0,0]=4 33704 B14R2.30 CC1CCCC1OC2CCCCC2 34a_100011216460_100000210327 [0,0,0,2,0,0|2,0,0]=4 33705 B14R2.30 CC1CCCC1OC2CCCCC2 7a_100011216460_100000210327 [0,0,0,2,0,0|2,0,0]=4 33706 B14R2.30 CC1SCCN1CC2CCCCO2 2230a_200011216479_100000211543 [0,0,0,2,0,0|2,0,0]=4 33707 B14R2.30 CC1SCCN1CC2CCCCO2 269982a_200011216479_100000211543 [0,0,0,2,0,0|2,0,0]=4 33708 B14R2.30 CC1SCCN1CC2CCCCO2 34a_200011216479_100000211543 [0,0,0,2,0,0|2,0,0]=4 33709 B14R2.30 C[C@@H]1CCCN1CC2CCCCC2 2230a_100015189458_100000211423 [0,0,0,2,0,0|2,0,0]=4 33710 B14R2.30 C[C@@H]1CCCN1CC2CCCCC2 269982a_100015189458_100000211423 [0,0,0,2,0,0|2,0,0]=4 33711 B14R2.30 C[C@@H]1CCCN1CC2CCCCC2 34a_100015189458_100000211423 [0,0,0,2,0,0|2,0,0]=4 33712 B14R2.30 C[C@@H]1CCCN1CC2CCCCO2 2230a_100015189458_100000211543 [0,0,0,2,0,0|1,0,0]=3 33713 B14R2.30 C[C@@H]1CCCN1CC2CCCCO2 269982a_100015189458_100000211543 [0,0,0,2,0,0|1,0,0]=3 33714 B14R2.30 C[C@@H]1CCCN1CC2CCCCO2 34a_100015189458_100000211543 [0,0,0,2,0,0|1,0,0]=3 33715 B14R2.30 C[C@H]1CCCN1CC2CCCCC2 2230a_100020605311_100000211423 [0,0,0,2,0,0|2,0,0]=4 33716 B14R2.30 C[C@H]1CCCN1CC2CCCCC2 269982a_100020605311_100000211423 [0,0,0,2,0,0|2,0,0]=4 33717 B14R2.30 C[C@H]1CCCN1CC2CCCCO2 2230a_100020605311_100000211543 [0,0,0,2,0,0|1,0,0]=3 33718 B14R2.30 C[C@H]1CCCN1CC2CCCCO2 269982a_100020605311_100000211543 [0,0,0,2,0,0|1,0,0]=3 33719 B14R2.30 Cl[C@@H]1CCC[C@H]1OC2CCCCC2 34a_200016002552_100000210327 [0,0,0,2,0,0|2,0,0]=4 33720 B14R2.30 N[C@H]1CCC[C@@H]1OC2CCCCC2 34a_100000748460_100000210327 [0,0,0,2,0,0|2,0,0]=4 33721 B14R2.30 OC1COCC1NC2CCCCC2 34a_100000182618_200000725654 [0,0,0,2,0,0|2,0,0]=4 33722 B14R2.30 OC1COCC1OC2CCCCC2 34a_100000210231_200000725654 [0,0,0,2,0,0|2,0,0]=4 33723 B14R2.30 OC1COCC1OC2CCCCC2 7a_100000210231_200000725654 [0,0,0,2,0,0|2,0,0]=4 33724 B14R2.30 OC1COCC1SC2CCCCC2 62a_100000210327_200000725654 [0,0,0,2,0,0|2,0,0]=4 33725 B14R2.30 OC1COCC1SC2CCCCC2 62a_200000725654_100000210327 [0,0,0,2,0,0|2,0,0]=4 33726 B14R2.30 O[C@@H]1CCC[C@H]1SC2CCCCC2 62a_100000210327_200016002552 [0,0,0,2,0,0|1,0,0]=3 33727 B14R2.30 O[C@@H]1CCC[C@H]1SC2CCCCC2 62a_200016002552_100000210327 [0,0,0,2,0,0|1,0,0]=3 33728 B14R2.30 O[C@@H]1CCC[C@H]1SC2CCCOC2 62a_200016002552_100000693364 [0,0,0,2,0,0|2,0,0]=4 33729 B14R2.30 O[C@@H]1CCC[C@H]1SC2CCOCC2 62a_200016002552_100011324220 [0,0,0,2,0,0|2,0,0]=4 33730 B14R2.30 O[C@@H]1CCC[C@H]1SC2CCSCC2 62a_200016002552_100000069128 [0,0,0,2,0,0|2,0,0]=4 33731 B14R2.30 O[C@H]1CCC[C@@H]1NC2CCCCC2 270004a_100000748460_100000210434 [0,0,0,2,0,0|1,0,0]=3 33732 B14R2.30 O[C@H]1CCC[C@@H]1NC2CCCOC2 270004a_100000748460_100000753404 [0,0,0,2,0,0|2,0,0]=4 33733 B14R2.30 O[C@H]1CCC[C@@H]1NC2CCCSC2 270004a_100000748460_100000057913 [0,0,0,2,0,0|2,0,0]=4 33734 B14R2.30 O[C@H]1CCC[C@@H]1NC2CCNCC2 270004a_100000748460_100015192401 [0,0,0,2,0,0|2,0,0]=4 33735 B14R2.30 O[C@H]1CCC[C@@H]1NC2CCOCC2 270004a_100000748460_100011217826 [0,0,0,2,0,0|2,0,0]=4 33736 B14R2.30 O[C@H]1CCC[C@@H]1NC2CCSCC2 270004a_100000748460_100000203788 [0,0,0,2,0,0|2,0,0]=4 33737 B14R2.30 O[C@H]1COC[C@@H]1NC2CCCCC2 270004a_100015191717_100000210434 [0,0,0,2,0,0|2,0,0]=4 33738 B14R2.31 CC1CCN1CCC2CCCCC2 269982a_100000755817_100011273959 [0,0,0,2,0,0|2,0,0]=4 33739 B14R2.31 CC1CCN1CCC2CCCCC2 34a_100000755817_100011209188 [0,0,0,2,0,0|2,0,0]=4 33740 B14R2.31 CC1CCN1CCC2OCCCO2 269982a_100000755817_100000764188 [0,0,0,2,0,0|2,0,0]=4 33741 B14R2.31 CC1CCN1CCC2OCCCO2 34a_100000755817_100000764188 [0,0,0,2,0,0|2,0,0]=4 33742 B14R2.49 CC1CC1COCC2CCCCC2 34a_100000744939_100000211423 [0,0,0,2,0,0|2,0,0]=4 33743 B14R2.49 CC1CC1COCC2CCCCC2 7a_100000744939_100000211423 [0,0,0,2,0,0|2,0,0]=4 33744 B14R2.49 CC1CC1COCC2CCCCO2 34a_100000744939_100000211543 [0,0,0,2,0,0|1,0,0]=3 33745 B14R2.49 CC1CC1COCC2CCCCO2 7a_100000744939_100000211543 [0,0,0,2,0,0|1,0,0]=3 33746 B14R2.49 F[C@@H]1C[C@H]1NCCC2CCCCC2 2230a_100025746932_100012355289 [0,0,0,2,0,0|2,0,0]=4 33747 B14R2.49 F[C@@H]1C[C@H]1NCCC2CCCCC2 34a_100025746932_100011209188 [0,0,0,2,0,0|2,0,0]=4 33748 B14R2.49 F[C@H]1C[C@H]1NCCC2CCCCC2 2230a_100015190264_100012355289 [0,0,0,2,0,0|2,0,0]=4 33749 B14R2.58 OCCN1CCOC12CCCCC2 269982a_200015422347_100000211926 [0,0,0,2,0,0|2,0,0]=4 33750 B14R2.58 OCCN1CCOC12CCCCC2 34a_200015422347_100000211926 [0,0,0,2,0,0|2,0,0]=4 33751 B14R2.101 C1CCC(C1)NC[C@H]2COCCO2 2230a_100010981119_100000179811 [0,0,0,2,0,0|2,0,0]=4 33752 B14R2.101 C1CCC(C1)NC[C@H]2COCCO2 270004a_100010981119_100000210133 [0,0,0,2,0,0|2,0,0]=4 33753 B14R2.101 C1CCC(C1)NC[C@H]2COCCO2 34a_100010981119_100000179811 [0,0,0,2,0,0|2,0,0]=4 33754 B14R2.101 C1CCC(C1)OC[C@@H]2CNCCO2 34a_100015189573_100000179811 [0,0,0,2,0,0|2,0,0]=4 33755 B14R2.101 C1CCC(C1)OC[C@H]2COCCO2 34a_100009875890_100000179811 [0,0,0,2,0,0|2,0,0]=4 33756 B14R2.101 C1CCC(CC1)CCN2CCCC2 2230a_100000188435_100012355289 [0,0,0,2,0,0|2,0,0]=4 33757 B14R2.101 C1CCC(CC1)CCN2CCCC2 269982a_100000188435_100011273959 [0,0,0,2,0,0|2,0,0]=4 33758 B14R2.101 C1CCC(CC1)CCN2CCCC2 270004a_100000188435_100011713444 [0,0,0,2,0,0|2,0,0]=4 33759 B14R2.101 C1CCC(CC1)CNC2CCCC2 2230a_100000210473_100000179811 [0,0,0,2,0,0|2,0,0]=4 33760 B14R2.101 C1CCC(CC1)CNC2CCCC2 2230a_100000211070_100000211423 [0,0,0,2,0,0|2,0,0]=4 33761 B14R2.101 C1CCC(CC1)CNC2CCCC2 269862a_100000211070_100000211278 [0,0,0,2,0,0|2,0,0]=4 33762 B14R2.101 C1CCC(CC1)CNC2CCCC2 270004a_100000210473_100000210133 [0,0,0,2,0,0|2,0,0]=4 33763 B14R2.101 C1CCC(CC1)CNC2CCCC2 34a_100000210473_100000179811 [0,0,0,2,0,0|2,0,0]=4 33764 B14R2.101 C1CCC(CC1)CNC2CCCC2 34a_100000211070_100000211423 [0,0,0,2,0,0|2,0,0]=4 33765 B14R2.101 C1CCC(CC1)COC2CCCC2 34a_100000210269_100000211423 [0,0,0,2,0,0|2,0,0]=4 33766 B14R2.101 C1CCC(CC1)COC2CCCC2 34a_100000212181_100000179811 [0,0,0,2,0,0|2,0,0]=4 33767 B14R2.101 C1CCC(CC1)COC2CCCC2 7a_100000210269_100000211423 [0,0,0,2,0,0|2,0,0]=4 33768 B14R2.101 C1CCC(CC1)COC2CCCC2 7a_100000212181_100000179811 [0,0,0,2,0,0|2,0,0]=4 33769 B14R2.101 C1CCC(CC1)COC2CCCO2 34a_100000085407_100000211423 [0,0,0,2,0,0|1,0,0]=3 33770 B14R2.101 C1CCC(CC1)CSC2CCCC2 62a_100000211423_100000179811 [0,0,0,2,0,0|2,0,0]=4 33771 B14R2.101 C1CCC(CC1)CSC2CCCC2 62a_100011217020_100000211423 [0,0,0,2,0,0|2,0,0]=4 33772 B14R2.101 C1CCC(CC1)NCC2CCCC2 2230a_100000182618_100000740388 [0,0,0,2,0,0|2,0,0]=4 33773 B14R2.101 C1CCC(CC1)NCC2CCCC2 269862a_100000182618_100000746403 [0,0,0,2,0,0|2,0,0]=4 33774 B14R2.101 C1CCC(CC1)NCC2CCCC2 270004a_100000737975_100000210434 [0,0,0,2,0,0|2,0,0]=4 33775 B14R2.101 C1CCC(CC1)NCC2CCCC2 34a_100000182618_100000740388 [0,0,0,2,0,0|2,0,0]=4 33776 B14R2.101 C1CCC(CC1)NCC2CCCC2 34a_100000737975_100000210327 [0,0,0,2,0,0|2,0,0]=4 33777 B14R2.101 C1CCC(CC1)NCC2CCCO2 2230a_100000182618_100000203698 [0,0,0,2,0,0|1,0,0]=3 33778 B14R2.101 C1CCC(CC1)NCC2OCCO2 2230a_100000182618_100000755774 [0,0,0,2,0,0|2,0,0]=4 33779 B14R2.101 C1CCC(CC1)NCC2OCCO2 270004a_100000036311_100000210434 [0,0,0,2,0,0|2,0,0]=4 33780 B14R2.101 C1CCC(CC1)NCC2OCCO2 34a_100000036311_100000210327 [0,0,0,2,0,0|2,0,0]=4 33781 B14R2.101 C1CCC(CC1)NCC2OCCO2 34a_100000182618_100000755774 [0,0,0,2,0,0|2,0,0]=4 33782 B14R2.101 C1CCC(CC1)NC[C@@H]2CCCO2 270004a_100020590478_100000210434 [0,0,0,2,0,0|1,0,0]=3 33783 B14R2.101 C1CCC(CC1)NC[C@@H]2CCCO2 34a_100020590478_100000210327 [0,0,0,2,0,0|1,0,0]=3 33784 B14R2.101 C1CCC(CC1)OCC2CCCC2 34a_100000210231_100000740388 [0,0,0,2,0,0|2,0,0]=4 33785 B14R2.101 C1CCC(CC1)OCC2CCCC2 34a_100000742336_100000210327 [0,0,0,2,0,0|2,0,0]=4 33786 B14R2.101 C1CCC(CC1)OCC2CCCC2 7a_100000210231_100000740388 [0,0,0,2,0,0|2,0,0]=4 33787 B14R2.101 C1CCC(CC1)OCC2CCCC2 7a_100000742336_100000210327 [0,0,0,2,0,0|2,0,0]=4 33788 B14R2.101 C1CCC(CC1)OCC2CCCO2 34a_100000210270_100000210327 [0,0,0,2,0,0|1,0,0]=3 33789 B14R2.101 C1CCC(CC1)OCC2CCCO2 7a_100000210231_100000203698 [0,0,0,2,0,0|1,0,0]=3 33790 B14R2.101 C1CCC(CC1)OCC2CCCO2 7a_100000210270_100000210327 [0,0,0,2,0,0|1,0,0]=3 33791 B14R2.101 C1CCC(CC1)OCC2COCO2 34a_100011216627_100000210327 [0,0,0,2,0,0|2,0,0]=4 33792 B14R2.101 C1CCC(CC1)OCC2OCCO2 34a_100000087154_100000210327 [0,0,0,2,0,0|2,0,0]=4 33793 B14R2.101 C1CCC(CC1)OCC2OCCO2 34a_100000210231_100000755774 [0,0,0,2,0,0|2,0,0]=4 33794 B14R2.101 C1CCC(CC1)OCC2OCCO2 7a_100000210231_100000755774 [0,0,0,2,0,0|2,0,0]=4 33795 B14R2.101 C1CCC(CC1)OC[C@H]2CCCN2 34a_100000745186_100000210327 [0,0,0,2,0,0|2,0,0]=4 33796 B14R2.101 C1CCC(CC1)SCC2CCCC2 62a_100000210327_100000740388 [0,0,0,2,0,0|2,0,0]=4 33797 B14R2.101 C1CCC(CC1)SCC2CCCC2 62a_100000740388_100000210327 [0,0,0,2,0,0|2,0,0]=4 33798 B14R2.101 C1CCC(CC1)SCC2CCCO2 62a_100000203698_100000210327 [0,0,0,2,0,0|1,0,0]=3 33799 B14R2.101 C1CCC(CC1)SCC2CCCO2 62a_100000210327_100000203698 [0,0,0,2,0,0|1,0,0]=3 33800 B14R2.101 C1CCC(CC1)SCC2OCCO2 62a_100000210327_100000755774 [0,0,0,2,0,0|2,0,0]=4 33801 B14R2.101 C1CCC(CC1)SCC2OCCO2 62a_100000755774_100000210327 [0,0,0,2,0,0|2,0,0]=4 33802 B14R2.101 C1CCC(NC1)COC2CCCC2 34a_100000210821_100000179811 [0,0,0,2,0,0|2,0,0]=4 33803 B14R2.101 C1CCC(OC1)CNC2CCCC2 2230a_100000174945_100000179811 [0,0,0,2,0,0|1,0,0]=3 33804 B14R2.101 C1CCC(OC1)CNC2CCCC2 2230a_100000211070_100000211543 [0,0,0,2,0,0|1,0,0]=3 33805 B14R2.101 C1CCC(OC1)CNC2CCCC2 270004a_100000174945_100000210133 [0,0,0,2,0,0|1,0,0]=3 33806 B14R2.101 C1CCC(OC1)CNC2CCCC2 34a_100000174945_100000179811 [0,0,0,2,0,0|1,0,0]=3 33807 B14R2.101 C1CCC(OC1)CNC2CCCC2 34a_100000211070_100000211543 [0,0,0,2,0,0|1,0,0]=3 33808 B14R2.101 C1CCC(OC1)CNC2CCOC2 2230a_100000174945_100000731011 [0,0,0,2,0,0|2,0,0]=4 33809 B14R2.101 C1CCC(OC1)CNC2CCOC2 270004a_100000174945_100000752484 [0,0,0,2,0,0|2,0,0]=4 33810 B14R2.101 C1CCC(OC1)CNC2CCOC2 34a_100000174945_100000690089 [0,0,0,2,0,0|2,0,0]=4 33811 B14R2.101 C1CCC(OC1)CNC2CCSC2 270004a_100000174945_100000212027 [0,0,0,2,0,0|2,0,0]=4 33812 B14R2.101 C1CCC(OC1)CN[C@@H]2CCOC2 2230a_200015188469_100000211543 [0,0,0,2,0,0|2,0,0]=4 33813 B14R2.101 C1CCC(OC1)CN[C@H]2CCOC2 2230a_100015188467_100000211543 [0,0,0,2,0,0|2,0,0]=4 33814 B14R2.101 C1CCC(OC1)CN[C@H]2CCOC2 34a_100015188467_100000211543 [0,0,0,2,0,0|2,0,0]=4 33815 B14R2.101 C1CCC(OC1)COC2CCCC2 34a_100000210269_100000211543 [0,0,0,2,0,0|1,0,0]=3 33816 B14R2.101 C1CCC(OC1)COC2CCCC2 34a_100000211370_100000179811 [0,0,0,2,0,0|1,0,0]=3 33817 B14R2.101 C1CCC(OC1)COC2CCCC2 7a_100000210269_100000211543 [0,0,0,2,0,0|1,0,0]=3 33818 B14R2.101 C1CCC(OC1)COC2CCCC2 7a_100000211370_100000179811 [0,0,0,2,0,0|1,0,0]=3 33819 B14R2.101 C1CCC(OC1)COC2CCCO2 34a_100000085407_100000211543 [0,0,0,2,0,0|2,0,0]=4 33820 B14R2.101 C1CCC(OC1)COC2CCOC2 34a_100000211370_100000690089 [0,0,0,2,0,0|2,0,0]=4 33821 B14R2.101 C1CCC(OC1)COC2CCOC2 7a_100000211370_100000731011 [0,0,0,2,0,0|2,0,0]=4 33822 B14R2.101 C1CCC(OC1)COC2CCSC2 7a_100011232664_100000211543 [0,0,0,2,0,0|2,0,0]=4 33823 B14R2.101 C1CCC(OC1)CO[C@H]2CCOC2 34a_100000717292_100000211543 [0,0,0,2,0,0|2,0,0]=4 33824 B14R2.101 C1CCC(OC1)CSC2CCCC2 62a_100000211543_100000179811 [0,0,0,2,0,0|1,0,0]=3 33825 B14R2.101 C1CCC(OC1)CSC2CCCC2 62a_100011217020_100000211543 [0,0,0,2,0,0|1,0,0]=3 33826 B14R2.101 C1CCC(OC1)CSC2CCOC2 62a_100000211543_100000690089 [0,0,0,2,0,0|2,0,0]=4 33827 B14R2.101 C1CCC(OC1)OCC2CCCC2 34a_100000033831_100000740388 [0,0,0,2,0,0|1,0,0]=3 33828 B14R2.101 C1CCC(OC1)OCC2CCOC2 34a_100000033831_100011261433 [0,0,0,2,0,0|2,0,0]=4 33829 B14R2.101 C1COC(C1)CNC2CCOCC2 2230a_100000741149_100000203698 [0,0,0,2,0,0|2,0,0]=4 33830 B14R2.101 C1COC(C1)CNC2CCSCC2 2230a_100000748639_100000203698 [0,0,0,2,0,0|2,0,0]=4 33831 B14R2.101 C1COC(C1)COC2CCCSC2 7a_100015962668_100000203698 [0,0,0,2,0,0|2,0,0]=4 33832 B14R2.101 C1COC(C1)COC2CCOCC2 7a_100000210270_100000686592 [0,0,0,2,0,0|2,0,0]=4 33833 B14R2.101 C1COC(C1)COC2CCSCC2 34a_100000210270_100000069128 [0,0,0,2,0,0|2,0,0]=4 33834 B14R2.101 C1COC(C1)COC2CCSCC2 7a_100000210270_100011500858 [0,0,0,2,0,0|2,0,0]=4 33835 B14R2.101 C1COC(C1)COC2CCSCC2 7a_100000731022_100000203698 [0,0,0,2,0,0|2,0,0]=4 33836 B14R2.101 C1COC(C1)CSC2CCCOC2 62a_100000203698_100000693364 [0,0,0,2,0,0|2,0,0]=4 33837 B14R2.101 C1COC(C1)CSC2CCOCC2 62a_100000203698_100011324220 [0,0,0,2,0,0|2,0,0]=4 33838 B14R2.101 C1COC(C1)CSC2CCSCC2 62a_100000203698_100000069128 [0,0,0,2,0,0|2,0,0]=4 33839 B14R2.101 C1COC(C1)OCC2CCOCC2 34a_100000085407_100000754603 [0,0,0,2,0,0|2,0,0]=4 33840 B14R2.101 C1COC(OC1)CCN2CCCC2 2230a_100000188435_100000764188 [0,0,0,2,0,0|2,0,0]=4 33841 B14R2.101 C1COC(OC1)CCN2CCCC2 269982a_100000188435_100000764188 [0,0,0,2,0,0|2,0,0]=4 33842 B14R2.101 C1COCC(C1)COC2CCCO2 34a_100000085407_100000741521 [0,0,0,2,0,0|2,0,0]=4 33843 B14R2.101 C1COCC(C1)NCC2CCCO2 2230a_100000719290_100000203698 [0,0,0,2,0,0|2,0,0]=4 33844 B14R2.101 C1COCC(C1)NC[C@@H]2CCCO2 270004a_100020590478_100000753404 [0,0,0,2,0,0|2,0,0]=4 33845 B14R2.101 C1COCC(C1)NC[C@@H]2CCCO2 34a_100020590478_100000693364 [0,0,0,2,0,0|2,0,0]=4 33846 B14R2.101 C1COCC(C1)OCC2CCCO2 34a_100000210270_100000693364 [0,0,0,2,0,0|2,0,0]=4 33847 B14R2.101 C1COCC(C1)OCC2CCCO2 7a_100000210270_100000693364 [0,0,0,2,0,0|2,0,0]=4 33848 B14R2.101 C1CO[C@@H](C1)CNC2CCNCC2 270004a_100020590478_100015192401 [0,0,0,2,0,0|2,0,0]=4 33849 B14R2.101 C1CO[C@@H](C1)CNC2CCOCC2 270004a_100020590478_100011217826 [0,0,0,2,0,0|2,0,0]=4 33850 B14R2.101 C1CO[C@@H](C1)CNC2CCSCC2 270004a_100020590478_100000203788 [0,0,0,2,0,0|2,0,0]=4 33851 B14R2.101 C1CO[C@@H](C1)CNC2CCSCC2 34a_100020590478_100000069128 [0,0,0,2,0,0|2,0,0]=4 33852 B14R2.101 C1CSCC(C1)NC[C@@H]2CCCO2 270004a_100020590478_100000057913 [0,0,0,2,0,0|2,0,0]=4 33853 B14R2.795 CCCNCC1CC12CCCCC2 2230a_100015185624_100000210303 [0,0,0,2,0,0|2,0,0]=4 33854 B14R2.795 CCCNCC1CC12CCCCC2 34a_100015185624_100000210303 [0,0,0,2,0,0|2,0,0]=4 33855 B14R2.795 FCCNCC1CC12CCCCC2 2230a_100015185624_100011217306 [0,0,0,2,0,0|2,0,0]=4 33856 B14R2.795 FCCNCC1CC12CCCCC2 34a_100015185624_100011217306 [0,0,0,2,0,0|2,0,0]=4 33857 B14R2.795 OCCNCC1CC12CCCCC2 2230a_100015185624_100000211926 [0,0,0,2,0,0|1,0,0]=3 33858 B14R2.795 OCCNCC1CC12CCCCC2 34a_100015185624_100000211926 [0,0,0,2,0,0|1,0,0]=3 33859 B14R2.856 OCCCN1CCN2CCC1CC2 269982a_100000027273_100011215043 [0,0,0,2,0,0|2,0,0]=4 33860 B14R2.1253 C1CCC(CC1)N2CCCCCC2 269982a_100000185865_100000210327 [0,0,0,2,0,0|2,0,0]=4 33861 B14R2.1253 C1CCC(CC1)N2CCCCCC2 270004a_100000185865_100000210434 [0,0,0,2,0,0|2,0,0]=4 33862 B14R2.1253 C1CCC(CC1)N2CCCCCC2 34a_100000185865_100000210327 [0,0,0,2,0,0|2,0,0]=4 33863 B14R2.2549 OCCCCCNC1C2C1COC2 2230a_100000702821_100000746330 [0,0,0,2,0,0|2,0,0]=4 33864 B14R2.2549 OCCCCCNC1C2C1COC2 34a_100000702821_100000746330 [0,0,0,2,0,0|2,0,0]=4 33865 B14R2.2549 OCCCCOCC1C2C1CNC2 34a_100000045132_100011216708 [0,0,0,2,0,0|2,0,0]=4 33866 B14R2.3018 C(CC1CC1)NC[C@H]2COCCO2 2230a_100010981119_100000694398 [0,0,0,2,0,0|2,0,0]=4 33867 B14R2.3018 C(CC1CC1)NC[C@H]2COCCO2 34a_100010981119_100000694398 [0,0,0,2,0,0|2,0,0]=4 33868 B14R2.3018 C(CC1CCOCC1)NCC2CO2 2230a_100000755988_100011216344 [0,0,0,2,0,0|2,0,0]=4 33869 B14R2.3018 C(CC1CCOCC1)NCC2CO2 34a_100000755988_102125554688 [0,0,0,2,0,0|2,0,0]=4 33870 B14R2.3018 C(CC1CO1)NCC2CCOCC2 2230a_100000746373_100000732470 [0,0,0,2,0,0|2,0,0]=4 33871 B14R2.3018 C(CC1CO1)NCC2CCOCC2 34a_100000746373_100000732470 [0,0,0,2,0,0|2,0,0]=4 33872 B14R2.3018 C(CC1CO1)NCC2CCSCC2 2230a_100015188806_100000732470 [0,0,0,2,0,0|2,0,0]=4 33873 B14R2.3018 C(CC1CO1)NCC2CCSCC2 34a_100015188806_100000732470 [0,0,0,2,0,0|2,0,0]=4 33874 B14R2.3018 C(CC1CO1)OCC2CCSCC2 34a_100000070558_100000732470 [0,0,0,2,0,0|2,0,0]=4 33875 B14R2.3018 C(CC1CO1)OCC2CCSCC2 7a_100000070558_100000732470 [0,0,0,2,0,0|2,0,0]=4 33876 B14R2.3018 C(CNC1CCOCC1)CC2CO2 2230a_100000741149_100000733510 [0,0,0,2,0,0|2,0,0]=4 33877 B14R2.3018 C(CNC1CCOCC1)CC2CO2 34a_100000741149_100000733510 [0,0,0,2,0,0|2,0,0]=4 33878 B14R2.3018 C(CNC1CCSCC1)CC2CO2 2230a_100000748639_100000733510 [0,0,0,2,0,0|2,0,0]=4 33879 B14R2.3018 C(CNC1CCSCC1)CC2CO2 34a_100000748639_100000733510 [0,0,0,2,0,0|2,0,0]=4 33880 B14R2.3018 C(COC1CCCSC1)CC2CO2 7a_100015962668_100000733510 [0,0,0,2,0,0|2,0,0]=4 33881 B14R2.3018 C(COC1CCOCC1)CC2CO2 34a_100000744328_100000733510 [0,0,0,2,0,0|2,0,0]=4 33882 B14R2.3018 C(COC1CCSCC1)CC2CO2 34a_100000731022_100000733510 [0,0,0,2,0,0|2,0,0]=4 33883 B14R2.3018 