0 B14R0.392 C#CCCCCCCCCCCOCC 34a_100000054667_100000210202 [0,0,0,0,0,0|2,0,1]=3 1 B14R0.392 C#CCCCCCCCCCCOCC 7a_100000054667_100000210202 [0,0,0,0,0,0|2,0,1]=3 2 B14R0.392 C#CCCCCCCCCCCOCF 34a_100000054667_100015361967 [0,0,0,0,0,0|3,0,1]=4 3 B14R0.392 C#CCCCCCCCCCCOCF 7a_100000054667_100015361967 [0,0,0,0,0,0|3,0,1]=4 4 B14R0.392 C#CCCCCCCCCCOCC=C 34a_100000034437_100015514636 [0,0,0,0,0,0|2,0,2]=4 5 B14R0.392 C#CCCCCCCCCCOCC=C 7a_100000034437_100015514636 [0,0,0,0,0,0|2,0,2]=4 6 B14R0.392 C#CCCCCCCCCCOCC=O 34a_100000034437_200009817547 [0,0,0,0,0,0|1,0,2]=3 7 B14R0.392 C#CCCCCCCCCCOCC=O 7a_100000034437_200015260668 [0,0,0,0,0,0|1,0,2]=3 8 B14R0.392 C#CCCCCCCCCCOCCC 34a_100000034437_100000210303 [0,0,0,0,0,0|2,0,1]=3 9 B14R0.392 C#CCCCCCCCCCOCCC 7a_100000034437_100000210303 [0,0,0,0,0,0|2,0,1]=3 10 B14R0.392 C#CCCCCCCCCCOCCF 34a_100000034437_100011217306 [0,0,0,0,0,0|3,0,1]=4 11 B14R0.392 C#CCCCCCCCCCOCCF 7a_100000034437_100011217306 [0,0,0,0,0,0|3,0,1]=4 12 B14R0.392 C#CCCCCCCCCCOCCO 34a_100000034437_100000211926 [0,0,0,0,0,0|3,0,1]=4 13 B14R0.392 C#CCCCCCCCCCOCCO 7a_100000034437_100000211926 [0,0,0,0,0,0|3,0,1]=4 14 B14R0.392 C#CCCCCCCCCCOCSC 34a_100000034437_100011218213 [0,0,0,0,0,0|3,0,1]=4 15 B14R0.392 C#CCCCCCCCCOCCC=C 34a_100000065265_100000754431 [0,0,0,0,0,0|2,0,2]=4 16 B14R0.392 C#CCCCCCCCCOCCC=C 7a_100000065265_100000754431 [0,0,0,0,0,0|2,0,2]=4 17 B14R0.392 C#CCCCCCCCCOCCCC 34a_100000065265_100000210210 [0,0,0,0,0,0|2,0,1]=3 18 B14R0.392 C#CCCCCCCCCOCCCC 7a_100000065265_100000210211 [0,0,0,0,0,0|2,0,1]=3 19 B14R0.392 C#CCCCCCCCCOCCCF 34a_100000065265_100011934791 [0,0,0,0,0,0|3,0,1]=4 20 B14R0.392 C#CCCCCCCCCOCCCF 7a_100000065265_100011934791 [0,0,0,0,0,0|3,0,1]=4 21 B14R0.392 C#CCCCCCCCCOCCCO 34a_100000065265_100000230001 [0,0,0,0,0,0|3,0,1]=4 22 B14R0.392 C#CCCCCCCCCOCCCO 7a_100000065265_100011215043 [0,0,0,0,0,0|3,0,1]=4 23 B14R0.392 C#CCCCCCCCCOCCOC 34a_100000065265_100011201679 [0,0,0,0,0,0|3,0,1]=4 24 B14R0.392 C#CCCCCCCCCOCCOC 7a_100000065265_100000233755 [0,0,0,0,0,0|3,0,1]=4 25 B14R0.392 C#CCCCCCCCCOCCSC 34a_100000065265_100000212216 [0,0,0,0,0,0|3,0,1]=4 26 B14R0.392 C#CCCCCCCCCOCCSC 7a_100000065265_100000212216 [0,0,0,0,0,0|3,0,1]=4 27 B14R0.392 C#CCCCCCCCNCCCC=C 2230a_100000700776_100153394163 [0,0,0,0,0,0|2,0,2]=4 28 B14R0.392 C#CCCCCCCCNCCCC=C 34a_100000700776_100153394163 [0,0,0,0,0,0|2,0,2]=4 29 B14R0.392 C#CCCCCCCCNCCCCC 2230a_100000209983_100153394163 [0,0,0,0,0,0|2,0,1]=3 30 B14R0.392 C#CCCCCCCCNCCCCO 2230a_100000750430_100153394163 [0,0,0,0,0,0|3,0,1]=4 31 B14R0.392 C#CCCCCCCCNCCCCO 34a_100000750430_100153394163 [0,0,0,0,0,0|3,0,1]=4 32 B14R0.392 C#CCCCCCCCNCCCOC 34a_100150723488_100153394163 [0,0,0,0,0,0|3,0,1]=4 33 B14R0.392 C#CCCCCCCCNCCCSC 2230a_100000749238_100153394163 [0,0,0,0,0,0|3,0,1]=4 34 B14R0.392 C#CCCCCCCCNCCOCC 2230a_102516460346_100153394163 [0,0,0,0,0,0|3,0,1]=4 35 B14R0.392 C#CCCCCCCCNCCOCC 34a_102516460346_100153394163 [0,0,0,0,0,0|3,0,1]=4 36 B14R0.392 C#CCCCCCCCNCCSCC 2230a_100000106463_100153394163 [0,0,0,0,0,0|3,0,1]=4 37 B14R0.392 C#CCCCCCCCOCCCC=C 34a_100000054614_100000757094 [0,0,0,0,0,0|2,0,2]=4 38 B14R0.392 C#CCCCCCCCOCCCC=C 34a_100000758997_100153394163 [0,0,0,0,0,0|2,0,2]=4 39 B14R0.392 C#CCCCCCCCOCCCC=C 7a_100000054614_100000757094 [0,0,0,0,0,0|2,0,2]=4 40 B14R0.392 C#CCCCCCCCOCCCC=C 7a_100000758997_100153394163 [0,0,0,0,0,0|2,0,2]=4 41 B14R0.392 C#CCCCCCCCOCCCC=O 7a_100000054614_200011292268 [0,0,0,0,0,0|1,0,2]=3 42 B14R0.392 C#CCCCCCCCOCCCCBr 34a_100011216708_100153394163 [0,0,0,0,0,0|3,0,1]=4 43 B14R0.392 C#CCCCCCCCOCCCCC 34a_100000054614_100000718602 [0,0,0,0,0,0|2,0,1]=3 44 B14R0.392 C#CCCCCCCCOCCCCC 34a_100000210253_100153394163 [0,0,0,0,0,0|2,0,1]=3 45 B14R0.392 C#CCCCCCCCOCCCCC 7a_100000054614_100000210326 [0,0,0,0,0,0|2,0,1]=3 46 B14R0.392 C#CCCCCCCCOCCCCC 7a_100000210253_100153394163 [0,0,0,0,0,0|2,0,1]=3 47 B14R0.392 C#CCCCCCCCOCCCCCl 34a_100000210776_100153394163 [0,0,0,0,0,0|3,0,1]=4 48 B14R0.392 C#CCCCCCCCOCCCCCl 7a_100000210776_100153394163 [0,0,0,0,0,0|3,0,1]=4 49 B14R0.392 C#CCCCCCCCOCCCCF 34a_100000054614_100000729493 [0,0,0,0,0,0|3,0,1]=4 50 B14R0.392 C#CCCCCCCCOCCCCF 34a_100011995726_100153394163 [0,0,0,0,0,0|3,0,1]=4 51 B14R0.392 C#CCCCCCCCOCCCCF 7a_100000054614_100000729493 [0,0,0,0,0,0|3,0,1]=4 52 B14R0.392 C#CCCCCCCCOCCCCF 7a_100011995726_100153394163 [0,0,0,0,0,0|3,0,1]=4 53 B14R0.392 C#CCCCCCCCOCCCCI 34a_200012148704_100153394163 [0,0,0,0,0,0|3,0,1]=4 54 B14R0.392 C#CCCCCCCCOCCCCN 34a_100000750430_100153394163 [0,0,0,0,0,0|3,0,1]=4 55 B14R0.392 C#CCCCCCCCOCCCCO 34a_100000054614_100011216708 [0,0,0,0,0,0|3,0,1]=4 56 B14R0.392 C#CCCCCCCCOCCCCO 7a_100000054614_100000210776 [0,0,0,0,0,0|3,0,1]=4 57 B14R0.392 C#CCCCCCCCOCCCNC 34a_100000213112_100153394163 [0,0,0,0,0,0|3,0,1]=4 58 B14R0.392 C#CCCCCCCCOCCCOC 34a_100000054614_100000740836 [0,0,0,0,0,0|3,0,1]=4 59 B14R0.392 C#CCCCCCCCOCCCOC 34a_100000740835_100153394163 [0,0,0,0,0,0|3,0,1]=4 60 B14R0.392 C#CCCCCCCCOCCCOC 7a_100000054614_100000740836 [0,0,0,0,0,0|3,0,1]=4 61 B14R0.392 C#CCCCCCCCOCCCSC 34a_100000690336_100153394163 [0,0,0,0,0,0|3,0,1]=4 62 B14R0.392 C#CCCCCCCCOCCCSC 7a_100000690336_100153394163 [0,0,0,0,0,0|3,0,1]=4 63 B14R0.392 C#CCCCCCCCOCCOCC 34a_100000054614_100000210147 [0,0,0,0,0,0|3,0,1]=4 64 B14R0.392 C#CCCCCCCCOCCOCC 34a_100000210136_100153394163 [0,0,0,0,0,0|3,0,1]=4 65 B14R0.392 C#CCCCCCCCOCCOCC 7a_100000054614_100011215890 [0,0,0,0,0,0|3,0,1]=4 66 B14R0.392 C#CCCCCCCCOCCOCC 7a_100000210136_100153394163 [0,0,0,0,0,0|3,0,1]=4 67 B14R0.392 C#CCCCCCCCOCCSCC 34a_100000054614_100000757381 [0,0,0,0,0,0|3,0,1]=4 68 B14R0.392 C#CCCCCCCCOCCSCC 34a_100000212035_100153394163 [0,0,0,0,0,0|3,0,1]=4 69 B14R0.392 C#CCCCCCCCOCCSCC 7a_100000054614_100000757381 [0,0,0,0,0,0|3,0,1]=4 70 B14R0.392 C#CCCCCCCCOCCSCC 7a_100000212035_100153394163 [0,0,0,0,0,0|3,0,1]=4 71 B14R0.392 C#CCCCCCCCSCCCC=C 62a_100011713584_100153394163 [0,0,0,0,0,0|2,0,2]=4 72 B14R0.392 C#CCCCCCCCSCCCC=C 62a_100153394163_100000757094 [0,0,0,0,0,0|2,0,2]=4 73 B14R0.392 C#CCCCCCCCSCCCC=O 62a_100153394163_200011292268 [0,0,0,0,0,0|1,0,2]=3 74 B14R0.392 C#CCCCCCCCSCCCC=O 62a_200011292268_100153394163 [0,0,0,0,0,0|1,0,2]=3 75 B14R0.392 C#CCCCCCCCSCCCCC 62a_100000210326_100153394163 [0,0,0,0,0,0|2,0,1]=3 76 B14R0.392 C#CCCCCCCCSCCCCC 62a_100153394163_100000210326 [0,0,0,0,0,0|2,0,1]=3 77 B14R0.392 C#CCCCCCCCSCCCCF 62a_100000729493_100153394163 [0,0,0,0,0,0|3,0,1]=4 78 B14R0.392 C#CCCCCCCCSCCCCF 62a_100153394163_100000729493 [0,0,0,0,0,0|3,0,1]=4 79 B14R0.392 C#CCCCCCCCSCCCCO 62a_100000210776_100153394163 [0,0,0,0,0,0|3,0,1]=4 80 B14R0.392 C#CCCCCCCCSCCCCO 62a_100153394163_100000210776 [0,0,0,0,0,0|3,0,1]=4 81 B14R0.392 C#CCCCCCCCSCCCOC 62a_100000709357_100153394163 [0,0,0,0,0,0|3,0,1]=4 82 B14R0.392 C#CCCCCCCCSCCCOC 62a_100153394163_100000709357 [0,0,0,0,0,0|3,0,1]=4 83 B14R0.392 C#CCCCCCCCSCCOCC 62a_100000210147_100153394163 [0,0,0,0,0,0|3,0,1]=4 84 B14R0.392 C#CCCCCCCCSCCOCC 62a_100153394163_100011215890 [0,0,0,0,0,0|3,0,1]=4 85 B14R0.392 C#CCCCCCCCSCCSCC 62a_100000757381_100153394163 [0,0,0,0,0,0|3,0,1]=4 86 B14R0.392 C#CCCCCCCCSCCSCC 62a_100153394163_100000757381 [0,0,0,0,0,0|3,0,1]=4 87 B14R0.392 C#CCCCCCCNCCCCC=C 2230a_100000703577_100012276617 [0,0,0,0,0,0|2,0,2]=4 88 B14R0.392 C#CCCCCCCNCCCCC=C 34a_100000703577_100012276617 [0,0,0,0,0,0|2,0,2]=4 89 B14R0.392 C#CCCCCCCNCCCCCC 2230a_100000210581_100012276617 [0,0,0,0,0,0|2,0,1]=3 90 B14R0.392 C#CCCCCCCNCCCCCO 2230a_100000762737_100012276617 [0,0,0,0,0,0|3,0,1]=4 91 B14R0.392 C#CCCCCCCNCCCCCO 34a_100000762737_100012276617 [0,0,0,0,0,0|3,0,1]=4 92 B14R0.392 C#CCCCCCCNCCCOCC 2230a_100000210961_100012276617 [0,0,0,0,0,0|3,0,1]=4 93 B14R0.392 C#CCCCCCCNCCCOCC 34a_100000210961_100012276617 [0,0,0,0,0,0|3,0,1]=4 94 B14R0.392 C#CCCCCCCNCCOCCC 2230a_100161115042_100012276617 [0,0,0,0,0,0|3,0,1]=4 95 B14R0.392 C#CCCCCCCNCCOCCC 34a_100161115042_100012276617 [0,0,0,0,0,0|3,0,1]=4 96 B14R0.392 C#CCCCCCCNCCSCCC 2230a_100020603323_100012276617 [0,0,0,0,0,0|3,0,1]=4 97 B14R0.392 C#CCCCCCCOCCCCC=C 34a_100000766645_100012276617 [0,0,0,0,0,0|2,0,2]=4 98 B14R0.392 C#CCCCCCCOCCCCC=C 34a_100011217361_100011215482 [0,0,0,0,0,0|2,0,2]=4 99 B14R0.392 C#CCCCCCCOCCCCC=C 7a_100000766645_100012276617 [0,0,0,0,0,0|2,0,2]=4 100 B14R0.392 C#CCCCCCCOCCCCC=C 7a_100011217361_100011215482 [0,0,0,0,0,0|2,0,2]=4 101 B14R0.392 C#CCCCCCCOCCCCC=O 7a_100011217361_100000139335 [0,0,0,0,0,0|1,0,2]=3 102 B14R0.392 C#CCCCCCCOCCCCCBr 34a_100000746331_100012276617 [0,0,0,0,0,0|3,0,1]=4 103 B14R0.392 C#CCCCCCCOCCCCCBr 7a_100000746331_100012276617 [0,0,0,0,0,0|3,0,1]=4 104 B14R0.392 C#CCCCCCCOCCCCCC 34a_100000210259_100012276617 [0,0,0,0,0,0|2,0,1]=3 105 B14R0.392 C#CCCCCCCOCCCCCC 34a_100011217361_100000210314 [0,0,0,0,0,0|2,0,1]=3 106 B14R0.392 C#CCCCCCCOCCCCCC 7a_100000210259_100012276617 [0,0,0,0,0,0|2,0,1]=3 107 B14R0.392 C#CCCCCCCOCCCCCC 7a_100011217361_100000210314 [0,0,0,0,0,0|2,0,1]=3 108 B14R0.392 C#CCCCCCCOCCCCCCl 34a_100000746330_100012276617 [0,0,0,0,0,0|3,0,1]=4 109 B14R0.392 C#CCCCCCCOCCCCCCl 7a_100000746330_100012276617 [0,0,0,0,0,0|3,0,1]=4 110 B14R0.392 C#CCCCCCCOCCCCCF 34a_100011217361_100000729378 [0,0,0,0,0,0|3,0,1]=4 111 B14R0.392 C#CCCCCCCOCCCCCF 7a_100011217361_100000729378 [0,0,0,0,0,0|3,0,1]=4 112 B14R0.392 C#CCCCCCCOCCCCCI 34a_200012148887_100012276617 [0,0,0,0,0,0|3,0,1]=4 113 B14R0.392 C#CCCCCCCOCCCCCI 7a_200012148887_100012276617 [0,0,0,0,0,0|3,0,1]=4 114 B14R0.392 C#CCCCCCCOCCCCCN 34a_100000762737_100012276617 [0,0,0,0,0,0|3,0,1]=4 115 B14R0.392 C#CCCCCCCOCCCCCO 34a_100011217361_100000746330 [0,0,0,0,0,0|3,0,1]=4 116 B14R0.392 C#CCCCCCCOCCCCCO 7a_100011217361_100000746330 [0,0,0,0,0,0|3,0,1]=4 117 B14R0.392 C#CCCCCCCOCCCCOC 34a_100000740925_100012276617 [0,0,0,0,0,0|3,0,1]=4 118 B14R0.392 C#CCCCCCCOCCCCOC 34a_100011217361_100000755781 [0,0,0,0,0,0|3,0,1]=4 119 B14R0.392 C#CCCCCCCOCCCCOC 7a_100011217361_100000730899 [0,0,0,0,0,0|3,0,1]=4 120 B14R0.392 C#CCCCCCCOCCCCSC 34a_100011217163_100012276617 [0,0,0,0,0,0|3,0,1]=4 121 B14R0.392 C#CCCCCCCOCCCCSC 7a_100011217163_100012276617 [0,0,0,0,0,0|3,0,1]=4 122 B14R0.392 C#CCCCCCCOCCCOCC 34a_100000757476_100012276617 [0,0,0,0,0,0|3,0,1]=4 123 B14R0.392 C#CCCCCCCOCCCOCC 34a_100011217361_100012232248 [0,0,0,0,0,0|3,0,1]=4 124 B14R0.392 C#CCCCCCCOCCCOCC 7a_100000757476_100012276617 [0,0,0,0,0,0|3,0,1]=4 125 B14R0.392 C#CCCCCCCOCCCOCC 7a_100011217361_100012232248 [0,0,0,0,0,0|3,0,1]=4 126 B14R0.392 C#CCCCCCCOCCCSCC 34a_100011216438_100012276617 [0,0,0,0,0,0|3,0,1]=4 127 B14R0.392 C#CCCCCCCOCCCSCC 7a_100011216438_100012276617 [0,0,0,0,0,0|3,0,1]=4 128 B14R0.392 C#CCCCCCCOCCOCCC 34a_100000752267_100012276617 [0,0,0,0,0,0|3,0,1]=4 129 B14R0.392 C#CCCCCCCOCCOCCC 34a_100011217361_100011215938 [0,0,0,0,0,0|3,0,1]=4 130 B14R0.392 C#CCCCCCCOCCOCCC 7a_100000752267_100012276617 [0,0,0,0,0,0|3,0,1]=4 131 B14R0.392 C#CCCCCCCOCCOCCC 7a_100011217361_100011215938 [0,0,0,0,0,0|3,0,1]=4 132 B14R0.392 C#CCCCCCCOCCSCCC 34a_200000230433_100012276617 [0,0,0,0,0,0|3,0,1]=4 133 B14R0.392 C#CCCCCCCOCCSCCC 7a_200000230433_100012276617 [0,0,0,0,0,0|3,0,1]=4 134 B14R0.392 C#CCCCCCCOCOCCCC 34a_100011217361_100011995733 [0,0,0,0,0,0|3,0,1]=4 135 B14R0.392 C#CCCCCCCSCCCCC=C 62a_100011215482_100012276617 [0,0,0,0,0,0|2,0,2]=4 136 B14R0.392 C#CCCCCCCSCCCCC=C 62a_100012276617_100011215482 [0,0,0,0,0,0|2,0,2]=4 137 B14R0.392 C#CCCCCCCSCCCCC=O 62a_100000139335_100012276617 [0,0,0,0,0,0|1,0,2]=3 138 B14R0.392 C#CCCCCCCSCCCCC=O 62a_100012276617_100000139335 [0,0,0,0,0,0|1,0,2]=3 139 B14R0.392 C#CCCCCCCSCCCCCC 62a_100000210314_100012276617 [0,0,0,0,0,0|2,0,1]=3 140 B14R0.392 C#CCCCCCCSCCCCCC 62a_100012276617_100000210757 [0,0,0,0,0,0|2,0,1]=3 141 B14R0.392 C#CCCCCCCSCCCCCF 62a_100000729378_100012276617 [0,0,0,0,0,0|3,0,1]=4 142 B14R0.392 C#CCCCCCCSCCCCCF 62a_100012276617_100000729378 [0,0,0,0,0,0|3,0,1]=4 143 B14R0.392 C#CCCCCCCSCCCCCO 62a_100000746330_100012276617 [0,0,0,0,0,0|3,0,1]=4 144 B14R0.392 C#CCCCCCCSCCCCCO 62a_100012276617_100000746330 [0,0,0,0,0,0|3,0,1]=4 145 B14R0.392 C#CCCCCCCSCCCCOC 62a_100000730899_100012276617 [0,0,0,0,0,0|3,0,1]=4 146 B14R0.392 C#CCCCCCCSCCCCOC 62a_100012276617_100000730899 [0,0,0,0,0,0|3,0,1]=4 147 B14R0.392 C#CCCCCCCSCCCOCC 62a_100012232248_100012276617 [0,0,0,0,0,0|3,0,1]=4 148 B14R0.392 C#CCCCCCCSCCCOCC 62a_100012276617_100012232248 [0,0,0,0,0,0|3,0,1]=4 149 B14R0.392 C#CCCCCCCSCCOCCC 62a_100011215938_100012276617 [0,0,0,0,0,0|3,0,1]=4 150 B14R0.392 C#CCCCCCCSCCOCCC 62a_100012276617_100011215938 [0,0,0,0,0,0|3,0,1]=4 151 B14R0.392 C#CCCCCCCSCOCCCC 62a_100011995733_100012276617 [0,0,0,0,0,0|3,0,1]=4 152 B14R0.392 C#CCCCCCCSCOCCCC 62a_100012276617_100011995733 [0,0,0,0,0,0|3,0,1]=4 153 B14R0.392 C#CCCCCCNCCCCCCC 2230a_100000229938_100012094781 [0,0,0,0,0,0|2,0,1]=3 154 B14R0.392 C#CCCCCCNCCCCCCO 2230a_100000686447_100012094781 [0,0,0,0,0,0|3,0,1]=4 155 B14R0.392 C#CCCCCCNCCCCCCO 34a_100000686447_100012094781 [0,0,0,0,0,0|3,0,1]=4 156 B14R0.392 C#CCCCCCNCCCCCOC 2230a_100000747528_100012094781 [0,0,0,0,0,0|3,0,1]=4 157 B14R0.392 C#CCCCCCNCCCCCOC 34a_100000747528_100012094781 [0,0,0,0,0,0|3,0,1]=4 158 B14R0.392 C#CCCCCCNCCCOCCC 2230a_100011217757_100012094781 [0,0,0,0,0,0|3,0,1]=4 159 B14R0.392 C#CCCCCCNCCCOCCC 34a_100011217757_100012094781 [0,0,0,0,0,0|3,0,1]=4 160 B14R0.392 C#CCCCCCNCCSCCCC 2230a_100025743550_100012094781 [0,0,0,0,0,0|3,0,1]=4 161 B14R0.392 C#CCCCCCOCCCCCC=C 34a_100000766912_100000700193 [0,0,0,0,0,0|2,0,2]=4 162 B14R0.392 C#CCCCCCOCCCCCC=C 34a_100011216702_100012094781 [0,0,0,0,0,0|2,0,2]=4 163 B14R0.392 C#CCCCCCOCCCCCC=C 7a_100000766912_100000700193 [0,0,0,0,0,0|2,0,2]=4 164 B14R0.392 C#CCCCCCOCCCCCC=C 7a_100011216702_100012094781 [0,0,0,0,0,0|2,0,2]=4 165 B14R0.392 C#CCCCCCOCCCCCC=O 7a_100000766912_100000139337 [0,0,0,0,0,0|1,0,2]=3 166 B14R0.392 C#CCCCCCOCCCCCCBr 34a_100011215345_100012094781 [0,0,0,0,0,0|3,0,1]=4 167 B14R0.392 C#CCCCCCOCCCCCCBr 7a_100011215345_100012094781 [0,0,0,0,0,0|3,0,1]=4 168 B14R0.392 C#CCCCCCOCCCCCCC 34a_100000210272_100012094781 [0,0,0,0,0,0|2,0,1]=3 169 B14R0.392 C#CCCCCCOCCCCCCC 34a_100000766912_100000210614 [0,0,0,0,0,0|2,0,1]=3 170 B14R0.392 C#CCCCCCOCCCCCCC 7a_100000210272_100012094781 [0,0,0,0,0,0|2,0,1]=3 171 B14R0.392 C#CCCCCCOCCCCCCC 7a_100000766912_100000210614 [0,0,0,0,0,0|2,0,1]=3 172 B14R0.392 C#CCCCCCOCCCCCCCl 34a_100000766143_100012094781 [0,0,0,0,0,0|3,0,1]=4 173 B14R0.392 C#CCCCCCOCCCCCCCl 7a_100000766143_100012094781 [0,0,0,0,0,0|3,0,1]=4 174 B14R0.392 C#CCCCCCOCCCCCCF 34a_100000732779_100012094781 [0,0,0,0,0,0|3,0,1]=4 175 B14R0.392 C#CCCCCCOCCCCCCF 34a_100000766912_100015922095 [0,0,0,0,0,0|3,0,1]=4 176 B14R0.392 C#CCCCCCOCCCCCCF 7a_100000732779_100012094781 [0,0,0,0,0,0|3,0,1]=4 177 B14R0.392 C#CCCCCCOCCCCCCF 7a_100000766912_100015922095 [0,0,0,0,0,0|3,0,1]=4 178 B14R0.392 C#CCCCCCOCCCCCCN 34a_100000686447_100012094781 [0,0,0,0,0,0|3,0,1]=4 179 B14R0.392 C#CCCCCCOCCCCCCO 34a_100000766912_100000766143 [0,0,0,0,0,0|3,0,1]=4 180 B14R0.392 C#CCCCCCOCCCCCCO 7a_100000766912_100000766143 [0,0,0,0,0,0|3,0,1]=4 181 B14R0.392 C#CCCCCCOCCCCCNC 34a_100000722520_100012094781 [0,0,0,0,0,0|3,0,1]=4 182 B14R0.392 C#CCCCCCOCCOCCCC 34a_100000210238_100012094781 [0,0,0,0,0,0|3,0,1]=4 183 B14R0.392 C#CCCCCCOCCOCCCC 34a_100000766912_100000743108 [0,0,0,0,0,0|3,0,1]=4 184 B14R0.392 C#CCCCCCOCCOCCCC 7a_100000210238_100012094781 [0,0,0,0,0,0|3,0,1]=4 185 B14R0.392 C#CCCCCCOCCOCCCC 7a_100000766912_100000743108 [0,0,0,0,0,0|3,0,1]=4 186 B14R0.392 C#CCCCCCOCCSCCCC 34a_200000230436_100012094781 [0,0,0,0,0,0|3,0,1]=4 187 B14R0.392 C#CCCCCCOCCSCCCC 7a_200000230436_100012094781 [0,0,0,0,0,0|3,0,1]=4 188 B14R0.392 C#CCCCCCSCCCCCC=C 62a_100000700193_100012094781 [0,0,0,0,0,0|2,0,2]=4 189 B14R0.392 C#CCCCCCSCCCCCC=C 62a_100012094781_100000700193 [0,0,0,0,0,0|2,0,2]=4 190 B14R0.392 C#CCCCCCSCCCCCC=O 62a_100000139337_100012094781 [0,0,0,0,0,0|1,0,2]=3 191 B14R0.392 C#CCCCCCSCCCCCC=O 62a_100012094781_100000139337 [0,0,0,0,0,0|1,0,2]=3 192 B14R0.392 C#CCCCCCSCCCCCCC 62a_100000210614_100012094781 [0,0,0,0,0,0|2,0,1]=3 193 B14R0.392 C#CCCCCCSCCCCCCC 62a_100012094781_100000210316 [0,0,0,0,0,0|2,0,1]=3 194 B14R0.392 C#CCCCCCSCCCCCCF 62a_100012094781_100015922095 [0,0,0,0,0,0|3,0,1]=4 195 B14R0.392 C#CCCCCCSCCCCCCF 62a_100015922095_100012094781 [0,0,0,0,0,0|3,0,1]=4 196 B14R0.392 C#CCCCCCSCCCCCCO 62a_100000766143_100012094781 [0,0,0,0,0,0|3,0,1]=4 197 B14R0.392 C#CCCCCCSCCCCCCO 62a_100012094781_100000766143 [0,0,0,0,0,0|3,0,1]=4 198 B14R0.392 C#CCCCCCSCCOCCCC 62a_100000743108_100012094781 [0,0,0,0,0,0|3,0,1]=4 199 B14R0.392 C#CCCCCCSCCOCCCC 62a_100012094781_100000743108 [0,0,0,0,0,0|3,0,1]=4 200 B14R0.392 C#CCCCCNCCCCCCC=C 2230a_100000706060_100011215473 [0,0,0,0,0,0|2,0,2]=4 201 B14R0.392 C#CCCCCNCCCCCCC=C 34a_100000706060_100011215473 [0,0,0,0,0,0|2,0,2]=4 202 B14R0.392 C#CCCCCNCCCCCCCC 2230a_100000229939_100010269958 [0,0,0,0,0,0|2,0,1]=3 203 B14R0.392 C#CCCCCNCCCCCCCC 2230a_100000706060_100000210759 [0,0,0,0,0,0|2,0,1]=3 204 B14R0.392 C#CCCCCNCCCCCCCC 34a_100000229939_100010269958 [0,0,0,0,0,0|2,0,1]=3 205 B14R0.392 C#CCCCCNCCCCCCCC 34a_100000706060_100000210759 [0,0,0,0,0,0|2,0,1]=3 206 B14R0.392 C#CCCCCNCCCCCCCO 2230a_100000706060_100000760002 [0,0,0,0,0,0|3,0,1]=4 207 B14R0.392 C#CCCCCNCCCCCCCO 2230a_100011996573_100010269958 [0,0,0,0,0,0|3,0,1]=4 208 B14R0.392 C#CCCCCNCCCCCCCO 34a_100000706060_100000760002 [0,0,0,0,0,0|3,0,1]=4 209 B14R0.392 C#CCCCCNCCCCCCCO 34a_100011996573_100010269958 [0,0,0,0,0,0|3,0,1]=4 210 B14R0.392 C#CCCCCNCCCCCCOC 2230a_100000706060_100011998445 [0,0,0,0,0,0|3,0,1]=4 211 B14R0.392 C#CCCCCNCCCCCCOC 34a_100000706060_100011998445 [0,0,0,0,0,0|3,0,1]=4 212 B14R0.392 C#CCCCCNCCCOCCCC 2230a_200000211371_100010269958 [0,0,0,0,0,0|3,0,1]=4 213 B14R0.392 C#CCCCCNCCCOCCCC 34a_200000211371_100010269958 [0,0,0,0,0,0|3,0,1]=4 214 B14R0.392 C#CCCCCOCCCCCCC=C 34a_100000766709_100011215473 [0,0,0,0,0,0|2,0,2]=4 215 B14R0.392 C#CCCCCOCCCCCCC=C 34a_200011216477_100010269958 [0,0,0,0,0,0|2,0,2]=4 216 B14R0.392 C#CCCCCOCCCCCCC=C 7a_100000766709_100011215473 [0,0,0,0,0,0|2,0,2]=4 217 B14R0.392 C#CCCCCOCCCCCCC=C 7a_200011216477_100010269958 [0,0,0,0,0,0|2,0,2]=4 218 B14R0.392 C#CCCCCOCCCCCCCBr 34a_100000760002_100010269958 [0,0,0,0,0,0|3,0,1]=4 219 B14R0.392 C#CCCCCOCCCCCCCBr 7a_100000760002_100010269958 [0,0,0,0,0,0|3,0,1]=4 220 B14R0.392 C#CCCCCOCCCCCCCC 34a_100000210232_100010269958 [0,0,0,0,0,0|2,0,1]=3 221 B14R0.392 C#CCCCCOCCCCCCCC 34a_100000766709_100000210759 [0,0,0,0,0,0|2,0,1]=3 222 B14R0.392 C#CCCCCOCCCCCCCC 7a_100000210232_100010269958 [0,0,0,0,0,0|2,0,1]=3 223 B14R0.392 C#CCCCCOCCCCCCCC 7a_100000766709_100000210759 [0,0,0,0,0,0|2,0,1]=3 224 B14R0.392 C#CCCCCOCCCCCCCN 34a_100011996573_100010269958 [0,0,0,0,0,0|3,0,1]=4 225 B14R0.392 C#CCCCCOCCCCCCCO 34a_100000766709_100000760002 [0,0,0,0,0,0|3,0,1]=4 226 B14R0.392 C#CCCCCOCCCCCCCO 7a_100000766709_100000760002 [0,0,0,0,0,0|3,0,1]=4 227 B14R0.392 C#CCCCCOCCCCCCOC 34a_100000766709_100011998445 [0,0,0,0,0,0|3,0,1]=4 228 B14R0.392 C#CCCCCOCCCCCCOC 34a_200012092642_100010269958 [0,0,0,0,0,0|3,0,1]=4 229 B14R0.392 C#CCCCCOCCCCCCOC 7a_100000766709_100011998445 [0,0,0,0,0,0|3,0,1]=4 230 B14R0.392 C#CCCCCOCCCCCCOC 7a_200012092642_100010269958 [0,0,0,0,0,0|3,0,1]=4 231 B14R0.392 C#CCCCCOCCCOCCCC 34a_200011215613_100010269958 [0,0,0,0,0,0|3,0,1]=4 232 B14R0.392 C#CCCCCOCCCOCCCC 7a_200011215613_100010269958 [0,0,0,0,0,0|3,0,1]=4 233 B14R0.392 C#CCCCCOCCNCCCCC 34a_100000224656_100010269958 [0,0,0,0,0,0|3,0,1]=4 234 B14R0.392 C#CCCCCOCCOCCCCC 34a_100011215259_100010269958 [0,0,0,0,0,0|3,0,1]=4 235 B14R0.392 C#CCCCCOCCOCCCCC 7a_100011215259_100010269958 [0,0,0,0,0,0|3,0,1]=4 236 B14R0.392 C#CCCCCSCCCCCCC=C 62a_100010269958_100011215473 [0,0,0,0,0,0|2,0,2]=4 237 B14R0.392 C#CCCCCSCCCCCCC=C 62a_100011215473_100010269958 [0,0,0,0,0,0|2,0,2]=4 238 B14R0.392 C#CCCCCSCCCCCCCC 62a_100000210759_100010269958 [0,0,0,0,0,0|2,0,1]=3 239 B14R0.392 C#CCCCCSCCCCCCCC 62a_100010269958_100000210317 [0,0,0,0,0,0|2,0,1]=3 240 B14R0.392 C#CCCCCSCCCCCCCO 62a_100000760002_100010269958 [0,0,0,0,0,0|3,0,1]=4 241 B14R0.392 C#CCCCCSCCCCCCCO 62a_100010269958_100000760002 [0,0,0,0,0,0|3,0,1]=4 242 B14R0.392 C#CCCCCSCCCCCCOC 62a_100010269958_100011998445 [0,0,0,0,0,0|3,0,1]=4 243 B14R0.392 