C(COC1CCSCC1)CC2CO2 7a_100000731022_100000733510 [0,0,0,2,0,0|2,0,0]=4 33884 B14R2.3018 C(CSC1CCCOC1)CC2CO2 62a_100000733510_100000693364 [0,0,0,2,0,0|2,0,0]=4 33885 B14R2.3018 C(CSC1CCOCC1)CC2CO2 62a_100000733510_100011324220 [0,0,0,2,0,0|2,0,0]=4 33886 B14R2.3018 C(CSC1CCSCC1)CC2CO2 62a_100000733510_100000069128 [0,0,0,2,0,0|2,0,0]=4 33887 B14R2.3018 C1CC(CCN1)CCOCC2CO2 34a_100015190746_102125554688 [0,0,0,2,0,0|2,0,0]=4 33888 B14R2.3018 C1CC(CCN1)COCCC2CO2 34a_100000738675_100000732470 [0,0,0,2,0,0|2,0,0]=4 33889 B14R2.3018 C1CC(CCO1)CCOCC2CO2 34a_100011933979_102125554688 [0,0,0,2,0,0|2,0,0]=4 33890 B14R2.3018 C1CC(CCO1)CCOCC2CO2 7a_100011933979_102125554688 [0,0,0,2,0,0|2,0,0]=4 33891 B14R2.3018 C1CC(CCO1)CCOC[C@@H]2CO2 34a_100000757423_100011934994 [0,0,0,2,0,0|2,0,0]=4 33892 B14R2.3018 C1CC(CCO1)CCOC[C@@H]2CO2 7a_100011933979_100000745022 [0,0,0,2,0,0|2,0,0]=4 33893 B14R2.3018 C1CC(CCO1)CCSCC2CO2 62a_100011934994_102125554688 [0,0,0,2,0,0|2,0,0]=4 33894 B14R2.3018 C1CC(CCO1)CCSCC2CO2 62a_102125554688_100011934994 [0,0,0,2,0,0|2,0,0]=4 33895 B14R2.3018 C1CC(CCO1)CCSC[C@@H]2CO2 62a_100000745022_100011934994 [0,0,0,2,0,0|2,0,0]=4 33896 B14R2.3018 C1CC(CCO1)CCSC[C@@H]2CO2 62a_100011934994_100000745022 [0,0,0,2,0,0|2,0,0]=4 33897 B14R2.3018 C1CC(CCO1)COCCC2CO2 34a_100000749013_100000732470 [0,0,0,2,0,0|2,0,0]=4 33898 B14R2.3018 C1CC(CCO1)COCC[C@@H]2CO2 34a_100009820653_100000754603 [0,0,0,2,0,0|2,0,0]=4 33899 B14R2.3018 C1CC(CCO1)CSCCC2CO2 62a_100000732470_100000749018 [0,0,0,2,0,0|2,0,0]=4 33900 B14R2.3018 C1CC(CCO1)CSCCC2CO2 62a_100000754603_100000732470 [0,0,0,2,0,0|2,0,0]=4 33901 B14R2.3018 C1CCC(CC1)CCCNC2CC2 34a_100000212008_100011713725 [0,0,0,2,0,0|2,0,0]=4 33902 B14R2.3018 C1CCC(CC1)CCCNC2CC2 34a_100011211642_100000211595 [0,0,0,2,0,0|2,0,0]=4 33903 B14R2.3018 C1CCC(CC1)CCCOC2CC2 34a_100000198086_100000211595 [0,0,0,2,0,0|2,0,0]=4 33904 B14R2.3018 C1CCC(CC1)CCCSC2CC2 62a_100011713725_100000211595 [0,0,0,2,0,0|2,0,0]=4 33905 B14R2.3018 C1CCC(CC1)CCNCC2CC2 2230a_100000735609_100012355289 [0,0,0,2,0,0|2,0,0]=4 33906 B14R2.3018 C1CCC(CC1)CCNCC2CC2 2230a_100000738074_100000742324 [0,0,0,2,0,0|2,0,0]=4 33907 B14R2.3018 C1CCC(CC1)CCNCC2CC2 269862a_100000738074_100000741477 [0,0,0,2,0,0|2,0,0]=4 33908 B14R2.3018 C1CCC(CC1)CCNCC2CC2 270004a_100000735609_100011713444 [0,0,0,2,0,0|2,0,0]=4 33909 B14R2.3018 C1CCC(CC1)CCNCC2CC2 34a_100000735609_100011209188 [0,0,0,2,0,0|2,0,0]=4 33910 B14R2.3018 C1CCC(CC1)CCNCC2CC2 34a_100000738074_100000742324 [0,0,0,2,0,0|2,0,0]=4 33911 B14R2.3018 C1CCC(CC1)CCNCC2CO2 2230a_100000738074_100011216344 [0,0,0,2,0,0|1,0,0]=3 33912 B14R2.3018 C1CCC(CC1)CCNCC2CO2 34a_100000738074_102125554688 [0,0,0,2,0,0|1,0,0]=3 33913 B14R2.3018 C1CCC(CC1)CCOCC2CC2 34a_100000211283_100011209188 [0,0,0,2,0,0|2,0,0]=4 33914 B14R2.3018 C1CCC(CC1)CCOCC2CC2 34a_100011217863_100000742324 [0,0,0,2,0,0|2,0,0]=4 33915 B14R2.3018 C1CCC(CC1)CCOCC2CC2 7a_100011217863_100000742324 [0,0,0,2,0,0|2,0,0]=4 33916 B14R2.3018 C1CCC(CC1)CCOCC2CO2 34a_100011217863_102125554688 [0,0,0,2,0,0|1,0,0]=3 33917 B14R2.3018 C1CCC(CC1)CCOCC2CO2 7a_100011217863_102125554688 [0,0,0,2,0,0|1,0,0]=3 33918 B14R2.3018 C1CCC(CC1)CCOCC2CS2 7a_100011217863_100000031435 [0,0,0,2,0,0|1,1,0]=4 33919 B14R2.3018 C1CCC(CC1)CCOC[C@@H]2CO2 34a_100000757423_100011209188 [0,0,0,2,0,0|1,0,0]=3 33920 B14R2.3018 C1CCC(CC1)CCOC[C@@H]2CO2 7a_100011217863_100000745022 [0,0,0,2,0,0|1,0,0]=3 33921 B14R2.3018 C1CCC(CC1)CCSCC2CC2 62a_100000756562_100012355289 [0,0,0,2,0,0|2,0,0]=4 33922 B14R2.3018 C1CCC(CC1)CCSCC2CC2 62a_100012355289_100000742324 [0,0,0,2,0,0|2,0,0]=4 33923 B14R2.3018 C1CCC(CC1)CCSCC2CO2 62a_100012355289_102125554688 [0,0,0,2,0,0|1,0,0]=3 33924 B14R2.3018 C1CCC(CC1)CCSCC2CO2 62a_102125554688_100012355289 [0,0,0,2,0,0|1,0,0]=3 33925 B14R2.3018 C1CCC(CC1)CCSCC2CS2 62a_100000031435_100012355289 [0,0,0,2,0,0|1,1,0]=4 33926 B14R2.3018 C1CCC(CC1)CCSCC2CS2 62a_100012355289_100000031435 [0,0,0,2,0,0|1,1,0]=4 33927 B14R2.3018 C1CCC(CC1)CCSC[C@@H]2CO2 62a_100000745022_100012355289 [0,0,0,2,0,0|1,0,0]=3 33928 B14R2.3018 C1CCC(CC1)CCSC[C@@H]2CO2 62a_100012355289_100000745022 [0,0,0,2,0,0|1,0,0]=3 33929 B14R2.3018 C1CCC(CC1)CNCCC2CC2 2230a_100000210473_100000694398 [0,0,0,2,0,0|2,0,0]=4 33930 B14R2.3018 C1CCC(CC1)CNCCC2CC2 269862a_100000764129_100000211278 [0,0,0,2,0,0|2,0,0]=4 33931 B14R2.3018 C1CCC(CC1)CNCCC2CC2 34a_100000210473_100000694398 [0,0,0,2,0,0|2,0,0]=4 33932 B14R2.3018 C1CCC(CC1)CNCCC2CC2 34a_100000764129_100000211423 [0,0,0,2,0,0|2,0,0]=4 33933 B14R2.3018 C1CCC(CC1)CNCCC2CO2 2230a_100000210473_100000732470 [0,0,0,2,0,0|1,0,0]=3 33934 B14R2.3018 C1CCC(CC1)CNCCC2CO2 34a_100000210473_100000732470 [0,0,0,2,0,0|1,0,0]=3 33935 B14R2.3018 C1CCC(CC1)COCCC2CC2 34a_100000212181_100000694398 [0,0,0,2,0,0|2,0,0]=4 33936 B14R2.3018 C1CCC(CC1)COCCC2CC2 34a_100000754188_100000211423 [0,0,0,2,0,0|2,0,0]=4 33937 B14R2.3018 C1CCC(CC1)COCCC2CC2 7a_100000212181_100000764125 [0,0,0,2,0,0|2,0,0]=4 33938 B14R2.3018 C1CCC(CC1)COCCC2CC2 7a_100000754188_100000211423 [0,0,0,2,0,0|2,0,0]=4 33939 B14R2.3018 C1CCC(CC1)COCCC2CO2 34a_100000212181_100000732470 [0,0,0,2,0,0|1,0,0]=3 33940 B14R2.3018 C1CCC(CC1)COCCC2CO2 7a_100000212181_100000732470 [0,0,0,2,0,0|1,0,0]=3 33941 B14R2.3018 C1CCC(CC1)COCC[C@@H]2CO2 34a_100009820653_100000211423 [0,0,0,2,0,0|1,0,0]=3 33942 B14R2.3018 C1CCC(CC1)CSCCC2CC2 62a_100000211423_100000764125 [0,0,0,2,0,0|2,0,0]=4 33943 B14R2.3018 C1CCC(CC1)CSCCC2CC2 62a_100000764125_100000211423 [0,0,0,2,0,0|2,0,0]=4 33944 B14R2.3018 C1CCC(CC1)CSCCC2CO2 62a_100000211423_100000732470 [0,0,0,2,0,0|1,0,0]=3 33945 B14R2.3018 C1CCC(CC1)CSCCC2CO2 62a_100000732470_100000211423 [0,0,0,2,0,0|1,0,0]=3 33946 B14R2.3018 C1CCC(CC1)NCCCC2CO2 2230a_100000182618_100000733510 [0,0,0,2,0,0|1,0,0]=3 33947 B14R2.3018 C1CCC(CC1)NCCCC2CO2 34a_100000182618_100000733510 [0,0,0,2,0,0|1,0,0]=3 33948 B14R2.3018 C1CCC(CC1)OCCCC2CO2 34a_100000210231_100000733510 [0,0,0,2,0,0|1,0,0]=3 33949 B14R2.3018 C1CCC(CC1)OCCCC2CO2 7a_100000210231_100000733510 [0,0,0,2,0,0|1,0,0]=3 33950 B14R2.3018 C1CCC(CC1)OCOC[C@@H]2CO2 34a_100000757423_100011935260 [0,0,0,2,0,0|2,0,0]=4 33951 B14R2.3018 C1CCC(CC1)OCSCC2CO2 62a_100011935260_102125554688 [0,0,0,2,0,0|2,0,0]=4 33952 B14R2.3018 C1CCC(CC1)OCSCC2CO2 62a_102125554688_100011935260 [0,0,0,2,0,0|2,0,0]=4 33953 B14R2.3018 C1CCC(CC1)OCSC[C@@H]2CO2 62a_100000745022_100011935260 [0,0,0,2,0,0|2,0,0]=4 33954 B14R2.3018 C1CCC(CC1)OCSC[C@@H]2CO2 62a_100011935260_100000745022 [0,0,0,2,0,0|2,0,0]=4 33955 B14R2.3018 C1CCC(CC1)SCCCC2CO2 62a_100000210327_100000733510 [0,0,0,2,0,0|1,0,0]=3 33956 B14R2.3018 C1CCC(CC1)SCCCC2CO2 62a_100000733510_100000210327 [0,0,0,2,0,0|1,0,0]=3 33957 B14R2.3018 C1CCC(NC1)CCCOC2CC2 34a_100011934581_100000211595 [0,0,0,2,0,0|2,0,0]=4 33958 B14R2.3018 C1CCC(NC1)CCOCC2CC2 34a_100000211664_100000742324 [0,0,0,2,0,0|2,0,0]=4 33959 B14R2.3018 C1CCC(NC1)CCOCC2CO2 34a_100000211664_102125554688 [0,0,0,2,0,0|2,0,0]=4 33960 B14R2.3018 C1CCC(NC1)COCCC2CC2 34a_100000210821_100000694398 [0,0,0,2,0,0|2,0,0]=4 33961 B14R2.3018 C1CCC(NC1)COCCC2CO2 34a_100000210821_100000732470 [0,0,0,2,0,0|2,0,0]=4 33962 B14R2.3018 C1CCC(OC1)CCNCC2CC2 2230a_100015183643_100000742324 [0,0,0,2,0,0|1,0,0]=3 33963 B14R2.3018 C1CCC(OC1)CCNCC2CC2 269862a_100015183643_100000741477 [0,0,0,2,0,0|1,0,0]=3 33964 B14R2.3018 C1CCC(OC1)CCNCC2CC2 34a_100015183643_100000742324 [0,0,0,2,0,0|1,0,0]=3 33965 B14R2.3018 C1CCC(OC1)CCNCC2CO2 2230a_100015183643_100011216344 [0,0,0,2,0,0|2,0,0]=4 33966 B14R2.3018 C1CCC(OC1)CCNCC2CO2 34a_100015183643_102125554688 [0,0,0,2,0,0|2,0,0]=4 33967 B14R2.3018 C1CCC(OC1)CNCCC2CC2 2230a_100000174945_100000694398 [0,0,0,2,0,0|1,0,0]=3 33968 B14R2.3018 C1CCC(OC1)CNCCC2CC2 34a_100000174945_100000694398 [0,0,0,2,0,0|1,0,0]=3 33969 B14R2.3018 C1CCC(OC1)CNCCC2CC2 34a_100000764129_100000211543 [0,0,0,2,0,0|1,0,0]=3 33970 B14R2.3018 C1CCC(OC1)CNCCC2CO2 2230a_100000174945_100000732470 [0,0,0,2,0,0|2,0,0]=4 33971 B14R2.3018 C1CCC(OC1)CNCCC2CO2 34a_100000174945_100000732470 [0,0,0,2,0,0|2,0,0]=4 33972 B14R2.3018 C1CCC(OC1)COCCC2CC2 34a_100000211370_100000694398 [0,0,0,2,0,0|1,0,0]=3 33973 B14R2.3018 C1CCC(OC1)COCCC2CC2 34a_100000754188_100000211543 [0,0,0,2,0,0|1,0,0]=3 33974 B14R2.3018 C1CCC(OC1)COCCC2CC2 7a_100000211370_100000764125 [0,0,0,2,0,0|1,0,0]=3 33975 B14R2.3018 C1CCC(OC1)COCCC2CC2 7a_100000754188_100000211543 [0,0,0,2,0,0|1,0,0]=3 33976 B14R2.3018 C1CCC(OC1)COCCC2CO2 34a_100000211370_100000732470 [0,0,0,2,0,0|2,0,0]=4 33977 B14R2.3018 C1CCC(OC1)COCCC2CO2 7a_100000211370_100000732470 [0,0,0,2,0,0|2,0,0]=4 33978 B14R2.3018 C1CCC(OC1)COCC[C@@H]2CO2 34a_100009820653_100000211543 [0,0,0,2,0,0|2,0,0]=4 33979 B14R2.3018 C1CCC(OC1)CSCCC2CC2 62a_100000211543_100000764125 [0,0,0,2,0,0|1,0,0]=3 33980 B14R2.3018 C1CCC(OC1)CSCCC2CC2 62a_100000764125_100000211543 [0,0,0,2,0,0|1,0,0]=3 33981 B14R2.3018 C1CCC(OC1)CSCCC2CO2 62a_100000211543_100000732470 [0,0,0,2,0,0|2,0,0]=4 33982 B14R2.3018 C1CCC(OC1)CSCCC2CO2 62a_100000732470_100000211543 [0,0,0,2,0,0|2,0,0]=4 33983 B14R2.3018 C1CCC(OC1)OCCCC2CO2 34a_100000033831_100000733510 [0,0,0,2,0,0|2,0,0]=4 33984 B14R2.3018 C1CCC(OC1)OCCNC2CC2 34a_100000212008_100000744793 [0,0,0,2,0,0|2,0,0]=4 33985 B14R2.3018 C1CCC(OC1)OCCOC2CC2 34a_100000034223_100000211595 [0,0,0,2,0,0|2,0,0]=4 33986 B14R2.3018 C1CCC(OC1)OCCSC2CC2 62a_100000744793_100000211595 [0,0,0,2,0,0|2,0,0]=4 33987 B14R2.3018 C1CCN(CC1)CCOC[C@@H]2CO2 34a_100000757423_100000739454 [0,0,0,2,0,0|2,0,0]=4 33988 B14R2.3018 C1CCN(CC1)CCSCC2CO2 62a_100000739454_102125554688 [0,0,0,2,0,0|2,0,0]=4 33989 B14R2.3018 C1CCN(CC1)CCSCC2CO2 62a_102125554688_100000739454 [0,0,0,2,0,0|2,0,0]=4 33990 B14R2.3018 C1CCN(CC1)CCSC[C@@H]2CO2 62a_100000739454_100000745022 [0,0,0,2,0,0|2,0,0]=4 33991 B14R2.3018 C1CCN(CC1)CCSC[C@@H]2CO2 62a_100000745022_100000739454 [0,0,0,2,0,0|2,0,0]=4 33992 B14R2.3018 C1CNCC(C1)CCOCC2CO2 34a_100000752241_102125554688 [0,0,0,2,0,0|2,0,0]=4 33993 B14R2.3018 C1CNCC(C1)COCCC2CO2 34a_100000211344_100000732470 [0,0,0,2,0,0|2,0,0]=4 33994 B14R2.3018 C1COC(OC1)CCNCC2CC2 2230a_100000735609_100000764188 [0,0,0,2,0,0|2,0,0]=4 33995 B14R2.3018 C1COC(OC1)CCNCC2CC2 34a_100000735609_100000764188 [0,0,0,2,0,0|2,0,0]=4 33996 B14R2.3018 C1COC(OC1)CCOCC2CC2 34a_100000211283_100000764188 [0,0,0,2,0,0|2,0,0]=4 33997 B14R2.3018 C1COC(OC1)CCSCC2CC2 62a_100000756562_100000764188 [0,0,0,2,0,0|2,0,0]=4 33998 B14R2.3018 C1COC(OC1)CCSCC2CC2 62a_100000764188_100000742324 [0,0,0,2,0,0|2,0,0]=4 33999 B14R2.3018 C1COCC(C1)CNCCC2CO2 2230a_100000720124_100000732470 [0,0,0,2,0,0|2,0,0]=4 34000 B14R2.3018 C1COCC(C1)CNCCC2CO2 34a_100000720124_100000732470 [0,0,0,2,0,0|2,0,0]=4 34001 B14R2.3018 C1COCC(C1)COCCC2CO2 34a_100000741520_100000732470 [0,0,0,2,0,0|2,0,0]=4 34002 B14R2.3018 C1COCC(C1)COCC[C@@H]2CO2 34a_100009820653_100000741521 [0,0,0,2,0,0|2,0,0]=4 34003 B14R2.3018 C1COCC(C1)CSCCC2CO2 62a_100000732470_100000741521 [0,0,0,2,0,0|2,0,0]=4 34004 B14R2.3018 C1COCC(C1)CSCCC2CO2 62a_100000741521_100000732470 [0,0,0,2,0,0|2,0,0]=4 34005 B14R2.3018 C1COCC(C1)NCCCC2CO2 2230a_100000719290_100000733510 [0,0,0,2,0,0|2,0,0]=4 34006 B14R2.3018 C1COCC(C1)NCCCC2CO2 34a_100000719290_100000733510 [0,0,0,2,0,0|2,0,0]=4 34007 B14R2.3018 C1COCC(C1)OCCCC2CO2 34a_100000754041_100000733510 [0,0,0,2,0,0|2,0,0]=4 34008 B14R2.3018 C1CO[C@@H](CN1)COCCC2CC2 34a_100015189573_100000694398 [0,0,0,2,0,0|2,0,0]=4 34009 B14R2.3018 C1CO[C@H](CO1)COCCC2CC2 34a_100009875890_100000694398 [0,0,0,2,0,0|2,0,0]=4 34010 B14R2.3019 C1CC(C1)CNC[C@H]2COCCO2 2230a_100010981119_100000763275 [0,0,0,2,0,0|2,0,0]=4 34011 B14R2.3019 C1CC(C1)CNC[C@H]2COCCO2 269862a_100010981119_100000753134 [0,0,0,2,0,0|2,0,0]=4 34012 B14R2.3019 C1CC(C1)CNC[C@H]2COCCO2 34a_100010981119_100000763275 [0,0,0,2,0,0|2,0,0]=4 34013 B14R2.3019 C1CC(C1)COC[C@@H]2CNCCO2 34a_100015189573_100000763275 [0,0,0,2,0,0|2,0,0]=4 34014 B14R2.3019 C1CC(C1)COC[C@H]2COCCO2 34a_100009875890_100000763275 [0,0,0,2,0,0|2,0,0]=4 34015 B14R2.3019 C1CC(CCN1)COCC2CCO2 34a_100000738675_100000103362 [0,0,0,2,0,0|2,0,0]=4 34016 B14R2.3019 C1CC(CCO1)CNCC2CCO2 2230a_100000746373_100000103362 [0,0,0,2,0,0|2,0,0]=4 34017 B14R2.3019 C1CC(CCO1)CNCC2CCO2 34a_100000746373_100000103362 [0,0,0,2,0,0|2,0,0]=4 34018 B14R2.3019 C1CC(CCO1)CNC[C@@H]2CCO2 2230a_100020831831_100000754603 [0,0,0,2,0,0|2,0,0]=4 34019 B14R2.3019 C1CC(CCO1)CNC[C@@H]2CCO2 269862a_100020831831_100000749017 [0,0,0,2,0,0|2,0,0]=4 34020 B14R2.3019 C1CC(CCO1)CNC[C@@H]2CCO2 34a_100020831831_100000754603 [0,0,0,2,0,0|2,0,0]=4 34021 B14R2.3019 C1CC(CCO1)COCC2CCO2 34a_100000039022_100000754603 [0,0,0,2,0,0|2,0,0]=4 34022 B14R2.3019 C1CC(CCO1)COCC2CCO2 34a_100000749013_100000103362 [0,0,0,2,0,0|2,0,0]=4 34023 B14R2.3019 C1CC(CCO1)CSCC2CCO2 62a_100000103362_100000749018 [0,0,0,2,0,0|2,0,0]=4 34024 B14R2.3019 C1CC(CCO1)CSCC2CCO2 62a_100000754603_100000103362 [0,0,0,2,0,0|2,0,0]=4 34025 B14R2.3019 C1CC(O1)CNCC2CCSCC2 2230a_100015188806_100000103362 [0,0,0,2,0,0|2,0,0]=4 34026 B14R2.3019 C1CC(O1)CNCC2CCSCC2 34a_100015188806_100000103362 [0,0,0,2,0,0|2,0,0]=4 34027 B14R2.3019 C1CC(O1)COCC2CCSCC2 34a_100000070558_100000103362 [0,0,0,2,0,0|2,0,0]=4 34028 B14R2.3019 C1CC(O1)COCC2CCSCC2 7a_100000070558_100000103362 [0,0,0,2,0,0|2,0,0]=4 34029 B14R2.3019 C1CCC(CC1)CCCN2CCC2 269982a_100000754969_100011713725 [0,0,0,2,0,0|2,0,0]=4 34030 B14R2.3019 C1CCC(CC1)CCNC2CCC2 2230a_100000749019_100012355289 [0,0,0,2,0,0|2,0,0]=4 34031 B14R2.3019 C1CCC(CC1)CCNC2CCC2 270004a_100000738074_100000241760 [0,0,0,2,0,0|2,0,0]=4 34032 B14R2.3019 C1CCC(CC1)CCNC2CCC2 34a_100000738074_100000749161 [0,0,0,2,0,0|2,0,0]=4 34033 B14R2.3019 C1CCC(CC1)CCNC2CCC2 34a_100000749019_100011209188 [0,0,0,2,0,0|2,0,0]=4 34034 B14R2.3019 C1CCC(CC1)CCOC2CCC2 34a_100000748187_100011209188 [0,0,0,2,0,0|2,0,0]=4 34035 B14R2.3019 C1CCC(CC1)CCOC2CCC2 34a_100011217863_100000749161 [0,0,0,2,0,0|2,0,0]=4 34036 B14R2.3019 C1CCC(CC1)CCSC2CCC2 62a_100012355289_100000749161 [0,0,0,2,0,0|2,0,0]=4 34037 B14R2.3019 C1CCC(CC1)CNCC2CCC2 2230a_100000210473_100000763275 [0,0,0,2,0,0|2,0,0]=4 34038 B14R2.3019 C1CCC(CC1)CNCC2CCC2 2230a_100000738700_100000211423 [0,0,0,2,0,0|2,0,0]=4 34039 B14R2.3019 C1CCC(CC1)CNCC2CCC2 269862a_100000210473_100000753134 [0,0,0,2,0,0|2,0,0]=4 34040 B14R2.3019 C1CCC(CC1)CNCC2CCC2 269862a_100000738700_100000211278 [0,0,0,2,0,0|2,0,0]=4 34041 B14R2.3019 C1CCC(CC1)CNCC2CCC2 34a_100000210473_100000763275 [0,0,0,2,0,0|2,0,0]=4 34042 B14R2.3019 C1CCC(CC1)CNCC2CCC2 34a_100000738700_100000211423 [0,0,0,2,0,0|2,0,0]=4 34043 B14R2.3019 C1CCC(CC1)CNCC2CCO2 2230a_100000210473_100000103362 [0,0,0,2,0,0|1,0,0]=3 34044 B14R2.3019 C1CCC(CC1)CNCC2CCO2 34a_100000210473_100000103362 [0,0,0,2,0,0|1,0,0]=3 34045 B14R2.3019 C1CCC(CC1)CNC[C@@H]2CCO2 2230a_100020831831_100000211423 [0,0,0,2,0,0|1,0,0]=3 34046 B14R2.3019 C1CCC(CC1)CNC[C@@H]2CCO2 269862a_100020831831_100000211278 [0,0,0,2,0,0|1,0,0]=3 34047 B14R2.3019 C1CCC(CC1)CNC[C@@H]2CCO2 34a_100020831831_100000211423 [0,0,0,2,0,0|1,0,0]=3 34048 B14R2.3019 C1CCC(CC1)COCC2CCC2 34a_100000212181_100000763275 [0,0,0,2,0,0|2,0,0]=4 34049 B14R2.3019 C1CCC(CC1)COCC2CCC2 34a_100000760304_100000211423 [0,0,0,2,0,0|2,0,0]=4 34050 B14R2.3019 C1CCC(CC1)COCC2CCC2 7a_100000212181_100000763275 [0,0,0,2,0,0|2,0,0]=4 34051 B14R2.3019 C1CCC(CC1)COCC2CCO2 34a_100000039022_100000211423 [0,0,0,2,0,0|1,0,0]=3 34052 B14R2.3019 C1CCC(CC1)COCC2CCO2 34a_100000212181_100000103362 [0,0,0,2,0,0|1,0,0]=3 34053 B14R2.3019 C1CCC(CC1)COCC2CCO2 7a_100000212181_100000103362 [0,0,0,2,0,0|1,0,0]=3 34054 B14R2.3019 C1CCC(CC1)CSCC2CCC2 62a_100000211423_100000763275 [0,0,0,2,0,0|2,0,0]=4 34055 B14R2.3019 C1CCC(CC1)CSCC2CCC2 62a_100000763275_100000211423 [0,0,0,2,0,0|2,0,0]=4 34056 B14R2.3019 C1CCC(CC1)CSCC2CCO2 62a_100000103362_100000211423 [0,0,0,2,0,0|1,0,0]=3 34057 B14R2.3019 C1CCC(CC1)CSCC2CCO2 62a_100000211423_100000103362 [0,0,0,2,0,0|1,0,0]=3 34058 B14R2.3019 C1CCC(NC1)CCOC2CCC2 34a_100000211664_100000749161 [0,0,0,2,0,0|2,0,0]=4 34059 B14R2.3019 C1CCC(NC1)COCC2CCC2 34a_100000210821_100000763275 [0,0,0,2,0,0|2,0,0]=4 34060 B14R2.3019 C1CCC(NC1)COCC2CCO2 34a_100000210821_100000103362 [0,0,0,2,0,0|2,0,0]=4 34061 B14R2.3019 C1CCC(OC1)CCNC2CCC2 270004a_100015183643_100000241760 [0,0,0,2,0,0|1,0,0]=3 34062 B14R2.3019 C1CCC(OC1)CCNC2CCC2 34a_100015183643_100000749161 [0,0,0,2,0,0|1,0,0]=3 34063 B14R2.3019 C1CCC(OC1)CCNC2COC2 34a_100015183643_100009818527 [0,0,0,2,0,0|2,0,0]=4 34064 B14R2.3019 C1CCC(OC1)CNCC2CCC2 2230a_100000174945_100000763275 [0,0,0,2,0,0|1,0,0]=3 34065 B14R2.3019 C1CCC(OC1)CNCC2CCC2 2230a_100000738700_100000211543 [0,0,0,2,0,0|1,0,0]=3 34066 B14R2.3019 C1CCC(OC1)CNCC2CCC2 269862a_100000174945_100000753134 [0,0,0,2,0,0|1,0,0]=3 34067 B14R2.3019 C1CCC(OC1)CNCC2CCC2 34a_100000174945_100000763275 [0,0,0,2,0,0|1,0,0]=3 34068 B14R2.3019 C1CCC(OC1)CNCC2CCC2 34a_100000738700_100000211543 [0,0,0,2,0,0|1,0,0]=3 34069 B14R2.3019 C1CCC(OC1)CNCC2CCO2 2230a_100000174945_100000103362 [0,0,0,2,0,0|2,0,0]=4 34070 B14R2.3019 C1CCC(OC1)CNCC2CCO2 34a_100000174945_100000103362 [0,0,0,2,0,0|2,0,0]=4 34071 B14R2.3019 C1CCC(OC1)CNCC2COC2 2230a_100000174945_100010264016 [0,0,0,2,0,0|2,0,0]=4 34072 B14R2.3019 C1CCC(OC1)CNCC2COC2 2230a_100015281925_100000211543 [0,0,0,2,0,0|2,0,0]=4 34073 B14R2.3019 C1CCC(OC1)CNCC2COC2 34a_100000174945_100010264016 [0,0,0,2,0,0|2,0,0]=4 34074 B14R2.3019 C1CCC(OC1)CNCC2COC2 34a_100015281925_100000211543 [0,0,0,2,0,0|2,0,0]=4 34075 B14R2.3019 C1CCC(OC1)CNC[C@@H]2CCO2 2230a_100020831831_100000211543 [0,0,0,2,0,0|2,0,0]=4 34076 B14R2.3019 C1CCC(OC1)CNC[C@@H]2CCO2 34a_100020831831_100000211543 [0,0,0,2,0,0|2,0,0]=4 34077 B14R2.3019 C1CCC(OC1)COCC2CCC2 34a_100000211370_100000763275 [0,0,0,2,0,0|1,0,0]=3 34078 B14R2.3019 C1CCC(OC1)COCC2CCC2 34a_100000760304_100000211543 [0,0,0,2,0,0|1,0,0]=3 34079 B14R2.3019 C1CCC(OC1)COCC2CCC2 7a_100000211370_100000763275 [0,0,0,2,0,0|1,0,0]=3 34080 B14R2.3019 C1CCC(OC1)COCC2CCO2 34a_100000039022_100000211543 [0,0,0,2,0,0|2,0,0]=4 34081 B14R2.3019 C1CCC(OC1)COCC2CCO2 34a_100000211370_100000103362 [0,0,0,2,0,0|2,0,0]=4 34082 B14R2.3019 C1CCC(OC1)COCC2CCO2 7a_100000211370_100000103362 [0,0,0,2,0,0|2,0,0]=4 34083 B14R2.3019 C1CCC(OC1)COCC2CNC2 34a_100016987283_100000211543 [0,0,0,2,0,0|2,0,0]=4 34084 B14R2.3019 C1CCC(OC1)COCC2COC2 34a_100000060846_100000211543 [0,0,0,2,0,0|2,0,0]=4 34085 B14R2.3019 C1CCC(OC1)COCC2COC2 34a_100000211370_100010264016 [0,0,0,2,0,0|2,0,0]=4 34086 B14R2.3019 C1CCC(OC1)COCC2COC2 7a_100000211370_100010264016 [0,0,0,2,0,0|2,0,0]=4 34087 B14R2.3019 C1CCC(OC1)CSCC2CCC2 62a_100000211543_100000763275 [0,0,0,2,0,0|1,0,0]=3 34088 B14R2.3019 C1CCC(OC1)CSCC2CCC2 62a_100000763275_100000211543 [0,0,0,2,0,0|1,0,0]=3 34089 B14R2.3019 C1CCC(OC1)CSCC2CCO2 62a_100000103362_100000211543 [0,0,0,2,0,0|2,0,0]=4 34090 B14R2.3019 C1CCC(OC1)CSCC2CCO2 62a_100000211543_100000103362 [0,0,0,2,0,0|2,0,0]=4 34091 B14R2.3019 C1CCC(OC1)CSCC2COC2 62a_100000211543_100010264016 [0,0,0,2,0,0|2,0,0]=4 34092 B14R2.3019 C1CCC(OC1)CSCC2COC2 62a_100010264016_100000211543 [0,0,0,2,0,0|2,0,0]=4 34093 B14R2.3019 C1CCC(OC1)OCCN2CCC2 269982a_100000754969_100000744793 [0,0,0,2,0,0|2,0,0]=4 34094 B14R2.3019 C1CNCC(C1)COCC2CCO2 34a_100000211344_100000103362 [0,0,0,2,0,0|2,0,0]=4 34095 B14R2.3019 C1COC(OC1)CCNC2CCC2 2230a_100000749019_100000764188 [0,0,0,2,0,0|2,0,0]=4 34096 B14R2.3019 C1COC(OC1)CCNC2CCC2 34a_100000749019_100000764188 [0,0,0,2,0,0|2,0,0]=4 34097 B14R2.3019 C1COC(OC1)CCOC2CCC2 34a_100000748187_100000764188 [0,0,0,2,0,0|2,0,0]=4 34098 B14R2.3019 C1COC(OC1)CCSC2CCC2 62a_100000764188_100000749161 [0,0,0,2,0,0|2,0,0]=4 34099 B14R2.3019 C1COCC(C1)CNCC2CCO2 2230a_100000720124_100000103362 [0,0,0,2,0,0|2,0,0]=4 34100 B14R2.3019 C1COCC(C1)CNCC2CCO2 34a_100000720124_100000103362 [0,0,0,2,0,0|2,0,0]=4 34101 B14R2.3019 C1COCC(C1)CNC[C@@H]2CCO2 2230a_100020831831_100000741521 [0,0,0,2,0,0|2,0,0]=4 34102 B14R2.3019 C1COCC(C1)CNC[C@@H]2CCO2 34a_100020831831_100000741521 [0,0,0,2,0,0|2,0,0]=4 34103 B14R2.3019 C1COCC(C1)COCC2CCO2 34a_100000039022_100000741521 [0,0,0,2,0,0|2,0,0]=4 34104 B14R2.3019 C1COCC(C1)COCC2CCO2 34a_100000741520_100000103362 [0,0,0,2,0,0|2,0,0]=4 34105 B14R2.3019 C1COCC(C1)CSCC2CCO2 62a_100000103362_100000741521 [0,0,0,2,0,0|2,0,0]=4 34106 B14R2.3019 C1COCC(C1)CSCC2CCO2 62a_100000741521_100000103362 [0,0,0,2,0,0|2,0,0]=4 34107 B14R2.3019 C1C[C@H](O1)CNCC2CCSCC2 269862a_100020831831_100000067145 [0,0,0,2,0,0|2,0,0]=4 34108 B14R2.3019 C1C[C@H](O1)CNCC2CCSCC2 270004a_100020831831_100000067145 [0,0,0,2,0,0|2,0,0]=4 34109 B14R2.3316 CCCCCN1CC2CCC1CC2 2230a_100000750499_100000210326 [0,0,0,2,0,0|2,0,0]=4 34110 B14R2.3316 CCCCCN1CC2CCC1CC2 269982a_100000750499_100000210215 [0,0,0,2,0,0|2,0,0]=4 34111 B14R2.3316 CCCCCN1CC2CCC1CC2 34a_100000750499_100000718602 [0,0,0,2,0,0|2,0,0]=4 34112 B14R2.3316 FCCCCN1CC2CCC1CC2 2230a_100000750499_100000729493 [0,0,0,2,0,0|2,0,0]=4 34113 B14R2.3316 FCCCCN1CC2CCC1CC2 269982a_100000750499_100000729493 [0,0,0,2,0,0|2,0,0]=4 34114 B14R2.3316 FCCCCN1CC2CCC1CC2 34a_100000750499_100000729493 [0,0,0,2,0,0|2,0,0]=4 34115 B14R2.3316 OCCCCN1CC2CCC1CC2 2230a_100000750499_100000210776 [0,0,0,2,0,0|1,0,0]=3 34116 B14R2.3316 OCCCCN1CC2CCC1CC2 269982a_100000750499_100000210776 [0,0,0,2,0,0|1,0,0]=3 34117 B14R2.3316 OCCCCN1CC2CCC1CC2 34a_100000750499_100011216708 [0,0,0,2,0,0|1,0,0]=3 34118 B14R2.3316 OCCCN[C@H]1CN2CCC1CC2 2230a_100016987387_100000230001 [0,0,0,2,0,0|2,0,0]=4 34119 B14R2.4411 BrCCCCOC1C2CCC1CC2 34a_100011216708_100009813300 [0,0,0,2,0,0|2,0,0]=4 34120 B14R2.4411 CCCCCCN1C2CCC1CC2 2230a_100000735658_100000210314 [0,0,0,2,0,0|2,0,0]=4 34121 B14R2.4411 CCCCCCN1C2CCC1CC2 269982a_100000735658_100000210757 [0,0,0,2,0,0|2,0,0]=4 34122 B14R2.4411 CCCCCCN1C2CCC1CC2 34a_100000735658_100000210314 [0,0,0,2,0,0|2,0,0]=4 34123 B14R2.4411 CCCCCOC1C2CCC1CC2 34a_100000210253_100009813300 [0,0,0,2,0,0|2,0,0]=4 34124 B14R2.4411 CCCCCSC1C2CCC1CC2 62a_100000210326_100009813300 [0,0,0,2,0,0|2,0,0]=4 34125 B14R2.4411 CCCCCSC1C2CCC1CC2 62a_100009813300_100000210326 [0,0,0,2,0,0|2,0,0]=4 34126 B14R2.4411 ClCCCCOC1C2CCC1CC2 34a_100000210776_100009813300 [0,0,0,2,0,0|2,0,0]=4 34127 B14R2.4411 FCCCCCN1C2CCC1CC2 2230a_100000735658_100000729378 [0,0,0,2,0,0|2,0,0]=4 34128 B14R2.4411 FCCCCCN1C2CCC1CC2 269982a_100000735658_100000729378 [0,0,0,2,0,0|2,0,0]=4 34129 B14R2.4411 FCCCCCN1C2CCC1CC2 34a_100000735658_100000729378 [0,0,0,2,0,0|2,0,0]=4 34130 B14R2.4411 FCCCCOC1C2CCC1CC2 34a_100011995726_100009813300 [0,0,0,2,0,0|2,0,0]=4 34131 B14R2.4411 FCCCCSC1C2CCC1CC2 62a_100000729493_100009813300 [0,0,0,2,0,0|2,0,0]=4 34132 B14R2.4411 FCCCCSC1C2CCC1CC2 62a_100009813300_100000729493 [0,0,0,2,0,0|2,0,0]=4 34133 B14R2.4411 ICCCCOC1C2CCC1CC2 34a_200012148704_100009813300 [0,0,0,2,0,0|2,0,0]=4 34134 B14R2.4411 NCCCCOC1C2CCC1CC2 34a_100000750430_100009813300 [0,0,0,2,0,0|2,0,0]=4 34135 B14R2.4411 OCCCCCN1C2CCC1CC2 2230a_100000735658_100000746330 [0,0,0,2,0,0|1,0,0]=3 34136 B14R2.4411 OCCCCCN1C2CCC1CC2 269982a_100000735658_100000746330 [0,0,0,2,0,0|1,0,0]=3 34137 B14R2.4411 OCCCCCN1C2CCC1CC2 34a_100000735658_100000746330 [0,0,0,2,0,0|1,0,0]=3 34138 B14R2.4411 OCCCCNC1C2CCC1CC2 34a_100000750430_100009813300 [0,0,0,2,0,0|1,0,0]=3 34139 B14R2.4411 OCCCCSC1C2CCC1CC2 62a_100000210776_100009813300 [0,0,0,2,0,0|1,0,0]=3 34140 B14R2.4411 OCCCCSC1C2CCC1CC2 62a_100009813300_100000210776 [0,0,0,2,0,0|1,0,0]=3 34141 B14R2.4411 OCCOCCN1C2CCC1CC2 2230a_100000735658_100011215305 [0,0,0,2,0,0|2,0,0]=4 34142 B14R2.4411 OCCOCCN1C2CCC1CC2 269982a_100000735658_100011215305 [0,0,0,2,0,0|2,0,0]=4 34143 B14R2.4411 OCCOCCN1C2CCC1CC2 34a_100000735658_100000692535 [0,0,0,2,0,0|2,0,0]=4 34144 B14R2.7150 CCCN1CCCC2C1CCCC2 2230a_100000211887_100000210303 [0,0,0,2,0,0|2,0,0]=4 34145 B14R2.7150 CCCN1CCCC2C1CCCC2 269982a_100000211887_100000210303 [0,0,0,2,0,0|2,0,0]=4 34146 B14R2.7150 CCCN1CCCC2C1CCCC2 34a_100000211887_100000210303 [0,0,0,2,0,0|2,0,0]=4 34147 B14R2.7150 CCNC1CCCC2C1CCCC2 269862a_100015525214_100000032293 [0,0,0,2,0,0|2,0,0]=4 34148 B14R2.7150 CCOC1CCCC2C1CCCC2 34a_100000042559_100000210202 [0,0,0,2,0,0|2,0,0]=4 34149 B14R2.7150 CCOC1CCCC2C1CCCC2 7a_100000042559_100000210202 [0,0,0,2,0,0|2,0,0]=4 34150 B14R2.7150 FCCN1CCCC2C1CCCC2 2230a_100000211887_100011217306 [0,0,0,2,0,0|2,0,0]=4 34151 B14R2.7150 FCCN1CCCC2C1CCCC2 269982a_100000211887_100011217306 [0,0,0,2,0,0|2,0,0]=4 34152 B14R2.7150 FCCN1CCCC2C1CCCC2 34a_100000211887_100011217306 [0,0,0,2,0,0|2,0,0]=4 34153 B14R2.7150 FCOC1CCCC2C1CCCC2 34a_100000042559_100015361967 [0,0,0,2,0,0|2,0,0]=4 34154 B14R2.7150 FCOC1CCCC2C1CCCC2 7a_100000042559_100015361967 [0,0,0,2,0,0|2,0,0]=4 34155 B14R2.7150 OCCN1CCCC2C1CCCC2 2230a_100000211887_100000211926 [0,0,0,2,0,0|1,0,0]=3 34156 B14R2.7150 OCCN1CCCC2C1CCCC2 269982a_100000211887_100000211926 [0,0,0,2,0,0|1,0,0]=3 34157 B14R2.7150 OCCN1CCCC2C1CCCC2 34a_100000211887_100000211926 [0,0,0,2,0,0|1,0,0]=3 34158 B14R2.7150 OCCN1CCOC2C1CCCC2 2230a_200000741227_100000211926 [0,0,0,2,0,0|2,0,0]=4 34159 B14R2.7150 OCCN1CCOC2C1CCCC2 269982a_200000741227_100000211926 [0,0,0,2,0,0|2,0,0]=4 34160 B14R2.7150 OCCN1CCOC2C1CCCC2 34a_200000741227_100000211926 [0,0,0,2,0,0|2,0,0]=4 34161 B14R2.10953 CCCCCCCN1CC2CC2C1 2230a_100000741873_100000210681 [0,0,0,2,0,0|2,0,0]=4 34162 B14R2.10953 CCCCCCCN1CC2CC2C1 269982a_100000741873_100000210681 [0,0,0,2,0,0|2,0,0]=4 34163 B14R2.10953 CCCCCCCN1CC2CC2C1 34a_100000741873_100000210614 [0,0,0,2,0,0|2,0,0]=4 34164 B14R2.10953 CCCCCCNC1CC2CC2C1 270004a_100000210581_100010340937 [0,0,0,2,0,0|2,0,0]=4 34165 B14R2.10953 FCCCCCCN1CC2CC2C1 2230a_100000741873_100015922095 [0,0,0,2,0,0|2,0,0]=4 34166 B14R2.10953 FCCCCCCN1CC2CC2C1 269982a_100000741873_100015922095 [0,0,0,2,0,0|2,0,0]=4 34167 B14R2.10953 FCCCCCCN1CC2CC2C1 34a_100000741873_100015922095 [0,0,0,2,0,0|2,0,0]=4 34168 B14R2.10953 OCCCCCCN1CC2CC2C1 2230a_100000741873_100000766143 [0,0,0,2,0,0|1,0,0]=3 34169 B14R2.10953 OCCCCCCN1CC2CC2C1 269982a_100000741873_100000766143 [0,0,0,2,0,0|1,0,0]=3 34170 B14R2.10953 OCCCCCCN1CC2CC2C1 34a_100000741873_100000766143 [0,0,0,2,0,0|1,0,0]=3 34171 B14R2.10953 OCCCCCNC1CC2CC2C1 270004a_100000762737_100010340937 [0,0,0,2,0,0|1,0,0]=3 34172 B14R2.10953 OCCOCCNC1CC2CC2C1 270004a_100000211614_100010340937 [0,0,0,2,0,0|2,0,0]=4 34173 B14R2.10953 OCCSCCNC1CC2CC2C1 270004a_100011219999_100010340937 [0,0,0,2,0,0|2,0,0]=4 34174 B14R2.13702 CCCCCCNC1CCC2C1C2 269862a_100000210581_100000692480 [0,0,0,2,0,0|2,0,0]=4 34175 B14R2.13702 CCCCCCNC1CCC2C1C2 270004a_100000210581_100000692480 [0,0,0,2,0,0|2,0,0]=4 34176 B14R2.13702 CCCCCCOC1CCC2C1C2 34a_200012295571_100000210314 [0,0,0,2,0,0|2,0,0]=4 34177 B14R2.13702 FCCCCCOC1CCC2C1C2 34a_200012295571_100000729378 [0,0,0,2,0,0|2,0,0]=4 34178 B14R2.13702 OCCCCCNC1CCC2C1C2 269862a_100000762737_100000692480 [0,0,0,2,0,0|1,0,0]=3 34179 B14R2.13702 OCCCCCNC1CCC2C1C2 270004a_100000762737_100000692480 [0,0,0,2,0,0|1,0,0]=3 34180 B14R2.13702 OCCCCCOC1CCC2C1C2 34a_200012295571_100000746330 [0,0,0,2,0,0|1,0,0]=3 34181 B14R2.13702 OCCOCCNC1CCC2C1C2 269862a_100000211614_100000692480 [0,0,0,2,0,0|2,0,0]=4 34182 B14R2.13702 OCCOCCNC1CCC2C1C2 270004a_100000211614_100000692480 [0,0,0,2,0,0|2,0,0]=4 34183 B14R2.13702 OCCOCCOC1CCC2C1C2 34a_200012295571_100000692535 [0,0,0,2,0,0|2,0,0]=4 34184 B14R2.13702 OCCSCCNC1CCC2C1C2 269862a_100011219999_100000692480 [0,0,0,2,0,0|2,0,0]=4 34185 B14R2.13702 OCCSCCNC1CCC2C1C2 270004a_100011219999_100000692480 [0,0,0,2,0,0|2,0,0]=4 34186 B14R2.98 CCC1CCCCC1N2CCCC2 270004a_100000188435_100000757040 [0,0,0,2,0,0|2,0,0]=4 34187 B14R2.98 CCC1CCCCN1C2CCCC2 2230a_100000210034_100000179811 [0,0,0,2,0,0|2,0,0]=4 34188 B14R2.98 CCC1CCCCN1C2CCCC2 269982a_100000210034_100000179811 [0,0,0,2,0,0|2,0,0]=4 34189 B14R2.98 CCC1CCCCN1C2CCCC2 270004a_100000210034_100000210133 [0,0,0,2,0,0|2,0,0]=4 34190 B14R2.98 CCC1CCCCN1C2CCCC2 34a_100000210034_100000179811 [0,0,0,2,0,0|2,0,0]=4 34191 B14R2.98 OCC1CCCCC1N2CCCC2 270004a_100000188435_100009861125 [0,0,0,2,0,0|1,0,0]=3 34192 B14R2.98 OCC1CCCCC1N2CCSC2 270004a_100011215254_100009861125 [0,0,0,2,0,0|2,0,0]=4 34193 B14R2.98 OCC1CCCCN1C2CCCC2 2230a_100000210821_100000179811 [0,0,0,2,0,0|1,0,0]=3 34194 B14R2.98 OCC1CCCCN1C2CCCC2 269982a_100000210821_100000179811 [0,0,0,2,0,0|1,0,0]=3 34195 B14R2.98 OCC1CCCCN1C2CCCC2 34a_100000210821_100000179811 [0,0,0,2,0,0|1,0,0]=3 34196 B14R2.98 OCC1CCCCN1C2CCOC2 2230a_100000210821_100000731011 [0,0,0,2,0,0|2,0,0]=4 34197 B14R2.98 OCC1CCCCN1C2CCOC2 269982a_100000210821_100000731011 [0,0,0,2,0,0|2,0,0]=4 34198 B14R2.98 OCC1CCCCN1C2CCOC2 34a_100000210821_100000690089 [0,0,0,2,0,0|2,0,0]=4 34199 B14R2.98 OC[C@@H]1COCCN1C2CCCC2 2230a_100000717676_100000179811 [0,0,0,2,0,0|2,0,0]=4 34200 B14R2.98 OC[C@@H]1COCCN1C2CCCC2 269982a_100000717676_100000179811 [0,0,0,2,0,0|2,0,0]=4 34201 B14R2.98 OC[C@@H]1COCCN1C2CCCC2 270004a_100000717676_100000210133 [0,0,0,2,0,0|2,0,0]=4 34202 B14R2.98 OC[C@@H]1COCCN1C2CCCC2 34a_100000717676_100000179811 [0,0,0,2,0,0|2,0,0]=4 34203 B14R2.112 CCCN1CCC2CCCCC2C1 2230a_100000211783_100000210303 [0,0,0,2,0,0|2,0,0]=4 34204 B14R2.112 CCCN1CCC2CCCCC2C1 269982a_100000211783_100000210303 [0,0,0,2,0,0|2,0,0]=4 34205 B14R2.112 CCCN1CCC2CCCCC2C1 34a_100000211783_100000210303 [0,0,0,2,0,0|2,0,0]=4 34206 B14R2.112 CCNC1CCC2CCCCC2C1 270004a_100015525214_100000211418 [0,0,0,2,0,0|2,0,0]=4 34207 B14R2.112 CCOC1CCC2CCCCC2C1 34a_100000211317_100000210202 [0,0,0,2,0,0|2,0,0]=4 34208 B14R2.112 CCOC1CCC2CCCCC2C1 7a_100000211317_100000210202 [0,0,0,2,0,0|2,0,0]=4 34209 B14R2.112 FCCN1CCC2CCCCC2C1 2230a_100000211783_100011217306 [0,0,0,2,0,0|2,0,0]=4 34210 B14R2.112 FCCN1CCC2CCCCC2C1 269982a_100000211783_100011217306 [0,0,0,2,0,0|2,0,0]=4 34211 B14R2.112 FCCN1CCC2CCCCC2C1 34a_100000211783_100011217306 [0,0,0,2,0,0|2,0,0]=4 34212 B14R2.112 FCOC1CCC2CCCCC2C1 34a_100000211317_100015361967 [0,0,0,2,0,0|2,0,0]=4 34213 B14R2.112 FCOC1CCC2CCCCC2C1 7a_100000211317_100015361967 [0,0,0,2,0,0|2,0,0]=4 34214 B14R2.112 OCCN1CCC2CCCCC2C1 2230a_100000211783_100000211926 [0,0,0,2,0,0|1,0,0]=3 34215 B14R2.112 OCCN1CCC2CCCCC2C1 269982a_100000211783_100000211926 [0,0,0,2,0,0|1,0,0]=3 34216 B14R2.112 OCCN1CCC2CCCCC2C1 34a_100000211783_100000211926 [0,0,0,2,0,0|1,0,0]=3 34217 B14R2.112 OCCN1CCN2CCCCC2C1 2230a_100000746566_100000211926 [0,0,0,2,0,0|2,0,0]=4 34218 B14R2.112 OCCN1CCN2CCCCC2C1 269982a_100000746566_100000211926 [0,0,0,2,0,0|2,0,0]=4 34219 B14R2.112 OCCN1CCN2CCCCC2C1 34a_100000746566_100000211926 [0,0,0,2,0,0|2,0,0]=4 34220 B14R2.1914 CCC1CCCCC1NC2CCC2 269862a_100000749019_100000757040 [0,0,0,2,0,0|2,0,0]=4 34221 B14R2.1914 CCC1CCCCC1OC2CCC2 34a_100000210738_100000749161 [0,0,0,2,0,0|2,0,0]=4 34222 B14R2.1914 CCC1CCCCN1CC2CCC2 2230a_100000210034_100000763275 [0,0,0,2,0,0|2,0,0]=4 34223 B14R2.1914 CCC1CCCCN1CC2CCC2 269982a_100000210034_100000763275 [0,0,0,2,0,0|2,0,0]=4 34224 B14R2.1914 CCC1CCCCN1CC2CCC2 34a_100000210034_100000763275 [0,0,0,2,0,0|2,0,0]=4 34225 B14R2.1914 CCC1CCCCN1CC2CCO2 2230a_100000210034_100000103362 [0,0,0,2,0,0|1,0,0]=3 34226 B14R2.1914 CCC1CCCCN1CC2CCO2 269982a_100000210034_100000103362 [0,0,0,2,0,0|1,0,0]=3 34227 B14R2.1914 CCC1CCCCN1CC2CCO2 34a_100000210034_100000103362 [0,0,0,2,0,0|1,0,0]=3 34228 B14R2.1914 CC[C@H]1COCCN1CC2CCO2 2230a_100016988097_100000103362 [0,0,0,2,0,0|2,0,0]=4 34229 B14R2.1914 CC[C@H]1COCCN1CC2CCO2 269982a_100016988097_100000103362 [0,0,0,2,0,0|2,0,0]=4 34230 B14R2.1914 CC[C@H]1COCCN1CC2CCO2 34a_100016988097_100000103362 [0,0,0,2,0,0|2,0,0]=4 34231 B14R2.1914 NCC1CCCCC1OC2CCC2 34a_100011216029_100000749161 [0,0,0,2,0,0|2,0,0]=4 34232 B14R2.1914 OCC1CCCCC1NC2COC2 270004a_100016991112_100009861125 [0,0,0,2,0,0|2,0,0]=4 34233 B14R2.1914 OCC1CCCCC1NC2CSC2 270004a_100016994217_100009861125 [0,0,0,2,0,0|2,0,0]=4 34234 B14R2.1914 OCC1CCCCN1CC2CCC2 2230a_100000210821_100000763275 [0,0,0,2,0,0|1,0,0]=3 34235 B14R2.1914 OCC1CCCCN1CC2CCC2 269982a_100000210821_100000763275 [0,0,0,2,0,0|1,0,0]=3 34236 B14R2.1914 OCC1CCCCN1CC2CCC2 34a_100000210821_100000763275 [0,0,0,2,0,0|1,0,0]=3 34237 B14R2.1914 OCC1CCCCN1CC2CCO2 2230a_100000210821_100000103362 [0,0,0,2,0,0|2,0,0]=4 34238 B14R2.1914 OCC1CCCCN1CC2CCO2 269982a_100000210821_100000103362 [0,0,0,2,0,0|2,0,0]=4 34239 B14R2.1914 OCC1CCCCN1CC2CCO2 34a_100000210821_100000103362 [0,0,0,2,0,0|2,0,0]=4 34240 B14R2.1914 OCC1CCCCN1CC2COC2 2230a_100000210821_100010264016 [0,0,0,2,0,0|2,0,0]=4 34241 B14R2.1914 OCC1CCCCN1CC2COC2 269982a_100000210821_100010264016 [0,0,0,2,0,0|2,0,0]=4 34242 B14R2.1914 OCC1CCCCN1CC2COC2 