C#CCCCCSCCCCCCOC 62a_100011998445_100010269958 [0,0,0,0,0,0|3,0,1]=4 244 B14R0.392 C#CCCCNCCCCCCCC=C 34a_100000718082_100012355270 [0,0,0,0,0,0|2,0,2]=4 245 B14R0.392 C#CCCCNCCCCCCCCC 2230a_100000212291_100000731252 [0,0,0,0,0,0|2,0,1]=3 246 B14R0.392 C#CCCCNCCCCCCCCC 34a_100000212291_100000695029 [0,0,0,0,0,0|2,0,1]=3 247 B14R0.392 C#CCCCNCCCCCCCCC 34a_100000718082_100011214924 [0,0,0,0,0,0|2,0,1]=3 248 B14R0.392 C#CCCCNCCCCCCCCO 2230a_102515433106_100000731252 [0,0,0,0,0,0|3,0,1]=4 249 B14R0.392 C#CCCCNCCCCCCCCO 34a_100000718082_100000033203 [0,0,0,0,0,0|3,0,1]=4 250 B14R0.392 C#CCCCNCCCCCCCCO 34a_102515433106_100000695029 [0,0,0,0,0,0|3,0,1]=4 251 B14R0.392 C#CCCCOCCCCCCCC=C 34a_100000215630_100012355270 [0,0,0,0,0,0|2,0,2]=4 252 B14R0.392 C#CCCCOCCCCCCCC=C 34a_100000730831_100000695029 [0,0,0,0,0,0|2,0,2]=4 253 B14R0.392 C#CCCCOCCCCCCCC=C 7a_100000215630_100012355270 [0,0,0,0,0,0|2,0,2]=4 254 B14R0.392 C#CCCCOCCCCCCCC=C 7a_100000730831_100011215417 [0,0,0,0,0,0|2,0,2]=4 255 B14R0.392 C#CCCCOCCCCCCCCBr 34a_100009813846_100000695029 [0,0,0,0,0,0|3,0,1]=4 256 B14R0.392 C#CCCCOCCCCCCCCBr 7a_100009813846_100011215417 [0,0,0,0,0,0|3,0,1]=4 257 B14R0.392 C#CCCCOCCCCCCCCC 34a_100000210712_100000695029 [0,0,0,0,0,0|2,0,1]=3 258 B14R0.392 C#CCCCOCCCCCCCCC 34a_100000215630_100011214924 [0,0,0,0,0,0|2,0,1]=3 259 B14R0.392 C#CCCCOCCCCCCCCC 7a_100000210712_100011215417 [0,0,0,0,0,0|2,0,1]=3 260 B14R0.392 C#CCCCOCCCCCCCCC 7a_100000215630_100000210328 [0,0,0,0,0,0|2,0,1]=3 261 B14R0.392 C#CCCCOCCCCCCCCCl 34a_100000033203_100000695029 [0,0,0,0,0,0|3,0,1]=4 262 B14R0.392 C#CCCCOCCCCCCCCCl 7a_100000033203_100011215417 [0,0,0,0,0,0|3,0,1]=4 263 B14R0.392 C#CCCCOCCCCCCCCN 34a_102515433106_100000695029 [0,0,0,0,0,0|3,0,1]=4 264 B14R0.392 C#CCCCOCCCCCCCCO 34a_100000215630_100000033203 [0,0,0,0,0,0|3,0,1]=4 265 B14R0.392 C#CCCCOCCCCCCCCO 7a_100000215630_100000033203 [0,0,0,0,0,0|3,0,1]=4 266 B14R0.392 C#CCCCOCCCCNCCCC 34a_200011216965_100000695029 [0,0,0,0,0,0|3,0,1]=4 267 B14R0.392 C#CCCCOCCCCOCCCC 34a_200000760531_100000695029 [0,0,0,0,0,0|3,0,1]=4 268 B14R0.392 C#CCCCOCCCCOCCCC 7a_200000760531_100011215417 [0,0,0,0,0,0|3,0,1]=4 269 B14R0.392 C#CCCCOCCOCCCCCC 34a_100000691444_100000695029 [0,0,0,0,0,0|3,0,1]=4 270 B14R0.392 C#CCCCOCCOCCCCCC 7a_100000691444_100011215417 [0,0,0,0,0,0|3,0,1]=4 271 B14R0.392 C#CCCCSCCCCCCCC=C 62a_100011215417_100012355270 [0,0,0,0,0,0|2,0,2]=4 272 B14R0.392 C#CCCCSCCCCCCCC=C 62a_100012355270_100011215417 [0,0,0,0,0,0|2,0,2]=4 273 B14R0.392 C#CCCCSCCCCCCCCC 62a_100011215417_100000210670 [0,0,0,0,0,0|2,0,1]=3 274 B14R0.392 C#CCCCSCCCCCCCCO 62a_100000033203_100011215417 [0,0,0,0,0,0|3,0,1]=4 275 B14R0.392 C#CCCCSCCCCCCCCO 62a_100011215417_100000033203 [0,0,0,0,0,0|3,0,1]=4 276 B14R0.392 C#CCCNCCCCCCCCC=C 34a_100000755551_100011933949 [0,0,0,0,0,0|2,0,2]=4 277 B14R0.392 C#CCCNCCCCCCCCCC 2230a_100000684558_100000688953 [0,0,0,0,0,0|2,0,1]=3 278 B14R0.392 C#CCCNCCCCCCCCCC 34a_100000684558_100000688953 [0,0,0,0,0,0|2,0,1]=3 279 B14R0.392 C#CCCNCCCCCCCCCC 34a_100000755551_100000210320 [0,0,0,0,0,0|2,0,1]=3 280 B14R0.392 C#CCCNCCCCCCCCCO 2230a_100000078944_100000688953 [0,0,0,0,0,0|3,0,1]=4 281 B14R0.392 C#CCCNCCCCCCCCCO 34a_100000078944_100000688953 [0,0,0,0,0,0|3,0,1]=4 282 B14R0.392 C#CCCNCCCCCCCCCO 34a_100000755551_100009813782 [0,0,0,0,0,0|3,0,1]=4 283 B14R0.392 C#CCCOCCCCCCCCC=C 34a_100011215194_100000688953 [0,0,0,0,0,0|2,0,2]=4 284 B14R0.392 C#CCCOCCCCCCCCC=C 34a_100011215631_100011933949 [0,0,0,0,0,0|2,0,2]=4 285 B14R0.392 C#CCCOCCCCCCCCC=C 7a_100011215194_100000688953 [0,0,0,0,0,0|2,0,2]=4 286 B14R0.392 C#CCCOCCCCCCCCCBr 34a_100009813782_100000688953 [0,0,0,0,0,0|3,0,1]=4 287 B14R0.392 C#CCCOCCCCCCCCCBr 7a_100009813782_100000688953 [0,0,0,0,0,0|3,0,1]=4 288 B14R0.392 C#CCCOCCCCCCCCCC 34a_100000210711_100000688953 [0,0,0,0,0,0|2,0,1]=3 289 B14R0.392 C#CCCOCCCCCCCCCC 34a_100011215631_100000210320 [0,0,0,0,0,0|2,0,1]=3 290 B14R0.392 C#CCCOCCCCCCCCCC 7a_100000210711_100000688953 [0,0,0,0,0,0|2,0,1]=3 291 B14R0.392 C#CCCOCCCCCCCCCCl 34a_100009868337_100000688953 [0,0,0,0,0,0|3,0,1]=4 292 B14R0.392 C#CCCOCCCCCCCCCCl 7a_100009868337_100000688953 [0,0,0,0,0,0|3,0,1]=4 293 B14R0.392 C#CCCOCCCCCCCCCN 34a_100000078944_100000688953 [0,0,0,0,0,0|3,0,1]=4 294 B14R0.392 C#CCCOCCCCCCCCCO 34a_100011215631_100009813782 [0,0,0,0,0,0|3,0,1]=4 295 B14R0.392 C#CCCSCCCCCCCCC=C 62a_100000688953_100011933949 [0,0,0,0,0,0|2,0,2]=4 296 B14R0.392 C#CCCSCCCCCCCCC=C 62a_100011933949_100000688953 [0,0,0,0,0,0|2,0,2]=4 297 B14R0.392 C#CCCSCCCCCCCCCC 62a_100000688953_100000210320 [0,0,0,0,0,0|2,0,1]=3 298 B14R0.392 C#CCCSCCCCCCCCCO 62a_100000688953_100009813782 [0,0,0,0,0,0|3,0,1]=4 299 B14R0.392 C#CCCSCCCCCCCCCO 62a_100009813782_100000688953 [0,0,0,0,0,0|3,0,1]=4 300 B14R0.392 C#CCNCCCCCCCCCC=C 2230a_100000081888_100000038162 [0,0,0,0,0,0|2,0,2]=4 301 B14R0.392 C#CCNCCCCCCCCCC=C 34a_100000081888_100000184674 [0,0,0,0,0,0|2,0,2]=4 302 B14R0.392 C#CCNCCCCCCCCCC=C 34a_100000212058_100009814027 [0,0,0,0,0,0|2,0,2]=4 303 B14R0.392 C#CCNCCCCCCCCCCC 2230a_200011215754_100000038162 [0,0,0,0,0,0|2,0,1]=3 304 B14R0.392 C#CCNCCCCCCCCCCC 34a_100000212058_100011215454 [0,0,0,0,0,0|2,0,1]=3 305 B14R0.392 C#CCNCCCCCCCCCCC 34a_200011215754_100000184674 [0,0,0,0,0,0|2,0,1]=3 306 B14R0.392 C#CCNCCCCCCCCCCO 2230a_100000066964_100000038162 [0,0,0,0,0,0|3,0,1]=4 307 B14R0.392 C#CCNCCCCCCCCCCO 34a_100000066964_100000184674 [0,0,0,0,0,0|3,0,1]=4 308 B14R0.392 C#CCNCCCCCCCCCCO 34a_100000212058_100009813290 [0,0,0,0,0,0|3,0,1]=4 309 B14R0.392 C#CCOCCCCCCCCCC=C 34a_100000038209_100000184674 [0,0,0,0,0,0|2,0,2]=4 310 B14R0.392 C#CCOCCCCCCCCCC=C 34a_100000210247_100009814027 [0,0,0,0,0,0|2,0,2]=4 311 B14R0.392 C#CCOCCCCCCCCCC=C 7a_100000038209_100000038162 [0,0,0,0,0,0|2,0,2]=4 312 B14R0.392 C#CCOCCCCCCCCCCBr 34a_100009813290_100000184674 [0,0,0,0,0,0|3,0,1]=4 313 B14R0.392 C#CCOCCCCCCCCCCBr 7a_100009813290_100000038162 [0,0,0,0,0,0|3,0,1]=4 314 B14R0.392 C#CCOCCCCCCCCCCC 34a_100000210247_100011215454 [0,0,0,0,0,0|2,0,1]=3 315 B14R0.392 C#CCOCCCCCCCCCCC 34a_100000210809_100000184674 [0,0,0,0,0,0|2,0,1]=3 316 B14R0.392 C#CCOCCCCCCCCCCC 7a_100000210809_100000038162 [0,0,0,0,0,0|2,0,1]=3 317 B14R0.392 C#CCOCCCCCCCCCCCl 34a_200000033068_100000184674 [0,0,0,0,0,0|3,0,1]=4 318 B14R0.392 C#CCOCCCCCCCCCCCl 7a_200000033068_100000038162 [0,0,0,0,0,0|3,0,1]=4 319 B14R0.392 C#CCOCCCCCCCCCCN 34a_100000066964_100000184674 [0,0,0,0,0,0|3,0,1]=4 320 B14R0.392 C#CCOCCCCCCCCCCO 34a_100000210247_100009813290 [0,0,0,0,0,0|3,0,1]=4 321 B14R0.392 C#CCOCCCCCCOCCCC 34a_200011021349_100000210210 [0,0,0,0,0,0|3,0,1]=4 322 B14R0.392 C#CCOCCCCCCOCCCC 7a_200011021349_100000210211 [0,0,0,0,0,0|3,0,1]=4 323 B14R0.392 C#CCOCCNCCCCCCCC 2230a_100000229939_100010402529 [0,0,0,0,0,0|3,0,1]=4 324 B14R0.392 C#CCOCCNCCCCCCCC 2230a_100000700922_100000210759 [0,0,0,0,0,0|3,0,1]=4 325 B14R0.392 C#CCOCCNCCCCCCCC 34a_100000229939_100010402529 [0,0,0,0,0,0|3,0,1]=4 326 B14R0.392 C#CCOCCNCCCCCCCC 34a_100000700922_100000210759 [0,0,0,0,0,0|3,0,1]=4 327 B14R0.392 C#CCOCCOCCCCCCCC 34a_100000054580_100000210759 [0,0,0,0,0,0|3,0,1]=4 328 B14R0.392 C#CCOCCOCCCCCCCC 34a_100000210232_100010402529 [0,0,0,0,0,0|3,0,1]=4 329 B14R0.392 C#CCOCCOCCCCCCCC 7a_100000054580_100000210759 [0,0,0,0,0,0|3,0,1]=4 330 B14R0.392 C#CCOCCOCCCCCCCC 7a_100000210232_100010402529 [0,0,0,0,0,0|3,0,1]=4 331 B14R0.392 C#CCOCCSCCCCCCCC 62a_100000210759_100010402529 [0,0,0,0,0,0|3,0,1]=4 332 B14R0.392 C#CCOCCSCCCCCCCC 62a_100010402529_100000210317 [0,0,0,0,0,0|3,0,1]=4 333 B14R0.392 C#CCSCCCCCCCCCC=C 62a_100000038162_100009814027 [0,0,0,0,0,0|2,0,2]=4 334 B14R0.392 C#CCSCCCCCCCCCCC 62a_100000038162_100011215454 [0,0,0,0,0,0|2,0,1]=3 335 B14R0.392 C#CCSCCCCCCCCCCO 62a_100000038162_200000033068 [0,0,0,0,0,0|3,0,1]=4 336 B14R0.392 C/C=C/CCOCCCCCCCCC 34a_100016278192_100011214924 [0,0,0,0,0,0|2,0,1]=3 337 B14R0.392 C/C=C/CCOCCCCCCCCO 34a_100016278192_100000033203 [0,0,0,0,0,0|3,0,1]=4 338 B14R0.392 C/C=C/CNCCCCCCCCCC 34a_100000684558_100102629194 [0,0,0,0,0,0|2,0,1]=3 339 B14R0.392 C/C=C/CNCCCCCCCCCO 34a_100000078944_100102629194 [0,0,0,0,0,0|3,0,1]=4 340 B14R0.392 C/C=C/COCCCCCCCCCBr 34a_100009813782_100102629194 [0,0,0,0,0,0|3,0,1]=4 341 B14R0.392 C/C=C/COCCCCCCCCCBr 7a_100009813782_100102629194 [0,0,0,0,0,0|3,0,1]=4 342 B14R0.392 C/C=C/COCCCCCCCCCC 34a_100000210711_100102629194 [0,0,0,0,0,0|2,0,1]=3 343 B14R0.392 C/C=C/COCCCCCCCCCC 34a_100016270725_100000210320 [0,0,0,0,0,0|2,0,1]=3 344 B14R0.392 C/C=C/COCCCCCCCCCC 7a_100000210711_100102629194 [0,0,0,0,0,0|2,0,1]=3 345 B14R0.392 C/C=C/COCCCCCCCCCCl 34a_100009868337_100102629194 [0,0,0,0,0,0|3,0,1]=4 346 B14R0.392 C/C=C/COCCCCCCCCCCl 7a_100009868337_100102629194 [0,0,0,0,0,0|3,0,1]=4 347 B14R0.392 C/C=C/COCCCCCCCCCN 34a_100000078944_100102629194 [0,0,0,0,0,0|3,0,1]=4 348 B14R0.392 C/C=C/COCCCCCCCCCO 34a_100016270725_100009813782 [0,0,0,0,0,0|3,0,1]=4 349 B14R0.392 C/C=C/CSCCCCCCCCCC 62a_100102629194_100000210320 [0,0,0,0,0,0|2,0,1]=3 350 B14R0.392 C/C=C/CSCCCCCCCCCO 62a_100009813782_100102629194 [0,0,0,0,0,0|3,0,1]=4 351 B14R0.392 C/C=C/CSCCCCCCCCCO 62a_100102629194_100009813782 [0,0,0,0,0,0|3,0,1]=4 352 B14R0.392 C=CCCC/C=C/COCCCCCC 34a_200016268473_100000210314 [0,0,0,0,0,0|2,0,2]=4 353 B14R0.392 C=CCCC/C=C/COCCCCCC 7a_200016268473_100000210314 [0,0,0,0,0,0|2,0,2]=4 354 B14R0.392 C=CCCCCCCCCC=NNCC 4a_100000756455_100000039675 [0,0,0,0,0,0|3,0,1]=4 355 B14R0.392 C=CCCCCCCCCCCCNC 2230a_106832991635_102130925996 [0,0,0,0,0,0|2,0,0]=2 356 B14R0.392 C=CCCCCCCCCCCCNC 34a_100102657272_102130925996 [0,0,0,0,0,0|2,0,0]=2 357 B14R0.392 C=CCCCCCCCCCCCNC 7a_106832991635_102130925996 [0,0,0,0,0,0|2,0,0]=2 358 B14R0.392 C=CCCCCCCCCCCCOC 34a_100138415774_102130925996 [0,0,0,0,0,0|2,0,0]=2 359 B14R0.392 C=CCCCCCCCCCCCSC 62a_102130925996_200000210301 [0,0,0,0,0,0|2,0,0]=2 360 B14R0.392 C=CCCCCCCCCCCCSC 62a_200000210301_102130925996 [0,0,0,0,0,0|2,0,0]=2 361 B14R0.392 C=CCCCCCCCCCCCS[13CH3] 62a_102130925996_200025704644 [0,0,0,0,0,0|2,0,0]=2 362 B14R0.392 C=CCCCCCCCCCCCS[13CH3] 62a_200025704644_102130925996 [0,0,0,0,0,0|2,0,0]=2 363 B14R0.392 C=CCCCCCCCCCCNCC 2230a_100015525214_100011093070 [0,0,0,0,0,0|2,0,0]=2 364 B14R0.392 C=CCCCCCCCCCCOCC 34a_100121572206_100011093070 [0,0,0,0,0,0|2,0,0]=2 365 B14R0.392 C=CCCCCCCCCCCSCC 62a_100000210202_100011093070 [0,0,0,0,0,0|2,0,0]=2 366 B14R0.392 C=CCCCCCCCCCCSCC 62a_100011093070_100000210202 [0,0,0,0,0,0|2,0,0]=2 367 B14R0.392 C=CCCCCCCCCCCSCF 62a_100011093070_100015361967 [0,0,0,0,0,0|3,0,0]=3 368 B14R0.392 C=CCCCCCCCCCCSCF 62a_100015361967_100011093070 [0,0,0,0,0,0|3,0,0]=3 369 B14R0.392 C=CCCCCCCCCCNCC#N 2230a_100000081888_100011215382 [0,0,0,0,0,0|3,0,1]=4 370 B14R0.392 C=CCCCCCCCCCNCC=C 2230a_100000081888_100000210623 [0,0,0,0,0,0|2,0,2]=4 371 B14R0.392 C=CCCCCCCCCCNCC=C 2230a_100020586998_100009814027 [0,0,0,0,0,0|2,0,2]=4 372 B14R0.392 C=CCCCCCCCCCNCC=C 34a_100000081888_100015514636 [0,0,0,0,0,0|2,0,2]=4 373 B14R0.392 C=CCCCCCCCCCNCC=O 2230a_100000081888_200015260668 [0,0,0,0,0,0|1,0,2]=3 374 B14R0.392 C=CCCCCCCCCCNCC=O 34a_100000081888_200009817547 [0,0,0,0,0,0|1,0,2]=3 375 B14R0.392 C=CCCCCCCCCCNCCC 2230a_100000081888_100000210303 [0,0,0,0,0,0|2,0,0]=2 376 B14R0.392 C=CCCCCCCCCCNCCC 34a_100000081888_100000210303 [0,0,0,0,0,0|2,0,0]=2 377 B14R0.392 C=CCCCCCCCCCNCCF 2230a_100000081888_100011217306 [0,0,0,0,0,0|3,0,0]=3 378 B14R0.392 C=CCCCCCCCCCNCCF 34a_100000081888_100011217306 [0,0,0,0,0,0|3,0,0]=3 379 B14R0.392 C=CCCCCCCCCCNCCF 34a_100000724931_100009814027 [0,0,0,0,0,0|3,0,0]=3 380 B14R0.392 C=CCCCCCCCCCNCCO 2230a_100000081888_100000211926 [0,0,0,0,0,0|3,0,0]=3 381 B14R0.392 C=CCCCCCCCCCNCCO 2230a_100016997473_100009814027 [0,0,0,0,0,0|3,0,0]=3 382 B14R0.392 C=CCCCCCCCCCNCCO 34a_100000081888_100000211926 [0,0,0,0,0,0|3,0,0]=3 383 B14R0.392 C=CCCCCCCCCCNCCO 34a_100016990907_100009814027 [0,0,0,0,0,0|3,0,0]=3 384 B14R0.392 C=CCCCCCCCCCNCOC 2230a_100000081888_100000766300 [0,0,0,0,0,0|3,0,0]=3 385 B14R0.392 C=CCCCCCCCCCNCSC 2230a_100000081888_100011218213 [0,0,0,0,0,0|3,0,0]=3 386 B14R0.392 C=CCCCCCCCCCNCSC 34a_100000081888_100011218213 [0,0,0,0,0,0|3,0,0]=3 387 B14R0.392 C=CCCCCCCCCCOCC#N 7a_100000038209_100011215382 [0,0,0,0,0,0|3,0,1]=4 388 B14R0.392 C=CCCCCCCCCCOCC=C 34a_100000038209_100015514636 [0,0,0,0,0,0|2,0,2]=4 389 B14R0.392 C=CCCCCCCCCCOCC=C 34a_200000210373_100009814027 [0,0,0,0,0,0|2,0,2]=4 390 B14R0.392 C=CCCCCCCCCCOCC=C 7a_100000038209_100015514636 [0,0,0,0,0,0|2,0,2]=4 391 B14R0.392 C=CCCCCCCCCCOCC=O 34a_100000038209_200009817547 [0,0,0,0,0,0|1,0,2]=3 392 B14R0.392 C=CCCCCCCCCCOCC=O 7a_100000038209_200015260668 [0,0,0,0,0,0|1,0,2]=3 393 B14R0.392 C=CCCCCCCCCCOCCBr 34a_100000211926_100009814027 [0,0,0,0,0,0|3,0,0]=3 394 B14R0.392 C=CCCCCCCCCCOCCC 34a_100000038209_100000210303 [0,0,0,0,0,0|2,0,0]=2 395 B14R0.392 C=CCCCCCCCCCOCCC 34a_100000210258_100009814027 [0,0,0,0,0,0|2,0,0]=2 396 B14R0.392 C=CCCCCCCCCCOCCC 7a_100000038209_100000210303 [0,0,0,0,0,0|2,0,0]=2 397 B14R0.392 C=CCCCCCCCCCOCCF 34a_100000038209_100011217306 [0,0,0,0,0,0|3,0,0]=3 398 B14R0.392 C=CCCCCCCCCCOCCF 7a_100000038209_100011217306 [0,0,0,0,0,0|3,0,0]=3 399 B14R0.392 C=CCCCCCCCCCOCCN 34a_100000210304_100009814027 [0,0,0,0,0,0|3,0,0]=3 400 B14R0.392 C=CCCCCCCCCCOCCO 34a_100000038209_100000211926 [0,0,0,0,0,0|3,0,0]=3 401 B14R0.392 C=CCCCCCCCCCOCCO 7a_100000038209_100000211926 [0,0,0,0,0,0|3,0,0]=3 402 B14R0.392 C=CCCCCCCCCCOCSC 34a_100000038209_100011218213 [0,0,0,0,0,0|3,0,0]=3 403 B14R0.392 C=CCCCCCCCCCSCC#N 62a_100009814027_100011215382 [0,0,0,0,0,0|3,0,1]=4 404 B14R0.392 C=CCCCCCCCCCSCC#N 62a_100011215382_100009814027 [0,0,0,0,0,0|3,0,1]=4 405 B14R0.392 C=CCCCCCCCCCSCC=C 62a_100000210623_100009814027 [0,0,0,0,0,0|2,0,2]=4 406 B14R0.392 C=CCCCCCCCCCSCC=C 62a_100009814027_100000210623 [0,0,0,0,0,0|2,0,2]=4 407 B14R0.392 C=CCCCCCCCCCSCC=O 62a_100009814027_200015260668 [0,0,0,0,0,0|1,0,2]=3 408 B14R0.392 C=CCCCCCCCCCSCC=O 62a_200015260668_100009814027 [0,0,0,0,0,0|1,0,2]=3 409 B14R0.392 C=CCCCCCCCCCSCCC 62a_100000210303_100009814027 [0,0,0,0,0,0|2,0,0]=2 410 B14R0.392 C=CCCCCCCCCCSCCC 62a_100009814027_100000210303 [0,0,0,0,0,0|2,0,0]=2 411 B14R0.392 C=CCCCCCCCCCSCCF 62a_100009814027_100011217306 [0,0,0,0,0,0|3,0,0]=3 412 B14R0.392 C=CCCCCCCCCCSCCF 62a_100011217306_100009814027 [0,0,0,0,0,0|3,0,0]=3 413 B14R0.392 C=CCCCCCCCCCSCCO 62a_100000211926_100009814027 [0,0,0,0,0,0|3,0,0]=3 414 B14R0.392 C=CCCCCCCCCCSCCO 62a_100009814027_100000211926 [0,0,0,0,0,0|3,0,0]=3 415 B14R0.392 C=CCCCCCCCCCSCOC 62a_100000766300_100009814027 [0,0,0,0,0,0|3,0,0]=3 416 B14R0.392 C=CCCCCCCCCCSCOC 62a_100009814027_100000766300 [0,0,0,0,0,0|3,0,0]=3 417 B14R0.392 C=CCCCCCCCCCSCSC 62a_100009814027_100011218213 [0,0,0,0,0,0|3,0,0]=3 418 B14R0.392 C=CCCCCCCCCCSCSC 62a_100011218213_100009814027 [0,0,0,0,0,0|3,0,0]=3 419 B14R0.392 C=CCCCCCCCCNCC#CC 2230a_100000685387_100011933949 [0,0,0,0,0,0|2,0,2]=4 420 B14R0.392 C=CCCCCCCCCNCC#CC 34a_100000685387_100011933949 [0,0,0,0,0,0|2,0,2]=4 421 B14R0.392 C=CCCCCCCCCNCCC=C 2230a_100015191253_100011933949 [0,0,0,0,0,0|2,0,2]=4 422 B14R0.392 C=CCCCCCCCCNCCCC 2230a_100000102301_100011933949 [0,0,0,0,0,0|2,0,0]=2 423 B14R0.392 C=CCCCCCCCCNCCCC 7a_106832991798_100011933949 [0,0,0,0,0,0|2,0,0]=2 424 B14R0.392 C=CCCCCCCCCNCCCF 2230a_100015189416_100011933949 [0,0,0,0,0,0|3,0,0]=3 425 B14R0.392 C=CCCCCCCCCNCCCF 34a_100015189416_100011933949 [0,0,0,0,0,0|3,0,0]=3 426 B14R0.392 C=CCCCCCCCCNCCOC 2230a_100000209980_100011933949 [0,0,0,0,0,0|3,0,0]=3 427 B14R0.392 C=CCCCCCCCCNCCSC 2230a_100020590264_100011933949 [0,0,0,0,0,0|3,0,0]=3 428 B14R0.392 C=CCCCCCCCCOC/C=C/C 34a_100011215194_100102629194 [0,0,0,0,0,0|2,0,2]=4 429 B14R0.392 C=CCCCCCCCCOC/C=C/C 34a_100016270725_100011933949 [0,0,0,0,0,0|2,0,2]=4 430 B14R0.392 C=CCCCCCCCCOC/C=C/C 7a_100011215194_100102629194 [0,0,0,0,0,0|2,0,2]=4 431 B14R0.392 C=CCCCCCCCCOCC#CC 34a_100000761923_100011933949 [0,0,0,0,0,0|2,0,2]=4 432 B14R0.392 C=CCCCCCCCCOCC#CC 34a_100011215194_100000748600 [0,0,0,0,0,0|2,0,2]=4 433 B14R0.392 C=CCCCCCCCCOCC#CC 7a_100011215194_100000748600 [0,0,0,0,0,0|2,0,2]=4 434 B14R0.392 C=CCCCCCCCCOCC=CC 34a_100011215194_100000070051 [0,0,0,0,0,0|2,0,2]=4 435 B14R0.392 C=CCCCCCCCCOCC=CC 7a_100011215194_100000070051 [0,0,0,0,0,0|2,0,2]=4 436 B14R0.392 C=CCCCCCCCCOCCC#N 7a_100011215194_100000184422 [0,0,0,0,0,0|3,0,1]=4 437 B14R0.392 C=CCCCCCCCCOCCC=C 34a_100011205117_100011933949 [0,0,0,0,0,0|2,0,2]=4 438 B14R0.392 C=CCCCCCCCCOCCC=C 34a_100011215194_100000754431 [0,0,0,0,0,0|2,0,2]=4 439 B14R0.392 C=CCCCCCCCCOCCC=C 7a_100011215194_100000754431 [0,0,0,0,0,0|2,0,2]=4 440 B14R0.392 C=CCCCCCCCCOCCCBr 34a_100011217188_100011933949 [0,0,0,0,0,0|3,0,0]=3 441 B14R0.392 C=CCCCCCCCCOCCCC 34a_100000210227_100011933949 [0,0,0,0,0,0|2,0,0]=2 442 B14R0.392 C=CCCCCCCCCOCCCC 34a_100011215194_100000210210 [0,0,0,0,0,0|2,0,0]=2 443 B14R0.392 C=CCCCCCCCCOCCCC 7a_100000210227_100011933949 [0,0,0,0,0,0|2,0,0]=2 444 B14R0.392 C=CCCCCCCCCOCCCC 7a_100011215194_100000210211 [0,0,0,0,0,0|2,0,0]=2 445 B14R0.392 C=CCCCCCCCCOCCCCl 34a_100000230001_100011933949 [0,0,0,0,0,0|3,0,0]=3 446 B14R0.392 C=CCCCCCCCCOCCCF 34a_100000759539_100011933949 [0,0,0,0,0,0|3,0,0]=3 447 B14R0.392 C=CCCCCCCCCOCCCF 34a_100011215194_100011934791 [0,0,0,0,0,0|3,0,0]=3 448 B14R0.392 C=CCCCCCCCCOCCCF 7a_100011215194_100011934791 [0,0,0,0,0,0|3,0,0]=3 449 B14R0.392 C=CCCCCCCCCOCCCN 34a_100000182051_100011933949 [0,0,0,0,0,0|3,0,0]=3 450 B14R0.392 C=CCCCCCCCCOCCCO 34a_100011215194_100000230001 [0,0,0,0,0,0|3,0,0]=3 451 B14R0.392 C=CCCCCCCCCOCCCO 7a_100011215194_100011215043 [0,0,0,0,0,0|3,0,0]=3 452 B14R0.392 C=CCCCCCCCCOCCOC 34a_100000210237_100011933949 [0,0,0,0,0,0|3,0,0]=3 453 B14R0.392 C=CCCCCCCCCOCCOC 34a_100011215194_100011201679 [0,0,0,0,0,0|3,0,0]=3 454 B14R0.392 C=CCCCCCCCCOCCOC 7a_100011215194_100000233755 [0,0,0,0,0,0|3,0,0]=3 455 B14R0.392 C=CCCCCCCCCOCCON 34a_100000700252_100011933949 [0,0,0,0,0,0|4,0,0]=4 456 B14R0.392 C=CCCCCCCCCOCCSC 34a_100000230434_100011933949 [0,0,0,0,0,0|3,0,0]=3 457 B14R0.392 C=CCCCCCCCCOCCSC 34a_100011215194_100000212216 [0,0,0,0,0,0|3,0,0]=3 458 B14R0.392 C=CCCCCCCCCOCCSC 7a_100000230434_100011933949 [0,0,0,0,0,0|3,0,0]=3 459 B14R0.392 C=CCCCCCCCCOCCSC 7a_100011215194_100000212216 [0,0,0,0,0,0|3,0,0]=3 460 B14R0.392 C=CCCCCCCCCSC/C=C/C 62a_100011933949_100102629194 [0,0,0,0,0,0|2,0,2]=4 461 B14R0.392 C=CCCCCCCCCSC/C=C/C 62a_100102629194_100011933949 [0,0,0,0,0,0|2,0,2]=4 462 B14R0.392 C=CCCCCCCCCSCC#CC 62a_100000748600_100011933949 [0,0,0,0,0,0|2,0,2]=4 463 B14R0.392 C=CCCCCCCCCSCC#CC 62a_100011933949_100000748600 [0,0,0,0,0,0|2,0,2]=4 464 B14R0.392 C=CCCCCCCCCSCC=CC 62a_100000070051_100011933949 [0,0,0,0,0,0|2,0,2]=4 465 B14R0.392 C=CCCCCCCCCSCC=CC 62a_100011933949_100000070051 [0,0,0,0,0,0|2,0,2]=4 466 B14R0.392 C=CCCCCCCCCSCCC#N 62a_100011215226_100011933949 [0,0,0,0,0,0|3,0,1]=4 467 B14R0.392 C=CCCCCCCCCSCCC#N 62a_100011933949_100011215226 [0,0,0,0,0,0|3,0,1]=4 468 B14R0.392 C=CCCCCCCCCSCCC=C 62a_100000754431_100011933949 [0,0,0,0,0,0|2,0,2]=4 469 B14R0.392 C=CCCCCCCCCSCCC=C 62a_100011933949_100000754431 [0,0,0,0,0,0|2,0,2]=4 470 B14R0.392 C=CCCCCCCCCSCCCC 62a_100000210211_100011933949 [0,0,0,0,0,0|2,0,0]=2 471 B14R0.392 C=CCCCCCCCCSCCCC 62a_100011933949_100000210210 [0,0,0,0,0,0|2,0,0]=2 472 B14R0.392 C=CCCCCCCCCSCCCF 62a_100011933949_100011934791 [0,0,0,0,0,0|3,0,0]=3 473 B14R0.392 C=CCCCCCCCCSCCCF 62a_100011934791_100011933949 [0,0,0,0,0,0|3,0,0]=3 474 B14R0.392 C=CCCCCCCCCSCCCO 62a_100011215043_100011933949 [0,0,0,0,0,0|3,0,0]=3 475 B14R0.392 C=CCCCCCCCCSCCCO 62a_100011933949_100011215043 [0,0,0,0,0,0|3,0,0]=3 476 B14R0.392 C=CCCCCCCCCSCCOC 62a_100000233755_100011933949 [0,0,0,0,0,0|3,0,0]=3 477 B14R0.392 C=CCCCCCCCCSCCOC 62a_100011933949_100000233755 [0,0,0,0,0,0|3,0,0]=3 478 B14R0.392 C=CCCCCCCCCSCCSC 62a_100000212216_100011933949 [0,0,0,0,0,0|3,0,0]=3 479 B14R0.392 C=CCCCCCCCCSCCSC 62a_100011933949_100000751147 [0,0,0,0,0,0|3,0,0]=3 480 B14R0.392 C=CCCCCCCCCSCOCC 62a_100000739092_100011933949 [0,0,0,0,0,0|3,0,0]=3 481 B14R0.392 C=CCCCCCCCCSCOCC 62a_100011933949_100000739092 [0,0,0,0,0,0|3,0,0]=3 482 B14R0.392 C=CCCCCCCCNCCCC=C 2230a_100000700776_100012355270 [0,0,0,0,0,0|2,0,2]=4 483 B14R0.392 C=CCCCCCCCNCCCC=C 34a_100000700776_100012355270 [0,0,0,0,0,0|2,0,2]=4 484 B14R0.392 C=CCCCCCCCNCCCCC 2230a_100000209983_100012355270 [0,0,0,0,0,0|2,0,0]=2 485 B14R0.392 C=CCCCCCCCNCCCCO 2230a_100000750430_100012355270 [0,0,0,0,0,0|3,0,0]=3 486 B14R0.392 C=CCCCCCCCNCCCCO 34a_100000750430_100012355270 [0,0,0,0,0,0|3,0,0]=3 487 B14R0.392 C=CCCCCCCCNCCCOC 34a_100150723488_100012355270 [0,0,0,0,0,0|3,0,0]=3 488 B14R0.392 C=CCCCCCCCNCCCSC 2230a_100000749238_100012355270 [0,0,0,0,0,0|3,0,0]=3 489 B14R0.392 C=CCCCCCCCNCCOCC 2230a_102516460346_100012355270 [0,0,0,0,0,0|3,0,0]=3 490 B14R0.392 C=CCCCCCCCNCCOCC 34a_102516460346_100012355270 [0,0,0,0,0,0|3,0,0]=3 491 B14R0.392 C=CCCCCCCCNCCSCC 2230a_100000106463_100012355270 [0,0,0,0,0,0|3,0,0]=3 492 B14R0.392 C=CCCCCCCCOC/C=C\CC 34a_100000730831_100103147603 [0,0,0,0,0,0|2,0,2]=4 493 B14R0.392 C=CCCCCCCCOC/C=C\CC 34a_100016268518_100012355270 [0,0,0,0,0,0|2,0,2]=4 494 B14R0.392 C=CCCCCCCCOC/C=C\CC 7a_100000730831_100103147603 [0,0,0,0,0,0|2,0,2]=4 495 B14R0.392 C=CCCCCCCCOCC#CCC 34a_100000032950_100012355270 [0,0,0,0,0,0|2,0,2]=4 496 B14R0.392 C=CCCCCCCCOCC#CCC 34a_100000730831_100009813939 [0,0,0,0,0,0|2,0,2]=4 497 B14R0.392 C=CCCCCCCCOCC#CCC 7a_100000730831_100009813939 [0,0,0,0,0,0|2,0,2]=4 498 B14R0.392 C=CCCCCCCCOCC/C=C/C 34a_100016278192_100012355270 [0,0,0,0,0,0|2,0,2]=4 499 B14R0.392 C=CCCCCCCCOCCC#CC 34a_100000750427_100012355270 [0,0,0,0,0,0|2,0,2]=4 500 B14R0.392 C=CCCCCCCCOCCCC#N 7a_100000730831_100000687738 [0,0,0,0,0,0|3,0,1]=4 501 B14R0.392 C=CCCCCCCCOCCCC=C 34a_100000730831_100000757094 [0,0,0,0,0,0|2,0,2]=4 502 B14R0.392 C=CCCCCCCCOCCCC=C 34a_100000758997_100012355270 [0,0,0,0,0,0|2,0,2]=4 503 B14R0.392 C=CCCCCCCCOCCCC=C 7a_100000730831_100000757094 [0,0,0,0,0,0|2,0,2]=4 504 B14R0.392 C=CCCCCCCCOCCCC=C 7a_100000758997_100012355270 [0,0,0,0,0,0|2,0,2]=4 505 B14R0.392 C=CCCCCCCCOCCCC=O 7a_100000730831_200011292268 [0,0,0,0,0,0|1,0,2]=3 506 B14R0.392 C=CCCCCCCCOCCCCBr 34a_100011216708_100012355270 [0,0,0,0,0,0|3,0,0]=3 507 B14R0.392 C=CCCCCCCCOCCCCC 34a_100000210253_100012355270 [0,0,0,0,0,0|2,0,0]=2 508 B14R0.392 C=CCCCCCCCOCCCCC 34a_100000730831_100000718602 [0,0,0,0,0,0|2,0,0]=2 509 B14R0.392 C=CCCCCCCCOCCCCC 7a_100000210253_100012355270 [0,0,0,0,0,0|2,0,0]=2 510 B14R0.392 C=CCCCCCCCOCCCCC 7a_100000730831_100000210326 [0,0,0,0,0,0|2,0,0]=2 511 B14R0.392 C=CCCCCCCCOCCCCCl 34a_100000210776_100012355270 [0,0,0,0,0,0|3,0,0]=3 512 B14R0.392 C=CCCCCCCCOCCCCCl 7a_100000210776_100012355270 [0,0,0,0,0,0|3,0,0]=3 513 B14R0.392 C=CCCCCCCCOCCCCF 34a_100000730831_100000729493 [0,0,0,0,0,0|3,0,0]=3 514 B14R0.392 C=CCCCCCCCOCCCCF 34a_100011995726_100012355270 [0,0,0,0,0,0|3,0,0]=3 515 B14R0.392 C=CCCCCCCCOCCCCF 7a_100000730831_100000729493 [0,0,0,0,0,0|3,0,0]=3 516 B14R0.392 C=CCCCCCCCOCCCCF 7a_100011995726_100012355270 [0,0,0,0,0,0|3,0,0]=3 517 B14R0.392 C=CCCCCCCCOCCCCI 34a_200012148704_100012355270 [0,0,0,0,0,0|3,0,0]=3 518 B14R0.392 C=CCCCCCCCOCCCCN 34a_100000750430_100012355270 [0,0,0,0,0,0|3,0,0]=3 519 B14R0.392 C=CCCCCCCCOCCCCO 34a_100000730831_100011216708 [0,0,0,0,0,0|3,0,0]=3 520 B14R0.392 C=CCCCCCCCOCCCCO 7a_100000730831_100000210776 [0,0,0,0,0,0|3,0,0]=3 521 B14R0.392 C=CCCCCCCCOCCCNC 34a_100000213112_100012355270 [0,0,0,0,0,0|3,0,0]=3 522 B14R0.392 C=CCCCCCCCOCCCOC 34a_100000730831_100000740836 [0,0,0,0,0,0|3,0,0]=3 523 B14R0.392 C=CCCCCCCCOCCCOC 34a_100000740835_100012355270 [0,0,0,0,0,0|3,0,0]=3 524 B14R0.392 C=CCCCCCCCOCCCOC 7a_100000730831_100000740836 [0,0,0,0,0,0|3,0,0]=3 525 B14R0.392 C=CCCCCCCCOCCCSC 34a_100000690336_100012355270 [0,0,0,0,0,0|3,0,0]=3 526 B14R0.392 C=CCCCCCCCOCCCSC 7a_100000690336_100012355270 [0,0,0,0,0,0|3,0,0]=3 527 B14R0.392 C=CCCCCCCCOCCOCC 34a_100000210136_100012355270 [0,0,0,0,0,0|3,0,0]=3 528 B14R0.392 C=CCCCCCCCOCCOCC 34a_100000730831_100000210147 [0,0,0,0,0,0|3,0,0]=3 529 B14R0.392 C=CCCCCCCCOCCOCC 7a_100000210136_100012355270 [0,0,0,0,0,0|3,0,0]=3 530 B14R0.392 C=CCCCCCCCOCCOCC 7a_100000730831_100011215890 [0,0,0,0,0,0|3,0,0]=3 531 B14R0.392 C=CCCCCCCCOCCSCC 34a_100000212035_100012355270 [0,0,0,0,0,0|3,0,0]=3 532 B14R0.392 C=CCCCCCCCOCCSCC 34a_100000730831_100000757381 [0,0,0,0,0,0|3,0,0]=3 533 B14R0.392 C=CCCCCCCCOCCSCC 7a_100000212035_100012355270 [0,0,0,0,0,0|3,0,0]=3 534 B14R0.392 C=CCCCCCCCOCCSCC 7a_100000730831_100000757381 [0,0,0,0,0,0|3,0,0]=3 535 B14R0.392 C=CCCCCCCCSC/C=C\CC 62a_100012355270_100103147603 [0,0,0,0,0,0|2,0,2]=4 536 B14R0.392 C=CCCCCCCCSC/C=C\CC 62a_100103147603_100012355270 [0,0,0,0,0,0|2,0,2]=4 537 B14R0.392 C=CCCCCCCCSCC#CCC 62a_100009813939_100012355270 [0,0,0,0,0,0|2,0,2]=4 538 B14R0.392 C=CCCCCCCCSCC#CCC 62a_100012355270_100009813939 [0,0,0,0,0,0|2,0,2]=4 539 B14R0.392 C=CCCCCCCCSCCCC#N 62a_100000687738_100012355270 [0,0,0,0,0,0|3,0,1]=4 540 B14R0.392 C=CCCCCCCCSCCCC#N 62a_100012355270_100000687738 [0,0,0,0,0,0|3,0,1]=4 541 B14R0.392 C=CCCCCCCCSCCCC=C 62a_100011713584_100012355270 [0,0,0,0,0,0|2,0,2]=4 542 B14R0.392 C=CCCCCCCCSCCCC=C 62a_100012355270_100000757094 [0,0,0,0,0,0|2,0,2]=4 543 B14R0.392 C=CCCCCCCCSCCCC=O 62a_100012355270_200011292268 [0,0,0,0,0,0|1,0,2]=3 544 B14R0.392 C=CCCCCCCCSCCCC=O 62a_200011292268_100012355270 [0,0,0,0,0,0|1,0,2]=3 545 B14R0.392 C=CCCCCCCCSCCCCC 62a_100000210326_100012355270 [0,0,0,0,0,0|2,0,0]=2 546 B14R0.392 C=CCCCCCCCSCCCCC 62a_100012355270_100000210326 [0,0,0,0,0,0|2,0,0]=2 547 B14R0.392 C=CCCCCCCCSCCCCF 62a_100000729493_100012355270 [0,0,0,0,0,0|3,0,0]=3 548 B14R0.392 C=CCCCCCCCSCCCCF 62a_100012355270_100000729493 [0,0,0,0,0,0|3,0,0]=3 549 B14R0.392 C=CCCCCCCCSCCCCO 62a_100000210776_100012355270 [0,0,0,0,0,0|3,0,0]=3 550 B14R0.392 C=CCCCCCCCSCCCCO 62a_100012355270_100000210776 [0,0,0,0,0,0|3,0,0]=3 551 B14R0.392 C=CCCCCCCCSCCCOC 62a_100000709357_100012355270 [0,0,0,0,0,0|3,0,0]=3 552 B14R0.392 C=CCCCCCCCSCCCOC 62a_100012355270_100000709357 [0,0,0,0,0,0|3,0,0]=3 553 B14R0.392 C=CCCCCCCCSCCOCC 62a_100000210147_100012355270 [0,0,0,0,0,0|3,0,0]=3 554 B14R0.392 C=CCCCCCCCSCCOCC 62a_100012355270_100011215890 [0,0,0,0,0,0|3,0,0]=3 555 B14R0.392 C=CCCCCCCCSCCSCC 62a_100000757381_100012355270 [0,0,0,0,0,0|3,0,0]=3 556 B14R0.392 C=CCCCCCCCSCCSCC 62a_100012355270_100000757381 [0,0,0,0,0,0|3,0,0]=3 557 B14R0.392 C=CCCCCCCNCCCCC=C 2230a_100000703577_100011215473 [0,0,0,0,0,0|2,0,2]=4 558 B14R0.392 C=CCCCCCCNCCCCC=C 34a_100000703577_100011215473 [0,0,0,0,0,0|2,0,2]=4 559 B14R0.392 C=CCCCCCCNCCCCCC 2230a_100000210581_100011215473 [0,0,0,0,0,0|2,0,0]=2 560 B14R0.392 C=CCCCCCCNCCCCCO 2230a_100000762737_100011215473 [0,0,0,0,0,0|3,0,0]=3 561 B14R0.392 C=CCCCCCCNCCCCCO 34a_100000762737_100011215473 [0,0,0,0,0,0|3,0,0]=3 562 B14R0.392 C=CCCCCCCNCCCOCC 2230a_100000210961_100011215473 [0,0,0,0,0,0|3,0,0]=3 563 B14R0.392 C=CCCCCCCNCCCOCC 34a_100000210961_100011215473 [0,0,0,0,0,0|3,0,0]=3 564 B14R0.392 C=CCCCCCCNCCOCCC 2230a_100161115042_100011215473 [0,0,0,0,0,0|3,0,0]=3 565 B14R0.392 C=CCCCCCCNCCOCCC 34a_100161115042_100011215473 [0,0,0,0,0,0|3,0,0]=3 566 B14R0.392 C=CCCCCCCNCCOCCO 2230a_100000211614_100011215473 [0,0,0,0,0,0|4,0,0]=4 567 B14R0.392 C=CCCCCCCNCCOCCO 34a_100000211614_100011215473 [0,0,0,0,0,0|4,0,0]=4 568 B14R0.392 C=CCCCCCCNCCSCCC 2230a_100020603323_100011215473 [0,0,0,0,0,0|3,0,0]=3 569 B14R0.392 C=CCCCCCCNCCSCCO 2230a_100011219999_100011215473 [0,0,0,0,0,0|4,0,0]=4 570 B14R0.392 C=CCCCCCCOC/C=C/CCC 34a_100016278788_100011215473 [0,0,0,0,0,0|2,0,2]=4 571 B14R0.392 C=CCCCCCCOC/C=C/CCC 7a_100016278788_100011215473 [0,0,0,0,0,0|2,0,2]=4 572 B14R0.392 C=CCCCCCCOCC#CCCC 34a_100000034806_100011215473 [0,0,0,0,0,0|2,0,2]=4 573 B14R0.392 C=CCCCCCCOCC#CCCC 7a_100000034806_100011215473 [0,0,0,0,0,0|2,0,2]=4 574 B14R0.392 C=CCCCCCCOCC/C=C\CC 34a_100016288707_100011215473 [0,0,0,0,0,0|2,0,2]=4 575 B14R0.392 C=CCCCCCCOCC/C=C\CC 34a_200011216477_100015370543 [0,0,0,0,0,0|2,0,2]=4 576 B14R0.392 C=CCCCCCCOCC/C=C\CC 7a_100016288707_100011215473 [0,0,0,0,0,0|2,0,2]=4 577 B14R0.392 C=CCCCCCCOCC/C=C\CC 7a_200011216477_100015370543 [0,0,0,0,0,0|2,0,2]=4 578 B14R0.392 C=CCCCCCCOCCC#CCC 34a_100000036655_100011215473 [0,0,0,0,0,0|2,0,2]=4 579 B14R0.392 C=CCCCCCCOCCC#CCC 7a_100000036655_100011215473 [0,0,0,0,0,0|2,0,2]=4 580 B14R0.392 C=CCCCCCCOCCCC=CC 34a_100020645299_100011215473 [0,0,0,0,0,0|2,0,2]=4 581 B14R0.392 C=CCCCCCCOCCCCC#N 7a_200011216477_100000211819 [0,0,0,0,0,0|3,0,1]=4 582 B14R0.392 C=CCCCCCCOCCCCC=C 34a_100000766645_100011215473 [0,0,0,0,0,0|2,0,2]=4 583 B14R0.392 C=CCCCCCCOCCCCC=C 34a_200011216477_100011215482 [0,0,0,0,0,0|2,0,2]=4 584 B14R0.392 C=CCCCCCCOCCCCC=C 7a_100000766645_100011215473 [0,0,0,0,0,0|2,0,2]=4 585 B14R0.392 C=CCCCCCCOCCCCC=C 7a_200011216477_100011215482 [0,0,0,0,0,0|2,0,2]=4 586 B14R0.392 C=CCCCCCCOCCCCC=O 7a_200011216477_100000139335 [0,0,0,0,0,0|1,0,2]=3 587 B14R0.392 C=CCCCCCCOCCCCCBr 34a_100000746331_100011215473 [0,0,0,0,0,0|3,0,0]=3 588 B14R0.392 C=CCCCCCCOCCCCCBr 7a_100000746331_100011215473 [0,0,0,0,0,0|3,0,0]=3 589 B14R0.392 C=CCCCCCCOCCCCCC 34a_100000210259_100011215473 [0,0,0,0,0,0|2,0,0]=2 590 B14R0.392 C=CCCCCCCOCCCCCC 34a_200011216477_100000210314 [0,0,0,0,0,0|2,0,0]=2 591 B14R0.392 C=CCCCCCCOCCCCCC 7a_100000210259_100011215473 [0,0,0,0,0,0|2,0,0]=2 592 B14R0.392 C=CCCCCCCOCCCCCC 7a_200011216477_100000210314 [0,0,0,0,0,0|2,0,0]=2 593 B14R0.392 C=CCCCCCCOCCCCCCl 34a_100000746330_100011215473 [0,0,0,0,0,0|3,0,0]=3 594 B14R0.392 C=CCCCCCCOCCCCCCl 7a_100000746330_100011215473 [0,0,0,0,0,0|3,0,0]=3 595 B14R0.392 C=CCCCCCCOCCCCCF 34a_200011216477_100000729378 [0,0,0,0,0,0|3,0,0]=3 596 B14R0.392 C=CCCCCCCOCCCCCF 7a_200011216477_100000729378 [0,0,0,0,0,0|3,0,0]=3 597 B14R0.392 C=CCCCCCCOCCCCCI 34a_200012148887_100011215473 [0,0,0,0,0,0|3,0,0]=3 598 B14R0.392 C=CCCCCCCOCCCCCI 7a_200012148887_100011215473 [0,0,0,0,0,0|3,0,0]=3 599 B14R0.392 C=CCCCCCCOCCCCCN 34a_100000762737_100011215473 [0,0,0,0,0,0|3,0,0]=3 600 B14R0.392 C=CCCCCCCOCCCCCO 34a_200011216477_100000746330 [0,0,0,0,0,0|3,0,0]=3 601 B14R0.392 C=CCCCCCCOCCCCCO 7a_200011216477_100000746330 [0,0,0,0,0,0|3,0,0]=3 602 B14R0.392 C=CCCCCCCOCCCCOC 34a_100000740925_100011215473 [0,0,0,0,0,0|3,0,0]=3 603 B14R0.392 C=CCCCCCCOCCCCOC 34a_200011216477_100000755781 [0,0,0,0,0,0|3,0,0]=3 604 B14R0.392 C=CCCCCCCOCCCCOC 7a_200011216477_100000730899 [0,0,0,0,0,0|3,0,0]=3 605 B14R0.392 C=CCCCCCCOCCCCSC 34a_100011217163_100011215473 [0,0,0,0,0,0|3,0,0]=3 606 B14R0.392 C=CCCCCCCOCCCCSC 7a_100011217163_100011215473 [0,0,0,0,0,0|3,0,0]=3 607 B14R0.392 C=CCCCCCCOCCCOCC 34a_100000757476_100011215473 [0,0,0,0,0,0|3,0,0]=3 608 B14R0.392 C=CCCCCCCOCCCOCC 34a_200011216477_100012232248 [0,0,0,0,0,0|3,0,0]=3 609 B14R0.392 C=CCCCCCCOCCCOCC 7a_100000757476_100011215473 [0,0,0,0,0,0|3,0,0]=3 610 B14R0.392 C=CCCCCCCOCCCOCC 7a_200011216477_100012232248 [0,0,0,0,0,0|3,0,0]=3 611 B14R0.392 C=CCCCCCCOCCCSCC 34a_100011216438_100011215473 [0,0,0,0,0,0|3,0,0]=3 612 B14R0.392 C=CCCCCCCOCCCSCC 7a_100011216438_100011215473 [0,0,0,0,0,0|3,0,0]=3 613 B14R0.392 C=CCCCCCCOCCOCCBr 34a_100000692535_100011215473 [0,0,0,0,0,0|4,0,0]=4 614 B14R0.392 C=CCCCCCCOCCOCCBr 7a_100000692535_100011215473 [0,0,0,0,0,0|4,0,0]=4 615 B14R0.392 C=CCCCCCCOCCOCCC 34a_100000752267_100011215473 [0,0,0,0,0,0|3,0,0]=3 616 B14R0.392 C=CCCCCCCOCCOCCC 34a_200011216477_100011215938 [0,0,0,0,0,0|3,0,0]=3 617 B14R0.392 C=CCCCCCCOCCOCCC 7a_100000752267_100011215473 [0,0,0,0,0,0|3,0,0]=3 618 B14R0.392 C=CCCCCCCOCCOCCC 7a_200011216477_100011215938 [0,0,0,0,0,0|3,0,0]=3 619 B14R0.392 C=CCCCCCCOCCOCCCl 34a_100011215305_100011215473 [0,0,0,0,0,0|4,0,0]=4 620 B14R0.392 C=CCCCCCCOCCOCCCl 7a_100011215305_100011215473 [0,0,0,0,0,0|4,0,0]=4 621 B14R0.392 C=CCCCCCCOCCOCCF 34a_200015357709_100011215473 [0,0,0,0,0,0|4,0,0]=4 622 B14R0.392 C=CCCCCCCOCCOCCF 7a_200015357709_100011215473 [0,0,0,0,0,0|4,0,0]=4 623 B14R0.392 C=CCCCCCCOCCOCCI 34a_100012149058_100011215473 [0,0,0,0,0,0|4,0,0]=4 624 B14R0.392 C=CCCCCCCOCCOCCI 7a_100012149058_100011215473 [0,0,0,0,0,0|4,0,0]=4 625 B14R0.392 C=CCCCCCCOCCOCCN 34a_100000211614_100011215473 [0,0,0,0,0,0|4,0,0]=4 626 B14R0.392 C=CCCCCCCOCCOCCO 34a_200011216477_100000692535 [0,0,0,0,0,0|4,0,0]=4 627 B14R0.392 C=CCCCCCCOCCOCCO 7a_200011216477_100011215305 [0,0,0,0,0,0|4,0,0]=4 628 B14R0.392 C=CCCCCCCOCCSCCC 34a_200000230433_100011215473 [0,0,0,0,0,0|3,0,0]=3 629 B14R0.392 C=CCCCCCCOCCSCCC 7a_200000230433_100011215473 [0,0,0,0,0,0|3,0,0]=3 630 B14R0.392 C=CCCCCCCOCOCCCC 34a_200011216477_100011995733 [0,0,0,0,0,0|3,0,0]=3 631 B14R0.392 C=CCCCCCCSCC/C=C\CC 62a_100011215473_100015370543 [0,0,0,0,0,0|2,0,2]=4 632 B14R0.392 C=CCCCCCCSCC/C=C\CC 62a_100015370543_100011215473 [0,0,0,0,0,0|2,0,2]=4 633 B14R0.392 C=CCCCCCCSCCCCC#N 62a_100011215473_100000211819 [0,0,0,0,0,0|3,0,1]=4 634 B14R0.392 C=CCCCCCCSCCCCC#N 62a_100011219923_100011215473 [0,0,0,0,0,0|3,0,1]=4 635 B14R0.392 C=CCCCCCCSCCCCC=C 62a_100011215473_100011215482 [0,0,0,0,0,0|2,0,2]=4 636 B14R0.392 C=CCCCCCCSCCCCC=C 62a_100011215482_100011215473 [0,0,0,0,0,0|2,0,2]=4 637 B14R0.392 C=CCCCCCCSCCCCC=O 62a_100000139335_100011215473 [0,0,0,0,0,0|1,0,2]=3 638 B14R0.392 C=CCCCCCCSCCCCC=O 62a_100011215473_100000139335 [0,0,0,0,0,0|1,0,2]=3 639 B14R0.392 C=CCCCCCCSCCCCCC 62a_100000210314_100011215473 [0,0,0,0,0,0|2,0,0]=2 640 B14R0.392 C=CCCCCCCSCCCCCC 62a_100011215473_100000210757 [0,0,0,0,0,0|2,0,0]=2 641 B14R0.392 C=CCCCCCCSCCCCCF 62a_100000729378_100011215473 [0,0,0,0,0,0|3,0,0]=3 642 B14R0.392 C=CCCCCCCSCCCCCF 62a_100011215473_100000729378 [0,0,0,0,0,0|3,0,0]=3 643 B14R0.392 C=CCCCCCCSCCCCCO 62a_100000746330_100011215473 [0,0,0,0,0,0|3,0,0]=3 644 B14R0.392 C=CCCCCCCSCCCCCO 62a_100011215473_100000746330 [0,0,0,0,0,0|3,0,0]=3 645 B14R0.392 C=CCCCCCCSCCCCOC 62a_100000730899_100011215473 [0,0,0,0,0,0|3,0,0]=3 646 B14R0.392 C=CCCCCCCSCCCCOC 62a_100011215473_100000730899 [0,0,0,0,0,0|3,0,0]=3 647 B14R0.392 C=CCCCCCCSCCCOCC 62a_100011215473_100012232248 [0,0,0,0,0,0|3,0,0]=3 648 B14R0.392 C=CCCCCCCSCCCOCC 62a_100012232248_100011215473 [0,0,0,0,0,0|3,0,0]=3 649 B14R0.392 C=CCCCCCCSCCOCCC 62a_100011215473_100011215938 [0,0,0,0,0,0|3,0,0]=3 650 B14R0.392 C=CCCCCCCSCCOCCC 62a_100011215938_100011215473 [0,0,0,0,0,0|3,0,0]=3 651 B14R0.392 C=CCCCCCCSCCOCCO 62a_100011215305_100011215473 [0,0,0,0,0,0|4,0,0]=4 652 B14R0.392 C=CCCCCCCSCCOCCO 62a_100011215473_100011215305 [0,0,0,0,0,0|4,0,0]=4 653 B14R0.392 C=CCCCCCCSCOCCCC 62a_100011215473_100011995733 [0,0,0,0,0,0|3,0,0]=3 654 B14R0.392 C=CCCCCCCSCOCCCC 62a_100011995733_100011215473 [0,0,0,0,0,0|3,0,0]=3 655 B14R0.392 C=CCCCCCCSCOCCOC 62a_100000231047_100011215473 [0,0,0,0,0,0|4,0,0]=4 656 B14R0.392 C=CCCCCCCSCOCCOC 62a_100011215473_100000231047 [0,0,0,0,0,0|4,0,0]=4 657 B14R0.392 C=CCCCCCNCCCCCCC 2230a_100000229938_100000700193 [0,0,0,0,0,0|2,0,0]=2 658 B14R0.392 C=CCCCCCNCCCCCCO 2230a_100000686447_100000700193 [0,0,0,0,0,0|3,0,0]=3 659 B14R0.392 C=CCCCCCNCCCCCCO 34a_100000686447_100000700193 [0,0,0,0,0,0|3,0,0]=3 660 B14R0.392 C=CCCCCCNCCCCCOC 2230a_100000747528_100000700193 [0,0,0,0,0,0|3,0,0]=3 661 B14R0.392 C=CCCCCCNCCCCCOC 34a_100000747528_100000700193 [0,0,0,0,0,0|3,0,0]=3 662 B14R0.392 C=CCCCCCNCCCOCCC 2230a_100011217757_100000700193 [0,0,0,0,0,0|3,0,0]=3 663 B14R0.392 C=CCCCCCNCCCOCCC 34a_100011217757_100000700193 [0,0,0,0,0,0|3,0,0]=3 664 B14R0.392 C=CCCCCCNCCOCCOC 2230a_100000745349_100000700193 [0,0,0,0,0,0|4,0,0]=4 665 B14R0.392 C=CCCCCCNCCOCCOC 34a_100000745349_100000700193 [0,0,0,0,0,0|4,0,0]=4 666 B14R0.392 C=CCCCCCNCCSCCCC 2230a_100025743550_100000700193 [0,0,0,0,0,0|3,0,0]=3 667 B14R0.392 C=CCCCCCOC/C=C/CCCC 34a_200016272032_100000700193 [0,0,0,0,0,0|2,0,2]=4 668 B14R0.392 C=CCCCCCOC/C=C/CCCC 7a_200016272032_100000700193 [0,0,0,0,0,0|2,0,2]=4 669 B14R0.392 C=CCCCCCOCC#CCCCC 34a_200000034558_100000700193 [0,0,0,0,0,0|2,0,2]=4 670 B14R0.392 C=CCCCCCOCC#CCCCC 7a_200000034558_100000700193 [0,0,0,0,0,0|2,0,2]=4 671 B14R0.392 C=CCCCCCOCCC#CCCC 34a_100000042726_100000700193 [0,0,0,0,0,0|2,0,2]=4 672 B14R0.392 C=CCCCCCOCCC#CCCC 7a_100000042726_100000700193 [0,0,0,0,0,0|2,0,2]=4 673 B14R0.392 C=CCCCCCOCCC/C=C/CC 34a_100016287902_100000700193 [0,0,0,0,0,0|2,0,2]=4 674 B14R0.392 C=CCCCCCOCCC/C=C/CC 7a_100016287902_100000700193 [0,0,0,0,0,0|2,0,2]=4 675 B14R0.392 C=CCCCCCOCCCCCC#N 7a_100011216702_100009813376 [0,0,0,0,0,0|3,0,1]=4 676 B14R0.392 C=CCCCCCOCCCCCC=C 34a_100011216702_100000700193 [0,0,0,0,0,0|2,0,2]=4 677 B14R0.392 C=CCCCCCOCCCCCC=C 7a_100011216702_100000700193 [0,0,0,0,0,0|2,0,2]=4 678 B14R0.392 C=CCCCCCOCCCCCC=O 7a_100011216702_100000139337 [0,0,0,0,0,0|1,0,2]=3 679 B14R0.392 C=CCCCCCOCCCCCCBr 34a_100011215345_100000700193 [0,0,0,0,0,0|3,0,0]=3 680 B14R0.392 C=CCCCCCOCCCCCCBr 7a_100011215345_100000700193 [0,0,0,0,0,0|3,0,0]=3 681 B14R0.392 C=CCCCCCOCCCCCCC 34a_100000210272_100000700193 [0,0,0,0,0,0|2,0,0]=2 682 B14R0.392 C=CCCCCCOCCCCCCC 34a_100011216702_100000210614 [0,0,0,0,0,0|2,0,0]=2 683 B14R0.392 C=CCCCCCOCCCCCCC 7a_100000210272_100000700193 [0,0,0,0,0,0|2,0,0]=2 684 B14R0.392 C=CCCCCCOCCCCCCC 7a_100011216702_100000210614 [0,0,0,0,0,0|2,0,0]=2 685 B14R0.392 C=CCCCCCOCCCCCCCl 34a_100000766143_100000700193 [0,0,0,0,0,0|3,0,0]=3 686 B14R0.392 C=CCCCCCOCCCCCCCl 7a_100000766143_100000700193 [0,0,0,0,0,0|3,0,0]=3 687 B14R0.392 C=CCCCCCOCCCCCCF 34a_100000732779_100000700193 [0,0,0,0,0,0|3,0,0]=3 688 B14R0.392 C=CCCCCCOCCCCCCF 34a_100011216702_100015922095 [0,0,0,0,0,0|3,0,0]=3 689 B14R0.392 C=CCCCCCOCCCCCCF 7a_100000732779_100000700193 [0,0,0,0,0,0|3,0,0]=3 690 B14R0.392 C=CCCCCCOCCCCCCF 7a_100011216702_100015922095 [0,0,0,0,0,0|3,0,0]=3 691 B14R0.392 C=CCCCCCOCCCCCCN 34a_100000686447_100000700193 [0,0,0,0,0,0|3,0,0]=3 692 B14R0.392 C=CCCCCCOCCCCCCO 34a_100011216702_100000766143 [0,0,0,0,0,0|3,0,0]=3 693 B14R0.392 C=CCCCCCOCCCCCCO 7a_100011216702_100000766143 [0,0,0,0,0,0|3,0,0]=3 694 B14R0.392 C=CCCCCCOCCCCCNC 34a_100000722520_100000700193 [0,0,0,0,0,0|3,0,0]=3 695 B14R0.392 C=CCCCCCOCCOCCCC 34a_100000210238_100000700193 [0,0,0,0,0,0|3,0,0]=3 696 B14R0.392 C=CCCCCCOCCOCCCC 34a_100011216702_100000743108 [0,0,0,0,0,0|3,0,0]=3 697 B14R0.392 C=CCCCCCOCCOCCCC 7a_100000210238_100000700193 [0,0,0,0,0,0|3,0,0]=3 698 B14R0.392 C=CCCCCCOCCOCCCC 7a_100011216702_100000743108 [0,0,0,0,0,0|3,0,0]=3 699 B14R0.392 C=CCCCCCOCCOCCNC 34a_100000228057_100000700193 [0,0,0,0,0,0|4,0,0]=4 700 B14R0.392 C=CCCCCCOCCOCCOC 34a_100011215163_100000700193 [0,0,0,0,0,0|4,0,0]=4 701 B14R0.392 C=CCCCCCOCCOCCOC 34a_100011216702_100000695917 [0,0,0,0,0,0|4,0,0]=4 702 B14R0.392 C=CCCCCCOCCOCCOC 7a_100011215163_100000700193 [0,0,0,0,0,0|4,0,0]=4 703 B14R0.392 C=CCCCCCOCCOCCOC 7a_100011216702_100000695917 [0,0,0,0,0,0|4,0,0]=4 704 B14R0.392 C=CCCCCCOCCSCCCC 34a_200000230436_100000700193 [0,0,0,0,0,0|3,0,0]=3 705 B14R0.392 C=CCCCCCOCCSCCCC 7a_200000230436_100000700193 [0,0,0,0,0,0|3,0,0]=3 706 B14R0.392 C=CCCCCCSCCCCCC#N 62a_100000700193_100009813376 [0,0,0,0,0,0|3,0,1]=4 707 B14R0.392 C=CCCCCCSCCCCCC#N 62a_100009813376_100000700193 [0,0,0,0,0,0|3,0,1]=4 708 B14R0.392 C=CCCCCCSCCCCCC=C 62a_100000700193_100000700193 [0,0,0,0,0,0|2,0,2]=4 709 B14R0.392 C=CCCCCCSCCCCCC=O 62a_100000139337_100000700193 [0,0,0,0,0,0|1,0,2]=3 710 B14R0.392 C=CCCCCCSCCCCCC=O 62a_100000700193_100000139337 [0,0,0,0,0,0|1,0,2]=3 711 B14R0.392 C=CCCCCCSCCCCCCC 62a_100000210614_100000700193 [0,0,0,0,0,0|2,0,0]=2 712 B14R0.392 C=CCCCCCSCCCCCCC 62a_100000700193_100000210316 [0,0,0,0,0,0|2,0,0]=2 713 B14R0.392 C=CCCCCCSCCCCCCF 62a_100000700193_100015922095 [0,0,0,0,0,0|3,0,0]=3 714 B14R0.392 C=CCCCCCSCCCCCCF 62a_100015922095_100000700193 [0,0,0,0,0,0|3,0,0]=3 715 B14R0.392 C=CCCCCCSCCCCCCO 62a_100000700193_100000766143 [0,0,0,0,0,0|3,0,0]=3 716 B14R0.392 C=CCCCCCSCCCCCCO 62a_100000766143_100000700193 [0,0,0,0,0,0|3,0,0]=3 717 B14R0.392 C=CCCCCCSCCOCCCC 62a_100000700193_100000743108 [0,0,0,0,0,0|3,0,0]=3 718 B14R0.392 C=CCCCCCSCCOCCCC 62a_100000743108_100000700193 [0,0,0,0,0,0|3,0,0]=3 719 B14R0.392 C=CCCCCCSCCOCCOC 62a_100000695917_100000700193 [0,0,0,0,0,0|4,0,0]=4 720 B14R0.392 C=CCCCCCSCCOCCOC 62a_100000700193_100000695917 [0,0,0,0,0,0|4,0,0]=4 721 B14R0.392 C=CCCCCNCC#CCCCCC 2230a_100000703577_100009816472 [0,0,0,0,0,0|2,0,2]=4 722 B14R0.392 C=CCCCCNCC#CCCCCC 34a_100000703577_100009816472 [0,0,0,0,0,0|2,0,2]=4 723 B14R0.392 C=CCCCCNCCCCCCC#N 2230a_100000703577_100009813337 [0,0,0,0,0,0|3,0,1]=4 724 B14R0.392 C=CCCCCNCCCCCCCC 2230a_100000229939_100011215482 [0,0,0,0,0,0|2,0,0]=2 725 B14R0.392 C=CCCCCNCCCCCCCC 2230a_100000703577_100000210759 [0,0,0,0,0,0|2,0,0]=2 726 B14R0.392 C=CCCCCNCCCCCCCC 34a_100000229939_100011215482 [0,0,0,0,0,0|2,0,0]=2 727 B14R0.392 C=CCCCCNCCCCCCCC 34a_100000703577_100000210759 [0,0,0,0,0,0|2,0,0]=2 728 B14R0.392 C=CCCCCNCCCCCCCO 2230a_100000703577_100000760002 [0,0,0,0,0,0|3,0,0]=3 729 B14R0.392 C=CCCCCNCCCCCCCO 2230a_100011996573_100011215482 [0,0,0,0,0,0|3,0,0]=3 730 B14R0.392 C=CCCCCNCCCCCCCO 34a_100000703577_100000760002 [0,0,0,0,0,0|3,0,0]=3 731 B14R0.392 C=CCCCCNCCCCCCCO 34a_100011996573_100011215482 [0,0,0,0,0,0|3,0,0]=3 732 B14R0.392 C=CCCCCNCCCCCCOC 2230a_100000703577_100011998445 [0,0,0,0,0,0|3,0,0]=3 733 B14R0.392 C=CCCCCNCCCCCCOC 34a_100000703577_100011998445 [0,0,0,0,0,0|3,0,0]=3 734 B14R0.392 C=CCCCCNCCCOCCCC 2230a_200000211371_100011215482 [0,0,0,0,0,0|3,0,0]=3 735 B14R0.392 C=CCCCCNCCCOCCCC 34a_200000211371_100011215482 [0,0,0,0,0,0|3,0,0]=3 736 B14R0.392 C=CCCCCNCCCOCCCO 2230a_100011310245_100011215482 [0,0,0,0,0,0|4,0,0]=4 737 B14R0.392 C=CCCCCNCCCOCCCO 34a_100011310245_100011215482 [0,0,0,0,0,0|4,0,0]=4 738 B14R0.392 C=CCCCCNCCCOCCOC 2230a_100000206027_100011215482 [0,0,0,0,0,0|4,0,0]=4 739 B14R0.392 C=CCCCCNCCCOCCOC 2230a_100000703577_100011216529 [0,0,0,0,0,0|4,0,0]=4 740 B14R0.392 C=CCCCCNCCCOCCOC 34a_100000206027_100011215482 [0,0,0,0,0,0|4,0,0]=4 741 B14R0.392 C=CCCCCNCCCOCCOC 34a_100000703577_100011216529 [0,0,0,0,0,0|4,0,0]=4 742 B14R0.392 C=CCCCCNCCOCCOCC 2230a_100000703577_100011211534 [0,0,0,0,0,0|4,0,0]=4 743 B14R0.392 C=CCCCCNCCOCCOCC 2230a_100102712874_100011215482 [0,0,0,0,0,0|4,0,0]=4 744 B14R0.392 C=CCCCCNCCOCCOCC 34a_100000703577_100011211534 [0,0,0,0,0,0|4,0,0]=4 745 B14R0.392 C=CCCCCNCCOCCOCC 34a_100102712874_100011215482 [0,0,0,0,0,0|4,0,0]=4 746 B14R0.392 C=CCCCCOC/C=C/CCCCC 34a_100016258190_100011215482 [0,0,0,0,0,0|2,0,2]=4 747 B14R0.392 C=CCCCCOC/C=C/CCCCC 7a_100016258190_100011215482 [0,0,0,0,0,0|2,0,2]=4 748 B14R0.392 C=CCCCCOCC#CCCCCC 34a_100000766645_100009816472 [0,0,0,0,0,0|2,0,2]=4 749 B14R0.392 C=CCCCCOCC#CCCCCC 34a_200000033628_100011215482 [0,0,0,0,0,0|2,0,2]=4 750 B14R0.392 C=CCCCCOCC#CCCCCC 7a_100000766645_100009816472 [0,0,0,0,0,0|2,0,2]=4 751 B14R0.392 C=CCCCCOCC#CCCCCC 7a_200000033628_100011215482 [0,0,0,0,0,0|2,0,2]=4 752 B14R0.392 C=CCCCCOCC/C=C\CCCC 34a_200016286491_100011215482 [0,0,0,0,0,0|2,0,2]=4 753 B14R0.392 C=CCCCCOCC/C=C\CCCC 7a_200016286491_100011215482 [0,0,0,0,0,0|2,0,2]=4 754 B14R0.392 C=CCCCCOCCC#CCCCC 34a_100000037610_100011215482 [0,0,0,0,0,0|2,0,2]=4 755 B14R0.392 C=CCCCCOCCC#CCCCC 7a_100000037610_100011215482 [0,0,0,0,0,0|2,0,2]=4 756 B14R0.392 C=CCCCCOCCCC/C=C\CC 34a_100016287862_100011215482 [0,0,0,0,0,0|2,0,2]=4 757 B14R0.392 C=CCCCCOCCCC/C=C\CC 7a_100016287862_100011215482 [0,0,0,0,0,0|2,0,2]=4 758 B14R0.392 C=CCCCCOCCCCCCC#N 7a_100000766645_100009813337 [0,0,0,0,0,0|3,0,1]=4 759 B14R0.392 C=CCCCCOCCCCCCCBr 34a_100000760002_100011215482 [0,0,0,0,0,0|3,0,0]=3 760 B14R0.392 C=CCCCCOCCCCCCCBr 7a_100000760002_100011215482 [0,0,0,0,0,0|3,0,0]=3 761 B14R0.392 C=CCCCCOCCCCCCCC 34a_100000210232_100011215482 [0,0,0,0,0,0|2,0,0]=2 762 B14R0.392 C=CCCCCOCCCCCCCC 34a_100000766645_100000210759 [0,0,0,0,0,0|2,0,0]=2 763 B14R0.392 C=CCCCCOCCCCCCCC 7a_100000210232_100011215482 [0,0,0,0,0,0|2,0,0]=2 764 B14R0.392 C=CCCCCOCCCCCCCC 7a_100000766645_100000210759 [0,0,0,0,0,0|2,0,0]=2 765 B14R0.392 C=CCCCCOCCCCCCCN 34a_100011996573_100011215482 [0,0,0,0,0,0|3,0,0]=3 766 B14R0.392 C=CCCCCOCCCCCCCO 34a_100000766645_100000760002 [0,0,0,0,0,0|3,0,0]=3 767 B14R0.392 C=CCCCCOCCCCCCCO 7a_100000766645_100000760002 [0,0,0,0,0,0|3,0,0]=3 768 B14R0.392 C=CCCCCOCCCCCCOC 34a_100000766645_100011998445 [0,0,0,0,0,0|3,0,0]=3 769 B14R0.392 C=CCCCCOCCCCCCOC 34a_200012092642_100011215482 [0,0,0,0,0,0|3,0,0]=3 770 B14R0.392 C=CCCCCOCCCCCCOC 7a_100000766645_100011998445 [0,0,0,0,0,0|3,0,0]=3 771 B14R0.392 C=CCCCCOCCCCCCOC 7a_200012092642_100011215482 [0,0,0,0,0,0|3,0,0]=3 772 B14R0.392 C=CCCCCOCCCOCCCC 34a_200011215613_100011215482 [0,0,0,0,0,0|3,0,0]=3 773 B14R0.392 C=CCCCCOCCCOCCCC 7a_200011215613_100011215482 [0,0,0,0,0,0|3,0,0]=3 774 B14R0.392 C=CCCCCOCCCOCCCN 34a_100011310245_100011215482 [0,0,0,0,0,0|4,0,0]=4 775 B14R0.392 C=CCCCCOCCCOCCOC 34a_100000766645_100011216529 [0,0,0,0,0,0|4,0,0]=4 776 B14R0.392 C=CCCCCOCCCOCCOC 7a_100000766645_100011216529 [0,0,0,0,0,0|4,0,0]=4 777 B14R0.392 C=CCCCCOCCNCCCCC 34a_100000224656_100011215482 [0,0,0,0,0,0|3,0,0]=3 778 B14R0.392 C=CCCCCOCCOCCCCC 34a_100011215259_100011215482 [0,0,0,0,0,0|3,0,0]=3 779 B14R0.392 C=CCCCCOCCOCCCCC 7a_100011215259_100011215482 [0,0,0,0,0,0|3,0,0]=3 780 B14R0.392 C=CCCCCOCCOCCOCC 34a_100000210240_100011215482 [0,0,0,0,0,0|4,0,0]=4 781 B14R0.392 C=CCCCCOCCOCCOCC 34a_100000766645_100011211534 [0,0,0,0,0,0|4,0,0]=4 782 B14R0.392 C=CCCCCOCCOCCOCC 7a_100000210240_100011215482 [0,0,0,0,0,0|4,0,0]=4 783 B14R0.392 C=CCCCCOCCOCCOCC 7a_100000766645_100011211534 [0,0,0,0,0,0|4,0,0]=4 784 B14R0.392 C=CCCCCSCC#CCCCCC 62a_100009816472_100011215482 [0,0,0,0,0,0|2,0,2]=4 785 B14R0.392 C=CCCCCSCC#CCCCCC 62a_100011215482_100009816472 [0,0,0,0,0,0|2,0,2]=4 786 B14R0.392 C=CCCCCSCCCCCCC#N 62a_100009813337_100011215482 [0,0,0,0,0,0|3,0,1]=4 787 B14R0.392 C=CCCCCSCCCCCCC#N 62a_100011215482_100009813337 [0,0,0,0,0,0|3,0,1]=4 788 B14R0.392 C=CCCCCSCCCCCCCC 62a_100000210759_100011215482 [0,0,0,0,0,0|2,0,0]=2 789 B14R0.392 C=CCCCCSCCCCCCCC 62a_100011215482_100000210317 [0,0,0,0,0,0|2,0,0]=2 790 B14R0.392 C=CCCCCSCCCCCCCO 62a_100000760002_100011215482 [0,0,0,0,0,0|3,0,0]=3 791 B14R0.392 C=CCCCCSCCCCCCCO 62a_100011215482_100000760002 [0,0,0,0,0,0|3,0,0]=3 792 B14R0.392 C=CCCCCSCCCCCCOC 62a_100011215482_100011998445 [0,0,0,0,0,0|3,0,0]=3 793 B14R0.392 C=CCCCCSCCCCCCOC 62a_100011998445_100011215482 [0,0,0,0,0,0|3,0,0]=3 794 B14R0.392 C=CCCCCSCCCOCCOC 62a_100011215482_100011216529 [0,0,0,0,0,0|4,0,0]=4 795 B14R0.392 C=CCCCCSCCCOCCOC 62a_100011216529_100011215482 [0,0,0,0,0,0|4,0,0]=4 796 B14R0.392 C=CCCCCSCCOCCOCC 62a_100011211534_100011215482 [0,0,0,0,0,0|4,0,0]=4 797 B14R0.392 C=CCCCCSCCOCCOCC 62a_100011215482_100011211534 [0,0,0,0,0,0|4,0,0]=4 798 B14R0.392 C=CCCCNCCCC#CCCCC 2230a_100000700776_200000047210 [0,0,0,0,0,0|2,0,2]=4 799 B14R0.392 C=CCCCNCCCC#CCCCC 34a_100000700776_200000047210 [0,0,0,0,0,0|2,0,2]=4 800 B14R0.392 C=CCCCNCCCCC/C=C\CC 269862a_100000700776_100016288537 [0,0,0,0,0,0|2,0,2]=4 801 B14R0.392 C=CCCCNCCCCCCCCC 2230a_100000212291_100011713584 [0,0,0,0,0,0|2,0,0]=2 802 B14R0.392 C=CCCCNCCCCCCCCC 2230a_100000700776_100011214924 [0,0,0,0,0,0|2,0,0]=2 803 B14R0.392 C=CCCCNCCCCCCCCC 34a_100000212291_100000757094 [0,0,0,0,0,0|2,0,0]=2 804 B14R0.392 C=CCCCNCCCCCCCCC 34a_100000700776_100011214924 [0,0,0,0,0,0|2,0,0]=2 805 B14R0.392 C=CCCCNCCCCCCCCO 2230a_100000700776_100000033203 [0,0,0,0,0,0|3,0,0]=3 806 B14R0.392 C=CCCCNCCCCCCCCO 2230a_102515433106_100011713584 [0,0,0,0,0,0|3,0,0]=3 807 B14R0.392 C=CCCCNCCCCCCCCO 34a_100000700776_100000033203 [0,0,0,0,0,0|3,0,0]=3 808 B14R0.392 C=CCCCNCCCCCCCCO 34a_102515433106_100000757094 [0,0,0,0,0,0|3,0,0]=3 809 B14R0.392 C=CCCCNCCOCCOCCC 2230a_200011904461_100011713584 [0,0,0,0,0,0|4,0,0]=4 810 B14R0.392 C=CCCCNCCOCCOCCC 34a_200011904461_100000757094 [0,0,0,0,0,0|4,0,0]=4 811 B14R0.392 C=CCCCOC/C=C/CCCCCC 34a_200016276170_100000757094 [0,0,0,0,0,0|2,0,2]=4 812 B14R0.392 C=CCCCOC/C=C/CCCCCC 7a_200016276170_100000757094 [0,0,0,0,0,0|2,0,2]=4 813 B14R0.392 C=CCCCOCC#CCCCCCC 34a_200000037284_100000757094 [0,0,0,0,0,0|2,0,2]=4 814 B14R0.392 C=CCCCOCC#CCCCCCC 7a_200000037284_100000757094 [0,0,0,0,0,0|2,0,2]=4 815 B14R0.392 C=CCCCOCC/C=C\CCCCC 34a_100016277358_100000757094 [0,0,0,0,0,0|2,0,2]=4 816 B14R0.392 C=CCCCOCC/C=C\CCCCC 7a_100016277358_100000757094 [0,0,0,0,0,0|2,0,2]=4 817 B14R0.392 C=CCCCOCCC#CCCCCC 34a_200000042877_100000757094 [0,0,0,0,0,0|2,0,2]=4 818 B14R0.392 C=CCCCOCCC#CCCCCC 7a_200000042877_100000757094 [0,0,0,0,0,0|2,0,2]=4 819 B14R0.392 C=CCCCOCCCC#CCCCC 34a_100000758997_200000047210 [0,0,0,0,0,0|2,0,2]=4 820 B14R0.392 C=CCCCOCCCC#CCCCC 7a_100000758997_200000047210 [0,0,0,0,0,0|2,0,2]=4 821 B14R0.392 C=CCCCOCCCCC/C=C\CC 34a_100016268722_100000757094 [0,0,0,0,0,0|2,0,2]=4 822 B14R0.392 C=CCCCOCCCCC/C=C\CC 7a_100016268722_100000757094 [0,0,0,0,0,0|2,0,2]=4 823 B14R0.392 C=CCCCOCCCCCCCCBr 34a_100009813846_100000757094 [0,0,0,0,0,0|3,0,0]=3 824 B14R0.392 C=CCCCOCCCCCCCCBr 7a_100009813846_100000757094 [0,0,0,0,0,0|3,0,0]=3 825 B14R0.392 C=CCCCOCCCCCCCCC 34a_100000210712_100000757094 [0,0,0,0,0,0|2,0,0]=2 826 B14R0.392 C=CCCCOCCCCCCCCC 34a_100000758997_100011214924 [0,0,0,0,0,0|2,0,0]=2 827 B14R0.392 C=CCCCOCCCCCCCCC 7a_100000210712_100000757094 [0,0,0,0,0,0|2,0,0]=2 828 B14R0.392 C=CCCCOCCCCCCCCC 7a_100000758997_100000210328 [0,0,0,0,0,0|2,0,0]=2 829 B14R0.392 C=CCCCOCCCCCCCCCl 34a_100000033203_100000757094 [0,0,0,0,0,0|3,0,0]=3 830 B14R0.392 C=CCCCOCCCCCCCCCl 7a_100000033203_100000757094 [0,0,0,0,0,0|3,0,0]=3 831 B14R0.392 C=CCCCOCCCCCCCCN 34a_102515433106_100000757094 [0,0,0,0,0,0|3,0,0]=3 832 B14R0.392 C=CCCCOCCCCCCCCO 34a_100000758997_100000033203 [0,0,0,0,0,0|3,0,0]=3 833 B14R0.392 C=CCCCOCCCCCCCCO 7a_100000758997_100000033203 [0,0,0,0,0,0|3,0,0]=3 834 B14R0.392 C=CCCCOCCCCCNCCN 34a_103619048469_100000757094 [0,0,0,0,0,0|4,0,0]=4 835 B14R0.392 C=CCCCOCCCCNCCCC 34a_200011216965_100000757094 [0,0,0,0,0,0|3,0,0]=3 836 B14R0.392 C=CCCCOCCCCOCCCC 34a_200000760531_100000757094 [0,0,0,0,0,0|3,0,0]=3 837 B14R0.392 C=CCCCOCCCCOCCCC 7a_200000760531_100000757094 [0,0,0,0,0,0|3,0,0]=3 838 B14R0.392 C=CCCCOCCCOCCCOC 34a_200011215475_100000757094 [0,0,0,0,0,0|4,0,0]=4 839 B14R0.392 C=CCCCOCCCOCCCOC 7a_200011215475_100000757094 [0,0,0,0,0,0|4,0,0]=4 840 B14R0.392 C=CCCCOCCOCCCCCC 34a_100000691444_100000757094 [0,0,0,0,0,0|3,0,0]=3 841 B14R0.392 C=CCCCOCCOCCCCCC 7a_100000691444_100000757094 [0,0,0,0,0,0|3,0,0]=3 842 B14R0.392 C=CCCCSCCCC#CCCCC 62a_100011713584_200000047210 [0,0,0,0,0,0|2,0,2]=4 843 B14R0.392 C=CCCCSCCCC#CCCCC 62a_200000047210_100000757094 [0,0,0,0,0,0|2,0,2]=4 844 B14R0.392 C=CCCCSCCCCCCCCC 62a_100011713584_100000210670 [0,0,0,0,0,0|2,0,0]=2 845 B14R0.392 C=CCCCSCCCCCCCCO 62a_100000033203_100000757094 [0,0,0,0,0,0|3,0,0]=3 846 B14R0.392 C=CCCCSCCCCCCCCO 62a_100011713584_100000033203 [0,0,0,0,0,0|3,0,0]=3 847 B14R0.392 C=CCCNCCCCCCC#CCC 2230a_100015191253_200000036426 [0,0,0,0,0,0|2,0,2]=4 848 B14R0.392 C=CCCNCCCCCCCCCC 2230a_100000684558_100000754431 [0,0,0,0,0,0|2,0,0]=2 849 B14R0.392 C=CCCNCCCCCCCCCC 2230a_100015191253_100000210320 [0,0,0,0,0,0|2,0,0]=2 850 B14R0.392 C=CCCNCCCCCCCCCC 34a_100000684558_100000754431 [0,0,0,0,0,0|2,0,0]=2 851 B14R0.392 C=CCCNCCCCCCCCCO 2230a_100000078944_100000754431 [0,0,0,0,0,0|3,0,0]=3 852 B14R0.392 C=CCCNCCCCCCCCCO 2230a_100015191253_100009813782 [0,0,0,0,0,0|3,0,0]=3 853 B14R0.392 C=CCCNCCCCCCCCCO 34a_100000078944_100000754431 [0,0,0,0,0,0|3,0,0]=3 854 B14R0.392 C=CCCOCC#CCCCCCCC 34a_200000061759_100000754431 [0,0,0,0,0,0|2,0,2]=4 855 B14R0.392 C=CCCOCC#CCCCCCCC 7a_200000061759_100000754431 [0,0,0,0,0,0|2,0,2]=4 856 B14R0.392 C=CCCOCCC#CCCCCCC 34a_200000033163_100000754431 [0,0,0,0,0,0|2,0,2]=4 857 B14R0.392 C=CCCOCCC#CCCCCCC 7a_200000033163_100000754431 [0,0,0,0,0,0|2,0,2]=4 858 B14R0.392 C=CCCOCCC/C=C\CCCCC 34a_100020655193_100000754431 [0,0,0,0,0,0|2,0,2]=4 859 B14R0.392 C=CCCOCCC/C=C\CCCCC 7a_100020655193_100000754431 [0,0,0,0,0,0|2,0,2]=4 860 B14R0.392 C=CCCOCCCC/C=C/CCCC 34a_200020645093_100000754431 [0,0,0,0,0,0|2,0,2]=4 861 B14R0.392 C=CCCOCCCC/C=C/CCCC 7a_200020645093_100000754431 [0,0,0,0,0,0|2,0,2]=4 862 B14R0.392 C=CCCOCCCCC#CCCCC 34a_200000066234_100000754431 [0,0,0,0,0,0|2,0,2]=4 863 B14R0.392 C=CCCOCCCCC#CCCCC 7a_200000066234_100000754431 [0,0,0,0,0,0|2,0,2]=4 864 B14R0.392 C=CCCOCCCCCCC#CCC 34a_100011205117_200000036426 [0,0,0,0,0,0|2,0,2]=4 865 B14R0.392 C=CCCOCCCCCCCCCBr 34a_100009813782_100000754431 [0,0,0,0,0,0|3,0,0]=3 866 B14R0.392 C=CCCOCCCCCCCCCBr 7a_100009813782_100000754431 [0,0,0,0,0,0|3,0,0]=3 867 B14R0.392 C=CCCOCCCCCCCCCC 34a_100000210711_100000754431 [0,0,0,0,0,0|2,0,0]=2 868 B14R0.392 C=CCCOCCCCCCCCCC 34a_100011205117_100000210320 [0,0,0,0,0,0|2,0,0]=2 869 B14R0.392 C=CCCOCCCCCCCCCC 7a_100000210711_100000754431 [0,0,0,0,0,0|2,0,0]=2 870 B14R0.392 C=CCCOCCCCCCCCCCl 34a_100009868337_100000754431 [0,0,0,0,0,0|3,0,0]=3 871 B14R0.392 C=CCCOCCCCCCCCCCl 7a_100009868337_100000754431 [0,0,0,0,0,0|3,0,0]=3 872 B14R0.392 C=CCCOCCCCCCCCCN 34a_100000078944_100000754431 [0,0,0,0,0,0|3,0,0]=3 873 B14R0.392 C=CCCOCCCCCCCCCO 34a_100011205117_100009813782 [0,0,0,0,0,0|3,0,0]=3 874 B14R0.392 C=CCCOCCOCCOCCCC 34a_100011215186_100000754431 [0,0,0,0,0,0|4,0,0]=4 875 B14R0.392 C=CCCOCCOCCOCCCC 7a_100011215186_100000754431 [0,0,0,0,0,0|4,0,0]=4 876 B14R0.392 C=CCCSCCCCCCC#CCC 62a_100000754431_200000036426 [0,0,0,0,0,0|2,0,2]=4 877 B14R0.392 C=CCCSCCCCCCC#CCC 62a_200000036426_100000754431 [0,0,0,0,0,0|2,0,2]=4 878 B14R0.392 C=CCCSCCCCCCCCCC 62a_100000754431_100000210320 [0,0,0,0,0,0|2,0,0]=2 879 B14R0.392 C=CCCSCCCCCCCCCO 62a_100000754431_100009813782 [0,0,0,0,0,0|3,0,0]=3 880 B14R0.392 C=CCCSCCCCCCCCCO 62a_100009813782_100000754431 [0,0,0,0,0,0|3,0,0]=3 881 B14R0.392 C=CCNCCCCCCCCCCC 2230a_100020586998_100011215454 [0,0,0,0,0,0|2,0,0]=2 882 B14R0.392 C=CCNCCCCCCCCCCC 2230a_200011215754_100000210623 [0,0,0,0,0,0|2,0,0]=2 883 B14R0.392 C=CCNCCCCCCCCCCC 34a_200011215754_100015514636 [0,0,0,0,0,0|2,0,0]=2 884 B14R0.392 C=CCNCCCCCCCCCCO 2230a_100000066964_100000210623 [0,0,0,0,0,0|3,0,0]=3 885 B14R0.392 C=CCNCCCCCCCCCCO 2230a_100020586998_100009813290 [0,0,0,0,0,0|3,0,0]=3 886 B14R0.392 C=CCNCCCCCCCCCCO 34a_100000066964_100015514636 [0,0,0,0,0,0|3,0,0]=3 887 B14R0.392 C=CCOC/C=C/CCCCCCCC 34a_200020667288_100015514636 [0,0,0,0,0,0|2,0,2]=4 888 B14R0.392 C=CCOC/C=C/CCCCCCCC 7a_200020667288_100015514636 [0,0,0,0,0,0|2,0,2]=4 889 B14R0.392 C=CCOCCCCCCCCCCBr 34a_100009813290_100015514636 [0,0,0,0,0,0|3,0,0]=3 890 B14R0.392 C=CCOCCCCCCCCCCBr 7a_100009813290_100015514636 [0,0,0,0,0,0|3,0,0]=3 891 B14R0.392 C=CCOCCCCCCCCCCC 34a_100000210809_100015514636 [0,0,0,0,0,0|2,0,0]=2 892 B14R0.392 C=CCOCCCCCCCCCCC 34a_200000210373_100011215454 [0,0,0,0,0,0|2,0,0]=2 893 B14R0.392 C=CCOCCCCCCCCCCC 7a_100000210809_100015514636 [0,0,0,0,0,0|2,0,0]=2 894 B14R0.392 C=CCOCCCCCCCCCCCl 34a_200000033068_100015514636 [0,0,0,0,0,0|3,0,0]=3 895 B14R0.392 C=CCOCCCCCCCCCCCl 7a_200000033068_100015514636 [0,0,0,0,0,0|3,0,0]=3 896 B14R0.392 C=CCOCCCCCCCCCCN 34a_100000066964_100015514636 [0,0,0,0,0,0|3,0,0]=3 897 B14R0.392 C=CCOCCCCCCCCCCO 34a_200000210373_100009813290 [0,0,0,0,0,0|3,0,0]=3 898 B14R0.392 C=CCOCCOCCCCCCCC 34a_100000037705_100000210759 [0,0,0,0,0,0|3,0,0]=3 899 B14R0.392 C=CCOCCOCCCCCCCC 7a_100000037705_100000210759 [0,0,0,0,0,0|3,0,0]=3 900 B14R0.392 C=CCOCCOCCCCCCCO 34a_100000037705_100000760002 [0,0,0,0,0,0|4,0,0]=4 901 B14R0.392 C=CCOCCOCCCCCCCO 7a_100000037705_100000760002 [0,0,0,0,0,0|4,0,0]=4 902 B14R0.392 C=CCOCCOCCCCCCOC 34a_100000037705_100011998445 [0,0,0,0,0,0|4,0,0]=4 903 B14R0.392 C=CCOCCOCCCCCCOC 7a_100000037705_100011998445 [0,0,0,0,0,0|4,0,0]=4 904 B14R0.392 C=CCOCCOCCOCCCCC 34a_100000065479_100000718602 [0,0,0,0,0,0|4,0,0]=4 905 B14R0.392 C=CCOCCOCCOCCCCC 7a_100000065479_100000210326 [0,0,0,0,0,0|4,0,0]=4 906 B14R0.392 C=CCSCCCCCCCCCCC 62a_100000210623_100011215454 [0,0,0,0,0,0|2,0,0]=2 907 B14R0.392 C=CCSCCCCCCCCCCO 62a_100000210623_200000033068 [0,0,0,0,0,0|3,0,0]=3 908 B14R0.392 C=CCSCCCCCCCCCCO 62a_100009813290_100000210623 [0,0,0,0,0,0|3,0,0]=3 909 B14R0.392 C=COCCCCOCCCCCC=O 7a_100000031558_100000139337 [0,0,0,0,0,0|2,0,2]=4 910 B14R0.392 C=COCCCCOCCCCCCC 34a_100000031558_100000210614 [0,0,0,0,0,0|3,0,0]=3 911 B14R0.392 C=COCCCCOCCCCCCC 7a_100000031558_100000210614 [0,0,0,0,0,0|3,0,0]=3 912 B14R0.392 C=COCCCCOCCCCCCF 34a_100000031558_100015922095 [0,0,0,0,0,0|4,0,0]=4 913 B14R0.392 C=COCCCCOCCCCCCF 7a_100000031558_100015922095 [0,0,0,0,0,0|4,0,0]=4 914 B14R0.392 C=COCCCCOCCCCCCO 34a_100000031558_100000766143 [0,0,0,0,0,0|4,0,0]=4 915 B14R0.392 C=COCCCCOCCCCCCO 7a_100000031558_100000766143 [0,0,0,0,0,0|4,0,0]=4 916 B14R0.392 C=COCCCCOCCOCCCC 34a_100000031558_100000743108 [0,0,0,0,0,0|4,0,0]=4 917 B14R0.392 C=COCCCCOCCOCCCC 7a_100000031558_100000743108 [0,0,0,0,0,0|4,0,0]=4 918 B14R0.392 C=COCCCNCCCCCCCC 2230a_100000210767_100000210759 [0,0,0,0,0,0|3,0,0]=3 919 B14R0.392 C=COCCCNCCCCCCCC 34a_100000210767_100000210759 [0,0,0,0,0,0|3,0,0]=3 920 B14R0.392 C=COCCCNCCCCCCCO 2230a_100000210767_100000760002 [0,0,0,0,0,0|4,0,0]=4 921 B14R0.392 C=COCCCNCCCCCCCO 34a_100000210767_100000760002 [0,0,0,0,0,0|4,0,0]=4 922 B14R0.392 C=COCCCNCCCCCCOC 2230a_100000210767_100011998445 [0,0,0,0,0,0|4,0,0]=4 923 B14R0.392 C=COCCCNCCCCCCOC 34a_100000210767_100011998445 [0,0,0,0,0,0|4,0,0]=4 924 B14R0.392 C=COCCNCCCCCCCCC 2230a_100000212291_100000039644 [0,0,0,0,0,0|3,0,0]=3 925 B14R0.392 C=COCCNCCCCCCCCC 34a_100000212291_100000039644 [0,0,0,0,0,0|3,0,0]=3 926 B14R0.392 C=COCCNCCCCCCCCO 2230a_102515433106_100000039644 [0,0,0,0,0,0|4,0,0]=4 927 B14R0.392 C=COCCNCCCCCCCCO 34a_102515433106_100000039644 [0,0,0,0,0,0|4,0,0]=4 928 B14R0.392 C=COCCOCCCCCCCCBr 34a_100009813846_100000039644 [0,0,0,0,0,0|4,0,0]=4 929 B14R0.392 C=COCCOCCCCCCCCBr 7a_100009813846_100000039644 [0,0,0,0,0,0|4,0,0]=4 930 B14R0.392 C=COCCOCCCCCCCCC 34a_100000033082_100011214924 [0,0,0,0,0,0|3,0,0]=3 931 B14R0.392 C=COCCOCCCCCCCCC 34a_100000210712_100000039644 [0,0,0,0,0,0|3,0,0]=3 932 B14R0.392 C=COCCOCCCCCCCCC 7a_100000210712_100000039644 [0,0,0,0,0,0|3,0,0]=3 933 B14R0.392 C=COCCOCCCCCCCCCl 34a_100000033203_100000039644 [0,0,0,0,0,0|4,0,0]=4 934 B14R0.392 C=COCCOCCCCCCCCCl 7a_100000033203_100000039644 [0,0,0,0,0,0|4,0,0]=4 935 B14R0.392 C=COCCOCCCCCCCCN 34a_102515433106_100000039644 [0,0,0,0,0,0|4,0,0]=4 936 B14R0.392 C=COCCOCCCCCCCCO 34a_100000033082_100000033203 [0,0,0,0,0,0|4,0,0]=4 937 B14R0.392 C=COCCOCCCCNCCCC 34a_200011216965_100000039644 [0,0,0,0,0,0|4,0,0]=4 938 B14R0.392 C=COCCOCCCCOCCCC 34a_200000760531_100000039644 [0,0,0,0,0,0|4,0,0]=4 939 B14R0.392 C=COCCOCCCCOCCCC 7a_200000760531_100000039644 [0,0,0,0,0,0|4,0,0]=4 940 B14R0.392 C=COCCOCCOCCCCCC 34a_100000039918_100000210314 [0,0,0,0,0,0|4,0,0]=4 941 B14R0.392 C=COCCOCCOCCCCCC 34a_100000691444_100000039644 [0,0,0,0,0,0|4,0,0]=4 942 B14R0.392 C=COCCOCCOCCCCCC 7a_100000039918_100000210314 [0,0,0,0,0,0|4,0,0]=4 943 B14R0.392 C=COCCOCCOCCCCCC 7a_100000691444_100000039644 [0,0,0,0,0,0|4,0,0]=4 944 B14R0.392 C=COCCSCCCCCCCCC 62a_100000039644_100000210670 [0,0,0,0,0,0|3,0,0]=3 945 B14R0.392 C=COCCSCCCCCCCCO 62a_100000033203_100000039644 [0,0,0,0,0,0|4,0,0]=4 946 B14R0.392 C=COCCSCCCCCCCCO 62a_100000039644_100000033203 [0,0,0,0,0,0|4,0,0]=4 947 B14R0.392 CC#CCCOCCCCCCCCC 34a_100000750427_100011214924 [0,0,0,0,0,0|2,0,2]=4 948 B14R0.392 CC#CCNCCCCCCCCCC 2230a_100000684558_100000748600 [0,0,0,0,0,0|2,0,2]=4 949 B14R0.392 CC#CCNCCCCCCCCCC 2230a_100000685387_100000210320 [0,0,0,0,0,0|2,0,2]=4 950 B14R0.392 CC#CCNCCCCCCCCCC 34a_100000684558_100000748600 [0,0,0,0,0,0|2,0,2]=4 951 B14R0.392 CC#CCNCCCCCCCCCC 34a_100000685387_100000210320 [0,0,0,0,0,0|2,0,2]=4 952 B14R0.392 CC#CCOCCCCCCCCCC 34a_100000210711_100000748600 [0,0,0,0,0,0|2,0,2]=4 953 B14R0.392 CC#CCOCCCCCCCCCC 34a_100000761923_100000210320 [0,0,0,0,0,0|2,0,2]=4 954 B14R0.392 CC#CCOCCCCCCCCCC 7a_100000210711_100000748600 [0,0,0,0,0,0|2,0,2]=4 955 B14R0.392 CC#CCSCCCCCCCCCC 62a_100000748600_100000210320 [0,0,0,0,0,0|2,0,2]=4 956 B14R0.392 CC/C=C/CCCOCCCCCC=O 7a_100016287902_100000139337 [0,0,0,0,0,0|1,0,2]=3 957 B14R0.392 CC/C=C\CCCCCOCCCC=O 7a_100016268722_200011292268 [0,0,0,0,0,0|1,0,2]=3 958 B14R0.392 CC/C=C\CCCCOCCCCC=O 7a_100016287862_100000139335 [0,0,0,0,0,0|1,0,2]=3 959 B14R0.392 CC=C=CCCOCCCCCCCC 34a_100011020354_100000210759 [0,0,0,0,0,0|2,0,2]=4 960 B14R0.392 CC=CCCCOCCCCCCCC 34a_100020645299_100000210759 [0,0,0,0,0,0|2,0,1]=3 961 B14R0.392 CC=CCCCOCCCCCCCO 34a_100020645299_100000760002 [0,0,0,0,0,0|3,0,1]=4 962 B14R0.392 CC=CCCCOCCCCCCOC 34a_100020645299_100011998445 [0,0,0,0,0,0|3,0,1]=4 963 B14R0.392 CC=CCNCCCCCCCCCC 2230a_100000684558_100000070051 [0,0,0,0,0,0|2,0,1]=3 964 B14R0.392 CC=CCNCCCCCCCCCC 34a_100000684558_100000070051 [0,0,0,0,0,0|2,0,1]=3 965 B14R0.392 CC=CCNCCCCCCCCCO 