34a_100000210821_100010264016 [0,0,0,2,0,0|2,0,0]=4 34243 B14R2.1914 OCC1COCCC1NC2CCC2 270004a_214813039666_100000241760 [0,0,0,2,0,0|2,0,0]=4 34244 B14R2.1914 OCC1COCCC1NC2CCC2 34a_214813039666_100000749161 [0,0,0,2,0,0|2,0,0]=4 34245 B14R2.1914 OC[C@@H]1COCCN1CC2CCC2 2230a_100000717676_100000763275 [0,0,0,2,0,0|2,0,0]=4 34246 B14R2.1914 OC[C@@H]1COCCN1CC2CCC2 269982a_100000717676_100000763275 [0,0,0,2,0,0|2,0,0]=4 34247 B14R2.1914 OC[C@@H]1COCCN1CC2CCC2 34a_100000717676_100000763275 [0,0,0,2,0,0|2,0,0]=4 34248 B14R2.9640 OCCCCN1C2CCC1COC2 2230a_100015205251_100000210776 [0,0,0,2,0,0|2,0,0]=4 34249 B14R2.9640 OCCCCN1C2CCC1COC2 269982a_100015205251_100000210776 [0,0,0,2,0,0|2,0,0]=4 34250 B14R2.9640 OCCCCN1C2CCC1COC2 34a_100015205251_100011216708 [0,0,0,2,0,0|2,0,0]=4 34251 B14R2.11625 CCC1CCCCC1NCC2CC2 270004a_100000735609_100000757040 [0,0,0,2,0,0|2,0,0]=4 34252 B14R2.11625 CCC1CCCCC1OCC2CC2 34a_100000210738_100000742324 [0,0,0,2,0,0|2,0,0]=4 34253 B14R2.11625 CCC1CCCCC1OCC2CC2 7a_100000210738_100000742324 [0,0,0,2,0,0|2,0,0]=4 34254 B14R2.11625 CCC1CCCCC1OCC2CO2 34a_100000210738_102125554688 [0,0,0,2,0,0|1,0,0]=3 34255 B14R2.11625 CCC1CCCCC1OCC2CO2 7a_100000210738_102125554688 [0,0,0,2,0,0|1,0,0]=3 34256 B14R2.11625 CCC1CCCCC1OCC2CS2 7a_100000210738_100000031435 [0,0,0,2,0,0|1,1,0]=4 34257 B14R2.11625 CCC1CCCCC1OC[C@@H]2CO2 7a_100000210738_100000745022 [0,0,0,2,0,0|1,0,0]=3 34258 B14R2.11625 CCC1CCCCN1CCC2CC2 2230a_100000210034_100000694398 [0,0,0,2,0,0|2,0,0]=4 34259 B14R2.11625 CCC1CCCCN1CCC2CC2 269982a_100000210034_100000694398 [0,0,0,2,0,0|2,0,0]=4 34260 B14R2.11625 CCC1CCCCN1CCC2CC2 34a_100000210034_100000694398 [0,0,0,2,0,0|2,0,0]=4 34261 B14R2.11625 CCC1CCCCN1CCC2CO2 2230a_100000210034_100000732470 [0,0,0,2,0,0|1,0,0]=3 34262 B14R2.11625 CCC1CCCCN1CCC2CO2 269982a_100000210034_100000732470 [0,0,0,2,0,0|1,0,0]=3 34263 B14R2.11625 CCC1CCCCN1CCC2CO2 34a_100000210034_100000732470 [0,0,0,2,0,0|1,0,0]=3 34264 B14R2.11625 CC[C@H]1COCCN1CCC2CO2 2230a_100016988097_100000732470 [0,0,0,2,0,0|2,0,0]=4 34265 B14R2.11625 CC[C@H]1COCCN1CCC2CO2 269982a_100016988097_100000732470 [0,0,0,2,0,0|2,0,0]=4 34266 B14R2.11625 CC[C@H]1COCCN1CCC2CO2 34a_100016988097_100000732470 [0,0,0,2,0,0|2,0,0]=4 34267 B14R2.11625 CN[C@@H]1CCCC[C@H]1OCC2CO2 34a_100000708425_102125554688 [0,0,0,2,0,0|2,0,0]=4 34268 B14R2.11625 COC1CCCCC1NCC2CO2 34a_100011208099_102125554688 [0,0,0,2,0,0|2,0,0]=4 34269 B14R2.11625 CO[C@H]1CCCC[C@@H]1OCC2CO2 34a_200009815850_102125554688 [0,0,0,2,0,0|2,0,0]=4 34270 B14R2.11625 CO[C@H]1CCCC[C@@H]1OCC2CO2 7a_200009815850_102125554688 [0,0,0,2,0,0|2,0,0]=4 34271 B14R2.11625 CO[C@H]1CCCC[C@@H]1OC[C@@H]2CO2 7a_200009815850_100000745022 [0,0,0,2,0,0|2,0,0]=4 34272 B14R2.11625 NCC1CCCCC1OCC2CC2 34a_100011216029_100000742324 [0,0,0,2,0,0|2,0,0]=4 34273 B14R2.11625 NCC1CCCCC1OCC2CO2 34a_100011216029_102125554688 [0,0,0,2,0,0|2,0,0]=4 34274 B14R2.11625 OCC1CCCCC1NCC2CC2 270004a_100000735609_100009861125 [0,0,0,2,0,0|1,0,0]=3 34275 B14R2.11625 OCC1CCCCN1CCC2CC2 2230a_100000210821_100000694398 [0,0,0,2,0,0|1,0,0]=3 34276 B14R2.11625 OCC1CCCCN1CCC2CC2 269982a_100000210821_100000694398 [0,0,0,2,0,0|1,0,0]=3 34277 B14R2.11625 OCC1CCCCN1CCC2CC2 34a_100000210821_100000694398 [0,0,0,2,0,0|1,0,0]=3 34278 B14R2.11625 OCC1CCCCN1CCC2CO2 2230a_100000210821_100000732470 [0,0,0,2,0,0|2,0,0]=4 34279 B14R2.11625 OCC1CCCCN1CCC2CO2 269982a_100000210821_100000732470 [0,0,0,2,0,0|2,0,0]=4 34280 B14R2.11625 OCC1CCCCN1CCC2CO2 34a_100000210821_100000732470 [0,0,0,2,0,0|2,0,0]=4 34281 B14R2.11625 OCC1COCCC1NCC2CC2 2230a_214813039666_100000742324 [0,0,0,2,0,0|2,0,0]=4 34282 B14R2.11625 OCC1COCCC1NCC2CC2 269862a_214813039666_100000741477 [0,0,0,2,0,0|2,0,0]=4 34283 B14R2.11625 OCC1COCCC1NCC2CC2 34a_214813039666_100000742324 [0,0,0,2,0,0|2,0,0]=4 34284 B14R2.11625 OC[C@@H]1COCCN1CCC2CC2 2230a_100000717676_100000694398 [0,0,0,2,0,0|2,0,0]=4 34285 B14R2.11625 OC[C@@H]1COCCN1CCC2CC2 269982a_100000717676_100000694398 [0,0,0,2,0,0|2,0,0]=4 34286 B14R2.11625 OC[C@@H]1COCCN1CCC2CC2 34a_100000717676_100000694398 [0,0,0,2,0,0|2,0,0]=4 34287 B14R2.38 COCC1CCN1CC2CCCO2 2230a_100015195929_100000203698 [0,0,0,2,0,0|2,0,0]=4 34288 B14R2.38 COCC1CCN1CC2CCCO2 269982a_100015195929_100000183445 [0,0,0,2,0,0|2,0,0]=4 34289 B14R2.50 CC1CCCCC1NC2CCCC2 2230a_100000211402_100000179811 [0,0,0,2,0,0|2,0,0]=4 34290 B14R2.50 CC1CCCCC1NC2CCCC2 269862a_100000211070_100000210921 [0,0,0,2,0,0|2,0,0]=4 34291 B14R2.50 CC1CCCCC1NC2CCCC2 270004a_100000211070_100000210921 [0,0,0,2,0,0|2,0,0]=4 34292 B14R2.50 CC1CCCCC1NC2CCCC2 270004a_100000211402_100000210133 [0,0,0,2,0,0|2,0,0]=4 34293 B14R2.50 CC1CCCCC1NC2CCCC2 34a_100000211402_100000179811 [0,0,0,2,0,0|2,0,0]=4 34294 B14R2.50 CC1CCCCC1OC2CCCC2 34a_100000211207_100000179811 [0,0,0,2,0,0|2,0,0]=4 34295 B14R2.50 CC1CCCCC1OC2CCCC2 7a_100000211207_100000179811 [0,0,0,2,0,0|2,0,0]=4 34296 B14R2.50 CC1CCCCN1CC2CCCC2 2230a_100000211376_100000740388 [0,0,0,2,0,0|2,0,0]=4 34297 B14R2.50 CC1CCCCN1CC2CCCC2 269982a_100000211376_100000740388 [0,0,0,2,0,0|2,0,0]=4 34298 B14R2.50 CC1CCCCN1CC2CCCC2 34a_100000211376_100000740388 [0,0,0,2,0,0|2,0,0]=4 34299 B14R2.50 CC1CCCCN1CC2CCCO2 2230a_100000211376_100000203698 [0,0,0,2,0,0|1,0,0]=3 34300 B14R2.50 CC1CCCCN1CC2CCCO2 269982a_100000211376_100000183445 [0,0,0,2,0,0|1,0,0]=3 34301 B14R2.50 CC1CCCCN1CC2OCCO2 2230a_100000211376_100000755774 [0,0,0,2,0,0|2,0,0]=4 34302 B14R2.50 CC1CCCCN1CC2OCCO2 269982a_100000211376_100000755774 [0,0,0,2,0,0|2,0,0]=4 34303 B14R2.50 CC1CCCCN1CC2OCCO2 34a_100000211376_100000755774 [0,0,0,2,0,0|2,0,0]=4 34304 B14R2.50 C[C@H]1COCCN1CC2CCCO2 2230a_100009815349_100000203698 [0,0,0,2,0,0|2,0,0]=4 34305 B14R2.50 C[C@H]1COCCN1CC2CCCO2 269982a_100009815349_100000183445 [0,0,0,2,0,0|2,0,0]=4 34306 B14R2.50 ClC1CCCCC1OC2CCCC2 34a_100000038908_100000179811 [0,0,0,2,0,0|2,0,0]=4 34307 B14R2.50 ClC1CCCCC1OC2CCCC2 7a_100000038908_100000179811 [0,0,0,2,0,0|2,0,0]=4 34308 B14R2.50 FC1CCCCC1NC2CCCC2 34a_100000211070_100015423560 [0,0,0,2,0,0|2,0,0]=4 34309 B14R2.50 FC1CCCCC1OC2CCCC2 34a_100000210269_100015423560 [0,0,0,2,0,0|2,0,0]=4 34310 B14R2.50 FC1CCCCC1OC2CCCO2 34a_100000085407_100015423560 [0,0,0,2,0,0|2,0,0]=4 34311 B14R2.50 FC1CCCCC1SC2CCCC2 62a_100011217020_100015423560 [0,0,0,2,0,0|2,0,0]=4 34312 B14R2.50 FC1CCCCC1SC2CCCC2 62a_100015423560_100000179811 [0,0,0,2,0,0|2,0,0]=4 34313 B14R2.50 F[C@@H]1CCCC[C@H]1NC2CCCC2 2230a_100015195156_100000179811 [0,0,0,2,0,0|2,0,0]=4 34314 B14R2.50 F[C@@H]1CCCC[C@H]1NC2CCCC2 270004a_100015195156_100000210133 [0,0,0,2,0,0|2,0,0]=4 34315 B14R2.50 F[C@@H]1CCCC[C@H]1NC2CCCC2 34a_100015195156_100000179811 [0,0,0,2,0,0|2,0,0]=4 34316 B14R2.50 F[C@@H]1CCCC[C@H]1OC2CCCC2 34a_100009816020_100000179811 [0,0,0,2,0,0|2,0,0]=4 34317 B14R2.50 F[C@@H]1CCCC[C@H]1OC2CCCC2 7a_100009816020_100000179811 [0,0,0,2,0,0|2,0,0]=4 34318 B14R2.50 N[C@@H]1CCCC[C@@H]1OC2CCCC2 34a_100015191688_100000179811 [0,0,0,2,0,0|2,0,0]=4 34319 B14R2.50 OC1CCCCC1NC2CCCC2 34a_100000211070_100000038908 [0,0,0,2,0,0|1,0,0]=3 34320 B14R2.50 OC1CCCCC1N[C@H]2CCOC2 34a_100015188467_100000038908 [0,0,0,2,0,0|2,0,0]=4 34321 B14R2.50 OC1CCCCC1OC2CCCC2 34a_100000210269_100000038908 [0,0,0,2,0,0|1,0,0]=3 34322 B14R2.50 OC1CCCCC1OC2CCCO2 34a_100000085407_100000038908 [0,0,0,2,0,0|2,0,0]=4 34323 B14R2.50 OC1CCCCC1O[C@H]2CCOC2 34a_100000717292_100000038908 [0,0,0,2,0,0|2,0,0]=4 34324 B14R2.50 OC1CCCCC1SC2CCCC2 62a_100000038908_100000179811 [0,0,0,2,0,0|1,0,0]=3 34325 B14R2.50 OC1CCCCC1SC2CCCC2 62a_100011217020_100000038908 [0,0,0,2,0,0|1,0,0]=3 34326 B14R2.50 OC1CCCCC1SC2CCOC2 62a_100000038908_100000690089 [0,0,0,2,0,0|2,0,0]=4 34327 B14R2.50 O[C@H]1CCCC[C@H]1NC2CCCC2 270004a_100015191688_100000210133 [0,0,0,2,0,0|1,0,0]=3 34328 B14R2.50 O[C@H]1CCCC[C@H]1NC2CCOC2 270004a_100015191688_100000752484 [0,0,0,2,0,0|2,0,0]=4 34329 B14R2.50 O[C@H]1CCCC[C@H]1NC2CCSC2 270004a_100015191688_100000212027 [0,0,0,2,0,0|2,0,0]=4 34330 B14R2.50 O[C@H]1CCOC[C@@H]1NC2CCCC2 2230a_100015739063_100000179811 [0,0,0,2,0,0|2,0,0]=4 34331 B14R2.50 O[C@H]1CCOC[C@@H]1NC2CCCC2 270004a_100015739063_100000210133 [0,0,0,2,0,0|2,0,0]=4 34332 B14R2.50 O[C@H]1COCC[C@H]1NC2CCCC2 2230a_100016994285_100000179811 [0,0,0,2,0,0|2,0,0]=4 34333 B14R2.50 O[C@H]1COCC[C@H]1NC2CCCC2 270004a_100016994285_100000210133 [0,0,0,2,0,0|2,0,0]=4 34334 B14R2.83 CCC1CCCC1NC2CCCC2 269862a_100000211070_100000749056 [0,0,0,2,0,0|2,0,0]=4 34335 B14R2.83 CCC1CCCC1NC2CCCC2 270004a_100000211070_100000749056 [0,0,0,2,0,0|2,0,0]=4 34336 B14R2.83 CCC1CCCN1CC2CCCC2 2230a_100000754278_100000740388 [0,0,0,2,0,0|2,0,0]=4 34337 B14R2.83 CCC1CCCN1CC2CCCC2 269982a_100000754278_100000740388 [0,0,0,2,0,0|2,0,0]=4 34338 B14R2.83 CCC1CCCN1CC2CCCC2 34a_100000754278_100000740388 [0,0,0,2,0,0|2,0,0]=4 34339 B14R2.83 CCC1CCCN1CC2CCCO2 2230a_100000754278_100000203698 [0,0,0,2,0,0|1,0,0]=3 34340 B14R2.83 CCC1CCCN1CC2CCCO2 269982a_100000754278_100000183445 [0,0,0,2,0,0|1,0,0]=3 34341 B14R2.83 CCC1CCCN1CC2OCCO2 2230a_100000754278_100000755774 [0,0,0,2,0,0|2,0,0]=4 34342 B14R2.83 CCC1CCCN1CC2OCCO2 269982a_100000754278_100000755774 [0,0,0,2,0,0|2,0,0]=4 34343 B14R2.83 CCC1CCCN1CC2OCCO2 34a_100000754278_100000755774 [0,0,0,2,0,0|2,0,0]=4 34344 B14R2.83 OC[C@H]1CCCN1CC2CCCC2 2230a_100000745186_100000740388 [0,0,0,2,0,0|1,0,0]=3 34345 B14R2.83 OC[C@H]1CCCN1CC2CCCC2 269982a_100000745186_100000740388 [0,0,0,2,0,0|1,0,0]=3 34346 B14R2.83 OC[C@H]1CCCN1CC2CCCC2 34a_100000745186_100000740388 [0,0,0,2,0,0|1,0,0]=3 34347 B14R2.83 OC[C@H]1CCCN1CC2CCCO2 2230a_100000745186_100000203698 [0,0,0,2,0,0|2,0,0]=4 34348 B14R2.83 OC[C@H]1CCCN1CC2CCCO2 269982a_100000745186_100000183445 [0,0,0,2,0,0|2,0,0]=4 34349 B14R2.83 OC[C@H]1CCCN1CC2CCOC2 2230a_100000745186_100000702531 [0,0,0,2,0,0|2,0,0]=4 34350 B14R2.83 OC[C@H]1CCCN1CC2CCOC2 269982a_100000745186_100000702531 [0,0,0,2,0,0|2,0,0]=4 34351 B14R2.83 OC[C@H]1CCCN1CC2CCOC2 34a_100000745186_100011261433 [0,0,0,2,0,0|2,0,0]=4 34352 B14R2.245 CCCC1CCCC1N2CCCC2 270004a_100000188435_100000723119 [0,0,0,2,0,0|2,0,0]=4 34353 B14R2.245 CCCN1CCCC1C2CCCC2 2230a_100000743374_100000210303 [0,0,0,2,0,0|2,0,0]=4 34354 B14R2.245 CCCN1CCCC1C2CCCC2 269982a_100000743374_100000210303 [0,0,0,2,0,0|2,0,0]=4 34355 B14R2.245 CCCN1CCCC1C2CCCC2 34a_100000743374_100000210303 [0,0,0,2,0,0|2,0,0]=4 34356 B14R2.245 CCNC1CCCC1C2CCCC2 269862a_100015525214_100011216175 [0,0,0,2,0,0|2,0,0]=4 34357 B14R2.245 CCNC1CCCC1C2CCCC2 270004a_100015525214_100011216175 [0,0,0,2,0,0|2,0,0]=4 34358 B14R2.245 FCCN1CCCC1C2CCCC2 2230a_100000743374_100011217306 [0,0,0,2,0,0|2,0,0]=4 34359 B14R2.245 FCCN1CCCC1C2CCCC2 269982a_100000743374_100011217306 [0,0,0,2,0,0|2,0,0]=4 34360 B14R2.245 FCCN1CCCC1C2CCCC2 34a_100000743374_100011217306 [0,0,0,2,0,0|2,0,0]=4 34361 B14R2.245 OCCN1CCCC1C2CCCC2 2230a_100000743374_100000211926 [0,0,0,2,0,0|1,0,0]=3 34362 B14R2.245 OCCN1CCCC1C2CCCC2 269982a_100000743374_100000211926 [0,0,0,2,0,0|1,0,0]=3 34363 B14R2.245 OCCN1CCCC1C2CCCC2 34a_100000743374_100000211926 [0,0,0,2,0,0|1,0,0]=3 34364 B14R2.322 C1CCC(C1)CCCN2CCCC2 2230a_100000188435_100011713738 [0,0,0,2,0,0|2,0,0]=4 34365 B14R2.322 C1CCC(C1)CCCN2CCCC2 269982a_100000188435_100011713738 [0,0,0,2,0,0|2,0,0]=4 34366 B14R2.322 C1CCC(C1)CCNC2CCCC2 2230a_100000211070_100000760354 [0,0,0,2,0,0|2,0,0]=4 34367 B14R2.322 C1CCC(C1)CCNC2CCCC2 2230a_100000739158_100000179811 [0,0,0,2,0,0|2,0,0]=4 34368 B14R2.322 C1CCC(C1)CCNC2CCCC2 270004a_100000739158_100000210133 [0,0,0,2,0,0|2,0,0]=4 34369 B14R2.322 C1CCC(C1)CCNC2CCCC2 34a_100000211070_100000760354 [0,0,0,2,0,0|2,0,0]=4 34370 B14R2.322 C1CCC(C1)CCNC2CCCC2 34a_100000739158_100000179811 [0,0,0,2,0,0|2,0,0]=4 34371 B14R2.322 C1CCC(C1)CCOC2CCCC2 34a_100000210269_100000760354 [0,0,0,2,0,0|2,0,0]=4 34372 B14R2.322 C1CCC(C1)CCOC2CCCC2 34a_100000749090_100000179811 [0,0,0,2,0,0|2,0,0]=4 34373 B14R2.322 C1CCC(C1)CCOC2CCCC2 7a_100000210269_100000760354 [0,0,0,2,0,0|2,0,0]=4 34374 B14R2.322 C1CCC(C1)CCOC2CCCC2 7a_100000749090_100000179811 [0,0,0,2,0,0|2,0,0]=4 34375 B14R2.322 C1CCC(C1)CCOC2CCCO2 34a_100000085407_100000760354 [0,0,0,2,0,0|1,0,0]=3 34376 B14R2.322 C1CCC(C1)CCSC2CCCC2 62a_100000760354_100000179811 [0,0,0,2,0,0|2,0,0]=4 34377 B14R2.322 C1CCC(C1)CCSC2CCCC2 62a_100011217020_100000760354 [0,0,0,2,0,0|2,0,0]=4 34378 B14R2.322 C1CCC(C1)CNCC2CCCC2 2230a_100000737975_100000740388 [0,0,0,2,0,0|2,0,0]=4 34379 B14R2.322 C1CCC(C1)CNCC2CCCC2 269862a_100000737975_100000746403 [0,0,0,2,0,0|2,0,0]=4 34380 B14R2.322 C1CCC(C1)CNCC2CCCC2 34a_100000737975_100000740388 [0,0,0,2,0,0|2,0,0]=4 34381 B14R2.322 C1CCC(C1)CNCC2CCCO2 2230a_100000737975_100000203698 [0,0,0,2,0,0|1,0,0]=3 34382 B14R2.322 C1CCC(C1)CNCC2OCCO2 2230a_100000036311_100000740388 [0,0,0,2,0,0|2,0,0]=4 34383 B14R2.322 C1CCC(C1)CNCC2OCCO2 2230a_100000737975_100000755774 [0,0,0,2,0,0|2,0,0]=4 34384 B14R2.322 C1CCC(C1)CNCC2OCCO2 34a_100000036311_100000740388 [0,0,0,2,0,0|2,0,0]=4 34385 B14R2.322 C1CCC(C1)CNCC2OCCO2 34a_100000737975_100000755774 [0,0,0,2,0,0|2,0,0]=4 34386 B14R2.322 C1CCC(C1)CNC[C@@H]2CCCO2 2230a_100020590478_100000740388 [0,0,0,2,0,0|1,0,0]=3 34387 B14R2.322 C1CCC(C1)CNC[C@@H]2CCCO2 269862a_100020590478_100000746403 [0,0,0,2,0,0|1,0,0]=3 34388 B14R2.322 C1CCC(C1)CNC[C@@H]2CCCO2 34a_100020590478_100000740388 [0,0,0,2,0,0|1,0,0]=3 34389 B14R2.322 C1CCC(C1)COCC2CCCC2 34a_100000742336_100000740388 [0,0,0,2,0,0|2,0,0]=4 34390 B14R2.322 C1CCC(C1)COCC2CCCC2 7a_100000742336_100000740388 [0,0,0,2,0,0|2,0,0]=4 34391 B14R2.322 C1CCC(C1)COCC2CCCO2 34a_100000210270_100000740388 [0,0,0,2,0,0|1,0,0]=3 34392 B14R2.322 C1CCC(C1)COCC2CCCO2 7a_100000210270_100000740388 [0,0,0,2,0,0|1,0,0]=3 34393 B14R2.322 C1CCC(C1)COCC2CCCO2 7a_100000742336_100000203698 [0,0,0,2,0,0|1,0,0]=3 34394 B14R2.322 C1CCC(C1)COCC2COCO2 34a_100011216627_100000740388 [0,0,0,2,0,0|2,0,0]=4 34395 B14R2.322 C1CCC(C1)COCC2OCCO2 34a_100000087154_100000740388 [0,0,0,2,0,0|2,0,0]=4 34396 B14R2.322 C1CCC(C1)COCC2OCCO2 34a_100000742336_100000755774 [0,0,0,2,0,0|2,0,0]=4 34397 B14R2.322 C1CCC(C1)COCC2OCCO2 7a_100000742336_100000755774 [0,0,0,2,0,0|2,0,0]=4 34398 B14R2.322 C1CCC(C1)COC[C@H]2CCCN2 34a_100000745186_100000740388 [0,0,0,2,0,0|2,0,0]=4 34399 B14R2.322 C1CCC(C1)CSCC2CCCC2 62a_100000740388_100000740388 [0,0,0,2,0,0|2,0,0]=4 34400 B14R2.322 C1CCC(C1)CSCC2CCCO2 62a_100000203698_100000740388 [0,0,0,2,0,0|1,0,0]=3 34401 B14R2.322 C1CCC(C1)CSCC2CCCO2 62a_100000740388_100000203698 [0,0,0,2,0,0|1,0,0]=3 34402 B14R2.322 C1CCC(C1)CSCC2OCCO2 62a_100000740388_100000755774 [0,0,0,2,0,0|2,0,0]=4 34403 B14R2.322 C1CCC(C1)CSCC2OCCO2 62a_100000755774_100000740388 [0,0,0,2,0,0|2,0,0]=4 34404 B14R2.322 C1CCC(C1)NCCC2OCCO2 2230a_100000034215_100000179811 [0,0,0,2,0,0|2,0,0]=4 34405 B14R2.322 C1CCC(C1)NCCC2OCCO2 2230a_100000211070_100000740749 [0,0,0,2,0,0|2,0,0]=4 34406 B14R2.322 C1CCC(C1)NCCC2OCCO2 270004a_100000034215_100000210133 [0,0,0,2,0,0|2,0,0]=4 34407 B14R2.322 C1CCC(C1)NCCC2OCCO2 34a_100000034215_100000179811 [0,0,0,2,0,0|2,0,0]=4 34408 B14R2.322 C1CCC(C1)NCCC2OCCO2 34a_100000211070_100000740749 [0,0,0,2,0,0|2,0,0]=4 34409 B14R2.322 C1CCC(C1)OCCC2OCCO2 34a_100000210269_100000740749 [0,0,0,2,0,0|2,0,0]=4 34410 B14R2.322 C1CCC(C1)OCCC2OCCO2 7a_100000210269_100000740749 [0,0,0,2,0,0|2,0,0]=4 34411 B14R2.322 C1CCC(C1)SCCC2OCCO2 62a_100011217020_100000740749 [0,0,0,2,0,0|2,0,0]=4 34412 B14R2.322 C1CCN(C1)CCCC2OCCO2 2230a_100000188435_100000042513 [0,0,0,2,0,0|2,0,0]=4 34413 B14R2.322 C1CCN(C1)CCCC2OCCO2 269982a_100000188435_100000042513 [0,0,0,2,0,0|2,0,0]=4 34414 B14R2.322 C1COC(C1)CNCC2CCOC2 2230a_100000737293_100000203698 [0,0,0,2,0,0|2,0,0]=4 34415 B14R2.322 C1COC(C1)CNC[C@@H]2CCCO2 2230a_100020590478_100000203698 [0,0,0,2,0,0|2,0,0]=4 34416 B14R2.322 C1COC(C1)COCC2CCCO2 7a_100000210270_100000203698 [0,0,0,2,0,0|2,0,0]=4 34417 B14R2.322 C1COC(C1)COCC2CCOC2 34a_100000210270_100011261433 [0,0,0,2,0,0|2,0,0]=4 34418 B14R2.322 C1COC(C1)COCC2CCOC2 7a_100000210270_100000702531 [0,0,0,2,0,0|2,0,0]=4 34419 B14R2.322 C1COC(C1)CSCC2CCCO2 62a_100000203698_100000203698 [0,0,0,2,0,0|2,0,0]=4 34420 B14R2.322 C1COC(C1)CSCC2CCOC2 62a_100000203698_100000702531 [0,0,0,2,0,0|2,0,0]=4 34421 B14R2.322 C1COC(C1)CSCC2CCOC2 62a_100000702531_100000203698 [0,0,0,2,0,0|2,0,0]=4 34422 B14R2.322 C1CO[C@@H](C1)CNCC2CCOC2 2230a_100020590478_100000702531 [0,0,0,2,0,0|2,0,0]=4 34423 B14R2.322 C1CO[C@@H](C1)CNCC2CCOC2 34a_100020590478_100011261433 [0,0,0,2,0,0|2,0,0]=4 34424 B14R2.356 CC1CC1COCCC2CCCC2 34a_100000744939_100000760354 [0,0,0,2,0,0|2,0,0]=4 34425 B14R2.356 CC1CC1COCCC2CCCC2 7a_100000744939_100000760354 [0,0,0,2,0,0|2,0,0]=4 34426 B14R2.356 CC1CC1COCCC2OCCO2 34a_100000744939_100000740749 [0,0,0,2,0,0|2,0,0]=4 34427 B14R2.356 CC1CC1COCCC2OCCO2 7a_100000744939_100000740749 [0,0,0,2,0,0|2,0,0]=4 34428 B14R2.356 F[C@@H]1C[C@H]1NCCCC2CCCC2 2230a_100025746932_100011713738 [0,0,0,2,0,0|2,0,0]=4 34429 B14R2.356 F[C@@H]1C[C@H]1NCCCC2CCCC2 34a_100025746932_100011713738 [0,0,0,2,0,0|2,0,0]=4 34430 B14R2.356 F[C@H]1C[C@H]1NCCCC2CCCC2 2230a_100015190264_100011713738 [0,0,0,2,0,0|2,0,0]=4 34431 B14R2.384 CC1CCCC1NCC2CCCC2 269862a_100000737975_100000752053 [0,0,0,2,0,0|2,0,0]=4 34432 B14R2.384 CC1CCCC1NC[C@@H]2CCCO2 269862a_100020590478_100000752053 [0,0,0,2,0,0|1,0,0]=3 34433 B14R2.384 CC1CCCC1OCC2CCCC2 34a_100011216460_100000740388 [0,0,0,2,0,0|2,0,0]=4 34434 B14R2.384 CC1CCCC1OCC2CCCC2 7a_100011216460_100000740388 [0,0,0,2,0,0|2,0,0]=4 34435 B14R2.384 CC1CCCC1OCC2CCCO2 7a_100011216460_100000203698 [0,0,0,2,0,0|1,0,0]=3 34436 B14R2.384 CC1CCCC1OCC2OCCO2 34a_100011216460_100000755774 [0,0,0,2,0,0|2,0,0]=4 34437 B14R2.384 CC1CCCC1OCC2OCCO2 7a_100011216460_100000755774 [0,0,0,2,0,0|2,0,0]=4 34438 B14R2.384 CC1OCCC1NC[C@@H]2CCCO2 270004a_100020590478_100000691750 [0,0,0,2,0,0|2,0,0]=4 34439 B14R2.384 C[C@@H]1CCCN1CCC2CCCC2 2230a_100015189458_100000760354 [0,0,0,2,0,0|2,0,0]=4 34440 B14R2.384 C[C@@H]1CCCN1CCC2CCCC2 269982a_100015189458_100000760354 [0,0,0,2,0,0|2,0,0]=4 34441 B14R2.384 C[C@@H]1CCCN1CCC2CCCC2 34a_100015189458_100000760354 [0,0,0,2,0,0|2,0,0]=4 34442 B14R2.384 C[C@@H]1CCCN1CCC2OCCO2 2230a_100015189458_100000740749 [0,0,0,2,0,0|2,0,0]=4 34443 B14R2.384 C[C@@H]1CCCN1CCC2OCCO2 269982a_100015189458_100000740749 [0,0,0,2,0,0|2,0,0]=4 34444 B14R2.384 C[C@@H]1CCCN1CCC2OCCO2 34a_100015189458_100000740749 [0,0,0,2,0,0|2,0,0]=4 34445 B14R2.384 C[C@H]1CCCN1CCC2CCCC2 2230a_100020605311_100000760354 [0,0,0,2,0,0|2,0,0]=4 34446 B14R2.384 C[C@H]1CCCN1CCC2CCCC2 269982a_100020605311_100000760354 [0,0,0,2,0,0|2,0,0]=4 34447 B14R2.384 C[C@H]1CCCN1CCC2OCCO2 2230a_100020605311_100000740749 [0,0,0,2,0,0|2,0,0]=4 34448 B14R2.384 C[C@H]1CCCN1CCC2OCCO2 269982a_100020605311_100000740749 [0,0,0,2,0,0|2,0,0]=4 34449 B14R2.384 Cl[C@@H]1CCC[C@H]1OCC2CCCC2 34a_200016002552_100000740388 [0,0,0,2,0,0|2,0,0]=4 34450 B14R2.384 N[C@H]1CCC[C@@H]1OCC2CCCC2 34a_100000748460_100000740388 [0,0,0,2,0,0|2,0,0]=4 34451 B14R2.384 OC1COCC1NCC2CCCC2 34a_100000737975_200000725654 [0,0,0,2,0,0|2,0,0]=4 34452 B14R2.384 OC1COCC1OCC2CCCC2 34a_100000742336_200000725654 [0,0,0,2,0,0|2,0,0]=4 34453 B14R2.384 OC1COCC1OCC2CCCC2 7a_100000742336_200000725654 [0,0,0,2,0,0|2,0,0]=4 34454 B14R2.384 OC1COCC1SCC2CCCC2 62a_100000740388_200000725654 [0,0,0,2,0,0|2,0,0]=4 34455 B14R2.384 OC1COCC1SCC2CCCC2 62a_200000725654_100000740388 [0,0,0,2,0,0|2,0,0]=4 34456 B14R2.384 O[C@@H]1CCC[C@H]1SCC2CCCC2 62a_100000740388_200016002552 [0,0,0,2,0,0|1,0,0]=3 34457 B14R2.384 O[C@@H]1CCC[C@H]1SCC2CCCC2 62a_200016002552_100000740388 [0,0,0,2,0,0|1,0,0]=3 34458 B14R2.384 O[C@@H]1CCC[C@H]1SCC2CCCO2 62a_100000203698_200016002552 [0,0,0,2,0,0|2,0,0]=4 34459 B14R2.384 O[C@@H]1CCC[C@H]1SCC2CCCO2 62a_200016002552_100000203698 [0,0,0,2,0,0|2,0,0]=4 34460 B14R2.384 O[C@@H]1CCC[C@H]1SCC2CCOC2 62a_100000702531_200016002552 [0,0,0,2,0,0|2,0,0]=4 34461 B14R2.384 O[C@@H]1CCC[C@H]1SCC2CCOC2 62a_200016002552_100000702531 [0,0,0,2,0,0|2,0,0]=4 34462 B14R2.384 O[C@H]1CCC[C@@H]1NCC2CCCC2 269862a_100000748460_100000746403 [0,0,0,2,0,0|1,0,0]=3 34463 B14R2.384 O[C@H]1COC[C@@H]1NCC2CCCC2 2230a_100015191717_100000740388 [0,0,0,2,0,0|2,0,0]=4 34464 B14R2.384 O[C@H]1COC[C@@H]1NCC2CCCC2 269862a_100015191717_100000746403 [0,0,0,2,0,0|2,0,0]=4 34465 B14R2.726 CC1CCN1CCCC2CCCC2 269982a_100000755817_100011713738 [0,0,0,2,0,0|2,0,0]=4 34466 B14R2.726 CC1CCN1CCCC2CCCC2 34a_100000755817_100011713738 [0,0,0,2,0,0|2,0,0]=4 34467 B14R2.726 CC1CCN1CCCC2OCCO2 269982a_100000755817_100000042513 [0,0,0,2,0,0|2,0,0]=4 34468 B14R2.726 CC1CCN1CCCC2OCCO2 34a_100000755817_100009861162 [0,0,0,2,0,0|2,0,0]=4 34469 B14R2.1255 C1CCCC(CCC1)N2CCCC2 270004a_100000188435_100000210524 [0,0,0,2,0,0|2,0,0]=4 34470 B14R2.1255 C1CCCN(CCC1)C2CCCC2 2230a_100000211400_100000179811 [0,0,0,2,0,0|2,0,0]=4 34471 B14R2.1255 C1CCCN(CCC1)C2CCCC2 269982a_100000211400_100000179811 [0,0,0,2,0,0|2,0,0]=4 34472 B14R2.1255 C1CCCN(CCC1)C2CCCC2 270004a_100000211400_100000210133 [0,0,0,2,0,0|2,0,0]=4 34473 B14R2.1255 C1CCCN(CCC1)C2CCCC2 34a_100000211400_100000179811 [0,0,0,2,0,0|2,0,0]=4 34474 B14R2.2840 C1CCCC(CC1)CN2CCCC2 2230a_100000188435_200000696569 [0,0,0,2,0,0|2,0,0]=4 34475 B14R2.2840 C1CCCC(CC1)CN2CCCC2 269982a_100000188435_200000696569 [0,0,0,2,0,0|2,0,0]=4 34476 B14R2.2840 C1CCCC(CC1)NC2CCCC2 2230a_100000210984_100000179811 [0,0,0,2,0,0|2,0,0]=4 34477 B14R2.2840 C1CCCC(CC1)NC2CCCC2 270004a_100000210984_100000210133 [0,0,0,2,0,0|2,0,0]=4 34478 B14R2.2840 C1CCCC(CC1)NC2CCCC2 270004a_100000211070_100000210131 [0,0,0,2,0,0|2,0,0]=4 34479 B14R2.2840 C1CCCC(CC1)NC2CCCC2 34a_100000210984_100000179811 [0,0,0,2,0,0|2,0,0]=4 34480 B14R2.2840 C1CCCC(CC1)NC2CCCC2 34a_100000211070_100011217769 [0,0,0,2,0,0|2,0,0]=4 34481 B14R2.2840 C1CCCC(CC1)OC2CCCC2 34a_100000210269_100011217769 [0,0,0,2,0,0|2,0,0]=4 34482 B14R2.2840 C1CCCC(CC1)OC2CCCC2 34a_100000210887_100000179811 [0,0,0,2,0,0|2,0,0]=4 34483 B14R2.2840 C1CCCC(CC1)OC2CCCC2 7a_100000210887_100000179811 [0,0,0,2,0,0|2,0,0]=4 34484 B14R2.2840 C1CCCC(CC1)OC2CCCO2 34a_100000085407_100011217769 [0,0,0,2,0,0|1,0,0]=3 34485 B14R2.2840 C1CCCC(CC1)SC2CCCC2 62a_100011217020_100011217769 [0,0,0,2,0,0|2,0,0]=4 34486 B14R2.2840 C1CCCC(CC1)SC2CCCC2 62a_100011217769_100000179811 [0,0,0,2,0,0|2,0,0]=4 34487 B14R2.2840 C1CCCN(CC1)CC2CCCC2 2230a_100000185865_100000740388 [0,0,0,2,0,0|2,0,0]=4 34488 B14R2.2840 C1CCCN(CC1)CC2CCCC2 269982a_100000185865_100000740388 [0,0,0,2,0,0|2,0,0]=4 34489 B14R2.2840 C1CCCN(CC1)CC2CCCC2 34a_100000185865_100000740388 [0,0,0,2,0,0|2,0,0]=4 34490 B14R2.2840 C1CCCN(CC1)CC2CCCO2 2230a_100000185865_100000203698 [0,0,0,2,0,0|1,0,0]=3 34491 B14R2.2840 C1CCCN(CC1)CC2CCCO2 269982a_100000185865_100000183445 [0,0,0,2,0,0|1,0,0]=3 34492 B14R2.2840 C1CCCN(CC1)CC2OCCO2 2230a_100000185865_100000755774 [0,0,0,2,0,0|2,0,0]=4 34493 B14R2.2840 C1CCCN(CC1)CC2OCCO2 269982a_100000185865_100000755774 [0,0,0,2,0,0|2,0,0]=4 34494 B14R2.2840 C1CCCN(CC1)CC2OCCO2 34a_100000185865_100000755774 [0,0,0,2,0,0|2,0,0]=4 34495 B14R2.2840 C1COC(C1)CN2CCCOCC2 2230a_100000685342_100000203698 [0,0,0,2,0,0|2,0,0]=4 34496 B14R2.2840 C1COC(C1)CN2CCCOCC2 269982a_100000685342_100000183445 [0,0,0,2,0,0|2,0,0]=4 34497 B14R2.3017 C(CC1CC1)NCCC2OCCO2 2230a_100000034215_100000694398 [0,0,0,2,0,0|2,0,0]=4 34498 B14R2.3017 C(CC1CC1)NCCC2OCCO2 34a_100000034215_100000694398 [0,0,0,2,0,0|2,0,0]=4 34499 B14R2.3017 C(CC1CC1)NCCC2OCCO2 34a_100000764129_100000740749 [0,0,0,2,0,0|2,0,0]=4 34500 B14R2.3017 C(CC1CC1)OCCC2OCCO2 34a_100000754188_100000740749 [0,0,0,2,0,0|2,0,0]=4 34501 B14R2.3017 C(CC1CC1)OCCC2OCCO2 7a_100000754188_100000740749 [0,0,0,2,0,0|2,0,0]=4 34502 B14R2.3017 C(CC1CCOC1)OCCC2CO2 34a_100011879284_100000732470 [0,0,0,2,0,0|2,0,0]=4 34503 B14R2.3017 C(CCC1OCCO1)CNC2CC2 34a_100000212008_200009813554 [0,0,0,2,0,0|2,0,0]=4 34504 B14R2.3017 C(CNCC1CC1)CC2OCCO2 2230a_100000735609_100000042513 [0,0,0,2,0,0|2,0,0]=4 34505 B14R2.3017 C(CNCC1CC1)CC2OCCO2 34a_100000735609_100009861162 [0,0,0,2,0,0|2,0,0]=4 34506 B14R2.3017 C(CNCC1CCOC1)CC2CO2 2230a_100000737293_100000733510 [0,0,0,2,0,0|2,0,0]=4 34507 B14R2.3017 C(CNCC1CCOC1)CC2CO2 34a_100000737293_100000733510 [0,0,0,2,0,0|2,0,0]=4 34508 B14R2.3017 C(CNC[C@@H]1CCCO1)CC2CO2 2230a_100020590478_100000733510 [0,0,0,2,0,0|2,0,0]=4 34509 B14R2.3017 C(CNC[C@@H]1CCCO1)CC2CO2 34a_100020590478_100000733510 [0,0,0,2,0,0|2,0,0]=4 34510 B14R2.3017 C(COCC1CC1)CC2OCCO2 34a_100000211283_100009861162 [0,0,0,2,0,0|2,0,0]=4 34511 B14R2.3017 C(COCC1CC1)CC2OCCO2 34a_100009871617_100000742324 [0,0,0,2,0,0|2,0,0]=4 34512 B14R2.3017 C(COCC1CC1)CC2OCCO2 7a_100009871617_100000742324 [0,0,0,2,0,0|2,0,0]=4 34513 B14R2.3017 C(COCC1CCNC1)CC2CO2 34a_100000748654_100000733510 [0,0,0,2,0,0|2,0,0]=4 34514 B14R2.3017 C(COCC1CCOC1)CC2CO2 34a_100000740260_100000733510 [0,0,0,2,0,0|2,0,0]=4 34515 B14R2.3017 C(COC[C@H]1CCCN1)CC2CO2 34a_100000745186_100000733510 [0,0,0,2,0,0|2,0,0]=4 34516 B14R2.3017 C(CSCC1CC1)CC2OCCO2 62a_100000756562_100000042513 [0,0,0,2,0,0|2,0,0]=4 34517 B14R2.3017 C(CSCC1CCCO1)CC2CO2 62a_100000203698_100000733510 [0,0,0,2,0,0|2,0,0]=4 34518 B14R2.3017 C(CSCC1CCCO1)CC2CO2 62a_100000733510_100000203698 [0,0,0,2,0,0|2,0,0]=4 34519 B14R2.3017 C(CSCC1CCOC1)CC2CO2 62a_100000702531_100000733510 [0,0,0,2,0,0|2,0,0]=4 34520 B14R2.3017 C(CSCC1CCOC1)CC2CO2 62a_100000733510_100000702531 [0,0,0,2,0,0|2,0,0]=4 34521 B14R2.3017 C1CC(CN1)CCOCCC2CO2 34a_100016987287_100000732470 [0,0,0,2,0,0|2,0,0]=4 34522 B14R2.3017 C1CCC(C1)CCCNCC2CC2 2230a_100000735609_100011713738 [0,0,0,2,0,0|2,0,0]=4 34523 B14R2.3017 C1CCC(C1)CCCNCC2CC2 2230a_100000736752_100000742324 [0,0,0,2,0,0|2,0,0]=4 34524 B14R2.3017 C1CCC(C1)CCCNCC2CC2 269862a_100000736752_100000741477 [0,0,0,2,0,0|2,0,0]=4 34525 B14R2.3017 C1CCC(C1)CCCNCC2CC2 34a_100000735609_100011713738 [0,0,0,2,0,0|2,0,0]=4 34526 B14R2.3017 C1CCC(C1)CCCNCC2CC2 34a_100000736752_100000742324 [0,0,0,2,0,0|2,0,0]=4 34527 B14R2.3017 C1CCC(C1)CCCNCC2CO2 2230a_100000736752_100011216344 [0,0,0,2,0,0|1,0,0]=3 34528 B14R2.3017 C1CCC(C1)CCCNCC2CO2 34a_100000736752_102125554688 [0,0,0,2,0,0|1,0,0]=3 34529 B14R2.3017 C1CCC(C1)CCCOCC2CC2 34a_100000211283_100011713738 [0,0,0,2,0,0|2,0,0]=4 34530 B14R2.3017 C1CCC(C1)CCCOCC2CC2 34a_100011215328_100000742324 [0,0,0,2,0,0|2,0,0]=4 34531 B14R2.3017 C1CCC(C1)CCCOCC2CC2 7a_100011215328_100000742324 [0,0,0,2,0,0|2,0,0]=4 34532 B14R2.3017 C1CCC(C1)CCCOCC2CO2 34a_100011215328_102125554688 [0,0,0,2,0,0|1,0,0]=3 34533 B14R2.3017 C1CCC(C1)CCCOCC2CO2 7a_100011215328_102125554688 [0,0,0,2,0,0|1,0,0]=3 34534 B14R2.3017 C1CCC(C1)CCCOCC2CS2 7a_100011215328_100000031435 [0,0,0,2,0,0|1,1,0]=4 34535 B14R2.3017 C1CCC(C1)CCCOC[C@@H]2CO2 34a_100000757423_100011713738 [0,0,0,2,0,0|1,0,0]=3 34536 B14R2.3017 C1CCC(C1)CCCOC[C@@H]2CO2 7a_100011215328_100000745022 [0,0,0,2,0,0|1,0,0]=3 34537 B14R2.3017 C1CCC(C1)CCCSCC2CC2 62a_100000756562_100011713738 [0,0,0,2,0,0|2,0,0]=4 34538 B14R2.3017 C1CCC(C1)CCCSCC2CC2 62a_100011713738_100000742324 [0,0,0,2,0,0|2,0,0]=4 34539 B14R2.3017 C1CCC(C1)CCCSCC2CO2 62a_100011713738_102125554688 [0,0,0,2,0,0|1,0,0]=3 34540 B14R2.3017 C1CCC(C1)CCCSCC2CO2 62a_102125554688_100011713738 [0,0,0,2,0,0|1,0,0]=3 34541 B14R2.3017 C1CCC(C1)CCCSCC2CS2 62a_100000031435_100011713738 [0,0,0,2,0,0|1,1,0]=4 34542 B14R2.3017 C1CCC(C1)CCCSCC2CS2 62a_100011713738_100000031435 [0,0,0,2,0,0|1,1,0]=4 34543 B14R2.3017 C1CCC(C1)CCCSC[C@@H]2CO2 62a_100000745022_100011713738 [0,0,0,2,0,0|1,0,0]=3 34544 B14R2.3017 C1CCC(C1)CCCSC[C@@H]2CO2 62a_100011713738_100000745022 [0,0,0,2,0,0|1,0,0]=3 34545 B14R2.3017 C1CCC(C1)CCNCCC2CC2 2230a_100000739158_100000694398 [0,0,0,2,0,0|2,0,0]=4 34546 B14R2.3017 C1CCC(C1)CCNCCC2CC2 34a_100000739158_100000694398 [0,0,0,2,0,0|2,0,0]=4 34547 B14R2.3017 C1CCC(C1)CCNCCC2CC2 34a_100000764129_100000760354 [0,0,0,2,0,0|2,0,0]=4 34548 B14R2.3017 C1CCC(C1)CCNCCC2CO2 2230a_100000739158_100000732470 [0,0,0,2,0,0|1,0,0]=3 34549 B14R2.3017 C1CCC(C1)CCNCCC2CO2 34a_100000739158_100000732470 [0,0,0,2,0,0|1,0,0]=3 34550 B14R2.3017 C1CCC(C1)CCOCCC2CC2 34a_100000749090_100000694398 [0,0,0,2,0,0|2,0,0]=4 34551 B14R2.3017 C1CCC(C1)CCOCCC2CC2 34a_100000754188_100000760354 [0,0,0,2,0,0|2,0,0]=4 34552 B14R2.3017 C1CCC(C1)CCOCCC2CC2 7a_100000749090_100000764125 [0,0,0,2,0,0|2,0,0]=4 34553 B14R2.3017 C1CCC(C1)CCOCCC2CC2 7a_100000754188_100000760354 [0,0,0,2,0,0|2,0,0]=4 34554 B14R2.3017 C1CCC(C1)CCOCCC2CO2 34a_100000749090_100000732470 [0,0,0,2,0,0|1,0,0]=3 34555 B14R2.3017 C1CCC(C1)CCOCCC2CO2 7a_100000749090_100000732470 [0,0,0,2,0,0|1,0,0]=3 34556 B14R2.3017 C1CCC(C1)CCOCC[C@@H]2CO2 34a_100009820653_100000760354 [0,0,0,2,0,0|1,0,0]=3 34557 B14R2.3017 C1CCC(C1)CCSCCC2CC2 62a_100000760354_100000764125 [0,0,0,2,0,0|2,0,0]=4 34558 B14R2.3017 C1CCC(C1)CCSCCC2CC2 62a_100000764125_100000760354 [0,0,0,2,0,0|2,0,0]=4 34559 B14R2.3017 C1CCC(C1)CCSCCC2CO2 62a_100000732470_100000760354 [0,0,0,2,0,0|1,0,0]=3 34560 B14R2.3017 C1CCC(C1)CCSCCC2CO2 62a_100000760354_100000732470 [0,0,0,2,0,0|1,0,0]=3 34561 B14R2.3017 C1CCC(C1)CNCCCC2CO2 2230a_100000737975_100000733510 [0,0,0,2,0,0|1,0,0]=3 34562 B14R2.3017 C1CCC(C1)CNCCCC2CO2 34a_100000737975_100000733510 [0,0,0,2,0,0|1,0,0]=3 34563 B14R2.3017 C1CCC(C1)COCCCC2CO2 34a_100000742336_100000733510 [0,0,0,2,0,0|1,0,0]=3 34564 B14R2.3017 C1CCC(C1)COCCCC2CO2 7a_100000742336_100000733510 [0,0,0,2,0,0|1,0,0]=3 34565 B14R2.3017 C1CCC(C1)CSCCCC2CO2 62a_100000733510_100000740388 [0,0,0,2,0,0|1,0,0]=3 34566 B14R2.3017 C1CCC(C1)CSCCCC2CO2 62a_100000740388_100000733510 [0,0,0,2,0,0|1,0,0]=3 34567 B14R2.3017 C1CCC(C1)NCCOCC2CO2 34a_200000200444_102125554688 [0,0,0,2,0,0|2,0,0]=4 34568 B14R2.3017 C1CCC(C1)OCCNCC2CO2 34a_100000741755_102125554688 [0,0,0,2,0,0|2,0,0]=4 34569 B14R2.3017 C1CCC(C1)OCCOCC2CO2 34a_100000738311_102125554688 [0,0,0,2,0,0|2,0,0]=4 34570 B14R2.3017 C1CCC(C1)OCCOCC2CO2 7a_100000738311_102125554688 [0,0,0,2,0,0|2,0,0]=4 34571 B14R2.3017 C1CCC(C1)OCCOC[C@@H]2CO2 7a_100000738311_100000745022 [0,0,0,2,0,0|2,0,0]=4 34572 B14R2.3017 C1CCN(C1)CCCOC[C@@H]2CO2 34a_100000757423_100016991639 [0,0,0,2,0,0|2,0,0]=4 34573 B14R2.3017 C1CCN(C1)CCCSCC2CO2 62a_100016991639_102125554688 [0,0,0,2,0,0|2,0,0]=4 34574 B14R2.3017 C1CCN(C1)CCCSCC2CO2 62a_102125554688_100011445909 [0,0,0,2,0,0|2,0,0]=4 34575 B14R2.3017 C1CCN(C1)CCCSC[C@@H]2CO2 62a_100000745022_100011445909 [0,0,0,2,0,0|2,0,0]=4 34576 B14R2.3017 C1CCN(C1)CCCSC[C@@H]2CO2 62a_100016991639_100000745022 [0,0,0,2,0,0|2,0,0]=4 34577 B14R2.3017 C1CCN(C1)CCSCCC2CO2 62a_100000700749_100000732470 [0,0,0,2,0,0|2,0,0]=4 34578 B14R2.3017 C1CCN(C1)CCSCCC2CO2 62a_100000732470_100000004467 [0,0,0,2,0,0|2,0,0]=4 34579 B14R2.3017 C1COC(C1)COCCCC2CO2 34a_100000210270_100000733510 [0,0,0,2,0,0|2,0,0]=4 34580 B14R2.3017 C1COC(C1)COCCCC2CO2 7a_100000210270_100000733510 [0,0,0,2,0,0|2,0,0]=4 34581 B14R2.3017 C1COC(O1)CCSCCC2CC2 62a_100000764125_100000740749 [0,0,0,2,0,0|2,0,0]=4 34582 B14R2.9636 CCCCO[C@H]1CO[C@@H]2[C@H]1CCO2 34a_100015698664_100000210210 [0,0,0,2,0,0|2,0,0]=4 34583 B14R2.9636 CCCCO[C@H]1CO[C@@H]2[C@H]1CCO2 7a_100015698664_100000210211 [0,0,0,2,0,0|2,0,0]=4 34584 B14R2.9707 BrCCCCOC1CC2CCC1C2 34a_100011216708_100000727232 [0,0,0,2,0,0|2,0,0]=4 34585 B14R2.9707 CCCCCCN1CC2CCC1C2 2230a_100000743476_100000210314 [0,0,0,2,0,0|2,0,0]=4 34586 B14R2.9707 CCCCCCN1CC2CCC1C2 269982a_100000743476_100000210757 [0,0,0,2,0,0|2,0,0]=4 34587 B14R2.9707 CCCCCCN1CC2CCC1C2 34a_100000743476_100000210314 [0,0,0,2,0,0|2,0,0]=4 34588 B14R2.9707 CCCCCCN1C[C@H]2C[C@@H]1CO2 2230a_100016995552_100000210314 [0,0,0,2,0,0|1,0,0]=3 34589 B14R2.9707 CCCCCCN1C[C@H]2C[C@@H]1CO2 269982a_100016995552_100000210757 [0,0,0,2,0,0|1,0,0]=3 34590 B14R2.9707 CCCCCCN1C[C@H]2C[C@@H]1CO2 34a_100016995552_100000210314 [0,0,0,2,0,0|1,0,0]=3 34591 B14R2.9707 CCCCCNC1CC2CCC1C2 2230a_100000758229_100000210326 [0,0,0,2,0,0|2,0,0]=4 34592 B14R2.9707 CCCCCNC1CC2CCC1C2 269862a_100000209983_100000223372 [0,0,0,2,0,0|2,0,0]=4 34593 B14R2.9707 CCCCCNC1CC2CCC1C2 270004a_100000209983_100000223372 [0,0,0,2,0,0|2,0,0]=4 34594 B14R2.9707 CCCCCNC1CC2CCC1C2 34a_100000758229_100000718602 [0,0,0,2,0,0|2,0,0]=4 34595 B14R2.9707 CCCCCOC1CC2CCC1C2 34a_100000210253_100000727232 [0,0,0,2,0,0|2,0,0]=4 34596 B14R2.9707 CCCCCOC1CC2CCC1C2 34a_100000211339_100000718602 [0,0,0,2,0,0|2,0,0]=4 34597 B14R2.9707 CCCCCSC1CC2CCC1C2 62a_100000210326_100000727232 [0,0,0,2,0,0|2,0,0]=4 34598 B14R2.9707 CCCCCSC1CC2CCC1C2 62a_100000727232_100000210326 [0,0,0,2,0,0|2,0,0]=4 34599 B14R2.9707 CCCCNCC1CC2CCC1C2 269862a_100000102301_100000697602 [0,0,0,2,0,0|2,0,0]=4 34600 B14R2.9707 CCCCNCC1CC2CCC1C2 270004a_100000102301_100000697602 [0,0,0,2,0,0|2,0,0]=4 34601 B14R2.9707 CCCCOCC1CC2CCC1C2 34a_100000229996_100000210210 [0,0,0,2,0,0|2,0,0]=4 34602 B14R2.9707 CCCCOCN1C[C@H]2C[C@@H]1CO2 2230a_100016995552_100011995733 [0,0,0,2,0,0|2,0,0]=4 34603 B14R2.9707 CCCCOCN1C[C@H]2C[C@@H]1CO2 269982a_100016995552_100011995733 [0,0,0,2,0,0|2,0,0]=4 34604 B14R2.9707 CCCCOCN1C[C@H]2C[C@@H]1CO2 34a_100016995552_100011995733 [0,0,0,2,0,0|2,0,0]=4 34605 B14R2.9707 CCCOCCN1C[C@H]2C[C@@H]1CO2 2230a_100016995552_100011215938 [0,0,0,2,0,0|2,0,0]=4 34606 B14R2.9707 CCCOCCN1C[C@H]2C[C@@H]1CO2 269982a_100016995552_100011215938 [0,0,0,2,0,0|2,0,0]=4 34607 B14R2.9707 CCCOCCN1C[C@H]2C[C@@H]1CO2 34a_100016995552_100011215938 [0,0,0,2,0,0|2,0,0]=4 34608 B14R2.9707 CCOCCCN1C[C@H]2C[C@@H]1CO2 2230a_100016995552_100012232248 [0,0,0,2,0,0|2,0,0]=4 34609 B14R2.9707 CCOCCCN1C[C@H]2C[C@@H]1CO2 269982a_100016995552_100012232248 [0,0,0,2,0,0|2,0,0]=4 34610 B14R2.9707 CCOCCCN1C[C@H]2C[C@@H]1CO2 34a_100016995552_100012232248 [0,0,0,2,0,0|2,0,0]=4 34611 B14R2.9707 COCCCCN1C[C@H]2C[C@@H]1CO2 2230a_100016995552_100000730899 [0,0,0,2,0,0|2,0,0]=4 34612 B14R2.9707 COCCCCN1C[C@H]2C[C@@H]1CO2 269982a_100016995552_100000730899 [0,0,0,2,0,0|2,0,0]=4 34613 B14R2.9707 COCCCCN1C[C@H]2C[C@@H]1CO2 34a_100016995552_100000755781 [0,0,0,2,0,0|2,0,0]=4 34614 B14R2.9707 ClCCCCOC1CC2CCC1C2 34a_100000210776_100000727232 [0,0,0,2,0,0|2,0,0]=4 34615 B14R2.9707 FCCCCCN1CC2CCC1C2 2230a_100000743476_100000729378 [0,0,0,2,0,0|2,0,0]=4 34616 B14R2.9707 FCCCCCN1CC2CCC1C2 269982a_100000743476_100000729378 [0,0,0,2,0,0|2,0,0]=4 34617 B14R2.9707 FCCCCCN1CC2CCC1C2 34a_100000743476_100000729378 [0,0,0,2,0,0|2,0,0]=4 34618 B14R2.9707 FCCCCCN1C[C@H]2C[C@@H]1CO2 2230a_100016995552_100000729378 [0,0,0,2,0,0|2,0,0]=4 34619 B14R2.9707 FCCCCCN1C[C@H]2C[C@@H]1CO2 269982a_100016995552_100000729378 [0,0,0,2,0,0|2,0,0]=4 34620 B14R2.9707 FCCCCCN1C[C@H]2C[C@@H]1CO2 34a_100016995552_100000729378 [0,0,0,2,0,0|2,0,0]=4 34621 B14R2.9707 FCCCCNC1CC2CCC1C2 2230a_100000758229_100000729493 [0,0,0,2,0,0|2,0,0]=4 34622 B14R2.9707 FCCCCNC1CC2CCC1C2 34a_100000758229_100000729493 [0,0,0,2,0,0|2,0,0]=4 34623 B14R2.9707 FCCCCOC1CC2CCC1C2 34a_100000211339_100000729493 [0,0,0,2,0,0|2,0,0]=4 34624 B14R2.9707 FCCCCOC1CC2CCC1C2 34a_100011995726_100000727232 [0,0,0,2,0,0|2,0,0]=4 34625 B14R2.9707 FCCCCSC1CC2CCC1C2 62a_100000727232_100000729493 [0,0,0,2,0,0|2,0,0]=4 34626 B14R2.9707 FCCCCSC1CC2CCC1C2 62a_100000729493_100000727232 [0,0,0,2,0,0|2,0,0]=4 34627 B14R2.9707 FCCCNCC1CC2CCC1C2 269862a_100015189416_100000697602 [0,0,0,2,0,0|2,0,0]=4 34628 B14R2.9707 FCCCNCC1CC2CCC1C2 270004a_100015189416_100000697602 [0,0,0,2,0,0|2,0,0]=4 34629 B14R2.9707 FCCCOCC1CC2CCC1C2 34a_100000229996_100011934791 [0,0,0,2,0,0|2,0,0]=4 34630 B14R2.9707 ICCCCOC1CC2CCC1C2 34a_200012148704_100000727232 [0,0,0,2,0,0|2,0,0]=4 34631 B14R2.9707 NCCCCOC1CC2CCC1C2 34a_100000750430_100000727232 [0,0,0,2,0,0|2,0,0]=4 34632 B14R2.9707 OCCCCCN1CC2CCC1C2 2230a_100000743476_100000746330 [0,0,0,2,0,0|1,0,0]=3 34633 B14R2.9707 OCCCCCN1CC2CCC1C2 269982a_100000743476_100000746330 [0,0,0,2,0,0|1,0,0]=3 34634 B14R2.9707 OCCCCCN1CC2CCC1C2 34a_100000743476_100000746330 [0,0,0,2,0,0|1,0,0]=3 34635 B14R2.9707 OCCCCCN1C[C@H]2C[C@@H]1CO2 2230a_100016995552_100000746330 [0,0,0,2,0,0|2,0,0]=4 34636 B14R2.9707 OCCCCCN1C[C@H]2C[C@@H]1CO2 269982a_100016995552_100000746330 [0,0,0,2,0,0|2,0,0]=4 34637 B14R2.9707 OCCCCCN1C[C@H]2C[C@@H]1CO2 34a_100016995552_100000746330 [0,0,0,2,0,0|2,0,0]=4 34638 B14R2.9707 OCCCCNC1CC2CCC1C2 2230a_100000758229_100000210776 [0,0,0,2,0,0|1,0,0]=3 34639 B14R2.9707 OCCCCNC1CC2CCC1C2 269862a_100000750430_100000223372 [0,0,0,2,0,0|1,0,0]=3 34640 B14R2.9707 OCCCCNC1CC2CCC1C2 270004a_100000750430_100000223372 [0,0,0,2,0,0|1,0,0]=3 34641 B14R2.9707 OCCCCNC1CC2CCC1C2 34a_100000750430_100000727232 [0,0,0,2,0,0|1,0,0]=3 34642 B14R2.9707 OCCCCNC1CC2CCC1C2 34a_100000758229_100011216708 [0,0,0,2,0,0|1,0,0]=3 34643 B14R2.9707 OCCCCOC1CC2CCC1C2 34a_100000211339_100011216708 [0,0,0,2,0,0|1,0,0]=3 34644 B14R2.9707 OCCCCSC1CC2CCC1C2 62a_100000210776_100000727232 [0,0,0,2,0,0|1,0,0]=3 34645 B14R2.9707 OCCCCSC1CC2CCC1C2 62a_100000727232_100000210776 [0,0,0,2,0,0|1,0,0]=3 34646 B14R2.9707 OCCCNCC1CC2CCC1C2 269862a_100000182051_100000697602 [0,0,0,2,0,0|1,0,0]=3 34647 B14R2.9707 OCCCNCC1CC2CCC1C2 270004a_100000182051_100000697602 [0,0,0,2,0,0|1,0,0]=3 34648 B14R2.9707 OCCCOCC1CC2CCC1C2 34a_100000229996_100000230001 [0,0,0,2,0,0|1,0,0]=3 34649 B14R2.9707 OCCOCCN1CC2CCC1C2 2230a_100000743476_100011215305 [0,0,0,2,0,0|2,0,0]=4 34650 B14R2.9707 OCCOCCN1CC2CCC1C2 269982a_100000743476_100011215305 [0,0,0,2,0,0|2,0,0]=4 34651 B14R2.9707 OCCOCCN1CC2CCC1C2 34a_100000743476_100000692535 [0,0,0,2,0,0|2,0,0]=4 34652 B14R2.9707 OCCOCCN1CC2CCC1C2 34a_200011499663_100000211926 [0,0,0,2,0,0|2,0,0]=4 34653 B14R2.15067 C(CCN1CCC1)CC2OCCO2 269982a_100000754969_100000034956 [0,0,0,2,0,0|2,0,0]=4 34654 B14R2.15067 C1CC(C1)CNCCC2OCCO2 2230a_100000034215_100000763275 [0,0,0,2,0,0|2,0,0]=4 34655 B14R2.15067 C1CC(C1)CNCCC2OCCO2 2230a_100000738700_100000740749 [0,0,0,2,0,0|2,0,0]=4 34656 B14R2.15067 C1CC(C1)CNCCC2OCCO2 34a_100000034215_100000763275 [0,0,0,2,0,0|2,0,0]=4 34657 B14R2.15067 C1CC(C1)CNCCC2OCCO2 34a_100000738700_100000740749 [0,0,0,2,0,0|2,0,0]=4 34658 B14R2.15067 C1CC(C1)COCCC2OCCO2 34a_100000760304_100000740749 [0,0,0,2,0,0|2,0,0]=4 34659 B14R2.15067 C1CC(C1)CSCCC2OCCO2 62a_100000763275_100000740749 [0,0,0,2,0,0|2,0,0]=4 34660 B14R2.15067 C1CC(C1)NCCCC2OCCO2 2230a_100000749019_100000042513 [0,0,0,2,0,0|2,0,0]=4 34661 B14R2.15067 C1CC(C1)NCCCC2OCCO2 34a_100000749019_100009861162 [0,0,0,2,0,0|2,0,0]=4 34662 B14R2.15067 C1CC(C1)OCCCC2OCCO2 34a_100000748187_100009861162 [0,0,0,2,0,0|2,0,0]=4 34663 B14R2.15067 C1CC(C1)OCCCC2OCCO2 34a_100009871617_100000749161 [0,0,0,2,0,0|2,0,0]=4 34664 B14R2.15067 C1CC(CN1)CCOCC2CCO2 34a_100016987287_100000103362 [0,0,0,2,0,0|2,0,0]=4 34665 B14R2.15067 C1CC(CO1)CCOCC2CCO2 34a_100011879284_100000103362 [0,0,0,2,0,0|2,0,0]=4 34666 B14R2.15067 C1CCC(C1)CCCNC2CCC2 2230a_100000749019_100011713738 [0,0,0,2,0,0|2,0,0]=4 34667 B14R2.15067 C1CCC(C1)CCCNC2CCC2 270004a_100000736752_100000241760 [0,0,0,2,0,0|2,0,0]=4 34668 B14R2.15067 C1CCC(C1)CCCNC2CCC2 34a_100000736752_100000749161 [0,0,0,2,0,0|2,0,0]=4 34669 B14R2.15067 C1CCC(C1)CCCNC2CCC2 34a_100000749019_100011713738 [0,0,0,2,0,0|2,0,0]=4 34670 B14R2.15067 C1CCC(C1)CCCOC2CCC2 34a_100000748187_100011713738 [0,0,0,2,0,0|2,0,0]=4 34671 B14R2.15067 C1CCC(C1)CCCOC2CCC2 34a_100011215328_100000749161 [0,0,0,2,0,0|2,0,0]=4 34672 B14R2.15067 C1CCC(C1)CCCSC2CCC2 62a_100011713738_100000749161 [0,0,0,2,0,0|2,0,0]=4 34673 B14R2.15067 C1CCC(C1)CCNCC2CCC2 2230a_100000738700_100000760354 [0,0,0,2,0,0|2,0,0]=4 34674 B14R2.15067 C1CCC(C1)CCNCC2CCC2 2230a_100000739158_100000763275 [0,0,0,2,0,0|2,0,0]=4 34675 B14R2.15067 C1CCC(C1)CCNCC2CCC2 269862a_100000739158_100000753134 [0,0,0,2,0,0|2,0,0]=4 34676 B14R2.15067 C1CCC(C1)CCNCC2CCC2 34a_100000738700_100000760354 [0,0,0,2,0,0|2,0,0]=4 34677 B14R2.15067 C1CCC(C1)CCNCC2CCC2 34a_100000739158_100000763275 [0,0,0,2,0,0|2,0,0]=4 34678 B14R2.15067 C1CCC(C1)CCNCC2CCO2 2230a_100000739158_100000103362 [0,0,0,2,0,0|1,0,0]=3 34679 B14R2.15067 C1CCC(C1)CCNCC2CCO2 34a_100000739158_100000103362 [0,0,0,2,0,0|1,0,0]=3 34680 B14R2.15067 C1CCC(C1)CCNC[C@@H]2CCO2 2230a_100020831831_100000760354 [0,0,0,2,0,0|1,0,0]=3 34681 B14R2.15067 C1CCC(C1)CCNC[C@@H]2CCO2 34a_100020831831_100000760354 [0,0,0,2,0,0|1,0,0]=3 34682 B14R2.15067 C1CCC(C1)CCOCC2CCC2 34a_100000749090_100000763275 [0,0,0,2,0,0|2,0,0]=4 34683 B14R2.15067 C1CCC(C1)CCOCC2CCC2 34a_100000760304_100000760354 [0,0,0,2,0,0|2,0,0]=4 34684 B14R2.15067 C1CCC(C1)CCOCC2CCC2 7a_100000749090_100000763275 [0,0,0,2,0,0|2,0,0]=4 34685 B14R2.15067 C1CCC(C1)CCOCC2CCO2 34a_100000039022_100000760354 [0,0,0,2,0,0|1,0,0]=3 34686 B14R2.15067 C1CCC(C1)CCOCC2CCO2 34a_100000749090_100000103362 [0,0,0,2,0,0|1,0,0]=3 34687 B14R2.15067 C1CCC(C1)CCOCC2CCO2 7a_100000749090_100000103362 [0,0,0,2,0,0|1,0,0]=3 34688 B14R2.15067 C1CCC(C1)CCSCC2CCC2 62a_100000760354_100000763275 [0,0,0,2,0,0|2,0,0]=4 34689 B14R2.15067 C1CCC(C1)CCSCC2CCC2 62a_100000763275_100000760354 [0,0,0,2,0,0|2,0,0]=4 34690 B14R2.15067 C1CCC(C1)CCSCC2CCO2 62a_100000103362_100000760354 [0,0,0,2,0,0|1,0,0]=3 34691 B14R2.15067 C1CCC(C1)CCSCC2CCO2 62a_100000760354_100000103362 [0,0,0,2,0,0|1,0,0]=3 34692 B14R2.15067 C1CCN(C1)CCSCC2CCO2 62a_100000103362_100000004467 [0,0,0,2,0,0|2,0,0]=4 34693 B14R2.15067 C1CCN(C1)CCSCC2CCO2 62a_100000700749_100000103362 [0,0,0,2,0,0|2,0,0]=4 34694 B14R2.170 CC1OCCC1N2CCC[C@@H]2CO 270004a_100000745186_100000691750 [0,0,0,2,0,0|2,0,0]=4 34695 B14R2.170 CCC1CCCC1N2CCC[C@@H]2C 270004a_100020605311_100000749056 [0,0,0,2,0,0|2,0,0]=4 34696 B14R2.170 CCC1CCCC1N2CCC[C@H]2C 270004a_100015189458_100000749056 [0,0,0,2,0,0|2,0,0]=4 34697 B14R2.170 CCC1CCCN1C2COCC2O 34a_100000754278_200000725654 [0,0,0,2,0,0|2,0,0]=4 34698 B14R2.170 CCC1CCCN1[C@@H]2CCC[C@H]2O 269982a_100000754278_200016002552 [0,0,0,2,0,0|1,0,0]=3 34699 B14R2.170 OC[C@H]1CCCN1[C@@H]2CCC[C@H]2O 269982a_100000745186_200016002552 [0,0,0,2,0,0|2,0,0]=4 34700 B14R2.332 CCCCCCN1CCCC12CC2 2230a_100020620911_100000210314 [0,0,0,2,0,0|2,0,0]=4 34701 B14R2.332 CCCCCCN1CCCC12CC2 269982a_100020620911_100000210757 [0,0,0,2,0,0|2,0,0]=4 34702 B14R2.332 CCCCCCN1CCCC12CC2 34a_100020620911_100000210314 [0,0,0,2,0,0|2,0,0]=4 34703 B14R2.332 CCCCCNC1CCCC12CC2 269862a_100000209983_100009881796 [0,0,0,2,0,0|2,0,0]=4 34704 B14R2.332 FCCCCCN1CCCC12CC2 2230a_100020620911_100000729378 [0,0,0,2,0,0|2,0,0]=4 34705 B14R2.332 FCCCCCN1CCCC12CC2 269982a_100020620911_100000729378 [0,0,0,2,0,0|2,0,0]=4 34706 B14R2.332 FCCCCCN1CCCC12CC2 34a_100020620911_100000729378 [0,0,0,2,0,0|2,0,0]=4 34707 B14R2.332 OCCCCCN1CCCC12CC2 2230a_100020620911_100000746330 [0,0,0,2,0,0|1,0,0]=3 34708 B14R2.332 OCCCCCN1CCCC12CC2 269982a_100020620911_100000746330 [0,0,0,2,0,0|1,0,0]=3 34709 B14R2.332 OCCCCCN1CCCC12CC2 34a_100020620911_100000746330 [0,0,0,2,0,0|1,0,0]=3 34710 B14R2.332 OCCCCNC1CCCC12CC2 269862a_100000750430_100009881796 [0,0,0,2,0,0|1,0,0]=3 34711 B14R2.332 OCCOCCN1CCCC12CC2 2230a_100020620911_100011215305 [0,0,0,2,0,0|2,0,0]=4 34712 B14R2.332 OCCOCCN1CCCC12CC2 269982a_100020620911_100011215305 [0,0,0,2,0,0|2,0,0]=4 34713 B14R2.332 OCCOCCN1CCCC12CC2 34a_100020620911_100000692535 [0,0,0,2,0,0|2,0,0]=4 34714 B14R2.808 CC1C2CCCN2CCN1CCO 2230a_200000066283_100000211926 [0,0,0,2,0,0|2,0,0]=4 34715 B14R2.808 CC1C2CCCN2CCN1CCO 269982a_200000066283_100000211926 [0,0,0,2,0,0|2,0,0]=4 34716 B14R2.808 CC1C2CCCN2CCN1CCO 34a_200000066283_100000211926 [0,0,0,2,0,0|2,0,0]=4 34717 B14R2.991 CCCOC1CCC2CCCC2C1 34a_100000073670_100000210303 [0,0,0,2,0,0|2,0,0]=4 34718 B14R2.991 CCCOC1CCC2CCCC2C1 7a_100000073670_100000210303 [0,0,0,2,0,0|2,0,0]=4 34719 B14R2.991 FCCOC1CCC2CCCC2C1 34a_100000073670_100011217306 [0,0,0,2,0,0|2,0,0]=4 34720 B14R2.991 FCCOC1CCC2CCCC2C1 7a_100000073670_100011217306 [0,0,0,2,0,0|2,0,0]=4 34721 B14R2.991 OCCCN1CCN2CCC[C@@H]2C1 2230a_100000008389_100000230001 [0,0,0,2,0,0|2,0,0]=4 34722 B14R2.991 OCCCN1CCN2CCC[C@@H]2C1 269982a_100000008389_100011215043 [0,0,0,2,0,0|2,0,0]=4 34723 B14R2.991 OCCCN1CCN2CCC[C@@H]2C1 34a_100000008389_100000230001 [0,0,0,2,0,0|2,0,0]=4 34724 B14R2.991 OCCOC1CCC2CCCC2C1 34a_100000073670_100000211926 [0,0,0,2,0,0|1,0,0]=3 34725 B14R2.991 OCCOC1CCC2CCCC2C1 7a_100000073670_100000211926 [0,0,0,2,0,0|1,0,0]=3 34726 B14R2.3541 CCC1CCCC1NCCC2CC2 269862a_100000764129_100000749056 [0,0,0,2,0,0|2,0,0]=4 34727 B14R2.3541 CCC1CCCC1NCCC2CC2 270004a_100000764129_100000749056 [0,0,0,2,0,0|2,0,0]=4 34728 B14R2.3541 CCC1CCCN1CCCC2CO2 2230a_100000754278_100000733510 [0,0,0,2,0,0|1,0,0]=3 34729 B14R2.3541 CCC1CCCN1CCCC2CO2 269982a_100000754278_100000733510 [0,0,0,2,0,0|1,0,0]=3 34730 B14R2.3541 CCC1CCCN1CCCC2CO2 34a_100000754278_100000733510 [0,0,0,2,0,0|1,0,0]=3 34731 B14R2.3541 CCN1CCCC1CNCC2CO2 2230a_100000211693_100011216344 [0,0,0,2,0,0|2,0,0]=4 34732 B14R2.3541 CCN1CCC[C@@H]1COCC2CO2 34a_100011739246_102125554688 [0,0,0,2,0,0|2,0,0]=4 34733 B14R2.3541 CCN1CCC[C@@H]1COCC2CO2 7a_100011739246_102125554688 [0,0,0,2,0,0|2,0,0]=4 34734 B14R2.3541 CCN1CCC[C@@H]1COC[C@@H]2CO2 7a_100011739246_100000745022 [0,0,0,2,0,0|2,0,0]=4 34735 B14R2.3541 OC[C@H]1CCCN1CCCC2CO2 2230a_100000745186_100000733510 [0,0,0,2,0,0|2,0,0]=4 34736 B14R2.3541 OC[C@H]1CCCN1CCCC2CO2 269982a_100000745186_100000733510 [0,0,0,2,0,0|2,0,0]=4 34737 B14R2.3541 OC[C@H]1CCCN1CCCC2CO2 34a_100000745186_100000733510 [0,0,0,2,0,0|2,0,0]=4 34738 B14R2.3563 CCC1CCCC1NCC2CCC2 269862a_100000738700_100000749056 [0,0,0,2,0,0|2,0,0]=4 34739 B14R2.3563 CCC1CCCC1NCC2CCC2 270004a_100000738700_100000749056 [0,0,0,2,0,0|2,0,0]=4 34740 B14R2.3563 CCC1CCCC1NC[C@@H]2CCO2 269862a_100020831831_100000749056 [0,0,0,2,0,0|1,0,0]=3 34741 B14R2.3563 CCC1CCCC1NC[C@@H]2CCO2 270004a_100020831831_100000749056 [0,0,0,2,0,0|1,0,0]=3 34742 B14R2.4539 CCN1C[C@H]2C[C@@H]1CN2CCCO 2230a_200016994038_100000230001 [0,0,0,2,0,0|2,0,0]=4 34743 B14R2.4539 CCN1C[C@H]2C[C@@H]1CN2CCCO 269982a_200016994038_100011215043 [0,0,0,2,0,0|2,0,0]=4 34744 B14R2.492 COCC1CCN1[C@@H]2CCC[C@H]2O 269982a_100015195929_200016002552 [0,0,0,2,0,0|2,0,0]=4 34745 B14R2.6522 COCC1CCN1CCCC2CO2 2230a_100015195929_100000733510 [0,0,0,2,0,0|2,0,0]=4 34746 B14R2.6522 COCC1CCN1CCCC2CO2 269982a_100015195929_100000733510 [0,0,0,2,0,0|2,0,0]=4 34747 B14R2.6522 COCC1CCN1CCCC2CO2 34a_100015195929_100000733510 [0,0,0,2,0,0|2,0,0]=4 34748 B14R2.20741 OCCCCCN1CCC12COC2 2230a_100015204706_100000746330 [0,0,0,2,0,0|2,0,0]=4 34749 B14R2.20741 OCCCCCN1CCC12COC2 269982a_100015204706_100000746330 [0,0,0,2,0,0|2,0,0]=4 34750 B14R2.583 CC1CN2CCCC2CN1CCO 2230a_200159271516_100000211926 [0,0,0,2,0,0|2,0,0]=4 34751 B14R2.583 CC1CN2CCCC2CN1CCO 269982a_200159271516_100000211926 [0,0,0,2,0,0|2,0,0]=4 34752 B14R2.583 CC1CN2CCCC2CN1CCO 34a_200159271516_100000211926 [0,0,0,2,0,0|2,0,0]=4 34753 B14R2.203 CC1CCC2CCCCC2N1CF 269982a_100132302184_100015361967 [0,0,0,2,0,0|2,0,0]=4 34754 B14R2.203 CC1CCC2CCCCC2N1CF 34a_100132302184_100015361967 [0,0,0,2,0,0|2,0,0]=4 34755 B14R2.203 CCN1C(CCC2C1CCCC2)C 2230a_100132302184_100000210202 [0,0,0,2,0,0|2,0,0]=4 34756 B14R2.203 CCN1C(CCC2C1CCCC2)C 269982a_100132302184_100000204670 [0,0,0,2,0,0|2,0,0]=4 34757 B14R2.203 CCN1C(CCC2C1CCCC2)C 34a_100132302184_100000210202 [0,0,0,2,0,0|2,0,0]=4 34758 B14R2.868 OCCCC1CCCCN1C2CC2 269982a_100011934581_100000211595 [0,0,0,2,0,0|1,0,0]=3 34759 B14R2.868 OCCCC1CCCCN1C2CC2 34a_100011934581_100000211595 [0,0,0,2,0,0|1,0,0]=3 34760 B14R2.3102 CCCC1CCCCC1OC2CC2 34a_100011217265_100000211595 [0,0,0,2,0,0|2,0,0]=4 34761 B14R2.3102 CCCC1CCCCN1CC2CC2 2230a_100000701414_100000742324 [0,0,0,2,0,0|2,0,0]=4 34762 B14R2.3102 CCCC1CCCCN1CC2CC2 269982a_100000701414_100000756562 [0,0,0,2,0,0|2,0,0]=4 34763 B14R2.3102 CCCC1CCCCN1CC2CC2 34a_100000701414_100000742324 [0,0,0,2,0,0|2,0,0]=4 34764 B14R2.3102 CCCC1CCCCN1CC2CO2 2230a_100000701414_100011216344 [0,0,0,2,0,0|1,0,0]=3 34765 B14R2.3102 CCCC1CCCCN1CC2CO2 269982a_100000701414_102125554688 [0,0,0,2,0,0|1,0,0]=3 34766 B14R2.3102 CCCC1CCCCN1CC2CO2 34a_100000701414_102125554688 [0,0,0,2,0,0|1,0,0]=3 34767 B14R2.3102 CCCC1CCCCN1CC2CS2 269982a_100000701414_100000031435 [0,0,0,2,0,0|1,1,0]=4 34768 B14R2.3102 CCCC1CCCCN1C[C@@H]2CO2 269982a_100000701414_100000745022 [0,0,0,2,0,0|1,0,0]=3 34769 B14R2.3102 CCCC1COCCN1CC2CO2 2230a_102495339903_100011216344 [0,0,0,2,0,0|2,0,0]=4 34770 B14R2.3102 CCCC1COCCN1CC2CO2 269982a_102495339903_102125554688 [0,0,0,2,0,0|2,0,0]=4 34771 B14R2.3102 CCCC1COCCN1CC2CO2 34a_102495339903_102125554688 [0,0,0,2,0,0|2,0,0]=4 34772 B14R2.3102 CCCC1COCCN1C[C@@H]2CO2 269982a_102495339903_100000745022 [0,0,0,2,0,0|2,0,0]=4 34773 B14R2.3102 COCC1CCCCN1CC2CO2 2230a_100015184032_100011216344 [0,0,0,2,0,0|2,0,0]=4 34774 B14R2.3102 COCC1CCCCN1CC2CO2 269982a_100015184032_102125554688 [0,0,0,2,0,0|2,0,0]=4 34775 B14R2.3102 COCC1CCCCN1CC2CO2 34a_100015184032_102125554688 [0,0,0,2,0,0|2,0,0]=4 34776 B14R2.3102 COCC1CCCCN1C[C@@H]2CO2 269982a_100015184032_100000745022 [0,0,0,2,0,0|2,0,0]=4 34777 B14R2.3102 OCCC1CCCCN1CC2CC2 2230a_100000211664_100000742324 [0,0,0,2,0,0|1,0,0]=3 34778 