2230a_100000078944_100000070051 [0,0,0,0,0,0|3,0,1]=4 966 B14R0.392 CC=CCNCCCCCCCCCO 34a_100000078944_100000070051 [0,0,0,0,0,0|3,0,1]=4 967 B14R0.392 CC=CCOCCCCCCCCCBr 34a_100009813782_100000070051 [0,0,0,0,0,0|3,0,1]=4 968 B14R0.392 CC=CCOCCCCCCCCCBr 7a_100009813782_100000070051 [0,0,0,0,0,0|3,0,1]=4 969 B14R0.392 CC=CCOCCCCCCCCCC 34a_100000210711_100000070051 [0,0,0,0,0,0|2,0,1]=3 970 B14R0.392 CC=CCOCCCCCCCCCC 7a_100000210711_100000070051 [0,0,0,0,0,0|2,0,1]=3 971 B14R0.392 CC=CCOCCCCCCCCCCl 34a_100009868337_100000070051 [0,0,0,0,0,0|3,0,1]=4 972 B14R0.392 CC=CCOCCCCCCCCCCl 7a_100009868337_100000070051 [0,0,0,0,0,0|3,0,1]=4 973 B14R0.392 CC=CCOCCCCCCCCCN 34a_100000078944_100000070051 [0,0,0,0,0,0|3,0,1]=4 974 B14R0.392 CC=CCSCCCCCCCCCC 62a_100000070051_100000210320 [0,0,0,0,0,0|2,0,1]=3 975 B14R0.392 CC=CCSCCCCCCCCCO 62a_100000070051_100009813782 [0,0,0,0,0,0|3,0,1]=4 976 B14R0.392 CC=CCSCCCCCCCCCO 62a_100009813782_100000070051 [0,0,0,0,0,0|3,0,1]=4 977 B14R0.392 CCCC#CCCOCCCCCC=O 7a_100000042726_100000139337 [0,0,0,0,0,0|1,0,2]=3 978 B14R0.392 CCCC/C=C/COCCCCCC=O 7a_200016272032_100000139337 [0,0,0,0,0,0|1,0,2]=3 979 B14R0.392 CCCC/C=C\CCOCCCCC=O 7a_200016286491_100000139335 [0,0,0,0,0,0|1,0,2]=3 980 B14R0.392 CCCCC#CCCCSCCCC=O 62a_200000047210_200011292268 [0,0,0,0,0,0|1,0,2]=3 981 B14R0.392 CCCCC#CCCCSCCCC=O 62a_200011292268_200000047210 [0,0,0,0,0,0|1,0,2]=3 982 B14R0.392 CCCCC#CCCOCCCCC=O 7a_100000037610_100000139335 [0,0,0,0,0,0|1,0,2]=3 983 B14R0.392 CCCCC#CCOCCCCCC=O 7a_200000034558_100000139337 [0,0,0,0,0,0|1,0,2]=3 984 B14R0.392 CCCCC/C=C/COCCCCC=O 7a_100016258190_100000139335 [0,0,0,0,0,0|1,0,2]=3 985 B14R0.392 CCCCC/C=C\CCOCCCC=O 7a_100016277358_200011292268 [0,0,0,0,0,0|1,0,2]=3 986 B14R0.392 CCCCCC#CCCOCCCC=O 7a_200000042877_200011292268 [0,0,0,0,0,0|1,0,2]=3 987 B14R0.392 CCCCCC#CCOCCCCC=O 7a_200000033628_100000139335 [0,0,0,0,0,0|1,0,2]=3 988 B14R0.392 CCCCCC#CCSCCCCC=O 62a_100000139335_100009816472 [0,0,0,0,0,0|1,0,2]=3 989 B14R0.392 CCCCCC#CCSCCCCC=O 62a_100009816472_100000139335 [0,0,0,0,0,0|1,0,2]=3 990 B14R0.392 CCCCCC/C=C/COCCCC=O 7a_200016276170_200011292268 [0,0,0,0,0,0|1,0,2]=3 991 B14R0.392 CCCCCCC#CCOCCCC=O 7a_200000037284_200011292268 [0,0,0,0,0,0|1,0,2]=3 992 B14R0.392 CCCCCCCC/C=C/COCC=O 34a_200020667288_200009817547 [0,0,0,0,0,0|1,0,2]=3 993 B14R0.392 CCCCCCCC/C=C/COCC=O 7a_200020667288_200015260668 [0,0,0,0,0,0|1,0,2]=3 994 B14R0.392 CCCCCCCCCC/C=C/COC 34a_200025761149_200000210301 [0,0,0,0,0,0|2,0,2]=4 995 B14R0.392 CCCCCCCCCC/C=C/COC 7a_200025761149_200000210301 [0,0,0,0,0,0|2,0,2]=4 996 B14R0.392 CCCCCCCCCC/C=C/CO[13CH3] 34a_200025761149_200025704644 [0,0,0,0,0,0|2,0,2]=4 997 B14R0.392 CCCCCCCCCC/C=C/CO[13CH3] 7a_200025761149_200025704644 [0,0,0,0,0,0|2,0,2]=4 998 B14R0.392 CCCCCCCCCCCCCNC 2230a_100011215765_200000210301 [0,0,0,0,0,0|2,0,0]=2 999 B14R0.392 CCCCCCCCCCCCCNC 2230a_106832991635_100000210684 [0,0,0,0,0,0|2,0,0]=2 1000 B14R0.392 CCCCCCCCCCCCCNC 270004a_106832991635_200011215488 [0,0,0,0,0,0|2,0,0]=2 1001 B14R0.392 CCCCCCCCCCCCCNC 34a_100011215765_200000210301 [0,0,0,0,0,0|2,0,0]=2 1002 B14R0.392 CCCCCCCCCCCCCNC 34a_100102657272_100000210684 [0,0,0,0,0,0|2,0,0]=2 1003 B14R0.392 CCCCCCCCCCCCCNC 7a_106832991635_100000210684 [0,0,0,0,0,0|2,0,0]=2 1004 B14R0.392 CCCCCCCCCCCCCN[13CH3] 2230a_100011215765_200025704644 [0,0,0,0,0,0|2,0,0]=2 1005 B14R0.392 CCCCCCCCCCCCCN[13CH3] 34a_100011215765_200025704644 [0,0,0,0,0,0|2,0,0]=2 1006 B14R0.392 CCCCCCCCCCCCCOC 34a_100000185773_200000210301 [0,0,0,0,0,0|2,0,0]=2 1007 B14R0.392 CCCCCCCCCCCCCOC 34a_100138415774_100000210684 [0,0,0,0,0,0|2,0,0]=2 1008 B14R0.392 CCCCCCCCCCCCCOC 7a_100000185773_200000210301 [0,0,0,0,0,0|2,0,0]=2 1009 B14R0.392 CCCCCCCCCCCCCO[13CH3] 34a_100000185773_200025704644 [0,0,0,0,0,0|2,0,0]=2 1010 B14R0.392 CCCCCCCCCCCCCO[13CH3] 7a_100000185773_200025704644 [0,0,0,0,0,0|2,0,0]=2 1011 B14R0.392 CCCCCCCCCCCCCSC 62a_200000210301_100011934334 [0,0,0,0,0,0|2,0,0]=2 1012 B14R0.392 CCCCCCCCCCCCCS[13CH3] 62a_200025704644_100011934334 [0,0,0,0,0,0|2,0,0]=2 1013 B14R0.392 CCCCCCCCCCCCNCC 2230a_100000210451_100000210202 [0,0,0,0,0,0|2,0,1]=3 1014 B14R0.392 CCCCCCCCCCCCNCC 2230a_100015525214_100011215052 [0,0,0,0,0,0|2,0,1]=3 1015 B14R0.392 CCCCCCCCCCCCNCC 270004a_100015525214_100011218549 [0,0,0,0,0,0|2,0,1]=3 1016 B14R0.392 CCCCCCCCCCCCNCC 34a_100000210451_100000210202 [0,0,0,0,0,0|2,0,1]=3 1017 B14R0.392 CCCCCCCCCCCCNCF 34a_100000210451_100015361967 [0,0,0,0,0,0|2,0,1]=3 1018 B14R0.392 CCCCCCCCCCCCOCC 34a_100000210810_100000210202 [0,0,0,0,0,0|2,0,1]=3 1019 B14R0.392 CCCCCCCCCCCCOCC 34a_100121572206_100000759014 [0,0,0,0,0,0|2,0,1]=3 1020 B14R0.392 CCCCCCCCCCCCOCC 7a_100000210810_100000210202 [0,0,0,0,0,0|2,0,1]=3 1021 B14R0.392 CCCCCCCCCCCCOCF 34a_100000210810_100015361967 [0,0,0,0,0,0|2,0,1]=3 1022 B14R0.392 CCCCCCCCCCCCOCF 7a_100000210810_100015361967 [0,0,0,0,0,0|2,0,1]=3 1023 B14R0.392 CCCCCCCCCCCCSCC 62a_100000210202_100000759014 [0,0,0,0,0,0|2,0,1]=3 1024 B14R0.392 CCCCCCCCCCCCSCF 62a_100015361967_100000759014 [0,0,0,0,0,0|2,0,1]=3 1025 B14R0.392 CCCCCCCCCCCNCC#N 2230a_200011215754_100011215382 [0,0,0,0,0,0|2,0,1]=3 1026 B14R0.392 CCCCCCCCCCCNCC=O 2230a_200011215754_200015260668 [0,0,0,0,0,0|1,0,0]=1 1027 B14R0.392 CCCCCCCCCCCNCC=O 34a_200011215754_200009817547 [0,0,0,0,0,0|1,0,0]=1 1028 B14R0.392 CCCCCCCCCCCNCCC 2230a_200011215754_100000210303 [0,0,0,0,0,0|2,0,1]=3 1029 B14R0.392 CCCCCCCCCCCNCCC 34a_200011215754_100000210303 [0,0,0,0,0,0|2,0,1]=3 1030 B14R0.392 CCCCCCCCCCCNCCF 2230a_200011215754_100011217306 [0,0,0,0,0,0|2,0,1]=3 1031 B14R0.392 CCCCCCCCCCCNCCF 34a_100000724931_100011215454 [0,0,0,0,0,0|2,0,1]=3 1032 B14R0.392 CCCCCCCCCCCNCCF 34a_200011215754_100011217306 [0,0,0,0,0,0|2,0,1]=3 1033 B14R0.392 CCCCCCCCCCCNCCO 2230a_100016997473_100011215454 [0,0,0,0,0,0|1,0,2]=3 1034 B14R0.392 CCCCCCCCCCCNCCO 2230a_200011215754_100000211926 [0,0,0,0,0,0|1,0,2]=3 1035 B14R0.392 CCCCCCCCCCCNCCO 34a_100016990907_100011215454 [0,0,0,0,0,0|1,0,2]=3 1036 B14R0.392 CCCCCCCCCCCNCCO 34a_200011215754_100000211926 [0,0,0,0,0,0|1,0,2]=3 1037 B14R0.392 CCCCCCCCCCCNCOC 2230a_200011215754_100000766300 [0,0,0,0,0,0|3,0,0]=3 1038 B14R0.392 CCCCCCCCCCCNCSC 2230a_200011215754_100011218213 [0,0,0,0,0,0|3,0,0]=3 1039 B14R0.392 CCCCCCCCCCCNCSC 34a_200011215754_100011218213 [0,0,0,0,0,0|3,0,0]=3 1040 B14R0.392 CCCCCCCCCCCOCC#N 7a_100000210809_100011215382 [0,0,0,0,0,0|2,0,1]=3 1041 B14R0.392 CCCCCCCCCCCOCC=O 34a_100000210809_200009817547 [0,0,0,0,0,0|1,0,0]=1 1042 B14R0.392 CCCCCCCCCCCOCC=O 7a_100000210809_200015260668 [0,0,0,0,0,0|1,0,0]=1 1043 B14R0.392 CCCCCCCCCCCOCCBr 34a_100000211926_100011215454 [0,0,0,0,0,0|2,0,1]=3 1044 B14R0.392 CCCCCCCCCCCOCCC 34a_100000210258_100011215454 [0,0,0,0,0,0|2,0,1]=3 1045 B14R0.392 CCCCCCCCCCCOCCC 34a_100000210809_100000210303 [0,0,0,0,0,0|2,0,1]=3 1046 B14R0.392 CCCCCCCCCCCOCCC 7a_100000210809_100000210303 [0,0,0,0,0,0|2,0,1]=3 1047 B14R0.392 CCCCCCCCCCCOCCF 34a_100000210809_100011217306 [0,0,0,0,0,0|2,0,1]=3 1048 B14R0.392 CCCCCCCCCCCOCCF 7a_100000210809_100011217306 [0,0,0,0,0,0|2,0,1]=3 1049 B14R0.392 CCCCCCCCCCCOCCN 34a_100000210304_100011215454 [0,0,0,0,0,0|2,0,1]=3 1050 B14R0.392 CCCCCCCCCCCOCCO 34a_100000210809_100000211926 [0,0,0,0,0,0|1,0,2]=3 1051 B14R0.392 CCCCCCCCCCCOCCO 7a_100000210809_100000211926 [0,0,0,0,0,0|1,0,2]=3 1052 B14R0.392 CCCCCCCCCCCOCSC 34a_100000210809_100011218213 [0,0,0,0,0,0|3,0,0]=3 1053 B14R0.392 CCCCCCCCCCCSCC#N 62a_100011215382_100011215454 [0,0,0,0,0,0|2,0,1]=3 1054 B14R0.392 CCCCCCCCCCCSCC=O 62a_200015260668_100011215454 [0,0,0,0,0,0|1,0,0]=1 1055 B14R0.392 CCCCCCCCCCCSCCC 62a_100000210303_100011215454 [0,0,0,0,0,0|2,0,1]=3 1056 B14R0.392 CCCCCCCCCCCSCCF 62a_100011217306_100011215454 [0,0,0,0,0,0|2,0,1]=3 1057 B14R0.392 CCCCCCCCCCCSCCO 62a_100000211926_100011215454 [0,0,0,0,0,0|1,0,2]=3 1058 B14R0.392 CCCCCCCCCCCSCOC 62a_100000766300_100011215454 [0,0,0,0,0,0|3,0,0]=3 1059 B14R0.392 CCCCCCCCCCCSCSC 62a_100011218213_100011215454 [0,0,0,0,0,0|3,0,0]=3 1060 B14R0.392 CCCCCCCCCCNCCC#N 2230a_100000684558_100011215226 [0,0,0,0,0,0|2,0,1]=3 1061 B14R0.392 CCCCCCCCCCNCCCC 2230a_100000102301_100000210320 [0,0,0,0,0,0|2,0,1]=3 1062 B14R0.392 CCCCCCCCCCNCCCC 2230a_100000684558_100000210211 [0,0,0,0,0,0|2,0,1]=3 1063 B14R0.392 CCCCCCCCCCNCCCC 34a_100000684558_100000210210 [0,0,0,0,0,0|2,0,1]=3 1064 B14R0.392 CCCCCCCCCCNCCCC 7a_106832991798_100000210320 [0,0,0,0,0,0|2,0,1]=3 1065 B14R0.392 CCCCCCCCCCNCCCF 2230a_100000684558_100011934791 [0,0,0,0,0,0|2,0,1]=3 1066 B14R0.392 CCCCCCCCCCNCCCF 2230a_100015189416_100000210320 [0,0,0,0,0,0|2,0,1]=3 1067 B14R0.392 CCCCCCCCCCNCCCF 34a_100000684558_100011934791 [0,0,0,0,0,0|2,0,1]=3 1068 B14R0.392 CCCCCCCCCCNCCCF 34a_100015189416_100000210320 [0,0,0,0,0,0|2,0,1]=3 1069 B14R0.392 CCCCCCCCCCNCCCO 2230a_100000684558_100000230001 [0,0,0,0,0,0|1,0,2]=3 1070 B14R0.392 CCCCCCCCCCNCCCO 34a_100000684558_100000230001 [0,0,0,0,0,0|1,0,2]=3 1071 B14R0.392 CCCCCCCCCCNCCOC 2230a_100000209980_100000210320 [0,0,0,0,0,0|3,0,0]=3 1072 B14R0.392 CCCCCCCCCCNCCOC 2230a_100000684558_100011201679 [0,0,0,0,0,0|3,0,0]=3 1073 B14R0.392 CCCCCCCCCCNCCOC 34a_100000684558_100011201679 [0,0,0,0,0,0|3,0,0]=3 1074 B14R0.392 CCCCCCCCCCNCCSC 2230a_100000684558_100000751147 [0,0,0,0,0,0|3,0,0]=3 1075 B14R0.392 CCCCCCCCCCNCCSC 2230a_100020590264_100000210320 [0,0,0,0,0,0|3,0,0]=3 1076 B14R0.392 CCCCCCCCCCNCCSC 34a_100000684558_100000212216 [0,0,0,0,0,0|3,0,0]=3 1077 B14R0.392 CCCCCCCCCCOCCC#N 7a_100000210711_100000184422 [0,0,0,0,0,0|2,0,1]=3 1078 B14R0.392 CCCCCCCCCCOCCCBr 34a_100011217188_100000210320 [0,0,0,0,0,0|2,0,1]=3 1079 B14R0.392 CCCCCCCCCCOCCCC 34a_100000210227_100000210320 [0,0,0,0,0,0|2,0,1]=3 1080 B14R0.392 CCCCCCCCCCOCCCC 34a_100000210711_100000210210 [0,0,0,0,0,0|2,0,1]=3 1081 B14R0.392 CCCCCCCCCCOCCCC 7a_100000210227_100000210320 [0,0,0,0,0,0|2,0,1]=3 1082 B14R0.392 CCCCCCCCCCOCCCC 7a_100000210711_100000210211 [0,0,0,0,0,0|2,0,1]=3 1083 B14R0.392 CCCCCCCCCCOCCCCl 34a_100000230001_100000210320 [0,0,0,0,0,0|2,0,1]=3 1084 B14R0.392 CCCCCCCCCCOCCCF 34a_100000210711_100011934791 [0,0,0,0,0,0|2,0,1]=3 1085 B14R0.392 CCCCCCCCCCOCCCF 34a_100000759539_100000210320 [0,0,0,0,0,0|2,0,1]=3 1086 B14R0.392 CCCCCCCCCCOCCCF 7a_100000210711_100011934791 [0,0,0,0,0,0|2,0,1]=3 1087 B14R0.392 CCCCCCCCCCOCCCN 34a_100000182051_100000210320 [0,0,0,0,0,0|2,0,1]=3 1088 B14R0.392 CCCCCCCCCCOCCCO 34a_100000210711_100000230001 [0,0,0,0,0,0|1,0,2]=3 1089 B14R0.392 CCCCCCCCCCOCCCO 7a_100000210711_100011215043 [0,0,0,0,0,0|1,0,2]=3 1090 B14R0.392 CCCCCCCCCCOCCOC 34a_100000210237_100000210320 [0,0,0,0,0,0|3,0,0]=3 1091 B14R0.392 CCCCCCCCCCOCCOC 34a_100000210711_100011201679 [0,0,0,0,0,0|3,0,0]=3 1092 B14R0.392 CCCCCCCCCCOCCOC 7a_100000210711_100000233755 [0,0,0,0,0,0|3,0,0]=3 1093 B14R0.392 CCCCCCCCCCOCCON 34a_100000700252_100000210320 [0,0,0,0,0,0|3,0,0]=3 1094 B14R0.392 CCCCCCCCCCOCCSC 34a_100000210711_100000212216 [0,0,0,0,0,0|3,0,0]=3 1095 B14R0.392 CCCCCCCCCCOCCSC 34a_100000230434_100000210320 [0,0,0,0,0,0|3,0,0]=3 1096 B14R0.392 CCCCCCCCCCOCCSC 7a_100000210711_100000212216 [0,0,0,0,0,0|3,0,0]=3 1097 B14R0.392 CCCCCCCCCCOCCSC 7a_100000230434_100000210320 [0,0,0,0,0,0|3,0,0]=3 1098 B14R0.392 CCCCCCCCCCSCCC#N 62a_100011215226_100000210320 [0,0,0,0,0,0|2,0,1]=3 1099 B14R0.392 CCCCCCCCCCSCCCC 62a_100000210211_100000210320 [0,0,0,0,0,0|2,0,1]=3 1100 B14R0.392 CCCCCCCCCCSCCCF 62a_100011934791_100000210320 [0,0,0,0,0,0|2,0,1]=3 1101 B14R0.392 CCCCCCCCCCSCCCO 62a_100011215043_100000210320 [0,0,0,0,0,0|1,0,2]=3 1102 B14R0.392 CCCCCCCCCCSCCOC 34a_100011628728_200000210301 [0,0,0,0,0,0|3,0,0]=3 1103 B14R0.392 CCCCCCCCCCSCCOC 62a_100000233755_100000210320 [0,0,0,0,0,0|3,0,0]=3 1104 B14R0.392 CCCCCCCCCCSCCOC 7a_100011628728_200000210301 [0,0,0,0,0,0|3,0,0]=3 1105 B14R0.392 CCCCCCCCCCSCCO[13CH3] 34a_100011628728_200025704644 [0,0,0,0,0,0|3,0,0]=3 1106 B14R0.392 CCCCCCCCCCSCCO[13CH3] 7a_100011628728_200025704644 [0,0,0,0,0,0|3,0,0]=3 1107 B14R0.392 CCCCCCCCCCSCCSC 62a_100000212216_100000210320 [0,0,0,0,0,0|3,0,0]=3 1108 B14R0.392 CCCCCCCCCCSCOCC 62a_100000739092_100000210320 [0,0,0,0,0,0|3,0,1]=4 1109 B14R0.392 CCCCCCCCCCSCSC#N 62a_100000211825_100000210320 [0,0,0,0,0,0|3,0,1]=4 1110 B14R0.392 CCCCCCCCCNCCCC#N 2230a_100000212291_100000687738 [0,0,0,0,0,0|2,0,1]=3 1111 B14R0.392 CCCCCCCCCNCCCC=O 2230a_100000212291_200011292268 [0,0,0,0,0,0|1,0,0]=1 1112 B14R0.392 CCCCCCCCCNCCCCC 2230a_100000209983_100011214924 [0,0,0,0,0,0|2,0,1]=3 1113 B14R0.392 CCCCCCCCCNCCCCC 2230a_100000212291_100000210326 [0,0,0,0,0,0|2,0,1]=3 1114 B14R0.392 CCCCCCCCCNCCCCC 34a_100000212291_100000718602 [0,0,0,0,0,0|2,0,1]=3 1115 B14R0.392 CCCCCCCCCNCCCCF 2230a_100000212291_100000729493 [0,0,0,0,0,0|2,0,1]=3 1116 B14R0.392 CCCCCCCCCNCCCCF 34a_100000212291_100000729493 [0,0,0,0,0,0|2,0,1]=3 1117 B14R0.392 CCCCCCCCCNCCCCO 2230a_100000212291_100000210776 [0,0,0,0,0,0|1,0,2]=3 1118 B14R0.392 CCCCCCCCCNCCCCO 2230a_100000750430_100011214924 [0,0,0,0,0,0|1,0,2]=3 1119 B14R0.392 CCCCCCCCCNCCCCO 34a_100000212291_100011216708 [0,0,0,0,0,0|1,0,2]=3 1120 B14R0.392 CCCCCCCCCNCCCCO 34a_100000750430_100011214924 [0,0,0,0,0,0|1,0,2]=3 1121 B14R0.392 CCCCCCCCCNCCCOC 2230a_100000212291_100000740836 [0,0,0,0,0,0|3,0,0]=3 1122 B14R0.392 CCCCCCCCCNCCCOC 34a_100000212291_100000740836 [0,0,0,0,0,0|3,0,0]=3 1123 B14R0.392 CCCCCCCCCNCCCOC 34a_100150723488_100011214924 [0,0,0,0,0,0|3,0,0]=3 1124 B14R0.392 CCCCCCCCCNCCCSC 2230a_100000749238_100011214924 [0,0,0,0,0,0|3,0,0]=3 1125 B14R0.392 CCCCCCCCCNCCOCC 2230a_100000212291_100011215890 [0,0,0,0,0,0|3,0,1]=4 1126 B14R0.392 CCCCCCCCCNCCOCC 2230a_102516460346_100011214924 [0,0,0,0,0,0|3,0,1]=4 1127 B14R0.392 CCCCCCCCCNCCOCC 34a_100000212291_100000210147 [0,0,0,0,0,0|3,0,1]=4 1128 B14R0.392 CCCCCCCCCNCCOCC 34a_102516460346_100011214924 [0,0,0,0,0,0|3,0,1]=4 1129 B14R0.392 CCCCCCCCCNCCSCC 2230a_100000106463_100011214924 [0,0,0,0,0,0|3,0,1]=4 1130 B14R0.392 CCCCCCCCCNCCSCC 2230a_100000212291_100000757381 [0,0,0,0,0,0|3,0,1]=4 1131 B14R0.392 CCCCCCCCCNCCSCC 34a_100000212291_100000757381 [0,0,0,0,0,0|3,0,1]=4 1132 B14R0.392 CCCCCCCCCOCCCC#N 7a_100000210712_100000687738 [0,0,0,0,0,0|2,0,1]=3 1133 B14R0.392 CCCCCCCCCOCCCC=O 7a_100000210712_200011292268 [0,0,0,0,0,0|1,0,0]=1 1134 B14R0.392 CCCCCCCCCOCCCCBr 34a_100011216708_100011214924 [0,0,0,0,0,0|2,0,1]=3 1135 B14R0.392 CCCCCCCCCOCCCCC 34a_100000210253_100011214924 [0,0,0,0,0,0|2,0,1]=3 1136 B14R0.392 CCCCCCCCCOCCCCC 34a_100000210712_100000718602 [0,0,0,0,0,0|2,0,1]=3 1137 B14R0.392 CCCCCCCCCOCCCCC 7a_100000210253_100000210328 [0,0,0,0,0,0|2,0,1]=3 1138 B14R0.392 CCCCCCCCCOCCCCC 7a_100000210712_100000210326 [0,0,0,0,0,0|2,0,1]=3 1139 B14R0.392 CCCCCCCCCOCCCCCl 34a_100000210776_100011214924 [0,0,0,0,0,0|2,0,1]=3 1140 B14R0.392 CCCCCCCCCOCCCCCl 7a_100000210776_100000210328 [0,0,0,0,0,0|2,0,1]=3 1141 B14R0.392 CCCCCCCCCOCCCCF 34a_100000210712_100000729493 [0,0,0,0,0,0|2,0,1]=3 1142 B14R0.392 CCCCCCCCCOCCCCF 34a_100011995726_100011214924 [0,0,0,0,0,0|2,0,1]=3 1143 B14R0.392 CCCCCCCCCOCCCCF 7a_100000210712_100000729493 [0,0,0,0,0,0|2,0,1]=3 1144 B14R0.392 CCCCCCCCCOCCCCF 7a_100011995726_100000210328 [0,0,0,0,0,0|2,0,1]=3 1145 B14R0.392 CCCCCCCCCOCCCCI 34a_200012148704_100011214924 [0,0,0,0,0,0|2,0,1]=3 1146 B14R0.392 CCCCCCCCCOCCCCN 34a_100000750430_100011214924 [0,0,0,0,0,0|2,0,1]=3 1147 B14R0.392 CCCCCCCCCOCCCCO 34a_100000210712_100011216708 [0,0,0,0,0,0|1,0,2]=3 1148 B14R0.392 CCCCCCCCCOCCCCO 7a_100000210712_100000210776 [0,0,0,0,0,0|1,0,2]=3 1149 B14R0.392 CCCCCCCCCOCCCNC 34a_100000213112_100011214924 [0,0,0,0,0,0|3,0,0]=3 1150 B14R0.392 CCCCCCCCCOCCCOC 34a_100000210712_100000740836 [0,0,0,0,0,0|3,0,0]=3 1151 B14R0.392 CCCCCCCCCOCCCOC 34a_100000740835_100011214924 [0,0,0,0,0,0|3,0,0]=3 1152 B14R0.392 CCCCCCCCCOCCCOC 7a_100000210712_100000740836 [0,0,0,0,0,0|3,0,0]=3 1153 B14R0.392 CCCCCCCCCOCCCSC 34a_100000690336_100011214924 [0,0,0,0,0,0|3,0,0]=3 1154 B14R0.392 CCCCCCCCCOCCCSC 7a_100000690336_100000210328 [0,0,0,0,0,0|3,0,0]=3 1155 B14R0.392 CCCCCCCCCOCCOCC 34a_100000210136_100011214924 [0,0,0,0,0,0|3,0,1]=4 1156 B14R0.392 CCCCCCCCCOCCOCC 34a_100000210712_100000210147 [0,0,0,0,0,0|3,0,1]=4 1157 B14R0.392 CCCCCCCCCOCCOCC 7a_100000210136_100000210328 [0,0,0,0,0,0|3,0,1]=4 1158 B14R0.392 CCCCCCCCCOCCOCC 7a_100000210712_100011215890 [0,0,0,0,0,0|3,0,1]=4 1159 B14R0.392 CCCCCCCCCOCCSCC 34a_100000210712_100000757381 [0,0,0,0,0,0|3,0,1]=4 1160 B14R0.392 CCCCCCCCCOCCSCC 34a_100000212035_100011214924 [0,0,0,0,0,0|3,0,1]=4 1161 B14R0.392 CCCCCCCCCOCCSCC 7a_100000210712_100000757381 [0,0,0,0,0,0|3,0,1]=4 1162 B14R0.392 CCCCCCCCCOCCSCC 7a_100000212035_100000210328 [0,0,0,0,0,0|3,0,1]=4 1163 B14R0.392 CCCCCCCCCSCCCC#N 62a_100000687738_100000210670 [0,0,0,0,0,0|2,0,1]=3 1164 B14R0.392 CCCCCCCCCSCCCC=O 62a_200011292268_100000210670 [0,0,0,0,0,0|1,0,0]=1 1165 B14R0.392 CCCCCCCCCSCCCCC 62a_100000210326_100000210670 [0,0,0,0,0,0|2,0,1]=3 1166 B14R0.392 CCCCCCCCCSCCCCF 62a_100000729493_100000210670 [0,0,0,0,0,0|2,0,1]=3 1167 B14R0.392 CCCCCCCCCSCCCCO 62a_100000210776_100000210670 [0,0,0,0,0,0|1,0,2]=3 1168 B14R0.392 CCCCCCCCCSCCCOC 62a_100000709357_100000210670 [0,0,0,0,0,0|3,0,0]=3 1169 B14R0.392 CCCCCCCCCSCCOCC 62a_100000210147_100000210670 [0,0,0,0,0,0|3,0,1]=4 1170 B14R0.392 CCCCCCCCCSCCSC#N 62a_100000034367_100000210670 [0,0,0,0,0,0|3,0,1]=4 1171 B14R0.392 CCCCCCCCCSCCSCC 62a_100000757381_100000210670 [0,0,0,0,0,0|3,0,1]=4 1172 B14R0.392 CCCCCCCCNCCCCC#N 2230a_100000229939_100000211819 [0,0,0,0,0,0|2,0,1]=3 1173 B14R0.392 CCCCCCCCNCCCCC=O 2230a_100000229939_100000139335 [0,0,0,0,0,0|1,0,0]=1 1174 B14R0.392 CCCCCCCCNCCCCCC 2230a_100000210581_100000210759 [0,0,0,0,0,0|2,0,1]=3 1175 B14R0.392 CCCCCCCCNCCCCCC 2230a_100000229939_100000210314 [0,0,0,0,0,0|2,0,1]=3 1176 B14R0.392 CCCCCCCCNCCCCCC 34a_100000229939_100000210314 [0,0,0,0,0,0|2,0,1]=3 1177 B14R0.392 CCCCCCCCNCCCCCF 2230a_100000229939_100000729378 [0,0,0,0,0,0|2,0,1]=3 1178 B14R0.392 CCCCCCCCNCCCCCF 34a_100000229939_100000729378 [0,0,0,0,0,0|2,0,1]=3 1179 B14R0.392 CCCCCCCCNCCCCCO 2230a_100000229939_100000746330 [0,0,0,0,0,0|1,0,2]=3 1180 B14R0.392 CCCCCCCCNCCCCCO 2230a_100000762737_100000210759 [0,0,0,0,0,0|1,0,2]=3 1181 B14R0.392 CCCCCCCCNCCCCCO 34a_100000229939_100000746330 [0,0,0,0,0,0|1,0,2]=3 1182 B14R0.392 CCCCCCCCNCCCCCO 34a_100000762737_100000210759 [0,0,0,0,0,0|1,0,2]=3 1183 B14R0.392 CCCCCCCCNCCCCOC 2230a_100000229939_100000730899 [0,0,0,0,0,0|3,0,0]=3 1184 B14R0.392 CCCCCCCCNCCCCOC 34a_100000229939_100000755781 [0,0,0,0,0,0|3,0,0]=3 1185 B14R0.392 CCCCCCCCNCCCN=[N+]=[N-] 2230a_100000744732_100000210759 [0,0,0,0,0,0|4,0,0]=4 1186 B14R0.392 CCCCCCCCNCCCOCC 2230a_100000210961_100000210759 [0,0,0,0,0,0|3,0,1]=4 1187 B14R0.392 CCCCCCCCNCCCOCC 2230a_100000229939_100012232248 [0,0,0,0,0,0|3,0,1]=4 1188 B14R0.392 CCCCCCCCNCCCOCC 34a_100000210961_100000210759 [0,0,0,0,0,0|3,0,1]=4 1189 B14R0.392 CCCCCCCCNCCCOCC 34a_100000229939_100012232248 [0,0,0,0,0,0|3,0,1]=4 1190 B14R0.392 CCCCCCCCNCCOCC#N 2230a_100000229939_200000047693 [0,0,0,0,0,0|3,0,1]=4 1191 B14R0.392 CCCCCCCCNCCOCCC 2230a_100000229939_100011215938 [0,0,0,0,0,0|3,0,1]=4 1192 B14R0.392 CCCCCCCCNCCOCCC 2230a_100161115042_100000210759 [0,0,0,0,0,0|3,0,1]=4 1193 B14R0.392 CCCCCCCCNCCOCCC 34a_100000229939_100011215938 [0,0,0,0,0,0|3,0,1]=4 1194 B14R0.392 CCCCCCCCNCCOCCC 34a_100161115042_100000210759 [0,0,0,0,0,0|3,0,1]=4 1195 B14R0.392 CCCCCCCCNCCOCCO 2230a_100000211614_100000210759 [0,0,0,0,0,0|2,0,2]=4 1196 B14R0.392 CCCCCCCCNCCOCCO 2230a_100000229939_100011215305 [0,0,0,0,0,0|2,0,2]=4 1197 B14R0.392 CCCCCCCCNCCOCCO 34a_100000211614_100000210759 [0,0,0,0,0,0|2,0,2]=4 1198 B14R0.392 CCCCCCCCNCCOCCO 34a_100000229939_100000692535 [0,0,0,0,0,0|2,0,2]=4 1199 B14R0.392 CCCCCCCCNCCSCCC 2230a_100020603323_100000210759 [0,0,0,0,0,0|3,0,1]=4 1200 B14R0.392 CCCCCCCCNCCSCCO 2230a_100011219999_100000210759 [0,0,0,0,0,0|2,0,2]=4 1201 B14R0.392 CCCCCCCCNCOCCCC 2230a_100000229939_100011995733 [0,0,0,0,0,0|3,0,1]=4 1202 B14R0.392 CCCCCCCCNCOCCCC 34a_100000229939_100011995733 [0,0,0,0,0,0|3,0,1]=4 1203 B14R0.392 CCCCCCCCNCOCCOC 2230a_100000229939_100000231047 [0,0,0,0,0,0|4,0,0]=4 1204 B14R0.392 CCCCCCCCOCCCCC#N 7a_100000210232_100000211819 [0,0,0,0,0,0|2,0,1]=3 1205 B14R0.392 CCCCCCCCOCCCCC=O 