B14R2.3102 OCCC1CCCCN1CC2CC2 269982a_100000211664_100000756562 [0,0,0,2,0,0|1,0,0]=3 34779 B14R2.3102 OCCC1CCCCN1CC2CC2 34a_100000211664_100000742324 [0,0,0,2,0,0|1,0,0]=3 34780 B14R2.3102 OCCC1CCCCN1CC2CO2 2230a_100000211664_100011216344 [0,0,0,2,0,0|2,0,0]=4 34781 B14R2.3102 OCCC1CCCCN1CC2CO2 269982a_100000211664_102125554688 [0,0,0,2,0,0|2,0,0]=4 34782 B14R2.3102 OCCC1CCCCN1CC2CO2 34a_100000211664_102125554688 [0,0,0,2,0,0|2,0,0]=4 34783 B14R2.3102 OCCC1CCCCN1CC2CS2 269982a_100000211664_100000031435 [0,0,0,2,0,0|2,0,0]=4 34784 B14R2.3102 OCCC1CCCCN1C[C@@H]2CO2 269982a_100000211664_100000745022 [0,0,0,2,0,0|2,0,0]=4 34785 B14R2.6558 CCCC1CCCCN1C2CCC2 269982a_100000701414_100000749161 [0,0,0,2,0,0|2,0,0]=4 34786 B14R2.6558 CCCC1CCCCN1C2CCC2 270004a_100000701414_100000241760 [0,0,0,2,0,0|2,0,0]=4 34787 B14R2.6558 CCCC1CCCCN1C2CCC2 34a_100000701414_100000749161 [0,0,0,2,0,0|2,0,0]=4 34788 B14R2.6558 OCCC1CCCCN1C2CCC2 269982a_100000211664_100000749161 [0,0,0,2,0,0|1,0,0]=3 34789 B14R2.6558 OCCC1CCCCN1C2CCC2 270004a_100000211664_100000241760 [0,0,0,2,0,0|1,0,0]=3 34790 B14R2.6558 OCCC1CCCCN1C2CCC2 34a_100000211664_100000749161 [0,0,0,2,0,0|1,0,0]=3 34791 B14R2.6558 OCCC1CCCCN1C2COC2 269982a_100000211664_100000687716 [0,0,0,2,0,0|2,0,0]=4 34792 B14R2.6558 OCCC1CCCCN1C2COC2 34a_100000211664_100009818527 [0,0,0,2,0,0|2,0,0]=4 34793 B14R2.67 CCCCN1C[C@H]2CCCC[C@H]2C1 2230a_100015204113_100000210211 [0,0,0,2,0,0|2,0,0]=4 34794 B14R2.67 CCCCN1C[C@H]2CCCC[C@H]2C1 269982a_100015204113_100000210211 [0,0,0,2,0,0|2,0,0]=4 34795 B14R2.67 CCCCN1C[C@H]2CCCC[C@H]2C1 34a_100015204113_100000210210 [0,0,0,2,0,0|2,0,0]=4 34796 B14R2.67 FCCCN1C[C@H]2CCCC[C@H]2C1 2230a_100015204113_100011934791 [0,0,0,2,0,0|2,0,0]=4 34797 B14R2.67 FCCCN1C[C@H]2CCCC[C@H]2C1 269982a_100015204113_100011934791 [0,0,0,2,0,0|2,0,0]=4 34798 B14R2.67 FCCCN1C[C@H]2CCCC[C@H]2C1 34a_100015204113_100011934791 [0,0,0,2,0,0|2,0,0]=4 34799 B14R2.67 OCCCN1C[C@H]2CCCC[C@H]2C1 2230a_100015204113_100000230001 [0,0,0,2,0,0|1,0,0]=3 34800 B14R2.67 OCCCN1C[C@H]2CCCC[C@H]2C1 269982a_100015204113_100011215043 [0,0,0,2,0,0|1,0,0]=3 34801 B14R2.67 OCCCN1C[C@H]2CCCC[C@H]2C1 34a_100015204113_100000230001 [0,0,0,2,0,0|1,0,0]=3 34802 B14R2.12793 C1CCCCN(CCC1)CC2CC2 2230a_100000039187_100000742324 [0,0,0,2,0,0|2,0,0]=4 34803 B14R2.12793 C1CCCCN(CCC1)CC2CC2 269982a_100000039187_100000756562 [0,0,0,2,0,0|2,0,0]=4 34804 B14R2.12793 C1CCCCN(CCC1)CC2CC2 34a_100000039187_100000742324 [0,0,0,2,0,0|2,0,0]=4 34805 B14R2.12793 C1CCCCN(CCC1)CC2CO2 2230a_100000039187_100011216344 [0,0,0,2,0,0|1,0,0]=3 34806 B14R2.12793 C1CCCCN(CCC1)CC2CO2 269982a_100000039187_102125554688 [0,0,0,2,0,0|1,0,0]=3 34807 B14R2.12793 C1CCCCN(CCC1)CC2CO2 34a_100000039187_102125554688 [0,0,0,2,0,0|1,0,0]=3 34808 B14R2.12793 C1CCCCN(CCC1)CC2CS2 269982a_100000039187_100000031435 [0,0,0,2,0,0|1,1,0]=4 34809 B14R2.12793 C1CCCCN(CCC1)C[C@@H]2CO2 269982a_100000039187_100000745022 [0,0,0,2,0,0|1,0,0]=3 34810 B14R2.21925 C1CCCCN(CCC1)C2CCC2 269982a_100000039187_100000749161 [0,0,0,2,0,0|2,0,0]=4 34811 B14R2.21925 C1CCCCN(CCC1)C2CCC2 270004a_100000039187_100000241760 [0,0,0,2,0,0|2,0,0]=4 34812 B14R2.21925 C1CCCCN(CCC1)C2CCC2 34a_100000039187_100000749161 [0,0,0,2,0,0|2,0,0]=4 34813 B14R2.294 CC1CC1COC2CCCCC2F 34a_100000744939_100015423560 [0,0,0,2,0,0|2,0,0]=4 34814 B14R2.294 CC1CC1COC2CCCCC2O 34a_100000744939_100000038908 [0,0,0,2,0,0|1,0,0]=3 34815 B14R2.296 CC1CCCCC1N2CCC[C@@H]2C 270004a_100020605311_100000210921 [0,0,0,2,0,0|2,0,0]=4 34816 B14R2.296 CC1CCCCC1N2CCC[C@H]2C 270004a_100015189458_100000210921 [0,0,0,2,0,0|2,0,0]=4 34817 B14R2.296 CC1CCCCN1C2COCC2O 34a_100000211376_200000725654 [0,0,0,2,0,0|2,0,0]=4 34818 B14R2.296 CC1CCCCN1[C@@H]2CCC[C@H]2O 269982a_100000211376_200016002552 [0,0,0,2,0,0|1,0,0]=3 34819 B14R2.296 CC1SCCN1C2CCCCC2O 269982a_200011216479_100000038908 [0,0,0,2,0,0|2,0,0]=4 34820 B14R2.296 CC1SCCN1C2CCCCC2O 34a_200011216479_100000038908 [0,0,0,2,0,0|2,0,0]=4 34821 B14R2.296 C[C@@H]1CCCN1C2CCCCC2F 269982a_100015189458_100015423560 [0,0,0,2,0,0|2,0,0]=4 34822 B14R2.296 C[C@@H]1CCCN1C2CCCCC2F 34a_100015189458_100015423560 [0,0,0,2,0,0|2,0,0]=4 34823 B14R2.296 C[C@@H]1CCCN1C2CCCCC2O 269982a_100015189458_100000038908 [0,0,0,2,0,0|1,0,0]=3 34824 B14R2.296 C[C@@H]1CCCN1C2CCCCC2O 34a_100015189458_100000038908 [0,0,0,2,0,0|1,0,0]=3 34825 B14R2.296 C[C@H]1CCCN1C2CCCCC2F 269982a_100020605311_100015423560 [0,0,0,2,0,0|2,0,0]=4 34826 B14R2.296 C[C@H]1CCCN1C2CCCCC2O 269982a_100020605311_100000038908 [0,0,0,2,0,0|1,0,0]=3 34827 B14R2.296 C[C@H]1COCCN1[C@@H]2CCC[C@H]2O 269982a_100009815349_200016002552 [0,0,0,2,0,0|2,0,0]=4 34828 B14R2.4622 CC1CCCCC1NCCC2CC2 2230a_100000211402_100000694398 [0,0,0,2,0,0|2,0,0]=4 34829 B14R2.4622 CC1CCCCC1NCCC2CC2 269862a_100000764129_100000210921 [0,0,0,2,0,0|2,0,0]=4 34830 B14R2.4622 CC1CCCCC1NCCC2CC2 270004a_100000764129_100000210921 [0,0,0,2,0,0|2,0,0]=4 34831 B14R2.4622 CC1CCCCC1NCCC2CC2 34a_100000211402_100000694398 [0,0,0,2,0,0|2,0,0]=4 34832 B14R2.4622 CC1CCCCC1NCCC2CO2 2230a_100000211402_100000732470 [0,0,0,2,0,0|1,0,0]=3 34833 B14R2.4622 CC1CCCCC1NCCC2CO2 34a_100000211402_100000732470 [0,0,0,2,0,0|1,0,0]=3 34834 B14R2.4622 CC1CCCCC1OCCC2CC2 34a_100000211207_100000694398 [0,0,0,2,0,0|2,0,0]=4 34835 B14R2.4622 CC1CCCCC1OCCC2CC2 7a_100000211207_100000764125 [0,0,0,2,0,0|2,0,0]=4 34836 B14R2.4622 CC1CCCCC1OCCC2CO2 34a_100000211207_100000732470 [0,0,0,2,0,0|1,0,0]=3 34837 B14R2.4622 CC1CCCCC1OCCC2CO2 7a_100000211207_100000732470 [0,0,0,2,0,0|1,0,0]=3 34838 B14R2.4622 CC1CCCCN1CCCC2CO2 2230a_100000211376_100000733510 [0,0,0,2,0,0|1,0,0]=3 34839 B14R2.4622 CC1CCCCN1CCCC2CO2 269982a_100000211376_100000733510 [0,0,0,2,0,0|1,0,0]=3 34840 B14R2.4622 CC1CCCCN1CCCC2CO2 34a_100000211376_100000733510 [0,0,0,2,0,0|1,0,0]=3 34841 B14R2.4622 CC1CCNCC1OCCC2CO2 34a_100000696640_100000732470 [0,0,0,2,0,0|2,0,0]=4 34842 B14R2.4622 CC1CNCCC1OCCC2CO2 34a_100011998114_100000732470 [0,0,0,2,0,0|2,0,0]=4 34843 B14R2.4622 CN1CCCCC1CNCC2CO2 34a_100011228421_102125554688 [0,0,0,2,0,0|2,0,0]=4 34844 B14R2.4622 CN1CCCCC1COCC2CO2 34a_100000225079_102125554688 [0,0,0,2,0,0|2,0,0]=4 34845 B14R2.4622 CN1CCCCC1COC[C@@H]2CO2 34a_100000757423_100015186950 [0,0,0,2,0,0|2,0,0]=4 34846 B14R2.4622 CN1CCCCC1CSCC2CO2 62a_100015185383_102125554688 [0,0,0,2,0,0|2,0,0]=4 34847 B14R2.4622 CN1CCCCC1CSCC2CO2 62a_102125554688_100015185383 [0,0,0,2,0,0|2,0,0]=4 34848 B14R2.4622 CN1CCCCC1CSC[C@@H]2CO2 62a_100000745022_100015185383 [0,0,0,2,0,0|2,0,0]=4 34849 B14R2.4622 CN1CCCCC1CSC[C@@H]2CO2 62a_100015185383_100000745022 [0,0,0,2,0,0|2,0,0]=4 34850 B14R2.4622 C[C@H]1COCCN1CCCC2CO2 2230a_100009815349_100000733510 [0,0,0,2,0,0|2,0,0]=4 34851 B14R2.4622 C[C@H]1COCCN1CCCC2CO2 269982a_100009815349_100000733510 [0,0,0,2,0,0|2,0,0]=4 34852 B14R2.4622 C[C@H]1COCCN1CCCC2CO2 34a_100009815349_100000733510 [0,0,0,2,0,0|2,0,0]=4 34853 B14R2.4622 ClC1CCCCC1OCCC2CC2 34a_100000038908_100000694398 [0,0,0,2,0,0|2,0,0]=4 34854 B14R2.4622 ClC1CCCCC1OCCC2CC2 7a_100000038908_100000764125 [0,0,0,2,0,0|2,0,0]=4 34855 B14R2.4622 ClC1CCCCC1OCCC2CO2 34a_100000038908_100000732470 [0,0,0,2,0,0|2,0,0]=4 34856 B14R2.4622 ClC1CCCCC1OCCC2CO2 7a_100000038908_100000732470 [0,0,0,2,0,0|2,0,0]=4 34857 B14R2.4622 FC1CCCCC1NCCC2CC2 34a_100000764129_100015423560 [0,0,0,2,0,0|2,0,0]=4 34858 B14R2.4622 FC1CCCCC1OCCC2CC2 34a_100000754188_100015423560 [0,0,0,2,0,0|2,0,0]=4 34859 B14R2.4622 FC1CCCCC1OCC[C@@H]2CO2 34a_100009820653_100015423560 [0,0,0,2,0,0|2,0,0]=4 34860 B14R2.4622 FC1CCCCC1SCCC2CC2 62a_100000764125_100015423560 [0,0,0,2,0,0|2,0,0]=4 34861 B14R2.4622 FC1CCCCC1SCCC2CC2 62a_100015423560_100000764125 [0,0,0,2,0,0|2,0,0]=4 34862 B14R2.4622 FC1CCCCC1SCCC2CO2 62a_100000732470_100015423560 [0,0,0,2,0,0|2,0,0]=4 34863 B14R2.4622 FC1CCCCC1SCCC2CO2 62a_100015423560_100000732470 [0,0,0,2,0,0|2,0,0]=4 34864 B14R2.4622 F[C@@H]1CCCC[C@H]1NCCC2CC2 2230a_100015195156_100000694398 [0,0,0,2,0,0|2,0,0]=4 34865 B14R2.4622 F[C@@H]1CCCC[C@H]1NCCC2CC2 34a_100015195156_100000694398 [0,0,0,2,0,0|2,0,0]=4 34866 B14R2.4622 F[C@@H]1CCCC[C@H]1NCCC2CO2 2230a_100015195156_100000732470 [0,0,0,2,0,0|2,0,0]=4 34867 B14R2.4622 F[C@@H]1CCCC[C@H]1NCCC2CO2 34a_100015195156_100000732470 [0,0,0,2,0,0|2,0,0]=4 34868 B14R2.4622 F[C@@H]1CCCC[C@H]1OCCC2CC2 34a_100009816020_100000694398 [0,0,0,2,0,0|2,0,0]=4 34869 B14R2.4622 F[C@@H]1CCCC[C@H]1OCCC2CC2 7a_100009816020_100000764125 [0,0,0,2,0,0|2,0,0]=4 34870 B14R2.4622 F[C@@H]1CCCC[C@H]1OCCC2CO2 34a_100009816020_100000732470 [0,0,0,2,0,0|2,0,0]=4 34871 B14R2.4622 F[C@@H]1CCCC[C@H]1OCCC2CO2 7a_100009816020_100000732470 [0,0,0,2,0,0|2,0,0]=4 34872 B14R2.4622 N[C@@H]1CCCC[C@@H]1OCCC2CC2 34a_100015191688_100000694398 [0,0,0,2,0,0|2,0,0]=4 34873 B14R2.4622 N[C@@H]1CCCC[C@@H]1OCCC2CO2 34a_100015191688_100000732470 [0,0,0,2,0,0|2,0,0]=4 34874 B14R2.4622 OC1CCCCC1CNCC2CC2 269862a_100011216029_100000741477 [0,0,0,2,0,0|1,0,0]=3 34875 B14R2.4622 OC1CCCCC1CNCC2CC2 34a_100011216029_100000742324 [0,0,0,2,0,0|1,0,0]=3 34876 B14R2.4622 OC1CCCCC1CNCC2CO2 34a_100011216029_102125554688 [0,0,0,2,0,0|2,0,0]=4 34877 B14R2.4622 OC1CCCCC1NCCC2CC2 34a_100000764129_100000038908 [0,0,0,2,0,0|1,0,0]=3 34878 B14R2.4622 OC1CCCCC1OCCC2CC2 34a_100000754188_100000038908 [0,0,0,2,0,0|1,0,0]=3 34879 B14R2.4622 OC1CCCCC1OCC[C@@H]2CO2 34a_100009820653_100000038908 [0,0,0,2,0,0|2,0,0]=4 34880 B14R2.4622 OC1CCCCC1SCCC2CC2 62a_100000038908_100000764125 [0,0,0,2,0,0|1,0,0]=3 34881 B14R2.4622 OC1CCCCC1SCCC2CC2 62a_100000764125_100000038908 [0,0,0,2,0,0|1,0,0]=3 34882 B14R2.4622 OC1CCCCC1SCCC2CO2 62a_100000038908_100000732470 [0,0,0,2,0,0|2,0,0]=4 34883 B14R2.4622 OC1CCCCC1SCCC2CO2 62a_100000732470_100000038908 [0,0,0,2,0,0|2,0,0]=4 34884 B14R2.4622 O[C@H]1CCOC[C@@H]1NCCC2CC2 2230a_100015739063_100000694398 [0,0,0,2,0,0|2,0,0]=4 34885 B14R2.4622 O[C@H]1COCC[C@H]1NCCC2CC2 2230a_100016994285_100000694398 [0,0,0,2,0,0|2,0,0]=4 34886 B14R2.4634 CC1CCCCC1NCC2CCC2 2230a_100000211402_100000763275 [0,0,0,2,0,0|2,0,0]=4 34887 B14R2.4634 CC1CCCCC1NCC2CCC2 269862a_100000211402_100000753134 [0,0,0,2,0,0|2,0,0]=4 34888 B14R2.4634 CC1CCCCC1NCC2CCC2 269862a_100000738700_100000210921 [0,0,0,2,0,0|2,0,0]=4 34889 B14R2.4634 CC1CCCCC1NCC2CCC2 270004a_100000738700_100000210921 [0,0,0,2,0,0|2,0,0]=4 34890 B14R2.4634 CC1CCCCC1NCC2CCC2 34a_100000211402_100000763275 [0,0,0,2,0,0|2,0,0]=4 34891 B14R2.4634 CC1CCCCC1NCC2CCO2 2230a_100000211402_100000103362 [0,0,0,2,0,0|1,0,0]=3 34892 B14R2.4634 CC1CCCCC1NCC2CCO2 34a_100000211402_100000103362 [0,0,0,2,0,0|1,0,0]=3 34893 B14R2.4634 CC1CCCCC1NC[C@@H]2CCO2 269862a_100020831831_100000210921 [0,0,0,2,0,0|1,0,0]=3 34894 B14R2.4634 CC1CCCCC1NC[C@@H]2CCO2 270004a_100020831831_100000210921 [0,0,0,2,0,0|1,0,0]=3 34895 B14R2.4634 CC1CCCCC1OCC2CCC2 34a_100000211207_100000763275 [0,0,0,2,0,0|2,0,0]=4 34896 B14R2.4634 CC1CCCCC1OCC2CCC2 7a_100000211207_100000763275 [0,0,0,2,0,0|2,0,0]=4 34897 B14R2.4634 CC1CCCCC1OCC2CCO2 34a_100000211207_100000103362 [0,0,0,2,0,0|1,0,0]=3 34898 B14R2.4634 CC1CCCCC1OCC2CCO2 7a_100000211207_100000103362 [0,0,0,2,0,0|1,0,0]=3 34899 B14R2.4634 CC1CCNCC1OCC2CCO2 34a_100000696640_100000103362 [0,0,0,2,0,0|2,0,0]=4 34900 B14R2.4634 CC1CNCCC1NC[C@@H]2CCO2 270004a_100020831831_100000703950 [0,0,0,2,0,0|2,0,0]=4 34901 B14R2.4634 CC1CNCCC1OCC2CCO2 34a_100011998114_100000103362 [0,0,0,2,0,0|2,0,0]=4 34902 B14R2.4634 CC1COCCC1NC[C@@H]2CCO2 270004a_100020831831_100000755695 [0,0,0,2,0,0|2,0,0]=4 34903 B14R2.4634 ClC1CCCCC1OCC2CCC2 34a_100000038908_100000763275 [0,0,0,2,0,0|2,0,0]=4 34904 B14R2.4634 ClC1CCCCC1OCC2CCC2 7a_100000038908_100000763275 [0,0,0,2,0,0|2,0,0]=4 34905 B14R2.4634 ClC1CCCCC1OCC2CCO2 34a_100000038908_100000103362 [0,0,0,2,0,0|2,0,0]=4 34906 B14R2.4634 ClC1CCCCC1OCC2CCO2 7a_100000038908_100000103362 [0,0,0,2,0,0|2,0,0]=4 34907 B14R2.4634 FC1CCCCC1NCC2CCC2 34a_100000738700_100015423560 [0,0,0,2,0,0|2,0,0]=4 34908 B14R2.4634 FC1CCCCC1NC[C@@H]2CCO2 34a_100020831831_100015423560 [0,0,0,2,0,0|2,0,0]=4 34909 B14R2.4634 FC1CCCCC1OCC2CCC2 34a_100000760304_100015423560 [0,0,0,2,0,0|2,0,0]=4 34910 B14R2.4634 FC1CCCCC1OCC2CCO2 34a_100000039022_100015423560 [0,0,0,2,0,0|2,0,0]=4 34911 B14R2.4634 FC1CCCCC1SCC2CCC2 62a_100000763275_100015423560 [0,0,0,2,0,0|2,0,0]=4 34912 B14R2.4634 FC1CCCCC1SCC2CCC2 62a_100015423560_100000763275 [0,0,0,2,0,0|2,0,0]=4 34913 B14R2.4634 FC1CCCCC1SCC2CCO2 62a_100000103362_100015423560 [0,0,0,2,0,0|2,0,0]=4 34914 B14R2.4634 FC1CCCCC1SCC2CCO2 62a_100015423560_100000103362 [0,0,0,2,0,0|2,0,0]=4 34915 B14R2.4634 F[C@@H]1CCCC[C@H]1NCC2CCC2 2230a_100015195156_100000763275 [0,0,0,2,0,0|2,0,0]=4 34916 B14R2.4634 F[C@@H]1CCCC[C@H]1NCC2CCC2 269862a_100015195156_100000753134 [0,0,0,2,0,0|2,0,0]=4 34917 B14R2.4634 F[C@@H]1CCCC[C@H]1NCC2CCC2 34a_100015195156_100000763275 [0,0,0,2,0,0|2,0,0]=4 34918 B14R2.4634 F[C@@H]1CCCC[C@H]1NCC2CCO2 2230a_100015195156_100000103362 [0,0,0,2,0,0|2,0,0]=4 34919 B14R2.4634 F[C@@H]1CCCC[C@H]1NCC2CCO2 34a_100015195156_100000103362 [0,0,0,2,0,0|2,0,0]=4 34920 B14R2.4634 F[C@@H]1CCCC[C@H]1OCC2CCC2 34a_100009816020_100000763275 [0,0,0,2,0,0|2,0,0]=4 34921 B14R2.4634 F[C@@H]1CCCC[C@H]1OCC2CCC2 7a_100009816020_100000763275 [0,0,0,2,0,0|2,0,0]=4 34922 B14R2.4634 F[C@@H]1CCCC[C@H]1OCC2CCO2 34a_100009816020_100000103362 [0,0,0,2,0,0|2,0,0]=4 34923 B14R2.4634 F[C@@H]1CCCC[C@H]1OCC2CCO2 7a_100009816020_100000103362 [0,0,0,2,0,0|2,0,0]=4 34924 B14R2.4634 N[C@@H]1CCCC[C@@H]1OCC2CCC2 34a_100015191688_100000763275 [0,0,0,2,0,0|2,0,0]=4 34925 B14R2.4634 N[C@@H]1CCCC[C@@H]1OCC2CCO2 34a_100015191688_100000103362 [0,0,0,2,0,0|2,0,0]=4 34926 B14R2.4634 OC1CCCCC1CNC2CCC2 270004a_100011216029_100000241760 [0,0,0,2,0,0|1,0,0]=3 34927 B14R2.4634 OC1CCCCC1CNC2CCC2 34a_100011216029_100000749161 [0,0,0,2,0,0|1,0,0]=3 34928 B14R2.4634 OC1CCCCC1CNC2COC2 34a_100011216029_100009818527 [0,0,0,2,0,0|2,0,0]=4 34929 B14R2.4634 OC1CCCCC1NCC2CCC2 34a_100000738700_100000038908 [0,0,0,2,0,0|1,0,0]=3 34930 B14R2.4634 OC1CCCCC1NCC2COC2 34a_100015281925_100000038908 [0,0,0,2,0,0|2,0,0]=4 34931 B14R2.4634 OC1CCCCC1NC[C@@H]2CCO2 34a_100020831831_100000038908 [0,0,0,2,0,0|2,0,0]=4 34932 B14R2.4634 OC1CCCCC1OCC2CCC2 34a_100000760304_100000038908 [0,0,0,2,0,0|1,0,0]=3 34933 B14R2.4634 OC1CCCCC1OCC2CCO2 34a_100000039022_100000038908 [0,0,0,2,0,0|2,0,0]=4 34934 B14R2.4634 OC1CCCCC1OCC2CNC2 34a_100016987283_100000038908 [0,0,0,2,0,0|2,0,0]=4 34935 B14R2.4634 OC1CCCCC1OCC2COC2 34a_100000060846_100000038908 [0,0,0,2,0,0|2,0,0]=4 34936 B14R2.4634 OC1CCCCC1SCC2CCC2 62a_100000038908_100000763275 [0,0,0,2,0,0|1,0,0]=3 34937 B14R2.4634 OC1CCCCC1SCC2CCC2 62a_100000763275_100000038908 [0,0,0,2,0,0|1,0,0]=3 34938 B14R2.4634 OC1CCCCC1SCC2CCO2 62a_100000038908_100000103362 [0,0,0,2,0,0|2,0,0]=4 34939 B14R2.4634 OC1CCCCC1SCC2CCO2 62a_100000103362_100000038908 [0,0,0,2,0,0|2,0,0]=4 34940 B14R2.4634 OC1CCCCC1SCC2COC2 62a_100000038908_100010264016 [0,0,0,2,0,0|2,0,0]=4 34941 B14R2.4634 OC1CCCCC1SCC2COC2 62a_100010264016_100000038908 [0,0,0,2,0,0|2,0,0]=4 34942 B14R2.4634 O[C@H]1CCCC[C@H]1NCC2CCC2 269862a_100015191688_100000753134 [0,0,0,2,0,0|1,0,0]=3 34943 B14R2.4634 O[C@H]1CCOC[C@@H]1NCC2CCC2 2230a_100015739063_100000763275 [0,0,0,2,0,0|2,0,0]=4 34944 B14R2.4634 O[C@H]1CCOC[C@@H]1NCC2CCC2 269862a_100015739063_100000753134 [0,0,0,2,0,0|2,0,0]=4 34945 B14R2.4634 O[C@H]1COCC[C@H]1NCC2CCC2 2230a_100016994285_100000763275 [0,0,0,2,0,0|2,0,0]=4 34946 B14R2.4634 O[C@H]1COCC[C@H]1NCC2CCC2 269862a_100016994285_100000753134 [0,0,0,2,0,0|2,0,0]=4 34947 B14R2.36014 CCCCCNC1CCCC2C1C2 269862a_100000209983_100000697651 [0,0,0,2,0,0|2,0,0]=4 34948 B14R2.36014 OCCCCNC1CCCC2C1C2 269862a_100000750430_100000697651 [0,0,0,2,0,0|1,0,0]=3 34949 B14R2.8782 CC1CC1COC2CCCCCC2 34a_100000744939_100011217769 [0,0,0,2,0,0|2,0,0]=4 34950 B14R2.8782 F[C@@H]1C[C@H]1NCC2CCCCCC2 2230a_100025746932_200000696569 [0,0,0,2,0,0|2,0,0]=4 34951 B14R2.8782 F[C@@H]1C[C@H]1NCC2CCCCCC2 34a_100025746932_200000696569 [0,0,0,2,0,0|2,0,0]=4 34952 B14R2.8782 F[C@H]1C[C@H]1NCC2CCCCCC2 2230a_100015190264_200000696569 [0,0,0,2,0,0|2,0,0]=4 34953 B14R2.4757 C(COCCC1COC1)CC2CO2 34a_100009855314_100000733510 [0,0,0,2,0,0|2,0,0]=4 34954 B14R2.5216 CN1CCCC1COCC2CCO2 34a_100000743107_100000103362 [0,0,0,2,0,0|2,0,0]=4 34955 B14R2.7074 CCCC1CCCC1NC2CCC2 269862a_100000749019_100000723119 [0,0,0,2,0,0|2,0,0]=4 34956 B14R2.7074 COC[C@@H]1CCCN1CC2CCO2 2230a_100020646714_100000103362 [0,0,0,2,0,0|2,0,0]=4 34957 B14R2.7074 COC[C@@H]1CCCN1CC2CCO2 269982a_100020646714_100000103362 [0,0,0,2,0,0|2,0,0]=4 34958 B14R2.7074 COC[C@@H]1CCCN1CC2CCO2 34a_100020646714_100000103362 [0,0,0,2,0,0|2,0,0]=4 34959 B14R2.12797 C1CCCC(CC1)CNC2CCC2 2230a_100000749019_200000696569 [0,0,0,2,0,0|2,0,0]=4 34960 B14R2.12797 C1CCCC(CC1)CNC2CCC2 269862a_100000749019_200000763224 [0,0,0,2,0,0|2,0,0]=4 34961 B14R2.12797 C1CCCC(CC1)CNC2CCC2 270004a_100015204231_100000241760 [0,0,0,2,0,0|2,0,0]=4 34962 B14R2.12797 C1CCCC(CC1)CNC2CCC2 34a_100000749019_200000696569 [0,0,0,2,0,0|2,0,0]=4 34963 B14R2.12797 C1CCCC(CC1)CNC2CCC2 34a_100015204231_100000749161 [0,0,0,2,0,0|2,0,0]=4 34964 B14R2.12797 C1CCCC(CC1)COC2CCC2 34a_100000699130_100000749161 [0,0,0,2,0,0|2,0,0]=4 34965 B14R2.12797 C1CCCC(CC1)COC2CCC2 34a_100000748187_200000696569 [0,0,0,2,0,0|2,0,0]=4 34966 B14R2.12797 C1CCCC(CC1)CSC2CCC2 62a_200000696569_100000749161 [0,0,0,2,0,0|2,0,0]=4 34967 B14R2.12797 C1CCCC(CC1)NCC2CCC2 2230a_100000210984_100000763275 [0,0,0,2,0,0|2,0,0]=4 34968 B14R2.12797 C1CCCC(CC1)NCC2CCC2 269862a_100000210984_100000753134 [0,0,0,2,0,0|2,0,0]=4 34969 B14R2.12797 C1CCCC(CC1)NCC2CCC2 270004a_100000738700_100000210131 [0,0,0,2,0,0|2,0,0]=4 34970 B14R2.12797 C1CCCC(CC1)NCC2CCC2 34a_100000210984_100000763275 [0,0,0,2,0,0|2,0,0]=4 34971 B14R2.12797 C1CCCC(CC1)NCC2CCC2 34a_100000738700_100011217769 [0,0,0,2,0,0|2,0,0]=4 34972 B14R2.12797 C1CCCC(CC1)NCC2CCO2 2230a_100000210984_100000103362 [0,0,0,2,0,0|1,0,0]=3 34973 B14R2.12797 C1CCCC(CC1)NCC2CCO2 34a_100000210984_100000103362 [0,0,0,2,0,0|1,0,0]=3 34974 B14R2.12797 C1CCCC(CC1)NC[C@@H]2CCO2 270004a_100020831831_100000210131 [0,0,0,2,0,0|1,0,0]=3 34975 B14R2.12797 C1CCCC(CC1)NC[C@@H]2CCO2 34a_100020831831_100011217769 [0,0,0,2,0,0|1,0,0]=3 34976 B14R2.12797 C1CCCC(CC1)OCC2CCC2 34a_100000210887_100000763275 [0,0,0,2,0,0|2,0,0]=4 34977 B14R2.12797 C1CCCC(CC1)OCC2CCC2 34a_100000760304_100011217769 [0,0,0,2,0,0|2,0,0]=4 34978 B14R2.12797 C1CCCC(CC1)OCC2CCC2 7a_100000210887_100000763275 [0,0,0,2,0,0|2,0,0]=4 34979 B14R2.12797 C1CCCC(CC1)OCC2CCO2 34a_100000039022_100011217769 [0,0,0,2,0,0|1,0,0]=3 34980 B14R2.12797 C1CCCC(CC1)OCC2CCO2 34a_100000210887_100000103362 [0,0,0,2,0,0|1,0,0]=3 34981 B14R2.12797 C1CCCC(CC1)OCC2CCO2 7a_100000210887_100000103362 [0,0,0,2,0,0|1,0,0]=3 34982 B14R2.12797 C1CCCC(CC1)SCC2CCC2 62a_100000763275_100011217769 [0,0,0,2,0,0|2,0,0]=4 34983 B14R2.12797 C1CCCC(CC1)SCC2CCC2 62a_100011217769_100000763275 [0,0,0,2,0,0|2,0,0]=4 34984 B14R2.12797 C1CCCC(CC1)SCC2CCO2 62a_100000103362_100011217769 [0,0,0,2,0,0|1,0,0]=3 34985 B14R2.12797 C1CCCC(CC1)SCC2CCO2 62a_100011217769_100000103362 [0,0,0,2,0,0|1,0,0]=3 34986 B14R2.12797 C1CNCCC(C1)NC[C@@H]2CCO2 270004a_100020831831_100015187895 [0,0,0,2,0,0|2,0,0]=4 34987 B14R2.12804 C1CCCC(CCC1)NC2CCC2 270004a_100000211152_100000241760 [0,0,0,2,0,0|2,0,0]=4 34988 B14R2.12804 C1CCCC(CCC1)NC2CCC2 34a_100000211152_100000749161 [0,0,0,2,0,0|2,0,0]=4 34989 B14R2.12804 C1CCCC(CCC1)OC2CCC2 34a_100000210054_100000749161 [0,0,0,2,0,0|2,0,0]=4 34990 B14R2.12804 C1CCCN(CCC1)CC2CCC2 2230a_100000211400_100000763275 [0,0,0,2,0,0|2,0,0]=4 34991 B14R2.12804 C1CCCN(CCC1)CC2CCC2 269982a_100000211400_100000763275 [0,0,0,2,0,0|2,0,0]=4 34992 B14R2.12804 C1CCCN(CCC1)CC2CCC2 34a_100000211400_100000763275 [0,0,0,2,0,0|2,0,0]=4 34993 B14R2.12804 C1CCCN(CCC1)CC2CCO2 2230a_100000211400_100000103362 [0,0,0,2,0,0|1,0,0]=3 34994 B14R2.12804 C1CCCN(CCC1)CC2CCO2 269982a_100000211400_100000103362 [0,0,0,2,0,0|1,0,0]=3 34995 B14R2.12804 C1CCCN(CCC1)CC2CCO2 34a_100000211400_100000103362 [0,0,0,2,0,0|1,0,0]=3 34996 B14R2.144 CCCCCN1C[C@H]2CCC[C@H]2C1 2230a_100102946302_100000210326 [0,0,0,2,0,0|2,0,0]=4 34997 B14R2.144 CCCCCN1C[C@H]2CCC[C@H]2C1 269982a_100102946302_100000210215 [0,0,0,2,0,0|2,0,0]=4 34998 B14R2.144 CCCCCN1C[C@H]2CCC[C@H]2C1 34a_100102946302_100000718602 [0,0,0,2,0,0|2,0,0]=4 34999 B14R2.144 FCCCCN1C[C@H]2CCC[C@H]2C1 2230a_100102946302_100000729493 [0,0,0,2,0,0|2,0,0]=4 35000 B14R2.144 FCCCCN1C[C@H]2CCC[C@H]2C1 269982a_100102946302_100000729493 [0,0,0,2,0,0|2,0,0]=4 35001 B14R2.144 FCCCCN1C[C@H]2CCC[C@H]2C1 34a_100102946302_100000729493 [0,0,0,2,0,0|2,0,0]=4 35002 B14R2.144 OCCCCN1C[C@H]2CCC[C@H]2C1 2230a_100102946302_100000210776 [0,0,0,2,0,0|1,0,0]=3 35003 B14R2.144 OCCCCN1C[C@H]2CCC[C@H]2C1 269982a_100102946302_100000210776 [0,0,0,2,0,0|1,0,0]=3 35004 B14R2.144 OCCCCN1C[C@H]2CCC[C@H]2C1 34a_100102946302_100011216708 [0,0,0,2,0,0|1,0,0]=3 35005 B14R2.144 OCCCCN1C[C@H]2COC[C@H]2C1 2230a_100000700037_100000210776 [0,0,0,2,0,0|2,0,0]=4 35006 B14R2.144 OCCCCN1C[C@H]2COC[C@H]2C1 269982a_100000700037_100000210776 [0,0,0,2,0,0|2,0,0]=4 35007 B14R2.144 OCCCCN1C[C@H]2COC[C@H]2C1 34a_100000700037_100011216708 [0,0,0,2,0,0|2,0,0]=4 35008 B14R2.309 CC1CCCC1N[C@H]2CCC[C@@H]2O 269862a_100000748460_100000752053 [0,0,0,2,0,0|1,0,0]=3 35009 B14R2.309 CC1CCCC1N[C@H]2COC[C@@H]2O 269862a_100015191717_100000752053 [0,0,0,2,0,0|2,0,0]=4 35010 B14R2.309 CC1CCCC1OC2COCC2O 34a_100011216460_200000725654 [0,0,0,2,0,0|2,0,0]=4 35011 B14R2.309 CC1CCCC1OC2COCC2O 7a_100011216460_200000725654 [0,0,0,2,0,0|2,0,0]=4 35012 B14R2.309 CC1OCCC1N[C@H]2CCC[C@@H]2O 270004a_100000748460_100000691750 [0,0,0,2,0,0|2,0,0]=4 35013 B14R2.309 O[C@@H]1CCC[C@H]1S[C@@H]2CCC[C@H]2O 62a_200016002552_200016002552 [0,0,0,2,0,0|2,0,0]=4 35014 B14R2.3314 CN1C[C@@H]2C[C@H]1CN2CCCCO 2230a_100025763010_100000210776 [0,0,0,2,0,0|2,0,0]=4 35015 B14R2.3314 CN1C[C@@H]2C[C@H]1CN2CCCCO 269982a_100025763010_100000210776 [0,0,0,2,0,0|2,0,0]=4 35016 B14R2.4734 CC1CCCC1OCCCC2CO2 34a_100011216460_100000733510 [0,0,0,2,0,0|1,0,0]=3 35017 B14R2.4734 CC1CCCC1OCCCC2CO2 7a_100011216460_100000733510 [0,0,0,2,0,0|1,0,0]=3 35018 B14R2.4734 CN1CCCC1CCOCC2CO2 34a_100011215177_102125554688 [0,0,0,2,0,0|2,0,0]=4 35019 B14R2.4734 CN1CCCC1CCOCC2CO2 7a_100011215177_102125554688 [0,0,0,2,0,0|2,0,0]=4 35020 B14R2.4734 CN1CCCC1CCOC[C@@H]2CO2 34a_100000757423_100000005710 [0,0,0,2,0,0|2,0,0]=4 35021 B14R2.4734 CN1CCCC1CCOC[C@@H]2CO2 7a_100011215177_100000745022 [0,0,0,2,0,0|2,0,0]=4 35022 B14R2.4734 CN1CCCC1CCSCC2CO2 62a_100000005710_102125554688 [0,0,0,2,0,0|2,0,0]=4 35023 B14R2.4734 CN1CCCC1CCSCC2CO2 62a_102125554688_100000005710 [0,0,0,2,0,0|2,0,0]=4 35024 B14R2.4734 CN1CCCC1CCSC[C@@H]2CO2 62a_100000005710_100000745022 [0,0,0,2,0,0|2,0,0]=4 35025 B14R2.4734 CN1CCCC1CCSC[C@@H]2CO2 62a_100000745022_100000005710 [0,0,0,2,0,0|2,0,0]=4 35026 B14R2.4734 CN1CCCC1COCCC2CO2 34a_100000743107_100000732470 [0,0,0,2,0,0|2,0,0]=4 35027 B14R2.4734 C[C@@H]1CNC[C@@H]1OCCCC2CO2 34a_200015306588_100000733510 [0,0,0,2,0,0|2,0,0]=4 35028 B14R2.4734 Cl[C@@H]1CCC[C@H]1OCCCC2CO2 34a_200016002552_100000733510 [0,0,0,2,0,0|2,0,0]=4 35029 B14R2.4734 N[C@H]1CCC[C@@H]1OCCCC2CO2 34a_100000748460_100000733510 [0,0,0,2,0,0|2,0,0]=4 35030 B14R2.4734 O[C@@H]1CCC[C@H]1SCCCC2CO2 62a_100000733510_200016002552 [0,0,0,2,0,0|2,0,0]=4 35031 B14R2.4734 O[C@@H]1CCC[C@H]1SCCCC2CO2 62a_200016002552_100000733510 [0,0,0,2,0,0|2,0,0]=4 35032 B14R2.5202 C[C@@H]1CCCN1C2CCCCCC2 269982a_100015189458_100011217769 [0,0,0,2,0,0|2,0,0]=4 35033 B14R2.5202 C[C@@H]1CCCN1C2CCCCCC2 270004a_100015189458_100000210131 [0,0,0,2,0,0|2,0,0]=4 35034 B14R2.5202 C[C@@H]1CCCN1C2CCCCCC2 34a_100015189458_100011217769 [0,0,0,2,0,0|2,0,0]=4 35035 B14R2.5202 C[C@H]1CCCN1C2CCCCCC2 269982a_100020605311_100011217769 [0,0,0,2,0,0|2,0,0]=4 35036 B14R2.5202 C[C@H]1CCCN1C2CCCCCC2 270004a_100020605311_100000210131 [0,0,0,2,0,0|2,0,0]=4 35037 B14R2.5202 OC1COCC1N2CCCCCC2 34a_100000185865_200000725654 [0,0,0,2,0,0|2,0,0]=4 35038 B14R2.5202 O[C@@H]1CCC[C@H]1N2CCCCCC2 269982a_100000185865_200016002552 [0,0,0,2,0,0|1,0,0]=3 35039 B14R2.5202 O[C@@H]1CCC[C@H]1N2CCCOCC2 269982a_100000685342_200016002552 [0,0,0,2,0,0|2,0,0]=4 35040 B14R2.4756 C(CCOC1CC1)COCC2CO2 34a_100010889290_100000211595 [0,0,0,2,0,0|2,0,0]=4 35041 B14R2.4756 C(COCCNC1CC1)CC2CO2 34a_100000738766_100000733510 [0,0,0,2,0,0|2,0,0]=4 35042 B14R2.4756 C(CSCCCC1CO1)CC2CO2 62a_100000733510_100000733510 [0,0,0,2,0,0|2,0,0]=4 35043 B14R2.6357 CCCC1CCCC1NCC2CC2 270004a_100000735609_100000723119 [0,0,0,2,0,0|2,0,0]=4 35044 B14R2.6357 COC[C@@H]1CCCN1CCC2CO2 2230a_100020646714_100000732470 [0,0,0,2,0,0|2,0,0]=4 35045 B14R2.6357 COC[C@@H]1CCCN1CCC2CO2 269982a_100020646714_100000732470 [0,0,0,2,0,0|2,0,0]=4 35046 B14R2.6357 COC[C@@H]1CCCN1CCC2CO2 34a_100020646714_100000732470 [0,0,0,2,0,0|2,0,0]=4 35047 B14R2.9618 CCCCCN1CCCC1C2CC2 2230a_200000757794_100000210326 [0,0,0,2,0,0|2,0,0]=4 35048 B14R2.9618 CCCCCN1CCCC1C2CC2 269982a_200000757794_100000210215 [0,0,0,2,0,0|2,0,0]=4 35049 B14R2.9618 CCCCCN1CCCC1C2CC2 34a_200000757794_100000718602 [0,0,0,2,0,0|2,0,0]=4 35050 B14R2.9618 FCCCCN1CCCC1C2CC2 2230a_200000757794_100000729493 [0,0,0,2,0,0|2,0,0]=4 35051 B14R2.9618 FCCCCN1CCCC1C2CC2 269982a_200000757794_100000729493 [0,0,0,2,0,0|2,0,0]=4 35052 B14R2.9618 FCCCCN1CCCC1C2CC2 34a_200000757794_100000729493 [0,0,0,2,0,0|2,0,0]=4 35053 B14R2.9618 OCCCCN1CCCC1C2CC2 2230a_200000757794_100000210776 [0,0,0,2,0,0|1,0,0]=3 35054 B14R2.9618 OCCCCN1CCCC1C2CC2 269982a_200000757794_100000210776 [0,0,0,2,0,0|1,0,0]=3 35055 B14R2.9618 OCCCCN1CCCC1C2CC2 34a_200000757794_100011216708 [0,0,0,2,0,0|1,0,0]=3 35056 B14R2.12796 C1CCCC(CCC1)COC2CC2 34a_100011216312_100000211595 [0,0,0,2,0,0|2,0,0]=4 35057 B14R2.12796 C1CCCC(CCC1)NCC2CC2 2230a_100000211152_100000742324 [0,0,0,2,0,0|2,0,0]=4 35058 B14R2.12796 C1CCCC(CCC1)NCC2CC2 269862a_100000211152_100000741477 [0,0,0,2,0,0|2,0,0]=4 35059 B14R2.12796 C1CCCC(CCC1)NCC2CC2 270004a_100000735609_100000210524 [0,0,0,2,0,0|2,0,0]=4 35060 B14R2.12796 C1CCCC(CCC1)NCC2CC2 34a_100000211152_100000742324 [0,0,0,2,0,0|2,0,0]=4 35061 B14R2.12796 C1CCCC(CCC1)NCC2CO2 2230a_100000211152_100011216344 [0,0,0,2,0,0|1,0,0]=3 35062 B14R2.12796 C1CCCC(CCC1)NCC2CO2 34a_100000211152_102125554688 [0,0,0,2,0,0|1,0,0]=3 35063 B14R2.12796 C1CCCC(CCC1)OCC2CC2 34a_100000210054_100000742324 [0,0,0,2,0,0|2,0,0]=4 35064 B14R2.12796 C1CCCC(CCC1)OCC2CC2 7a_100000210054_100000742324 [0,0,0,2,0,0|2,0,0]=4 35065 B14R2.12796 C1CCCC(CCC1)OCC2CO2 34a_100000210054_102125554688 [0,0,0,2,0,0|1,0,0]=3 35066 B14R2.12796 C1CCCC(CCC1)OCC2CO2 7a_100000210054_102125554688 [0,0,0,2,0,0|1,0,0]=3 35067 B14R2.12796 C1CCCC(CCC1)OCC2CS2 7a_100000210054_100000031435 [0,0,0,2,0,0|1,1,0]=4 35068 B14R2.12796 C1CCCC(CCC1)OC[C@@H]2CO2 7a_100000210054_100000745022 [0,0,0,2,0,0|1,0,0]=3 35069 B14R2.12796 C1CCCN(CCC1)CCC2CC2 2230a_100000211400_100000694398 [0,0,0,2,0,0|2,0,0]=4 35070 B14R2.12796 C1CCCN(CCC1)CCC2CC2 269982a_100000211400_100000694398 [0,0,0,2,0,0|2,0,0]=4 35071 B14R2.12796 C1CCCN(CCC1)CCC2CC2 34a_100000211400_100000694398 [0,0,0,2,0,0|2,0,0]=4 35072 B14R2.12796 C1CCCN(CCC1)CCC2CO2 2230a_100000211400_100000732470 [0,0,0,2,0,0|1,0,0]=3 35073 B14R2.12796 C1CCCN(CCC1)CCC2CO2 269982a_100000211400_100000732470 [0,0,0,2,0,0|1,0,0]=3 35074 B14R2.12796 C1CCCN(CCC1)CCC2CO2 34a_100000211400_100000732470 [0,0,0,2,0,0|1,0,0]=3 35075 B14R2.12798 C1CCCC(CC1)CCNC2CC2 34a_100011532351_100000211595 [0,0,0,2,0,0|2,0,0]=4 35076 B14R2.12798 C1CCCC(CC1)CNCC2CC2 2230a_100000735609_200000696569 [0,0,0,2,0,0|2,0,0]=4 35077 B14R2.12798 C1CCCC(CC1)CNCC2CC2 2230a_100015204231_100000742324 [0,0,0,2,0,0|2,0,0]=4 35078 B14R2.12798 C1CCCC(CC1)CNCC2CC2 269862a_100015204231_100000741477 [0,0,0,2,0,0|2,0,0]=4 35079 B14R2.12798 C1CCCC(CC1)CNCC2CC2 34a_100000735609_200000696569 [0,0,0,2,0,0|2,0,0]=4 35080 B14R2.12798 C1CCCC(CC1)CNCC2CC2 34a_100015204231_100000742324 [0,0,0,2,0,0|2,0,0]=4 35081 B14R2.12798 C1CCCC(CC1)CNCC2CO2 2230a_100015204231_100011216344 [0,0,0,2,0,0|1,0,0]=3 35082 B14R2.12798 C1CCCC(CC1)CNCC2CO2 34a_100015204231_102125554688 [0,0,0,2,0,0|1,0,0]=3 35083 B14R2.12798 C1CCCC(CC1)COCC2CC2 34a_100000211283_200000696569 [0,0,0,2,0,0|2,0,0]=4 35084 B14R2.12798 C1CCCC(CC1)COCC2CC2 34a_100000699130_100000742324 [0,0,0,2,0,0|2,0,0]=4 35085 B14R2.12798 C1CCCC(CC1)COCC2CC2 7a_100000699130_100000742324 [0,0,0,2,0,0|2,0,0]=4 35086 B14R2.12798 C1CCCC(CC1)COCC2CO2 34a_100000699130_102125554688 [0,0,0,2,0,0|1,0,0]=3 35087 B14R2.12798 C1CCCC(CC1)COCC2CO2 7a_100000699130_102125554688 [0,0,0,2,0,0|1,0,0]=3 35088 B14R2.12798 C1CCCC(CC1)COCC2CS2 7a_100000699130_100000031435 [0,0,0,2,0,0|1,1,0]=4 35089 B14R2.12798 C1CCCC(CC1)COC[C@@H]2CO2 34a_100000757423_200000696569 [0,0,0,2,0,0|1,0,0]=3 35090 B14R2.12798 C1CCCC(CC1)COC[C@@H]2CO2 7a_100000699130_100000745022 [0,0,0,2,0,0|1,0,0]=3 35091 B14R2.12798 C1CCCC(CC1)CSCC2CC2 62a_100000756562_200000696569 [0,0,0,2,0,0|2,0,0]=4 35092 B14R2.12798 C1CCCC(CC1)CSCC2CC2 62a_200000696569_100000742324 [0,0,0,2,0,0|2,0,0]=4 35093 B14R2.12798 C1CCCC(CC1)CSCC2CO2 62a_102125554688_200000696569 [0,0,0,2,0,0|1,0,0]=3 35094 B14R2.12798 C1CCCC(CC1)CSCC2CO2 62a_200000696569_102125554688 [0,0,0,2,0,0|1,0,0]=3 35095 B14R2.12798 C1CCCC(CC1)CSCC2CS2 62a_100000031435_200000696569 [0,0,0,2,0,0|1,1,0]=4 35096 B14R2.12798 C1CCCC(CC1)CSCC2CS2 62a_200000696569_100000031435 [0,0,0,2,0,0|1,1,0]=4 35097 B14R2.12798 C1CCCC(CC1)CSC[C@@H]2CO2 62a_100000745022_200000696569 [0,0,0,2,0,0|1,0,0]=3 35098 B14R2.12798 C1CCCC(CC1)CSC[C@@H]2CO2 62a_200000696569_100000745022 [0,0,0,2,0,0|1,0,0]=3 35099 B14R2.12798 C1CCCC(CC1)NCCC2CC2 2230a_100000210984_100000694398 [0,0,0,2,0,0|2,0,0]=4 35100 B14R2.12798 C1CCCC(CC1)NCCC2CC2 270004a_100000764129_100000210131 [0,0,0,2,0,0|2,0,0]=4 35101 B14R2.12798 C1CCCC(CC1)NCCC2CC2 34a_100000210984_100000694398 [0,0,0,2,0,0|2,0,0]=4 35102 B14R2.12798 C1CCCC(CC1)NCCC2CC2 34a_100000764129_100011217769 [0,0,0,2,0,0|2,0,0]=4 35103 B14R2.12798 C1CCCC(CC1)NCCC2CO2 2230a_100000210984_100000732470 [0,0,0,2,0,0|1,0,0]=3 35104 B14R2.12798 C1CCCC(CC1)NCCC2CO2 34a_100000210984_100000732470 [0,0,0,2,0,0|1,0,0]=3 35105 B14R2.12798 C1CCCC(CC1)OCCC2CC2 34a_100000210887_100000694398 [0,0,0,2,0,0|2,0,0]=4 35106 B14R2.12798 C1CCCC(CC1)OCCC2CC2 34a_100000754188_100011217769 [0,0,0,2,0,0|2,0,0]=4 35107 B14R2.12798 C1CCCC(CC1)OCCC2CC2 7a_100000210887_100000764125 [0,0,0,2,0,0|2,0,0]=4 35108 B14R2.12798 C1CCCC(CC1)OCCC2CO2 34a_100000210887_100000732470 [0,0,0,2,0,0|1,0,0]=3 35109 B14R2.12798 C1CCCC(CC1)OCCC2CO2 7a_100000210887_100000732470 [0,0,0,2,0,0|1,0,0]=3 35110 B14R2.12798 C1CCCC(CC1)OCC[C@@H]2CO2 34a_100009820653_100011217769 [0,0,0,2,0,0|1,0,0]=3 35111 B14R2.12798 C1CCCC(CC1)SCCC2CC2 62a_100000764125_100011217769 [0,0,0,2,0,0|2,0,0]=4 35112 B14R2.12798 C1CCCC(CC1)SCCC2CC2 62a_100011217769_100000764125 [0,0,0,2,0,0|2,0,0]=4 35113 B14R2.12798 C1CCCC(CC1)SCCC2CO2 62a_100000732470_100011217769 [0,0,0,2,0,0|1,0,0]=3 35114 B14R2.12798 C1CCCC(CC1)SCCC2CO2 62a_100011217769_100000732470 [0,0,0,2,0,0|1,0,0]=3 35115 B14R2.12798 C1CCCN(CC1)CCCC2CO2 2230a_100000185865_100000733510 [0,0,0,2,0,0|1,0,0]=3 35116 B14R2.12798 C1CCCN(CC1)CCCC2CO2 269982a_100000185865_100000733510 [0,0,0,2,0,0|1,0,0]=3 35117 B14R2.12798 C1CCCN(CC1)CCCC2CO2 34a_100000185865_100000733510 [0,0,0,2,0,0|1,0,0]=3 35118 B14R2.12798 C1COCCN(C1)CCCC2CO2 2230a_100000685342_100000733510 [0,0,0,2,0,0|2,0,0]=4 35119 B14R2.12798 C1COCCN(C1)CCCC2CO2 269982a_100000685342_100000733510 [0,0,0,2,0,0|2,0,0]=4 35120 B14R2.12798 C1COCCN(C1)CCCC2CO2 34a_100000685342_100000733510 [0,0,0,2,0,0|2,0,0]=4 35121 B14R2.5498 CC1CCN1CC2CCCCCC2 269982a_100000755817_200000696569 [0,0,0,2,0,0|2,0,0]=4 35122 B14R2.5498 CC1CCN1CC2CCCCCC2 34a_100000755817_200000696569 [0,0,0,2,0,0|2,0,0]=4 35123 B14R2.32000 CCCNCC12CCCC1CCC2 2230a_100159271432_100000210303 [0,0,0,2,0,0|2,0,0]=4 35124 B14R2.32000 CCCNCC12CCCC1CCC2 34a_100159271432_100000210303 [0,0,0,2,0,0|2,0,0]=4 35125 B14R2.32000 FCCNCC12CCCC1CCC2 2230a_100159271432_100011217306 [0,0,0,2,0,0|2,0,0]=4 35126 B14R2.32000 FCCNCC12CCCC1CCC2 34a_100159271432_100011217306 [0,0,0,2,0,0|2,0,0]=4 35127 B14R2.32000 OCCNCC12CCCC1CCC2 2230a_100159271432_100000211926 [0,0,0,2,0,0|1,0,0]=3 35128 B14R2.32000 OCCNCC12CCCC1CCC2 34a_100159271432_100000211926 [0,0,0,2,0,0|1,0,0]=3 35129 B14R2.32000 OCCOCC12CCCN1CCC2 34a_100000722608_100000211926 [0,0,0,2,0,0|2,0,0]=4 35130 B14R2.32000 OCCOCC12CCCN1CCC2 7a_100000722608_100000211926 [0,0,0,2,0,0|2,0,0]=4