7a_100000210232_100000139335 [0,0,0,0,0,0|1,0,0]=1 1206 B14R0.392 CCCCCCCCOCCCCCBr 34a_100000746331_100000210759 [0,0,0,0,0,0|2,0,1]=3 1207 B14R0.392 CCCCCCCCOCCCCCBr 7a_100000746331_100000210759 [0,0,0,0,0,0|2,0,1]=3 1208 B14R0.392 CCCCCCCCOCCCCCC 34a_100000210232_100000210314 [0,0,0,0,0,0|2,0,1]=3 1209 B14R0.392 CCCCCCCCOCCCCCC 34a_100000210259_100000210759 [0,0,0,0,0,0|2,0,1]=3 1210 B14R0.392 CCCCCCCCOCCCCCC 7a_100000210232_100000210314 [0,0,0,0,0,0|2,0,1]=3 1211 B14R0.392 CCCCCCCCOCCCCCC 7a_100000210259_100000210759 [0,0,0,0,0,0|2,0,1]=3 1212 B14R0.392 CCCCCCCCOCCCCCCl 34a_100000746330_100000210759 [0,0,0,0,0,0|2,0,1]=3 1213 B14R0.392 CCCCCCCCOCCCCCCl 7a_100000746330_100000210759 [0,0,0,0,0,0|2,0,1]=3 1214 B14R0.392 CCCCCCCCOCCCCCF 34a_100000210232_100000729378 [0,0,0,0,0,0|2,0,1]=3 1215 B14R0.392 CCCCCCCCOCCCCCF 7a_100000210232_100000729378 [0,0,0,0,0,0|2,0,1]=3 1216 B14R0.392 CCCCCCCCOCCCCCI 34a_200012148887_100000210759 [0,0,0,0,0,0|2,0,1]=3 1217 B14R0.392 CCCCCCCCOCCCCCI 7a_200012148887_100000210759 [0,0,0,0,0,0|2,0,1]=3 1218 B14R0.392 CCCCCCCCOCCCCCN 34a_100000762737_100000210759 [0,0,0,0,0,0|2,0,1]=3 1219 B14R0.392 CCCCCCCCOCCCCCO 34a_100000210232_100000746330 [0,0,0,0,0,0|1,0,2]=3 1220 B14R0.392 CCCCCCCCOCCCCCO 7a_100000210232_100000746330 [0,0,0,0,0,0|1,0,2]=3 1221 B14R0.392 CCCCCCCCOCCCCOC 34a_100000210232_100000755781 [0,0,0,0,0,0|3,0,0]=3 1222 B14R0.392 CCCCCCCCOCCCCOC 34a_100000740925_100000210759 [0,0,0,0,0,0|3,0,0]=3 1223 B14R0.392 CCCCCCCCOCCCCOC 7a_100000210232_100000730899 [0,0,0,0,0,0|3,0,0]=3 1224 B14R0.392 CCCCCCCCOCCCCSC 34a_100011217163_100000210759 [0,0,0,0,0,0|3,0,0]=3 1225 B14R0.392 CCCCCCCCOCCCCSC 7a_100011217163_100000210759 [0,0,0,0,0,0|3,0,0]=3 1226 B14R0.392 CCCCCCCCOCCCOCC 34a_100000210232_100012232248 [0,0,0,0,0,0|3,0,1]=4 1227 B14R0.392 CCCCCCCCOCCCOCC 34a_100000757476_100000210759 [0,0,0,0,0,0|3,0,1]=4 1228 B14R0.392 CCCCCCCCOCCCOCC 7a_100000210232_100012232248 [0,0,0,0,0,0|3,0,1]=4 1229 B14R0.392 CCCCCCCCOCCCOCC 7a_100000757476_100000210759 [0,0,0,0,0,0|3,0,1]=4 1230 B14R0.392 CCCCCCCCOCCCSCC 34a_100011216438_100000210759 [0,0,0,0,0,0|3,0,1]=4 1231 B14R0.392 CCCCCCCCOCCCSCC 7a_100011216438_100000210759 [0,0,0,0,0,0|3,0,1]=4 1232 B14R0.392 CCCCCCCCOCCOCC#N 7a_100000210232_200000047693 [0,0,0,0,0,0|3,0,1]=4 1233 B14R0.392 CCCCCCCCOCCOCCBr 34a_100000692535_100000210759 [0,0,0,0,0,0|3,0,1]=4 1234 B14R0.392 CCCCCCCCOCCOCCBr 7a_100000692535_100000210759 [0,0,0,0,0,0|3,0,1]=4 1235 B14R0.392 CCCCCCCCOCCOCCC 34a_100000210232_100011215938 [0,0,0,0,0,0|3,0,1]=4 1236 B14R0.392 CCCCCCCCOCCOCCC 34a_100000752267_100000210759 [0,0,0,0,0,0|3,0,1]=4 1237 B14R0.392 CCCCCCCCOCCOCCC 7a_100000210232_100011215938 [0,0,0,0,0,0|3,0,1]=4 1238 B14R0.392 CCCCCCCCOCCOCCC 7a_100000752267_100000210759 [0,0,0,0,0,0|3,0,1]=4 1239 B14R0.392 CCCCCCCCOCCOCCCl 34a_100011215305_100000210759 [0,0,0,0,0,0|3,0,1]=4 1240 B14R0.392 CCCCCCCCOCCOCCCl 7a_100011215305_100000210759 [0,0,0,0,0,0|3,0,1]=4 1241 B14R0.392 CCCCCCCCOCCOCCF 34a_200015357709_100000210759 [0,0,0,0,0,0|3,0,1]=4 1242 B14R0.392 CCCCCCCCOCCOCCF 7a_200015357709_100000210759 [0,0,0,0,0,0|3,0,1]=4 1243 B14R0.392 CCCCCCCCOCCOCCI 34a_100012149058_100000210759 [0,0,0,0,0,0|3,0,1]=4 1244 B14R0.392 CCCCCCCCOCCOCCI 7a_100012149058_100000210759 [0,0,0,0,0,0|3,0,1]=4 1245 B14R0.392 CCCCCCCCOCCOCCN 34a_100000211614_100000210759 [0,0,0,0,0,0|3,0,1]=4 1246 B14R0.392 CCCCCCCCOCCOCCO 34a_100000210232_100000692535 [0,0,0,0,0,0|2,0,2]=4 1247 B14R0.392 CCCCCCCCOCCOCCO 7a_100000210232_100011215305 [0,0,0,0,0,0|2,0,2]=4 1248 B14R0.392 CCCCCCCCOCCSCCC 34a_200000230433_100000210759 [0,0,0,0,0,0|3,0,1]=4 1249 B14R0.392 CCCCCCCCOCCSCCC 7a_200000230433_100000210759 [0,0,0,0,0,0|3,0,1]=4 1250 B14R0.392 CCCCCCCCOCOCCCC 34a_100000210232_100011995733 [0,0,0,0,0,0|3,0,1]=4 1251 B14R0.392 CCCCCCCCSCCCCC#N 62a_100000210759_100000211819 [0,0,0,0,0,0|2,0,1]=3 1252 B14R0.392 CCCCCCCCSCCCCC#N 62a_100011219923_100000210317 [0,0,0,0,0,0|2,0,1]=3 1253 B14R0.392 CCCCCCCCSCCCCC=O 62a_100000139335_100000210317 [0,0,0,0,0,0|1,0,0]=1 1254 B14R0.392 CCCCCCCCSCCCCC=O 62a_100000210759_100000139335 [0,0,0,0,0,0|1,0,0]=1 1255 B14R0.392 CCCCCCCCSCCCCCC 62a_100000210314_100000210317 [0,0,0,0,0,0|2,0,1]=3 1256 B14R0.392 CCCCCCCCSCCCCCC 62a_100000210759_100000210757 [0,0,0,0,0,0|2,0,1]=3 1257 B14R0.392 CCCCCCCCSCCCCCF 62a_100000210759_100000729378 [0,0,0,0,0,0|2,0,1]=3 1258 B14R0.392 CCCCCCCCSCCCCCF 62a_100000729378_100000210317 [0,0,0,0,0,0|2,0,1]=3 1259 B14R0.392 CCCCCCCCSCCCCCO 62a_100000210759_100000746330 [0,0,0,0,0,0|1,0,2]=3 1260 B14R0.392 CCCCCCCCSCCCCCO 62a_100000746330_100000210317 [0,0,0,0,0,0|1,0,2]=3 1261 B14R0.392 CCCCCCCCSCCCCOC 62a_100000210759_100000730899 [0,0,0,0,0,0|3,0,0]=3 1262 B14R0.392 CCCCCCCCSCCCCOC 62a_100000730899_100000210317 [0,0,0,0,0,0|3,0,0]=3 1263 B14R0.392 CCCCCCCCSCCCOCC 62a_100000210759_100012232248 [0,0,0,0,0,0|3,0,1]=4 1264 B14R0.392 CCCCCCCCSCCCOCC 62a_100012232248_100000210317 [0,0,0,0,0,0|3,0,1]=4 1265 B14R0.392 CCCCCCCCSCCOCC#N 62a_100000210759_200000047693 [0,0,0,0,0,0|3,0,1]=4 1266 B14R0.392 CCCCCCCCSCCOCC#N 62a_200000047693_100000210317 [0,0,0,0,0,0|3,0,1]=4 1267 B14R0.392 CCCCCCCCSCCOCCC 62a_100000210759_100011215938 [0,0,0,0,0,0|3,0,1]=4 1268 B14R0.392 CCCCCCCCSCCOCCC 62a_100011215938_100000210317 [0,0,0,0,0,0|3,0,1]=4 1269 B14R0.392 CCCCCCCCSCCOCCO 62a_100000210759_100011215305 [0,0,0,0,0,0|2,0,2]=4 1270 B14R0.392 CCCCCCCCSCCOCCO 62a_100011215305_100000210317 [0,0,0,0,0,0|2,0,2]=4 1271 B14R0.392 CCCCCCCCSCOCCCC 62a_100000210759_100011995733 [0,0,0,0,0,0|3,0,1]=4 1272 B14R0.392 CCCCCCCCSCOCCCC 62a_100011995733_100000210317 [0,0,0,0,0,0|3,0,1]=4 1273 B14R0.392 CCCCCCCCSCOCCOC 62a_100000210759_100000231047 [0,0,0,0,0,0|4,0,0]=4 1274 B14R0.392 CCCCCCCCSCOCCOC 62a_100000231047_100000210317 [0,0,0,0,0,0|4,0,0]=4 1275 B14R0.392 CCCCCCCNCCCCCC#N 2230a_100000229938_100009813376 [0,0,0,0,0,0|2,0,1]=3 1276 B14R0.392 CCCCCCCNCCCCCC=O 2230a_100000229938_100000139337 [0,0,0,0,0,0|1,0,0]=1 1277 B14R0.392 CCCCCCCNCCCCCCC 2230a_100000229938_100000210681 [0,0,0,0,0,0|2,0,1]=3 1278 B14R0.392 CCCCCCCNCCCCCCF 2230a_100000229938_100015922095 [0,0,0,0,0,0|2,0,1]=3 1279 B14R0.392 CCCCCCCNCCCCCCO 2230a_100000229938_100000766143 [0,0,0,0,0,0|1,0,2]=3 1280 B14R0.392 CCCCCCCNCCCCCCO 2230a_100000686447_100000210681 [0,0,0,0,0,0|1,0,2]=3 1281 B14R0.392 CCCCCCCNCCCCCCO 34a_100000686447_100000210614 [0,0,0,0,0,0|1,0,2]=3 1282 B14R0.392 CCCCCCCNCCCCCOC 2230a_100000747528_100000210681 [0,0,0,0,0,0|3,0,0]=3 1283 B14R0.392 CCCCCCCNCCCCCOC 34a_100000747528_100000210614 [0,0,0,0,0,0|3,0,0]=3 1284 B14R0.392 CCCCCCCNCCCCN=[N+]=[N-] 2230a_100000101370_100000210681 [0,0,0,0,0,0|4,0,0]=4 1285 B14R0.392 CCCCCCCNCCCOCCC 2230a_100011217757_100000210681 [0,0,0,0,0,0|3,0,1]=4 1286 B14R0.392 CCCCCCCNCCCOCCC 34a_100011217757_100000210614 [0,0,0,0,0,0|3,0,1]=4 1287 B14R0.392 CCCCCCCNCCOCCCC 2230a_100000229938_100000743108 [0,0,0,0,0,0|3,0,1]=4 1288 B14R0.392 CCCCCCCNCCOCCOC 2230a_100000229938_100000695917 [0,0,0,0,0,0|4,0,0]=4 1289 B14R0.392 CCCCCCCNCCOCCOC 2230a_100000745349_100000210681 [0,0,0,0,0,0|4,0,0]=4 1290 B14R0.392 CCCCCCCNCCOCCOC 34a_100000745349_100000210614 [0,0,0,0,0,0|4,0,0]=4 1291 B14R0.392 CCCCCCCNCCSCCCC 2230a_100025743550_100000210681 [0,0,0,0,0,0|3,0,1]=4 1292 B14R0.392 CCCCCCCOCCCCCC#N 7a_100000210272_100009813376 [0,0,0,0,0,0|2,0,1]=3 1293 B14R0.392 CCCCCCCOCCCCCC=O 7a_100000210272_100000139337 [0,0,0,0,0,0|1,0,0]=1 1294 B14R0.392 CCCCCCCOCCCCCCBr 34a_100011215345_100000210614 [0,0,0,0,0,0|2,0,1]=3 1295 B14R0.392 CCCCCCCOCCCCCCBr 7a_100011215345_100000210614 [0,0,0,0,0,0|2,0,1]=3 1296 B14R0.392 CCCCCCCOCCCCCCC 34a_100000210272_100000210614 [0,0,0,0,0,0|2,0,1]=3 1297 B14R0.392 CCCCCCCOCCCCCCC 7a_100000210272_100000210614 [0,0,0,0,0,0|2,0,1]=3 1298 B14R0.392 CCCCCCCOCCCCCCCl 34a_100000766143_100000210614 [0,0,0,0,0,0|2,0,1]=3 1299 B14R0.392 CCCCCCCOCCCCCCCl 7a_100000766143_100000210614 [0,0,0,0,0,0|2,0,1]=3 1300 B14R0.392 CCCCCCCOCCCCCCF 34a_100000210272_100015922095 [0,0,0,0,0,0|2,0,1]=3 1301 B14R0.392 CCCCCCCOCCCCCCF 34a_100000732779_100000210614 [0,0,0,0,0,0|2,0,1]=3 1302 B14R0.392 CCCCCCCOCCCCCCF 7a_100000210272_100015922095 [0,0,0,0,0,0|2,0,1]=3 1303 B14R0.392 CCCCCCCOCCCCCCF 7a_100000732779_100000210614 [0,0,0,0,0,0|2,0,1]=3 1304 B14R0.392 CCCCCCCOCCCCCCN 34a_100000686447_100000210614 [0,0,0,0,0,0|2,0,1]=3 1305 B14R0.392 CCCCCCCOCCCCCCO 34a_100000210272_100000766143 [0,0,0,0,0,0|1,0,2]=3 1306 B14R0.392 CCCCCCCOCCCCCCO 7a_100000210272_100000766143 [0,0,0,0,0,0|1,0,2]=3 1307 B14R0.392 CCCCCCCOCCCCCNC 34a_100000722520_100000210614 [0,0,0,0,0,0|3,0,0]=3 1308 B14R0.392 CCCCCCCOCCOCCCC 34a_100000210238_100000210614 [0,0,0,0,0,0|3,0,1]=4 1309 B14R0.392 CCCCCCCOCCOCCCC 34a_100000210272_100000743108 [0,0,0,0,0,0|3,0,1]=4 1310 B14R0.392 CCCCCCCOCCOCCCC 7a_100000210238_100000210614 [0,0,0,0,0,0|3,0,1]=4 1311 B14R0.392 CCCCCCCOCCOCCCC 7a_100000210272_100000743108 [0,0,0,0,0,0|3,0,1]=4 1312 B14R0.392 CCCCCCCOCCOCCNC 34a_100000228057_100000210614 [0,0,0,0,0,0|4,0,0]=4 1313 B14R0.392 CCCCCCCOCCOCCOC 34a_100000210272_100000695917 [0,0,0,0,0,0|4,0,0]=4 1314 B14R0.392 CCCCCCCOCCOCCOC 34a_100011215163_100000210614 [0,0,0,0,0,0|4,0,0]=4 1315 B14R0.392 CCCCCCCOCCOCCOC 7a_100000210272_100000695917 [0,0,0,0,0,0|4,0,0]=4 1316 B14R0.392 CCCCCCCOCCOCCOC 7a_100011215163_100000210614 [0,0,0,0,0,0|4,0,0]=4 1317 B14R0.392 CCCCCCCOCCSCCCC 34a_200000230436_100000210614 [0,0,0,0,0,0|3,0,1]=4 1318 B14R0.392 CCCCCCCOCCSCCCC 7a_200000230436_100000210614 [0,0,0,0,0,0|3,0,1]=4 1319 B14R0.392 CCCCCCCSCCCCCC#N 62a_100000210614_100009813376 [0,0,0,0,0,0|2,0,1]=3 1320 B14R0.392 CCCCCCCSCCCCCC#N 62a_100009813376_100000210316 [0,0,0,0,0,0|2,0,1]=3 1321 B14R0.392 CCCCCCCSCCCCCC=O 62a_100000139337_100000210316 [0,0,0,0,0,0|1,0,0]=1 1322 B14R0.392 CCCCCCCSCCCCCC=O 62a_100000210614_100000139337 [0,0,0,0,0,0|1,0,0]=1 1323 B14R0.392 CCCCCCCSCCCCCCC 62a_100000210614_100000210316 [0,0,0,0,0,0|2,0,1]=3 1324 B14R0.392 CCCCCCCSCCCCCCF 62a_100000210614_100015922095 [0,0,0,0,0,0|2,0,1]=3 1325 B14R0.392 CCCCCCCSCCCCCCF 62a_100015922095_100000210316 [0,0,0,0,0,0|2,0,1]=3 1326 B14R0.392 CCCCCCCSCCCCCCO 62a_100000210614_100000766143 [0,0,0,0,0,0|1,0,2]=3 1327 B14R0.392 CCCCCCCSCCCCCCO 62a_100000766143_100000210316 [0,0,0,0,0,0|1,0,2]=3 1328 B14R0.392 CCCCCCCSCCOCCCC 62a_100000210614_100000743108 [0,0,0,0,0,0|3,0,1]=4 1329 B14R0.392 CCCCCCCSCCOCCCC 62a_100000743108_100000210316 [0,0,0,0,0,0|3,0,1]=4 1330 B14R0.392 CCCCCCCSCCOCCOC 62a_100000210614_100000695917 [0,0,0,0,0,0|4,0,0]=4 1331 B14R0.392 CCCCCCCSCCOCCOC 62a_100000695917_100000210316 [0,0,0,0,0,0|4,0,0]=4 1332 B14R0.392 CCCCCCNCCCCCCC#N 2230a_100000210581_100009813337 [0,0,0,0,0,0|2,0,1]=3 1333 B14R0.392 CCCCCCNCCCCCCCO 2230a_100000210581_100000760002 [0,0,0,0,0,0|1,0,2]=3 1334 B14R0.392 CCCCCCNCCCCCCCO 2230a_100011996573_100000210314 [0,0,0,0,0,0|1,0,2]=3 1335 B14R0.392 CCCCCCNCCCCCCCO 34a_100011996573_100000210314 [0,0,0,0,0,0|1,0,2]=3 1336 B14R0.392 CCCCCCNCCCCCCOC 2230a_100000210581_100011998445 [0,0,0,0,0,0|3,0,0]=3 1337 B14R0.392 CCCCCCNCCCOCCCC 2230a_200000211371_100000210314 [0,0,0,0,0,0|3,0,1]=4 1338 B14R0.392 CCCCCCNCCCOCCCC 34a_200000211371_100000210314 [0,0,0,0,0,0|3,0,1]=4 1339 B14R0.392 CCCCCCNCCCOCCCO 2230a_100011310245_100000210314 [0,0,0,0,0,0|2,0,2]=4 1340 B14R0.392 CCCCCCNCCCOCCCO 34a_100011310245_100000210314 [0,0,0,0,0,0|2,0,2]=4 1341 B14R0.392 CCCCCCNCCCOCCOC 2230a_100000206027_100000210314 [0,0,0,0,0,0|4,0,0]=4 1342 B14R0.392 CCCCCCNCCCOCCOC 2230a_100000210581_100011216529 [0,0,0,0,0,0|4,0,0]=4 1343 B14R0.392 CCCCCCNCCCOCCOC 34a_100000206027_100000210314 [0,0,0,0,0,0|4,0,0]=4 1344 B14R0.392 CCCCCCOCCCCCCC#N 7a_100000210259_100009813337 [0,0,0,0,0,0|2,0,1]=3 1345 B14R0.392 CCCCCCOCCCCCCCBr 34a_100000760002_100000210314 [0,0,0,0,0,0|2,0,1]=3 1346 B14R0.392 CCCCCCOCCCCCCCBr 7a_100000760002_100000210314 [0,0,0,0,0,0|2,0,1]=3 1347 B14R0.392 CCCCCCOCCCCCCCN 34a_100011996573_100000210314 [0,0,0,0,0,0|2,0,1]=3 1348 B14R0.392 CCCCCCOCCCCCCCO 34a_100000210259_100000760002 [0,0,0,0,0,0|1,0,2]=3 1349 B14R0.392 CCCCCCOCCCCCCCO 7a_100000210259_100000760002 [0,0,0,0,0,0|1,0,2]=3 1350 B14R0.392 CCCCCCOCCCCCCOC 34a_100000210259_100011998445 [0,0,0,0,0,0|3,0,0]=3 1351 B14R0.392 CCCCCCOCCCCCCOC 34a_200012092642_100000210314 [0,0,0,0,0,0|3,0,0]=3 1352 B14R0.392 CCCCCCOCCCCCCOC 7a_100000210259_100011998445 [0,0,0,0,0,0|3,0,0]=3 1353 B14R0.392 CCCCCCOCCCCCCOC 7a_200012092642_100000210314 [0,0,0,0,0,0|3,0,0]=3 1354 B14R0.392 CCCCCCOCCCOCCCC 34a_200011215613_100000210314 [0,0,0,0,0,0|3,0,1]=4 1355 B14R0.392 CCCCCCOCCCOCCCC 7a_200011215613_100000210314 [0,0,0,0,0,0|3,0,1]=4 1356 B14R0.392 CCCCCCOCCCOCCCN 34a_100011310245_100000210314 [0,0,0,0,0,0|3,0,1]=4 1357 B14R0.392 CCCCCCOCCCOCCOC 34a_100000210259_100011216529 [0,0,0,0,0,0|4,0,0]=4 1358 B14R0.392 CCCCCCOCCCOCCOC 7a_100000210259_100011216529 [0,0,0,0,0,0|4,0,0]=4 1359 B14R0.392 CCCCCCOCCNCCCCC 34a_100000224656_100000210314 [0,0,0,0,0,0|3,0,1]=4 1360 B14R0.392 CCCCCCOCCOCCCC#N 7a_100000691444_100000687738 [0,0,0,0,0,0|3,0,1]=4 1361 B14R0.392 CCCCCCOCCOCCCC=O 7a_100000691444_200011292268 [0,0,0,0,0,0|2,0,0]=2 1362 B14R0.392 CCCCCCOCCOCCCCC 34a_100000691444_100000718602 [0,0,0,0,0,0|3,0,1]=4 1363 B14R0.392 CCCCCCOCCOCCCCC 34a_100011215259_100000210314 [0,0,0,0,0,0|3,0,1]=4 1364 B14R0.392 CCCCCCOCCOCCCCC 7a_100000691444_100000210326 [0,0,0,0,0,0|3,0,1]=4 1365 B14R0.392 CCCCCCOCCOCCCCC 7a_100011215259_100000210314 [0,0,0,0,0,0|3,0,1]=4 1366 B14R0.392 CCCCCCOCCOCCCCF 34a_100000691444_100000729493 [0,0,0,0,0,0|3,0,1]=4 1367 B14R0.392 CCCCCCOCCOCCCCF 7a_100000691444_100000729493 [0,0,0,0,0,0|3,0,1]=4 1368 B14R0.392 CCCCCCOCCOCCCCO 34a_100000691444_100011216708 [0,0,0,0,0,0|2,0,2]=4 1369 B14R0.392 CCCCCCOCCOCCCCO 7a_100000691444_100000210776 [0,0,0,0,0,0|2,0,2]=4 1370 B14R0.392 CCCCCCOCCOCCCOC 34a_100000691444_100000740836 [0,0,0,0,0,0|4,0,0]=4 1371 B14R0.392 CCCCCCOCCOCCCOC 7a_100000691444_100000740836 [0,0,0,0,0,0|4,0,0]=4 1372 B14R0.392 CCCCCCSCCCCCCC#N 62a_100000210314_100009813337 [0,0,0,0,0,0|2,0,1]=3 1373 B14R0.392 CCCCCCSCCCCCCC#N 62a_100009813337_100000210757 [0,0,0,0,0,0|2,0,1]=3 1374 B14R0.392 CCCCCCSCCCCCCCO 62a_100000210314_100000760002 [0,0,0,0,0,0|1,0,2]=3 1375 B14R0.392 CCCCCCSCCCCCCCO 62a_100000760002_100000210757 [0,0,0,0,0,0|1,0,2]=3 1376 B14R0.392 CCCCCCSCCCCCCOC 62a_100000210314_100011998445 [0,0,0,0,0,0|3,0,0]=3 1377 B14R0.392 CCCCCCSCCCCCCOC 62a_100011998445_100000210757 [0,0,0,0,0,0|3,0,0]=3 1378 B14R0.392 CCCCCCSCCCOCCOC 62a_100000210314_100011216529 [0,0,0,0,0,0|4,0,0]=4 1379 B14R0.392 CCCCCCSCCCOCCOC 62a_100011216529_100000210757 [0,0,0,0,0,0|4,0,0]=4 1380 B14R0.392 CCCCCNCCCCCCCCO 2230a_100000209983_100000033203 [0,0,0,0,0,0|1,0,2]=3 1381 B14R0.392 CCCCCNCCCCCCCCO 2230a_102515433106_100000210326 [0,0,0,0,0,0|1,0,2]=3 1382 B14R0.392 CCCCCNCCCCCCCCO 34a_102515433106_100000718602 [0,0,0,0,0,0|1,0,2]=3 1383 B14R0.392 CCCCCNCCCCCCN=[N+]=[N-] 2230a_200000049180_100000210326 [0,0,0,0,0,0|4,0,0]=4 1384 B14R0.392 CCCCCNCCOCCCCCF 34a_100000224656_100000729378 [0,0,0,0,0,0|3,0,1]=4 1385 B14R0.392 CCCCCNCCOCCCCCO 34a_100000224656_100000746330 [0,0,0,0,0,0|2,0,2]=4 1386 B14R0.392 CCCCCNCCOCCCCOC 34a_100000224656_100000755781 [0,0,0,0,0,0|4,0,0]=4 1387 B14R0.392 CCCCCOCCCCCCCCBr 34a_100009813846_100000718602 [0,0,0,0,0,0|2,0,1]=3 1388 B14R0.392 CCCCCOCCCCCCCCBr 7a_100009813846_100000210326 [0,0,0,0,0,0|2,0,1]=3 1389 B14R0.392 CCCCCOCCCCCCCCCl 34a_100000033203_100000718602 [0,0,0,0,0,0|2,0,1]=3 1390 B14R0.392 CCCCCOCCCCCCCCCl 7a_100000033203_100000210326 [0,0,0,0,0,0|2,0,1]=3 1391 B14R0.392 CCCCCOCCCCCCCCN 34a_102515433106_100000718602 [0,0,0,0,0,0|2,0,1]=3 1392 B14R0.392 CCCCCOCCCCCCCCO 34a_100000210253_100000033203 [0,0,0,0,0,0|1,0,2]=3 1393 B14R0.392 CCCCCOCCCCCCCCO 7a_100000210253_100000033203 [0,0,0,0,0,0|1,0,2]=3 1394 B14R0.392 CCCCCOCCCCCNCCN 34a_103619048469_100000718602 [0,0,0,0,0,0|3,0,1]=4 1395 B14R0.392 CCCCCOCCCCNCCCC 34a_200011216965_100000718602 [0,0,0,0,0,0|3,0,1]=4 1396 B14R0.392 CCCCCOCCCCOCCCC 34a_200000760531_100000718602 [0,0,0,0,0,0|3,0,1]=4 1397 B14R0.392 CCCCCOCCCCOCCCC 7a_200000760531_100000210326 [0,0,0,0,0,0|3,0,1]=4 1398 B14R0.392 CCCCCOCCCOCCCOC 34a_200011215475_100000718602 [0,0,0,0,0,0|4,0,0]=4 1399 B14R0.392 CCCCCOCCCOCCCOC 7a_200011215475_100000210326 [0,0,0,0,0,0|4,0,0]=4 1400 B14R0.392 CCCCCOCCOCCCCC#N 7a_100011215259_100000211819 [0,0,0,0,0,0|3,0,1]=4 1401 B14R0.392 CCCCCOCCOCCCCC=O 7a_100011215259_100000139335 [0,0,0,0,0,0|2,0,0]=2 1402 B14R0.392 CCCCCOCCOCCCCCF 34a_100011215259_100000729378 [0,0,0,0,0,0|3,0,1]=4 1403 B14R0.392 CCCCCOCCOCCCCCF 7a_100011215259_100000729378 [0,0,0,0,0,0|3,0,1]=4 1404 B14R0.392 CCCCCOCCOCCCCCO 34a_100011215259_100000746330 [0,0,0,0,0,0|2,0,2]=4 1405 B14R0.392 CCCCCOCCOCCCCCO 7a_100011215259_100000746330 [0,0,0,0,0,0|2,0,2]=4 1406 B14R0.392 CCCCCOCCOCCCCOC 34a_100011215259_100000755781 [0,0,0,0,0,0|4,0,0]=4 1407 B14R0.392 CCCCCOCCOCCCCOC 7a_100011215259_100000730899 [0,0,0,0,0,0|4,0,0]=4 1408 B14R0.392 CCCCCSCCCCCCCCO 62a_100000033203_100000210326 [0,0,0,0,0,0|1,0,2]=3 1409 B14R0.392 CCCCCSCCCCCCCCO 62a_100000210326_100000033203 [0,0,0,0,0,0|1,0,2]=3 1410 B14R0.392 CCCCNCCCCCCCCCO 2230a_100000078944_100000210211 [0,0,0,0,0,0|1,0,2]=3 1411 B14R0.392 CCCCNCCCCCCCCCO 2230a_100000102301_100009813782 [0,0,0,0,0,0|1,0,2]=3 1412 B14R0.392 CCCCNCCCCCCCCCO 34a_100000078944_100000210210 [0,0,0,0,0,0|1,0,2]=3 1413 B14R0.392 CCCCNCCCCCCCCCO 7a_106832991798_100009813782 [0,0,0,0,0,0|1,0,2]=3 1414 B14R0.392 CCCCNCCCCOCCCCF 34a_200011216965_100000729493 [0,0,0,0,0,0|3,0,1]=4 1415 B14R0.392 CCCCNCCCCOCCCCO 34a_200011216965_100011216708 [0,0,0,0,0,0|2,0,2]=4 1416 B14R0.392 CCCCNCCCCOCCCOC 34a_200011216965_100000740836 [0,0,0,0,0,0|4,0,0]=4 1417 B14R0.392 CCCCOCCCCCCCCCBr 34a_100009813782_100000210210 [0,0,0,0,0,0|2,0,1]=3 1418 B14R0.392 CCCCOCCCCCCCCCBr 7a_100009813782_100000210211 [0,0,0,0,0,0|2,0,1]=3 1419 B14R0.392 CCCCOCCCCCCCCCCl 34a_100009868337_100000210210 [0,0,0,0,0,0|2,0,1]=3 1420 B14R0.392 CCCCOCCCCCCCCCCl 7a_100009868337_100000210211 [0,0,0,0,0,0|2,0,1]=3 1421 B14R0.392 CCCCOCCCCCCCCCN 34a_100000078944_100000210210 [0,0,0,0,0,0|2,0,1]=3 1422 B14R0.392 CCCCOCCCCCCCCCO 34a_100000210227_100009813782 [0,0,0,0,0,0|1,0,2]=3 1423 B14R0.392 CCCCOCCCCCCCCCO 7a_100000210227_100009813782 [0,0,0,0,0,0|1,0,2]=3 1424 B14R0.392 CCCCOCCCCOCCCC#N 7a_200000760531_100000687738 [0,0,0,0,0,0|3,0,1]=4 1425 B14R0.392 CCCCOCCCCOCCCC=O 7a_200000760531_200011292268 [0,0,0,0,0,0|2,0,0]=2 1426 B14R0.392 CCCCOCCCCOCCCCF 34a_200000760531_100000729493 [0,0,0,0,0,0|3,0,1]=4 1427 B14R0.392 CCCCOCCCCOCCCCF 7a_200000760531_100000729493 [0,0,0,0,0,0|3,0,1]=4 1428 B14R0.392 CCCCOCCCCOCCCCO 34a_200000760531_100011216708 [0,0,0,0,0,0|2,0,2]=4 1429 B14R0.392 CCCCOCCCCOCCCCO 7a_200000760531_100000210776 [0,0,0,0,0,0|2,0,2]=4 1430 B14R0.392 CCCCOCCCCOCCCOC 34a_200000760531_100000740836 [0,0,0,0,0,0|4,0,0]=4 1431 B14R0.392 CCCCOCCCCOCCCOC 7a_200000760531_100000740836 [0,0,0,0,0,0|4,0,0]=4 1432 B14R0.392 CCCCOCCCNCCCCC#N 2230a_200000211371_100000211819 [0,0,0,0,0,0|3,0,1]=4 1433 B14R0.392 CCCCOCCCNCCCCC=O 2230a_200000211371_100000139335 [0,0,0,0,0,0|2,0,0]=2 1434 B14R0.392 CCCCOCCCNCCCCCF 2230a_200000211371_100000729378 [0,0,0,0,0,0|3,0,1]=4 1435 B14R0.392 CCCCOCCCNCCCCCF 34a_200000211371_100000729378 [0,0,0,0,0,0|3,0,1]=4 1436 B14R0.392 CCCCOCCCNCCCCCO 2230a_200000211371_100000746330 [0,0,0,0,0,0|2,0,2]=4 1437 B14R0.392 CCCCOCCCNCCCCCO 34a_200000211371_100000746330 [0,0,0,0,0,0|2,0,2]=4 1438 B14R0.392 CCCCOCCCNCCCCOC 2230a_200000211371_100000730899 [0,0,0,0,0,0|4,0,0]=4 1439 B14R0.392 CCCCOCCCNCCCCOC 34a_200000211371_100000755781 [0,0,0,0,0,0|4,0,0]=4 1440 B14R0.392 CCCCOCCCOCCCCC#N 7a_200011215613_100000211819 [0,0,0,0,0,0|3,0,1]=4 1441 B14R0.392 CCCCOCCCOCCCCC=O 7a_200011215613_100000139335 [0,0,0,0,0,0|2,0,0]=2 1442 B14R0.392 CCCCOCCCOCCCCCF 34a_200011215613_100000729378 [0,0,0,0,0,0|3,0,1]=4 1443 B14R0.392 CCCCOCCCOCCCCCF 7a_200011215613_100000729378 [0,0,0,0,0,0|3,0,1]=4 1444 B14R0.392 CCCCOCCCOCCCCCO 34a_200011215613_100000746330 [0,0,0,0,0,0|2,0,2]=4 1445 B14R0.392 CCCCOCCCOCCCCCO 7a_200011215613_100000746330 [0,0,0,0,0,0|2,0,2]=4 1446 B14R0.392 CCCCOCCCOCCCCOC 34a_200011215613_100000755781 [0,0,0,0,0,0|4,0,0]=4 1447 B14R0.392 CCCCOCCCOCCCCOC 7a_200011215613_100000730899 [0,0,0,0,0,0|4,0,0]=4 1448 B14R0.392 CCCCOCCNCCCCCCO 2230a_100000686447_100000743108 [0,0,0,0,0,0|2,0,2]=4 1449 B14R0.392 CCCCOCCNCCCCCCO 34a_100000686447_100000743108 [0,0,0,0,0,0|2,0,2]=4 1450 B14R0.392 CCCCOCCNCCCCCOC 2230a_100000747528_100000743108 [0,0,0,0,0,0|4,0,0]=4 1451 B14R0.392 CCCCOCCNCCCCCOC 34a_100000747528_100000743108 [0,0,0,0,0,0|4,0,0]=4 1452 B14R0.392 CCCCOCCOCCCCCC#N 7a_100000210238_100009813376 [0,0,0,0,0,0|3,0,1]=4 1453 B14R0.392 CCCCOCCOCCCCCC=O 7a_100000210238_100000139337 [0,0,0,0,0,0|2,0,0]=2 1454 B14R0.392 CCCCOCCOCCCCCCBr 34a_100011215345_100000743108 [0,0,0,0,0,0|3,0,1]=4 1455 B14R0.392 CCCCOCCOCCCCCCBr 7a_100011215345_100000743108 [0,0,0,0,0,0|3,0,1]=4 1456 B14R0.392 CCCCOCCOCCCCCCCl 34a_100000766143_100000743108 [0,0,0,0,0,0|3,0,1]=4 1457 B14R0.392 CCCCOCCOCCCCCCCl 7a_100000766143_100000743108 [0,0,0,0,0,0|3,0,1]=4 1458 B14R0.392 CCCCOCCOCCCCCCF 34a_100000210238_100015922095 [0,0,0,0,0,0|3,0,1]=4 1459 B14R0.392 CCCCOCCOCCCCCCF 34a_100000732779_100000743108 [0,0,0,0,0,0|3,0,1]=4 1460 B14R0.392 CCCCOCCOCCCCCCF 7a_100000210238_100015922095 [0,0,0,0,0,0|3,0,1]=4 1461 B14R0.392 CCCCOCCOCCCCCCF 7a_100000732779_100000743108 [0,0,0,0,0,0|3,0,1]=4 1462 B14R0.392 CCCCOCCOCCCCCCN 34a_100000686447_100000743108 [0,0,0,0,0,0|3,0,1]=4 1463 B14R0.392 CCCCOCCOCCCCCCO 34a_100000210238_100000766143 [0,0,0,0,0,0|2,0,2]=4 1464 B14R0.392 CCCCOCCOCCCCCCO 7a_100000210238_100000766143 [0,0,0,0,0,0|2,0,2]=4 1465 B14R0.392 CCCCOCCOCCCCCNC 34a_100000722520_100000743108 [0,0,0,0,0,0|4,0,0]=4 1466 B14R0.392 CCCCOCCSCCCCCC#N 62a_100000743108_100009813376 [0,0,0,0,0,0|3,0,1]=4 1467 B14R0.392 CCCCOCCSCCCCCC#N 62a_100009813376_100000743108 [0,0,0,0,0,0|3,0,1]=4 1468 B14R0.392 CCCCOCCSCCCCCC=O 62a_100000139337_100000743108 [0,0,0,0,0,0|2,0,0]=2 1469 B14R0.392 CCCCOCCSCCCCCC=O 62a_100000743108_100000139337 [0,0,0,0,0,0|2,0,0]=2 1470 B14R0.392 CCCCOCCSCCCCCCF 62a_100000743108_100015922095 [0,0,0,0,0,0|3,0,1]=4 1471 B14R0.392 CCCCOCCSCCCCCCF 62a_100015922095_100000743108 [0,0,0,0,0,0|3,0,1]=4 1472 B14R0.392 CCCCOCCSCCCCCCO 62a_100000743108_100000766143 [0,0,0,0,0,0|2,0,2]=4 1473 B14R0.392 CCCCOCCSCCCCCCO 62a_100000766143_100000743108 [0,0,0,0,0,0|2,0,2]=4 1474 B14R0.392 CCCCOCNCCCCCCCO 2230a_100011996573_100011995733 [0,0,0,0,0,0|2,0,2]=4 1475 B14R0.392 CCCCOCNCCCCCCCO 34a_100011996573_100011995733 [0,0,0,0,0,0|2,0,2]=4 1476 B14R0.392 CCCCOCOCCCCCCCBr 34a_100000760002_100011995733 [0,0,0,0,0,0|3,0,1]=4 1477 B14R0.392 CCCCOCOCCCCCCCN 34a_100011996573_100011995733 [0,0,0,0,0,0|3,0,1]=4 1478 B14R0.392 CCCCOCOCCCCCCOC 34a_200012092642_100011995733 [0,0,0,0,0,0|4,0,0]=4 1479 B14R0.392 CCCCOCSCCCCCCC#N 62a_100009813337_100011995733 [0,0,0,0,0,0|3,0,1]=4 1480 B14R0.392 CCCCOCSCCCCCCC#N 62a_100011995733_100009813337 [0,0,0,0,0,0|3,0,1]=4 1481 B14R0.392 CCCCOCSCCCCCCCO 62a_100000760002_100011995733 [0,0,0,0,0,0|2,0,2]=4 1482 B14R0.392 CCCCOCSCCCCCCCO 62a_100011995733_100000760002 [0,0,0,0,0,0|2,0,2]=4 1483 B14R0.392 CCCCOCSCCCCCCOC 62a_100011995733_100011998445 [0,0,0,0,0,0|4,0,0]=4 1484 B14R0.392 CCCCOCSCCCCCCOC 62a_100011998445_100011995733 [0,0,0,0,0,0|4,0,0]=4 1485 B14R0.392 CCCCSCCCCCCCCCO 62a_100000210211_100009813782 [0,0,0,0,0,0|1,0,2]=3 1486 B14R0.392 CCCCSCCCCCCCCCO 62a_100009813782_100000210210 [0,0,0,0,0,0|1,0,2]=3 1487 B14R0.392 CCCCSCCNCCCCCC#N 2230a_100025743550_100009813376 [0,0,0,0,0,0|3,0,1]=4 1488 B14R0.392 CCCCSCCNCCCCCC=O 2230a_100025743550_100000139337 [0,0,0,0,0,0|2,0,0]=2 1489 B14R0.392 CCCCSCCNCCCCCCF 2230a_100025743550_100015922095 [0,0,0,0,0,0|3,0,1]=4 1490 B14R0.392 CCCCSCCNCCCCCCO 2230a_100025743550_100000766143 [0,0,0,0,0,0|2,0,2]=4 1491 B14R0.392 CCCCSCCOCCCCCC#N 7a_200000230436_100009813376 [0,0,0,0,0,0|3,0,1]=4 1492 B14R0.392 CCCCSCCOCCCCCC=O 7a_200000230436_100000139337 [0,0,0,0,0,0|2,0,0]=2 1493 B14R0.392 CCCCSCCOCCCCCCF 34a_200000230436_100015922095 [0,0,0,0,0,0|3,0,1]=4 1494 B14R0.392 CCCCSCCOCCCCCCF 7a_200000230436_100015922095 [0,0,0,0,0,0|3,0,1]=4 1495 B14R0.392 CCCCSCCOCCCCCCO 34a_200000230436_100000766143 [0,0,0,0,0,0|2,0,2]=4 1496 B14R0.392 CCCCSCCOCCCCCCO 7a_200000230436_100000766143 [0,0,0,0,0,0|2,0,2]=4 1497 B14R0.392 CCCNCCCCCCCCCCO 2230a_100000066964_100000210303 [0,0,0,0,0,0|1,0,2]=3 1498 B14R0.392 CCCNCCCCCCCCCCO 34a_100000066964_100000210303 [0,0,0,0,0,0|1,0,2]=3 1499 B14R0.392 CCCOCCCCCCCCCCBr 34a_100009813290_100000210303 [0,0,0,0,0,0|2,0,1]=3 1500 B14R0.392 CCCOCCCCCCCCCCBr 7a_100009813290_100000210303 [0,0,0,0,0,0|2,0,1]=3 1501 B14R0.392 CCCOCCCCCCCCCCCl 34a_200000033068_100000210303 [0,0,0,0,0,0|2,0,1]=3 1502 B14R0.392 CCCOCCCCCCCCCCCl 7a_200000033068_100000210303 [0,0,0,0,0,0|2,0,1]=3 1503 B14R0.392 CCCOCCCCCCCCCCN 34a_100000066964_100000210303 [0,0,0,0,0,0|2,0,1]=3 1504 B14R0.392 CCCOCCCCCCCCCCO 34a_100000210258_100009813290 [0,0,0,0,0,0|1,0,2]=3 1505 B14R0.392 CCCOCCCNCCCCCC#N 2230a_100011217757_100009813376 [0,0,0,0,0,0|3,0,1]=4 1506 B14R0.392 CCCOCCCNCCCCCC=O 2230a_100011217757_100000139337 [0,0,0,0,0,0|2,0,0]=2 1507 B14R0.392 CCCOCCCNCCCCCCF 2230a_100011217757_100015922095 [0,0,0,0,0,0|3,0,1]=4 1508 B14R0.392 CCCOCCCNCCCCCCF 34a_100011217757_100015922095 [0,0,0,0,0,0|3,0,1]=4 1509 B14R0.392 CCCOCCCNCCCCCCO 2230a_100011217757_100000766143 [0,0,0,0,0,0|2,0,2]=4 1510 B14R0.392 CCCOCCCNCCCCCCO 34a_100011217757_100000766143 [0,0,0,0,0,0|2,0,2]=4 1511 B14R0.392 CCCOCCNCCCCCCC#N 2230a_100161115042_100009813337 [0,0,0,0,0,0|3,0,1]=4 1512 B14R0.392 CCCOCCNCCCCCCCO 2230a_100011996573_100011215938 [0,0,0,0,0,0|2,0,2]=4 1513 B14R0.392 CCCOCCNCCCCCCCO 2230a_100161115042_100000760002 [0,0,0,0,0,0|2,0,2]=4 1514 B14R0.392 CCCOCCNCCCCCCCO 34a_100011996573_100011215938 [0,0,0,0,0,0|2,0,2]=4 1515 B14R0.392 CCCOCCNCCCCCCCO 34a_100161115042_100000760002 [0,0,0,0,0,0|2,0,2]=4 1516 B14R0.392 CCCOCCNCCCCCCOC 2230a_100161115042_100011998445 [0,0,0,0,0,0|4,0,0]=4 1517 B14R0.392 CCCOCCNCCCCCCOC 34a_100161115042_100011998445 [0,0,0,0,0,0|4,0,0]=4 1518 B14R0.392 CCCOCCOCCCCCCC#N 7a_100000752267_100009813337 [0,0,0,0,0,0|3,0,1]=4 1519 B14R0.392 CCCOCCOCCCCCCCBr 34a_100000760002_100011215938 [0,0,0,0,0,0|3,0,1]=4 1520 B14R0.392 CCCOCCOCCCCCCCBr 7a_100000760002_100011215938 [0,0,0,0,0,0|3,0,1]=4 1521 B14R0.392 CCCOCCOCCCCCCCN 34a_100011996573_100011215938 [0,0,0,0,0,0|3,0,1]=4 1522 B14R0.392 CCCOCCOCCCCCCCO 34a_100000752267_100000760002 [0,0,0,0,0,0|2,0,2]=4 1523 B14R0.392 CCCOCCOCCCCCCCO 7a_100000752267_100000760002 [0,0,0,0,0,0|2,0,2]=4 1524 B14R0.392 CCCOCCOCCCCCCOC 34a_100000752267_100011998445 [0,0,0,0,0,0|4,0,0]=4 1525 B14R0.392 CCCOCCOCCCCCCOC 34a_200012092642_100011215938 [0,0,0,0,0,0|4,0,0]=4 1526 B14R0.392 CCCOCCOCCCCCCOC 7a_100000752267_100011998445 [0,0,0,0,0,0|4,0,0]=4 1527 B14R0.392 CCCOCCOCCCCCCOC 7a_200012092642_100011215938 [0,0,0,0,0,0|4,0,0]=4 1528 B14R0.392 CCCOCCOCCNCCCC=O 2230a_200011904461_200011292268 [0,0,0,0,0,0|3,0,0]=3 1529 B14R0.392 CCCOCCSCCCCCCC#N 62a_100009813337_100011215938 [0,0,0,0,0,0|3,0,1]=4 1530 B14R0.392 CCCOCCSCCCCCCC#N 62a_100011215938_100009813337 [0,0,0,0,0,0|3,0,1]=4 1531 B14R0.392 CCCOCCSCCCCCCCO 62a_100000760002_100011215938 [0,0,0,0,0,0|2,0,2]=4 1532 B14R0.392 CCCOCCSCCCCCCCO 62a_100011215938_100000760002 [0,0,0,0,0,0|2,0,2]=4 1533 B14R0.392 CCCOCCSCCCCCCOC 62a_100011215938_100011998445 [0,0,0,0,0,0|4,0,0]=4 1534 B14R0.392 CCCOCCSCCCCCCOC 62a_100011998445_100011215938 [0,0,0,0,0,0|4,0,0]=4 1535 B14R0.392 CCCSCCCCCCCCCCO 62a_100000210303_200000033068 [0,0,0,0,0,0|1,0,2]=3 1536 B14R0.392 CCCSCCCCCCCCCCO 62a_100009813290_100000210303 [0,0,0,0,0,0|1,0,2]=3 1537 B14R0.392 CCCSCCNCCCCCCC#N 2230a_100020603323_100009813337 [0,0,0,0,0,0|3,0,1]=4 1538 B14R0.392 CCCSCCNCCCCCCCO 2230a_100020603323_100000760002 [0,0,0,0,0,0|2,0,2]=4 1539 B14R0.392 CCCSCCNCCCCCCOC 2230a_100020603323_100011998445 [0,0,0,0,0,0|4,0,0]=4 1540 B14R0.392 CCCSCCOCCCCCCC#N 7a_200000230433_100009813337 [0,0,0,0,0,0|3,0,1]=4 1541 B14R0.392 CCCSCCOCCCCCCCO 34a_200000230433_100000760002 [0,0,0,0,0,0|2,0,2]=4 1542 B14R0.392 CCCSCCOCCCCCCCO 7a_200000230433_100000760002 [0,0,0,0,0,0|2,0,2]=4 1543 B14R0.392 CCCSCCOCCCCCCOC 34a_200000230433_100011998445 [0,0,0,0,0,0|4,0,0]=4 1544 B14R0.392 CCCSCCOCCCCCCOC 7a_200000230433_100011998445 [0,0,0,0,0,0|4,0,0]=4 1545 B14R0.392 CCNCCCCCCCCCCCO 2230a_100015525214_100009812471 [0,0,0,0,0,0|1,0,2]=3 1546 B14R0.392 CCOCCCCCCCCCCCBr 34a_100009812471_100000210202 [0,0,0,0,0,0|2,0,1]=3 1547 B14R0.392 CCOCCCCCCCCCCCBr 7a_100009812471_100000210202 [0,0,0,0,0,0|2,0,1]=3 1548 B14R0.392 CCOCCCCCCCCCCCO 34a_100121572206_100009812471 [0,0,0,0,0,0|1,0,2]=3 1549 B14R0.392 CCOCCCCCCCCCOCC 34a_100009875440_100000210202 [0,0,0,0,0,0|3,0,1]=4 1550 B14R0.392 CCOCCCCCCCCCOCC 7a_100009875440_100000210202 [0,0,0,0,0,0|3,0,1]=4 1551 B14R0.392 CCOCCCCCCCCCOCF 34a_100009875440_100015361967 [0,0,0,0,0,0|3,0,1]=4 1552 B14R0.392 CCOCCCCCCCCCOCF 7a_100009875440_100015361967 [0,0,0,0,0,0|3,0,1]=4 1553 B14R0.392 CCOCCCNCCCCCCC#N 2230a_100000210961_100009813337 [0,0,0,0,0,0|3,0,1]=4 1554 B14R0.392 CCOCCCNCCCCCCCO 2230a_100000210961_100000760002 [0,0,0,0,0,0|2,0,2]=4 1555 B14R0.392 CCOCCCNCCCCCCCO 2230a_100011996573_100012232248 [0,0,0,0,0,0|2,0,2]=4 1556 B14R0.392 CCOCCCNCCCCCCCO 34a_100000210961_100000760002 [0,0,0,0,0,0|2,0,2]=4 1557 B14R0.392 CCOCCCNCCCCCCCO 34a_100011996573_100012232248 [0,0,0,0,0,0|2,0,2]=4 1558 B14R0.392 CCOCCCNCCCCCCOC 2230a_100000210961_100011998445 [0,0,0,0,0,0|4,0,0]=4 1559 B14R0.392 CCOCCCNCCCCCCOC 34a_100000210961_100011998445 [0,0,0,0,0,0|4,0,0]=4 1560 B14R0.392 CCOCCCOCCCCCCC#N 7a_100000757476_100009813337 [0,0,0,0,0,0|3,0,1]=4 1561 B14R0.392 CCOCCCOCCCCCCCBr 34a_100000760002_100012232248 [0,0,0,0,0,0|3,0,1]=4 1562 B14R0.392 CCOCCCOCCCCCCCBr 7a_100000760002_100012232248 [0,0,0,0,0,0|3,0,1]=4 1563 B14R0.392 CCOCCCOCCCCCCCN 34a_100011996573_100012232248 [0,0,0,0,0,0|3,0,1]=4 1564 B14R0.392 CCOCCCOCCCCCCCO 34a_100000757476_100000760002 [0,0,0,0,0,0|2,0,2]=4 1565 B14R0.392 CCOCCCOCCCCCCCO 7a_100000757476_100000760002 [0,0,0,0,0,0|2,0,2]=4 1566 B14R0.392 CCOCCCOCCCCCCOC 34a_100000757476_100011998445 [0,0,0,0,0,0|4,0,0]=4 1567 B14R0.392 CCOCCCOCCCCCCOC 34a_200012092642_100012232248 [0,0,0,0,0,0|4,0,0]=4 1568 B14R0.392 CCOCCCOCCCCCCOC 7a_100000757476_100011998445 [0,0,0,0,0,0|4,0,0]=4 1569 B14R0.392 CCOCCCOCCCCCCOC 7a_200012092642_100012232248 [0,0,0,0,0,0|4,0,0]=4 1570 B14R0.392 CCOCCCSCCCCCCC#N 62a_100009813337_100012232248 [0,0,0,0,0,0|3,0,1]=4 1571 B14R0.392 CCOCCCSCCCCCCC#N 62a_100012232248_100009813337 [0,0,0,0,0,0|3,0,1]=4 1572 B14R0.392 CCOCCCSCCCCCCCO 62a_100000760002_100012232248 [0,0,0,0,0,0|2,0,2]=4 1573 B14R0.392 CCOCCCSCCCCCCCO 62a_100012232248_100000760002 [0,0,0,0,0,0|2,0,2]=4 1574 B14R0.392 CCOCCCSCCCCCCOC 62a_100011998445_100012232248 [0,0,0,0,0,0|4,0,0]=4 1575 B14R0.392 CCOCCCSCCCCCCOC 62a_100012232248_100011998445 [0,0,0,0,0,0|4,0,0]=4 1576 B14R0.392 CCOCCNCCCCCCCCO 2230a_102515433106_100011215890 [0,0,0,0,0,0|2,0,2]=4 1577 B14R0.392 CCOCCNCCCCCCCCO 2230a_102516460346_100000033203 [0,0,0,0,0,0|2,0,2]=4 1578 B14R0.392 CCOCCNCCCCCCCCO 34a_102515433106_100000210147 [0,0,0,0,0,0|2,0,2]=4 1579 B14R0.392 CCOCCNCCCCCCCCO 34a_102516460346_100000033203 [0,0,0,0,0,0|2,0,2]=4 1580 B14R0.392 CCOCCOCCCCCCCCBr 34a_100009813846_100000210147 [0,0,0,0,0,0|3,0,1]=4 1581 B14R0.392 CCOCCOCCCCCCCCBr 7a_100009813846_100011215890 [0,0,0,0,0,0|3,0,1]=4 1582 B14R0.392 CCOCCOCCCCCCCCCl 34a_100000033203_100000210147 [0,0,0,0,0,0|3,0,1]=4 1583 B14R0.392 CCOCCOCCCCCCCCCl 7a_100000033203_100011215890 [0,0,0,0,0,0|3,0,1]=4 1584 B14R0.392 CCOCCOCCCCCCCCN 34a_102515433106_100000210147 [0,0,0,0,0,0|3,0,1]=4 1585 B14R0.392 CCOCCOCCCCCCCCO 34a_100000210136_100000033203 [0,0,0,0,0,0|2,0,2]=4 1586 B14R0.392 CCOCCOCCCCCCCCO 7a_100000210136_100000033203 [0,0,0,0,0,0|2,0,2]=4 1587 B14R0.392 CCOCCOCCNCCCCC=O 2230a_100102712874_100000139335 [0,0,0,0,0,0|3,0,0]=3 1588 B14R0.392 CCOCCOCCOCCCCC=O 7a_100000210240_100000139335 [0,0,0,0,0,0|3,0,0]=3 1589 B14R0.392 CCOCCOCCOCCNCC=O 2230a_100012282185_200015260668 [0,0,0,0,0,0|4,0,0]=4 1590 B14R0.392 CCOCCOCCOCCNCC=O 34a_100012282185_200009817547 [0,0,0,0,0,0|4,0,0]=4 1591 B14R0.392 CCOCCOCCOCCOCC=O 34a_100000033264_200009817547 [0,0,0,0,0,0|4,0,0]=4 1592 B14R0.392 CCOCCOCCOCCOCC=O 7a_100000033264_200015260668 [0,0,0,0,0,0|4,0,0]=4 1593 B14R0.392 CCOCCOCCSCCCCC=O 62a_100000139335_100011211534 [0,0,0,0,0,0|3,0,0]=3 1594 B14R0.392 CCOCCOCCSCCCCC=O 62a_100011211534_100000139335 [0,0,0,0,0,0|3,0,0]=3 1595 B14R0.392 CCOCCSCCCCCCCCO 62a_100000033203_100011215890 [0,0,0,0,0,0|2,0,2]=4 1596 B14R0.392 CCOCCSCCCCCCCCO 62a_100000210147_100000033203 [0,0,0,0,0,0|2,0,2]=4 1597 B14R0.392 CCOCSCCCCCCCCCO 62a_100000739092_100009813782 [0,0,0,0,0,0|2,0,2]=4 1598 B14R0.392 CCOCSCCCCCCCCCO 62a_100009813782_100000739092 [0,0,0,0,0,0|2,0,2]=4 1599 B14R0.392 CCSCCCCCCCCCCCO 62a_100009812471_100000210202 [0,0,0,0,0,0|1,0,2]=3 1600 B14R0.392 CCSCCCOCCCCCCC#N 7a_100011216438_100009813337 [0,0,0,0,0,0|3,0,1]=4 1601 B14R0.392 CCSCCCOCCCCCCCO 34a_100011216438_100000760002 [0,0,0,0,0,0|2,0,2]=4 1602 B14R0.392 CCSCCCOCCCCCCCO 7a_100011216438_100000760002 [0,0,0,0,0,0|2,0,2]=4 1603 B14R0.392 CCSCCCOCCCCCCOC 34a_100011216438_100011998445 [0,0,0,0,0,0|4,0,0]=4 1604 B14R0.392 CCSCCCOCCCCCCOC 7a_100011216438_100011998445 [0,0,0,0,0,0|4,0,0]=4 1605 B14R0.392 CCSCCNCCCCCCCCO 2230a_100000106463_100000033203 [0,0,0,0,0,0|2,0,2]=4 1606 B14R0.392 CCSCCNCCCCCCCCO 2230a_102515433106_100000757381 [0,0,0,0,0,0|2,0,2]=4 1607 B14R0.392 CCSCCNCCCCCCCCO 34a_102515433106_100000757381 [0,0,0,0,0,0|2,0,2]=4 1608 B14R0.392 CCSCCOCCCCCCCCBr 34a_100009813846_100000757381 [0,0,0,0,0,0|3,0,1]=4 1609 B14R0.392 CCSCCOCCCCCCCCBr 7a_100009813846_100000757381 [0,0,0,0,0,0|3,0,1]=4 1610 B14R0.392 CCSCCOCCCCCCCCCl 34a_100000033203_100000757381 [0,0,0,0,0,0|3,0,1]=4 1611 B14R0.392 CCSCCOCCCCCCCCCl 7a_100000033203_100000757381 [0,0,0,0,0,0|3,0,1]=4 1612 B14R0.392 CCSCCOCCCCCCCCN 34a_102515433106_100000757381 [0,0,0,0,0,0|3,0,1]=4 1613 B14R0.392 CCSCCOCCCCCCCCO 34a_100000212035_100000033203 [0,0,0,0,0,0|2,0,2]=4 1614 B14R0.392 CCSCCOCCCCCCCCO 7a_100000212035_100000033203 [0,0,0,0,0,0|2,0,2]=4 1615 B14R0.392 CCSCCSCCCCCCCCO 62a_100000033203_100000757381 [0,0,0,0,0,0|2,0,2]=4 1616 B14R0.392 CCSCCSCCCCCCCCO 62a_100000757381_100000033203 [0,0,0,0,0,0|2,0,2]=4 1617 B14R0.392 CNCCCCCCCCCCCCO 2230a_100000066677_200000210301 [0,0,0,0,0,0|1,0,2]=3 1618 B14R0.392 CNCCCCCCCCCCCCO 2230a_106832991635_100009813331 [0,0,0,0,0,0|1,0,2]=3 1619 B14R0.392 CNCCCCCCCCCCCCO 34a_100000066677_200000210301 [0,0,0,0,0,0|1,0,2]=3 1620 B14R0.392 CNCCCCCCCCCCCCO 34a_100102657272_100009813331 [0,0,0,0,0,0|1,0,2]=3 1621 B14R0.392 CNCCCCCCCCCCCCO 7a_106832991635_100009813331 [0,0,0,0,0,0|1,0,2]=3 1622 B14R0.392 CNCCCCCCOCCCCCO 2230a_106832991635_200132310570 [0,0,0,0,0,0|2,0,2]=4 1623 B14R0.392 CNCCCCCCOCCCCCO 34a_100102657272_200132310570 [0,0,0,0,0,0|2,0,2]=4 1624 B14R0.392 CNCCCCCCOCCCCCO 7a_106832991635_200132310570 [0,0,0,0,0,0|2,0,2]=4 1625 B14R0.392 CNCCCCCOCCCCCCF 34a_100000722520_100015922095 [0,0,0,0,0,0|3,0,1]=4 1626 B14R0.392 CNCCCCCOCCCCCCO 34a_100000722520_100000766143 [0,0,0,0,0,0|2,0,2]=4 1627 B14R0.392 CNCCCOCCCCCCCCO 34a_100000213112_100000033203 [0,0,0,0,0,0|2,0,2]=4 1628 B14R0.392 COCCCCCCCCCCCCBr 34a_100009813331_200000210301 [0,0,0,0,0,0|2,0,1]=3 1629 B14R0.392 COCCCCCCCCCCCCBr 7a_100009813331_200000210301 [0,0,0,0,0,0|2,0,1]=3 1630 B14R0.392 COCCCCCCCCCCCCN 34a_100000066677_200000210301 [0,0,0,0,0,0|2,0,1]=3 1631 B14R0.392 COCCCCCCCCCCCCO 34a_100138415774_100009813331 [0,0,0,0,0,0|1,0,2]=3 1632 B14R0.392 COCCCCCCNCCCCCO 2230a_100000762737_100011998445 [0,0,0,0,0,0|2,0,2]=4 1633 B14R0.392 COCCCCCCNCCCCCO 34a_100000762737_100011998445 [0,0,0,0,0,0|2,0,2]=4 1634 B14R0.392 COCCCCCCOCCCCC#N 7a_200012092642_100000211819 [0,0,0,0,0,0|3,0,1]=4 1635 B14R0.392 COCCCCCCOCCCCC=O 7a_200012092642_100000139335 [0,0,0,0,0,0|2,0,0]=2 1636 B14R0.392 COCCCCCCOCCCCCBr 34a_100000746331_100011998445 [0,0,0,0,0,0|3,0,1]=4 1637 B14R0.392 COCCCCCCOCCCCCBr 7a_100000746331_100011998445 [0,0,0,0,0,0|3,0,1]=4 1638 B14R0.392 COCCCCCCOCCCCCCl 34a_100000746330_100011998445 [0,0,0,0,0,0|3,0,1]=4 1639 B14R0.392 COCCCCCCOCCCCCCl 7a_100000746330_100011998445 [0,0,0,0,0,0|3,0,1]=4 1640 B14R0.392 COCCCCCCOCCCCCF 34a_200012092642_100000729378 [0,0,0,0,0,0|3,0,1]=4 1641 B14R0.392 COCCCCCCOCCCCCF 7a_200012092642_100000729378 [0,0,0,0,0,0|3,0,1]=4 1642 B14R0.392 COCCCCCCOCCCCCI 34a_200012148887_100011998445 [0,0,0,0,0,0|3,0,1]=4 1643 B14R0.392 COCCCCCCOCCCCCI 7a_200012148887_100011998445 [0,0,0,0,0,0|3,0,1]=4 1644 B14R0.392 COCCCCCCOCCCCCN 34a_100000762737_100011998445 [0,0,0,0,0,0|3,0,1]=4 1645 B14R0.392 COCCCCCCOCCCCCO 34a_100138415774_200132310570 [0,0,0,0,0,0|2,0,2]=4 1646 B14R0.392 COCCCCCCOCCCCCO 34a_200012092642_100000746330 [0,0,0,0,0,0|2,0,2]=4 1647 B14R0.392 COCCCCCCOCCCCCO 7a_200012092642_100000746330 [0,0,0,0,0,0|2,0,2]=4 1648 B14R0.392 COCCCCCCOCCCCOC 34a_100000740925_100011998445 [0,0,0,0,0,0|4,0,0]=4 1649 B14R0.392 COCCCCCCOCCCCOC 34a_200012092642_100000755781 [0,0,0,0,0,0|4,0,0]=4 1650 B14R0.392 COCCCCCCOCCCCOC 7a_200012092642_100000730899 [0,0,0,0,0,0|4,0,0]=4 1651 B14R0.392 COCCCCCCOCCCCSC 34a_100011217163_100011998445 [0,0,0,0,0,0|4,0,0]=4 1652 B14R0.392 COCCCCCCOCCCCSC 7a_100011217163_100011998445 [0,0,0,0,0,0|4,0,0]=4 1653 B14R0.392 COCCCCCCSCCCCC#N 62a_100011219923_100011998445 [0,0,0,0,0,0|3,0,1]=4 1654 B14R0.392 COCCCCCCSCCCCC#N 62a_100011998445_100000211819 [0,0,0,0,0,0|3,0,1]=4 1655 B14R0.392 COCCCCCCSCCCCC=O 62a_100000139335_100011998445 [0,0,0,0,0,0|2,0,0]=2 1656 B14R0.392 COCCCCCCSCCCCC=O 62a_100011998445_100000139335 [0,0,0,0,0,0|2,0,0]=2 1657 B14R0.392 COCCCCCCSCCCCCF 62a_100000729378_100011998445 [0,0,0,0,0,0|3,0,1]=4 1658 B14R0.392 COCCCCCCSCCCCCF 62a_100011998445_100000729378 [0,0,0,0,0,0|3,0,1]=4 1659 B14R0.392 COCCCCCCSCCCCCO 62a_100000746330_100011998445 [0,0,0,0,0,0|2,0,2]=4 1660 B14R0.392 COCCCCCCSCCCCCO 62a_100011998445_100000746330 [0,0,0,0,0,0|2,0,2]=4 1661 B14R0.392 COCCCCCCSCCCCOC 62a_100000730899_100011998445 [0,0,0,0,0,0|4,0,0]=4 1662 B14R0.392 COCCCCCCSCCCCOC 62a_100011998445_100000730899 [0,0,0,0,0,0|4,0,0]=4 1663 B14R0.392 COCCCCCNCCCCCC#N 2230a_100000747528_100009813376 [0,0,0,0,0,0|3,0,1]=4 1664 B14R0.392 COCCCCCNCCCCCC=O 2230a_100000747528_100000139337 [0,0,0,0,0,0|2,0,0]=2 1665 B14R0.392 COCCCCCNCCCCCCF 2230a_100000747528_100015922095 [0,0,0,0,0,0|3,0,1]=4 1666 B14R0.392 COCCCCCNCCCCCCF 34a_100000747528_100015922095 [0,0,0,0,0,0|3,0,1]=4 1667 B14R0.392 COCCCCCNCCCCCCO 2230a_100000747528_100000766143 [0,0,0,0,0,0|2,0,2]=4 1668 B14R0.392 COCCCCCNCCCCCCO 34a_100000747528_100000766143 [0,0,0,0,0,0|2,0,2]=4 1669 B14R0.392 COCCCCCOCCCCCCCl 34a_200132310570_200000210301 [0,0,0,0,0,0|3,0,1]=4 1670 B14R0.392 COCCCCCOCCCCCCCl 7a_200132310570_200000210301 [0,0,0,0,0,0|3,0,1]=4 1671 B14R0.392 COCCCCNCCCCCCCO 2230a_100011996573_100000730899 [0,0,0,0,0,0|2,0,2]=4 1672 B14R0.392 COCCCCNCCCCCCCO 34a_100011996573_100000755781 [0,0,0,0,0,0|2,0,2]=4 1673 B14R0.392 COCCCCOCCCCCCCBr 34a_100000760002_100000755781 [0,0,0,0,0,0|3,0,1]=4 1674 B14R0.392 COCCCCOCCCCCCCBr 7a_100000760002_100000730899 [0,0,0,0,0,0|3,0,1]=4 1675 B14R0.392 COCCCCOCCCCCCCN 34a_100011996573_100000755781 [0,0,0,0,0,0|3,0,1]=4 1676 B14R0.392 COCCCCOCCCCCCCO 34a_100000740925_100000760002 [0,0,0,0,0,0|2,0,2]=4 1677 B14R0.392 COCCCCSCCCCCCC#N 62a_100000730899_100009813337 [0,0,0,0,0,0|3,0,1]=4 1678 B14R0.392 COCCCCSCCCCCCC#N 62a_100009813337_100000730899 [0,0,0,0,0,0|3,0,1]=4 1679 B14R0.392 COCCCCSCCCCCCCO 62a_100000730899_100000760002 [0,0,0,0,0,0|2,0,2]=4 1680 B14R0.392 COCCCCSCCCCCCCO 62a_100000760002_100000730899 [0,0,0,0,0,0|2,0,2]=4 1681 B14R0.392 COCCCNCCCCCCCCO 2230a_102515433106_100000740836 [0,0,0,0,0,0|2,0,2]=4 1682 B14R0.392 COCCCNCCCCCCCCO 34a_100150723488_100000033203 [0,0,0,0,0,0|2,0,2]=4 1683 B14R0.392 COCCCNCCCCCCCCO 34a_102515433106_100000740836 [0,0,0,0,0,0|2,0,2]=4 1684 B14R0.392 COCCCOCCCCCCCCBr 34a_100009813846_100000740836 [0,0,0,0,0,0|3,0,1]=4 1685 B14R0.392 COCCCOCCCCCCCCBr 7a_100009813846_100000740836 [0,0,0,0,0,0|3,0,1]=4 1686 B14R0.392 COCCCOCCCCCCCCCl 34a_100000033203_100000740836 [0,0,0,0,0,0|3,0,1]=4 1687 B14R0.392 COCCCOCCCCCCCCCl 7a_100000033203_100000740836 [0,0,0,0,0,0|3,0,1]=4 1688 B14R0.392 COCCCOCCCCCCCCN 34a_102515433106_100000740836 [0,0,0,0,0,0|3,0,1]=4 1689 B14R0.392 COCCCOCCCCCCCCO 34a_100000740835_100000033203 [0,0,0,0,0,0|2,0,2]=4 1690 B14R0.392 COCCCOCCCOCCCC=O 7a_200011215475_200011292268 [0,0,0,0,0,0|3,0,0]=3 1691 B14R0.392 COCCCSCCCCCCCCO 62a_100000033203_100000709357 [0,0,0,0,0,0|2,0,2]=4 1692 B14R0.392 COCCCSCCCCCCCCO 62a_100000709357_100000033203 [0,0,0,0,0,0|2,0,2]=4 1693 B14R0.392 COCCNCCCCCCCCCO 2230a_100000078944_100011201679 [0,0,0,0,0,0|2,0,2]=4 1694 B14R0.392 COCCNCCCCCCCCCO 2230a_100000209980_100009813782 [0,0,0,0,0,0|2,0,2]=4 1695 B14R0.392 COCCNCCCCCCCCCO 34a_100000078944_100011201679 [0,0,0,0,0,0|2,0,2]=4 1696 B14R0.392 COCCOCCCCCCCCCBr 34a_100009813782_100011201679 [0,0,0,0,0,0|3,0,1]=4 1697 B14R0.392 COCCOCCCCCCCCCBr 7a_100009813782_100000233755 [0,0,0,0,0,0|3,0,1]=4 1698 B14R0.392 COCCOCCCCCCCCCCl 34a_100009868337_100011201679 [0,0,0,0,0,0|3,0,1]=4 1699 B14R0.392 COCCOCCCCCCCCCCl 7a_100009868337_100000233755 [0,0,0,0,0,0|3,0,1]=4 1700 B14R0.392 COCCOCCCCCCCCCN 34a_100000078944_100011201679 [0,0,0,0,0,0|3,0,1]=4 1701 B14R0.392 COCCOCCCCCCCCCO 34a_100000210237_100009813782 [0,0,0,0,0,0|2,0,2]=4 1702 B14R0.392 COCCOCCCNCCCCC=O 2230a_100000206027_100000139335 [0,0,0,0,0,0|3,0,0]=3 1703 B14R0.392 COCCOCCCSCCCCC=O 62a_100000139335_100011216529 [0,0,0,0,0,0|3,0,0]=3 1704 B14R0.392 COCCOCCCSCCCCC=O 62a_100011216529_100000139335 [0,0,0,0,0,0|3,0,0]=3 1705 B14R0.392 COCCOCCNCCCCCC=O 2230a_100000745349_100000139337 [0,0,0,0,0,0|3,0,0]=3 1706 B14R0.392 COCCOCCOCCCCCC=O 7a_100011215163_100000139337 [0,0,0,0,0,0|3,0,0]=3 1707 B14R0.392 COCCOCCSCCCCCC=O 62a_100000139337_100000695917 [0,0,0,0,0,0|3,0,0]=3 1708 B14R0.392 COCCOCCSCCCCCC=O 62a_100000695917_100000139337 [0,0,0,0,0,0|3,0,0]=3 1709 B14R0.392 COCCSCCCCCCCCCO 62a_100000233755_100009813782 [0,0,0,0,0,0|2,0,2]=4 1710 B14R0.392 COCCSCCCCCCCCCO 62a_100009813782_100000233755 [0,0,0,0,0,0|2,0,2]=4 1711 B14R0.392 COCNCCCCCCCCCCO 2230a_100000066964_100000766300 [0,0,0,0,0,0|2,0,2]=4 1712 B14R0.392 COCSCCCCCCCCCCO 62a_100000766300_200000033068 [0,0,0,0,0,0|2,0,2]=4 1713 B14R0.392 COCSCCCCCCCCCCO 62a_100009813290_100000766300 [0,0,0,0,0,0|2,0,2]=4 1714 B14R0.392 CSCCCCCCCCCCCCO 62a_100009813331_200000210301 [0,0,0,0,0,0|1,0,2]=3 1715 B14R0.392 CSCCCCCCOCCCCCO 62a_200000210301_200132310570 [0,0,0,0,0,0|2,0,2]=4 1716 B14R0.392 CSCCCCCCOCCCCCO 62a_200132310570_200000210301 [0,0,0,0,0,0|2,0,2]=4 1717 B14R0.392 CSCCCCOCCCCCCC#N 7a_100011217163_100009813337 [0,0,0,0,0,0|3,0,1]=4 1718 B14R0.392 CSCCCCOCCCCCCCO 34a_100011217163_100000760002 [0,0,0,0,0,0|2,0,2]=4 1719 B14R0.392 CSCCCCOCCCCCCCO 7a_100011217163_100000760002 [0,0,0,0,0,0|2,0,2]=4 1720 B14R0.392 CSCCCNCCCCCCCCO 2230a_100000749238_100000033203 [0,0,0,0,0,0|2,0,2]=4 1721 B14R0.392 CSCCCOCCCCCCCCO 34a_100000690336_100000033203 [0,0,0,0,0,0|2,0,2]=4 1722 B14R0.392 CSCCCOCCCCCCCCO 7a_100000690336_100000033203 [0,0,0,0,0,0|2,0,2]=4 1723 B14R0.392 CSCCNCCCCCCCCCO 2230a_100000078944_100000751147 [0,0,0,0,0,0|2,0,2]=4 1724 B14R0.392 CSCCNCCCCCCCCCO 2230a_100020590264_100009813782 [0,0,0,0,0,0|2,0,2]=4 1725 B14R0.392 CSCCNCCCCCCCCCO 34a_100000078944_100000212216 [0,0,0,0,0,0|2,0,2]=4 1726 B14R0.392 CSCCOCCCCCCCCCBr 34a_100009813782_100000212216 [0,0,0,0,0,0|3,0,1]=4 1727 B14R0.392 CSCCOCCCCCCCCCBr 7a_100009813782_100000212216 [0,0,0,0,0,0|3,0,1]=4 1728 B14R0.392 CSCCOCCCCCCCCCCl 34a_100009868337_100000212216 [0,0,0,0,0,0|3,0,1]=4 1729 B14R0.392 CSCCOCCCCCCCCCCl 7a_100009868337_100000212216 [0,0,0,0,0,0|3,0,1]=4 1730 B14R0.392 CSCCOCCCCCCCCCN 34a_100000078944_100000212216 [0,0,0,0,0,0|3,0,1]=4 1731 B14R0.392 CSCCOCCCCCCCCCO 34a_100000230434_100009813782 [0,0,0,0,0,0|2,0,2]=4 1732 B14R0.392 CSCCOCCCCCCCCCO 7a_100000230434_100009813782 [0,0,0,0,0,0|2,0,2]=4 1733 B14R0.392 CSCCSCCCCCCCCCO 62a_100000212216_100009813782 [0,0,0,0,0,0|2,0,2]=4 1734 B14R0.392 CSCCSCCCCCCCCCO 62a_100009813782_100000751147 [0,0,0,0,0,0|2,0,2]=4 1735 B14R0.392 CSCNCCCCCCCCCCO 2230a_100000066964_100011218213 [0,0,0,0,0,0|2,0,2]=4 1736 B14R0.392 CSCNCCCCCCCCCCO 34a_100000066964_100011218213 [0,0,0,0,0,0|2,0,2]=4 1737 B14R0.392 CSCOCCCCCCCCCCBr 34a_100009813290_100011218213 [0,0,0,0,0,0|3,0,1]=4 1738 B14R0.392 CSCOCCCCCCCCCCCl 34a_200000033068_100011218213 [0,0,0,0,0,0|3,0,1]=4 1739 B14R0.392 CSCOCCCCCCCCCCN 34a_100000066964_100011218213 [0,0,0,0,0,0|3,0,1]=4 1740 B14R0.392 CSCSCCCCCCCCCCO 62a_100009813290_100011218213 [0,0,0,0,0,0|2,0,2]=4 1741 B14R0.392 CSCSCCCCCCCCCCO 62a_100011218213_200000033068 [0,0,0,0,0,0|2,0,2]=4 1742 B14R0.392 FCCCCCCOCCCCCCBr 34a_100011215345_100015922095 [0,0,0,0,0,0|3,0,1]=4 1743 B14R0.392 FCCCCCCOCCCCCCBr 7a_100011215345_100015922095 [0,0,0,0,0,0|3,0,1]=4 1744 B14R0.392 FCCCCCCOCCCCCCCl 34a_100000766143_100015922095 [0,0,0,0,0,0|3,0,1]=4 1745 B14R0.392 FCCCCCCOCCCCCCCl 7a_100000766143_100015922095 [0,0,0,0,0,0|3,0,1]=4 1746 B14R0.392 FCCCCCCOCCCCCCF 34a_100000732779_100015922095 [0,0,0,0,0,0|3,0,1]=4 1747 B14R0.392 FCCCCCCOCCCCCCF 7a_100000732779_100015922095 [0,0,0,0,0,0|3,0,1]=4 1748 B14R0.392 FCCCCCCSCCCCCCF 62a_100015922095_100015922095 [0,0,0,0,0,0|3,0,1]=4 1749 B14R0.392 FCCCCCOCCCCCCCBr 34a_100000760002_100000729378 [0,0,0,0,0,0|3,0,1]=4 1750 B14R0.392 FCCCCCOCCCCCCCBr 7a_100000760002_100000729378 [0,0,0,0,0,0|3,0,1]=4 1751 B14R0.392 FCCCCOCCCCCCCCBr 34a_100009813846_100000729493 [0,0,0,0,0,0|3,0,1]=4 1752 B14R0.392 FCCCCOCCCCCCCCBr 7a_100009813846_100000729493 [0,0,0,0,0,0|3,0,1]=4 1753 B14R0.392 FCCCCOCCCCCCCCCl 34a_100000033203_100000729493 [0,0,0,0,0,0|3,0,1]=4 1754 B14R0.392 FCCCCOCCCCCCCCCl 7a_100000033203_100000729493 [0,0,0,0,0,0|3,0,1]=4 1755 B14R0.392 FCCCOCCCCCCCCCBr 34a_100009813782_100011934791 [0,0,0,0,0,0|3,0,1]=4 1756 B14R0.392 FCCCOCCCCCCCCCBr 7a_100009813782_100011934791 [0,0,0,0,0,0|3,0,1]=4 1757 B14R0.392 FCCCOCCCCCCCCCCl 34a_100009868337_100011934791 [0,0,0,0,0,0|3,0,1]=4 1758 B14R0.392 FCCCOCCCCCCCCCCl 7a_100009868337_100011934791 [0,0,0,0,0,0|3,0,1]=4 1759 B14R0.392 FCCOCCCCCCCCCCBr 34a_100009813290_100011217306 [0,0,0,0,0,0|3,0,1]=4 1760 B14R0.392 FCCOCCCCCCCCCCBr 7a_100009813290_100011217306 [0,0,0,0,0,0|3,0,1]=4 1761 B14R0.392 FCCOCCCCCCCCCCCl 34a_200000033068_100011217306 [0,0,0,0,0,0|3,0,1]=4 1762 B14R0.392 FCCOCCCCCCCCCCCl 7a_200000033068_100011217306 [0,0,0,0,0,0|3,0,1]=4 1763 B14R0.392 FCOCCCCCCCCCCCBr 34a_100009812471_100015361967 [0,0,0,0,0,0|3,0,1]=4 1764 B14R0.392 FCOCCCCCCCCCCCBr 7a_100009812471_100015361967 [0,0,0,0,0,0|3,0,1]=4 1765 B14R0.392 N#CCCCCCCNCCCCCO 2230a_100000762737_100009813337 [0,0,0,0,0,0|3,0,1]=4 1766 B14R0.392 N#CCCCCCCOCCCCCBr 7a_100000746331_100009813337 [0,0,0,0,0,0|3,0,1]=4 1767 B14R0.392 N#CCCCCCCOCCCCCCl 7a_100000746330_100009813337 [0,0,0,0,0,0|3,0,1]=4 1768 B14R0.392 N#CCCCCCCOCCCCCI 7a_200012148887_100009813337 [0,0,0,0,0,0|3,0,1]=4 1769 B14R0.392 N#CCCCCCCSCCCCC=O 62a_100000139335_100009813337 [0,0,0,0,0,0|2,0,1]=3 1770 B14R0.392 N#CCCCCCCSCCCCC=O 62a_100009813337_100000139335 [0,0,0,0,0,0|2,0,1]=3 1771 B14R0.392 N#CCCCCCCSCCCCCF 62a_100000729378_100009813337 [0,0,0,0,0,0|3,0,1]=4 1772 B14R0.392 N#CCCCCCCSCCCCCF 62a_100009813337_100000729378 [0,0,0,0,0,0|3,0,1]=4 1773 B14R0.392 N#CCCCCCCSCCCCCO 62a_100000746330_100009813337 [0,0,0,0,0,0|3,0,1]=4 1774 B14R0.392 N#CCCCCCCSCCCCCO 62a_100009813337_100000746330 [0,0,0,0,0,0|3,0,1]=4 1775 B14R0.392 N#CCCCCCNCCCCCCO 2230a_100000686447_100009813376 [0,0,0,0,0,0|3,0,1]=4 1776 B14R0.392 N#CCCCCCOCCCCCCBr 7a_100011215345_100009813376 [0,0,0,0,0,0|3,0,1]=4 1777 B14R0.392 N#CCCCCCOCCCCCCCl 7a_100000766143_100009813376 [0,0,0,0,0,0|3,0,1]=4 1778 B14R0.392 N#CCCCCCOCCCCCCF 7a_100000732779_100009813376 [0,0,0,0,0,0|3,0,1]=4 1779 B14R0.392 N#CCCCCCSCCCCCC=O 62a_100000139337_100009813376 [0,0,0,0,0,0|2,0,1]=3 1780 B14R0.392 N#CCCCCCSCCCCCC=O 62a_100009813376_100000139337 [0,0,0,0,0,0|2,0,1]=3 1781 B14R0.392 N#CCCCCCSCCCCCCF 62a_100009813376_100015922095 [0,0,0,0,0,0|3,0,1]=4 1782 B14R0.392 N#CCCCCCSCCCCCCF 62a_100015922095_100009813376 [0,0,0,0,0,0|3,0,1]=4 1783 B14R0.392 N#CCCCCCSCCCCCCO 62a_100000766143_100009813376 [0,0,0,0,0,0|3,0,1]=4 1784 B14R0.392 N#CCCCCCSCCCCCCO 62a_100009813376_100000766143 [0,0,0,0,0,0|3,0,1]=4 1785 B14R0.392 N#CCCCCNCCCCCCCO 2230a_100011996573_100000211819 [0,0,0,0,0,0|3,0,1]=4 1786 B14R0.392 N#CCCCCOCCCCCCCBr 7a_100000760002_100000211819 [0,0,0,0,0,0|3,0,1]=4 1787 B14R0.392 N#CCCCCSCCCCCCCO 62a_100000760002_100000211819 [0,0,0,0,0,0|3,0,1]=4 1788 B14R0.392 N#CCCCCSCCCCCCCO 62a_100011219923_100000760002 [0,0,0,0,0,0|3,0,1]=4 1789 B14R0.392 N#CCCCNCCCCCCCCO 2230a_102515433106_100000687738 [0,0,0,0,0,0|3,0,1]=4 1790 B14R0.392 N#CCCCOCCCCCCCCBr 7a_100009813846_100000687738 [0,0,0,0,0,0|3,0,1]=4 1791 B14R0.392 N#CCCCOCCCCCCCCCl 7a_100000033203_100000687738 [0,0,0,0,0,0|3,0,1]=4 1792 B14R0.392 N#CCCCSCCCCCCCCO 62a_100000033203_100000687738 [0,0,0,0,0,0|3,0,1]=4 1793 B14R0.392 N#CCCCSCCCCCCCCO 62a_100000687738_100000033203 [0,0,0,0,0,0|3,0,1]=4 1794 B14R0.392 N#CCCNCCCCCCCCCO 2230a_100000078944_100011215226 [0,0,0,0,0,0|3,0,1]=4 1795 B14R0.392 N#CCCOCCCCCCCCCBr 7a_100009813782_100000184422 [0,0,0,0,0,0|3,0,1]=4 1796 B14R0.392 N#CCCOCCCCCCCCCCl 7a_100009868337_100000184422 [0,0,0,0,0,0|3,0,1]=4 1797 B14R0.392 N#CCCSCCCCCCCCCO 62a_100009813782_100011215226 [0,0,0,0,0,0|3,0,1]=4 1798 B14R0.392 N#CCCSCCCCCCCCCO 62a_100011215226_100009813782 [0,0,0,0,0,0|3,0,1]=4 1799 B14R0.392 N#CCNCCCCCCCCCCO 2230a_100000066964_100011215382 [0,0,0,0,0,0|3,0,1]=4 1800 B14R0.392 N#CCOCCCCCCCCCCBr 7a_100009813290_100011215382 [0,0,0,0,0,0|3,0,1]=4 1801 B14R0.392 N#CCOCCCCCCCCCCCl 7a_200000033068_100011215382 [0,0,0,0,0,0|3,0,1]=4 1802 B14R0.392 N#CCSCCCCCCCCCCO 62a_100009813290_100011215382 [0,0,0,0,0,0|3,0,1]=4 1803 B14R0.392 N#CCSCCCCCCCCCCO 62a_100011215382_200000033068 [0,0,0,0,0,0|3,0,1]=4 1804 B14R0.392 NCCCCCCCCCCOCC=O 34a_100000066964_200009817547 [0,0,0,0,0,0|2,0,0]=2 1805 B14R0.392 NCCCCCCCCCCOCCF 34a_100000066964_100011217306 [0,0,0,0,0,0|3,0,1]=4 1806 B14R0.392 NCCCCCCCCCCOCCO 34a_100000066964_100000211926 [0,0,0,0,0,0|2,0,2]=4 1807 B14R0.392 NCCCCCCCCCOCCCF 34a_100000078944_100011934791 [0,0,0,0,0,0|3,0,1]=4 1808 B14R0.392 NCCCCCCCCCOCCCO 34a_100000078944_100000230001 [0,0,0,0,0,0|2,0,2]=4 1809 B14R0.392 NCCCCCCCCOCCCCF 34a_102515433106_100000729493 [0,0,0,0,0,0|3,0,1]=4 1810 B14R0.392 NCCCCCCCCOCCCCO 34a_102515433106_100011216708 [0,0,0,0,0,0|2,0,2]=4 1811 B14R0.392 NCCCCCCCOCCCCCF 34a_100011996573_100000729378 [0,0,0,0,0,0|3,0,1]=4 1812 B14R0.392 NCCCCCCCOCCCCCO 34a_100011996573_100000746330 [0,0,0,0,0,0|2,0,2]=4 1813 B14R0.392 NCCCCCCOCCCCCCF 34a_100000686447_100015922095 [0,0,0,0,0,0|3,0,1]=4 1814 B14R0.392 NCCCCCCOCCCCCCO 34a_100000686447_100000766143 [0,0,0,0,0,0|2,0,2]=4 1815 B14R0.392 NCCCCCOCCCCCCCO 34a_100000762737_100000760002 [0,0,0,0,0,0|2,0,2]=4 1816 B14R0.392 NCCCCOCCCCCCCCO 34a_100000750430_100000033203 [0,0,0,0,0,0|2,0,2]=4 1817 B14R0.392 NCCCOCCCCCCCCCO 34a_100000182051_100009813782 [0,0,0,0,0,0|2,0,2]=4 1818 B14R0.392 NCCOCCCCCCCCCCO 34a_100000210304_100009813290 [0,0,0,0,0,0|2,0,2]=4 1819 B14R0.392 NOCCOCCCCCCCCCO 34a_100000700252_100009813782 [0,0,0,0,0,0|4,0,0]=4 1820 B14R0.392 O=CCCCCCNCCCCCCO 2230a_100000686447_100000139337 [0,0,0,0,0,0|2,0,0]=2 1821 B14R0.392 O=CCCCCCOCCCCCCBr 7a_100011215345_100000139337 [0,0,0,0,0,0|2,0,0]=2 1822 B14R0.392 O=CCCCCCOCCCCCCCl 7a_100000766143_100000139337 [0,0,0,0,0,0|2,0,0]=2 1823 B14R0.392 O=CCCCCCOCCCCCCF 7a_100000732779_100000139337 [0,0,0,0,0,0|2,0,0]=2 1824 B14R0.392 O=CCCCCCSCCCCCC=O 62a_100000139337_100000139337 [0,0,0,0,0,0|2,0,1]=3 1825 B14R0.392 O=CCCCCCSCCCCCCF 62a_100000139337_100015922095 [0,0,0,0,0,0|2,0,0]=2 1826 B14R0.392 O=CCCCCCSCCCCCCF 62a_100015922095_100000139337 [0,0,0,0,0,0|2,0,0]=2 1827 B14R0.392 O=CCCCCCSCCCCCCO 62a_100000139337_100000766143 [0,0,0,0,0,0|2,0,0]=2 1828 B14R0.392 O=CCCCCCSCCCCCCO 62a_100000766143_100000139337 [0,0,0,0,0,0|2,0,0]=2 1829 B14R0.392 O=CCCCCNCCCCCCCO 2230a_100011996573_100000139335 [0,0,0,0,0,0|2,0,0]=2 1830 B14R0.392 O=CCCCCNCCCOCCCO 2230a_100011310245_100000139335 [0,0,0,0,0,0|3,0,0]=3 1831 B14R0.392 O=CCCCCOCCCCCCCBr 7a_100000760002_100000139335 [0,0,0,0,0,0|2,0,0]=2 1832 B14R0.392 O=CCCCCSCCCCCCCO 62a_100000139335_100000760002 [0,0,0,0,0,0|2,0,0]=2 1833 B14R0.392 O=CCCCCSCCCCCCCO 62a_100000760002_100000139335 [0,0,0,0,0,0|2,0,0]=2 1834 B14R0.392 O=CCCCNCCCCCCCCO 2230a_102515433106_200011292268 [0,0,0,0,0,0|2,0,0]=2 1835 B14R0.392 O=CCCCNCCOCCOCCO 2230a_100011998139_200011292268 [0,0,0,0,0,0|4,0,0]=4 1836 B14R0.392 O=CCCCOCCCCCCCCBr 7a_100009813846_200011292268 [0,0,0,0,0,0|2,0,0]=2 1837 B14R0.392 O=CCCCOCCCCCCCCCl 7a_100000033203_200011292268 [0,0,0,0,0,0|2,0,0]=2 1838 B14R0.392 O=CCCCOCCOCCOCCBr 7a_100010132937_200011292268 [0,0,0,0,0,0|4,0,0]=4 1839 B14R0.392 O=CCCCOCCOCCOCCCl 7a_100000032323_200011292268 [0,0,0,0,0,0|4,0,0]=4 1840 B14R0.392 O=CCCCSCCCCCCCCO 62a_100000033203_200011292268 [0,0,0,0,0,0|2,0,0]=2 1841 B14R0.392 O=CCCCSCCCCCCCCO 62a_200011292268_100000033203 [0,0,0,0,0,0|2,0,0]=2 1842 B14R0.392 O=CCCCSCCOCCOCCO 62a_100000032323_200011292268 [0,0,0,0,0,0|4,0,0]=4 1843 B14R0.392 O=CCCCSCCOCCOCCO 62a_200011292268_100000032323 [0,0,0,0,0,0|4,0,0]=4 1844 B14R0.392 O=CCNCCCCCCCCCCO 2230a_100000066964_200015260668 [0,0,0,0,0,0|2,0,0]=2 1845 B14R0.392 O=CCNCCCCCCCCCCO 34a_100000066964_200009817547 [0,0,0,0,0,0|2,0,0]=2 1846 B14R0.392 O=CCOCCCCCCCCCCBr 34a_100009813290_200009817547 [0,0,0,0,0,0|2,0,0]=2 1847 B14R0.392 O=CCOCCCCCCCCCCBr 7a_100009813290_200015260668 [0,0,0,0,0,0|2,0,0]=2 1848 B14R0.392 O=CCOCCCCCCCCCCCl 34a_200000033068_200009817547 [0,0,0,0,0,0|2,0,0]=2 1849 B14R0.392 O=CCOCCCCCCCCCCCl 7a_200000033068_200015260668 [0,0,0,0,0,0|2,0,0]=2 1850 B14R0.392 O=CCSCCCCCCCCCCO 62a_100009813290_200015260668 [0,0,0,0,0,0|2,0,0]=2 1851 B14R0.392 O=CCSCCCCCCCCCCO 62a_200015260668_200000033068 [0,0,0,0,0,0|2,0,0]=2 1852 B14R0.392 OCCCCCCCCCCCSCF 62a_100009812471_100015361967 [0,0,0,0,0,0|2,0,2]=4 1853 B14R0.392 OCCCCCCCCCCNCCF 2230a_100000066964_100011217306 [0,0,0,0,0,0|2,0,2]=4 1854 B14R0.392 OCCCCCCCCCCNCCF 34a_100000066964_100011217306 [0,0,0,0,0,0|2,0,2]=4 1855 B14R0.392 OCCCCCCCCCCNCCF 34a_100000724931_100009813290 [0,0,0,0,0,0|2,0,2]=4 1856 B14R0.392 OCCCCCCCCCCNCCO 2230a_100000066964_100000211926 [0,0,0,0,0,0|2,0,2]=4 1857 B14R0.392 OCCCCCCCCCCNCCO 2230a_100016997473_100009813290 [0,0,0,0,0,0|2,0,2]=4 1858 B14R0.392 OCCCCCCCCCCNCCO 34a_100000066964_100000211926 [0,0,0,0,0,0|2,0,2]=4 1859 B14R0.392 OCCCCCCCCCCNCCO 34a_100016990907_100009813290 [0,0,0,0,0,0|2,0,2]=4 1860 B14R0.392 OCCCCCCCCCCOCCBr 34a_100000211926_100009813290 [0,0,0,0,0,0|2,0,2]=4 1861 B14R0.392 OCCCCCCCCCCSCCF 62a_100009813290_100011217306 [0,0,0,0,0,0|2,0,2]=4 1862 B14R0.392 OCCCCCCCCCCSCCF 62a_100011217306_200000033068 [0,0,0,0,0,0|2,0,2]=4 1863 B14R0.392 OCCCCCCCCCCSCCO 62a_100000211926_200000033068 [0,0,0,0,0,0|2,0,2]=4 1864 B14R0.392 OCCCCCCCCCCSCCO 62a_100009813290_100000211926 [0,0,0,0,0,0|2,0,2]=4 1865 B14R0.392 OCCCCCCCCCNCCCF 2230a_100000078944_100011934791 [0,0,0,0,0,0|2,0,2]=4 1866 B14R0.392 OCCCCCCCCCNCCCF 2230a_100015189416_100009813782 [0,0,0,0,0,0|2,0,2]=4 1867 B14R0.392 OCCCCCCCCCNCCCF 34a_100000078944_100011934791 [0,0,0,0,0,0|2,0,2]=4 1868 B14R0.392 OCCCCCCCCCNCCCF 34a_100015189416_100009813782 [0,0,0,0,0,0|2,0,2]=4 1869 B14R0.392 OCCCCCCCCCNCCCO 2230a_100000078944_100000230001 [0,0,0,0,0,0|2,0,2]=4 1870 B14R0.392 OCCCCCCCCCNCCCO 34a_100000078944_100000230001 [0,0,0,0,0,0|2,0,2]=4 1871 B14R0.392 OCCCCCCCCCOCCCBr 34a_100011217188_100009813782 [0,0,0,0,0,0|2,0,2]=4 1872 B14R0.392 OCCCCCCCCCOCCCCl 34a_100000230001_100009813782 [0,0,0,0,0,0|2,0,2]=4 1873 B14R0.392 OCCCCCCCCCOCCCF 34a_100000759539_100009813782 [0,0,0,0,0,0|2,0,2]=4 1874 B14R0.392 OCCCCCCCCCSCCCF 62a_100009813782_100011934791 [0,0,0,0,0,0|2,0,2]=4 1875 B14R0.392 OCCCCCCCCCSCCCF 62a_100011934791_100009813782 [0,0,0,0,0,0|2,0,2]=4 1876 B14R0.392 OCCCCCCCCCSCCCO 62a_100009813782_100011215043 [0,0,0,0,0,0|2,0,2]=4 1877 B14R0.392 OCCCCCCCCCSCCCO 62a_100011215043_100009813782 [0,0,0,0,0,0|2,0,2]=4 1878 B14R0.392 OCCCCCCCCNCCCCF 2230a_102515433106_100000729493 [0,0,0,0,0,0|2,0,2]=4 1879 B14R0.392 OCCCCCCCCNCCCCF 34a_102515433106_100000729493 [0,0,0,0,0,0|2,0,2]=4 1880 B14R0.392 OCCCCCCCCNCCCCO 2230a_100000750430_100000033203 [0,0,0,0,0,0|2,0,2]=4 1881 B14R0.392 OCCCCCCCCNCCCCO 2230a_102515433106_100000210776 [0,0,0,0,0,0|2,0,2]=4 1882 B14R0.392 OCCCCCCCCNCCCCO 34a_100000750430_100000033203 [0,0,0,0,0,0|2,0,2]=4 1883 B14R0.392 OCCCCCCCCNCCCCO 34a_102515433106_100011216708 [0,0,0,0,0,0|2,0,2]=4 1884 B14R0.392 OCCCCCCCCOCCCCBr 34a_100011216708_100000033203 [0,0,0,0,0,0|2,0,2]=4 1885 B14R0.392 OCCCCCCCCOCCCCCl 34a_100000210776_100000033203 [0,0,0,0,0,0|2,0,2]=4 1886 B14R0.392 OCCCCCCCCOCCCCCl 7a_100000210776_100000033203 [0,0,0,0,0,0|2,0,2]=4 1887 B14R0.392 OCCCCCCCCOCCCCF 34a_100011995726_100000033203 [0,0,0,0,0,0|2,0,2]=4 1888 B14R0.392 OCCCCCCCCOCCCCF 7a_100011995726_100000033203 [0,0,0,0,0,0|2,0,2]=4 1889 B14R0.392 OCCCCCCCCOCCCCI 34a_200012148704_100000033203 [0,0,0,0,0,0|2,0,2]=4 1890 B14R0.392 OCCCCCCCCSCCCCF 62a_100000033203_100000729493 [0,0,0,0,0,0|2,0,2]=4 1891 B14R0.392 OCCCCCCCCSCCCCF 62a_100000729493_100000033203 [0,0,0,0,0,0|2,0,2]=4 1892 B14R0.392 OCCCCCCCCSCCCCO 62a_100000033203_100000210776 [0,0,0,0,0,0|2,0,2]=4 1893 B14R0.392 OCCCCCCCCSCCCCO 62a_100000210776_100000033203 [0,0,0,0,0,0|2,0,2]=4 1894 B14R0.392 OCCCCCCCNCCCCCF 2230a_100011996573_100000729378 [0,0,0,0,0,0|2,0,2]=4 1895 B14R0.392 OCCCCCCCNCCCCCF 34a_100011996573_100000729378 [0,0,0,0,0,0|2,0,2]=4 1896 B14R0.392 OCCCCCCCNCCCCCO 2230a_100000762737_100000760002 [0,0,0,0,0,0|2,0,2]=4 1897 B14R0.392 OCCCCCCCNCCCCCO 2230a_100011996573_100000746330 [0,0,0,0,0,0|2,0,2]=4 1898 B14R0.392 OCCCCCCCNCCCCCO 34a_100000762737_100000760002 [0,0,0,0,0,0|2,0,2]=4 1899 B14R0.392 OCCCCCCCNCCCCCO 34a_100011996573_100000746330 [0,0,0,0,0,0|2,0,2]=4 1900 B14R0.392 OCCCCCCCOCCCCCBr 34a_100000746331_100000760002 [0,0,0,0,0,0|2,0,2]=4 1901 B14R0.392 OCCCCCCCOCCCCCBr 7a_100000746331_100000760002 [0,0,0,0,0,0|2,0,2]=4 1902 B14R0.392 OCCCCCCCOCCCCCCl 34a_100000746330_100000760002 [0,0,0,0,0,0|2,0,2]=4 1903 B14R0.392 OCCCCCCCOCCCCCCl 7a_100000746330_100000760002 [0,0,0,0,0,0|2,0,2]=4 1904 B14R0.392 OCCCCCCCOCCCCCI 34a_200012148887_100000760002 [0,0,0,0,0,0|2,0,2]=4 1905 B14R0.392 OCCCCCCCOCCCCCI 7a_200012148887_100000760002 [0,0,0,0,0,0|2,0,2]=4 1906 B14R0.392 OCCCCCCCSCCCCCF 62a_100000729378_100000760002 [0,0,0,0,0,0|2,0,2]=4 1907 B14R0.392 OCCCCCCCSCCCCCF 62a_100000760002_100000729378 [0,0,0,0,0,0|2,0,2]=4 1908 B14R0.392 OCCCCCCCSCCCCCO 62a_100000746330_100000760002 [0,0,0,0,0,0|2,0,2]=4 1909 B14R0.392 OCCCCCCCSCCCCCO 62a_100000760002_100000746330 [0,0,0,0,0,0|2,0,2]=4 1910 B14R0.392 OCCCCCCNCCCCCCF 2230a_100000686447_100015922095 [0,0,0,0,0,0|2,0,2]=4 1911 B14R0.392 OCCCCCCNCCCCCCF 34a_100000686447_100015922095 [0,0,0,0,0,0|2,0,2]=4 1912 B14R0.392 OCCCCCCNCCCCCCO 2230a_100000686447_100000766143 [0,0,0,0,0,0|2,0,2]=4 1913 B14R0.392 OCCCCCCNCCCCCCO 34a_100000686447_100000766143 [0,0,0,0,0,0|2,0,2]=4 1914 B14R0.392 OCCCCCCOCCCCCCBr 34a_100011215345_100000766143 [0,0,0,0,0,0|2,0,2]=4 1915 B14R0.392 OCCCCCCOCCCCCCBr 7a_100011215345_100000766143 [0,0,0,0,0,0|2,0,2]=4 1916 B14R0.392 OCCCCCCOCCCCCCCl 34a_100000766143_100000766143 [0,0,0,0,0,0|2,0,2]=4 1917 B14R0.392 OCCCCCCOCCCCCCCl 7a_100000766143_100000766143 [0,0,0,0,0,0|2,0,2]=4 1918 B14R0.392 OCCCCCCOCCCCCCF 34a_100000732779_100000766143 [0,0,0,0,0,0|2,0,2]=4 1919 B14R0.392 OCCCCCCOCCCCCCF 7a_100000732779_100000766143 [0,0,0,0,0,0|2,0,2]=4 1920 B14R0.392 OCCCCCCSCCCCCCF 62a_100000766143_100015922095 [0,0,0,0,0,0|2,0,2]=4 1921 B14R0.392 OCCCCCCSCCCCCCF 62a_100015922095_100000766143 [0,0,0,0,0,0|2,0,2]=4 1922 B14R0.392 OCCCCCCSCCCCCCO 62a_100000766143_100000766143 [0,0,0,0,0,0|2,0,2]=4 1923 B14R0.392 OCCCCCOCCCCCCCBr 34a_100000760002_100000746330 [0,0,0,0,0,0|2,0,2]=4 1924 B14R0.392 OCCCCCOCCCCCCCBr 7a_100000760002_100000746330 [0,0,0,0,0,0|2,0,2]=4 1925 B14R0.392 OCCCCOCCCCCCCCBr 34a_100009813846_100011216708 [0,0,0,0,0,0|2,0,2]=4 1926 B14R0.392 OCCCCOCCCCCCCCBr 7a_100009813846_100000210776 [0,0,0,0,0,0|2,0,2]=4 1927 B14R0.392 OCCCCOCCCCCCCCCl 34a_100000033203_100011216708 [0,0,0,0,0,0|2,0,2]=4 1928 B14R0.392 OCCCCOCCCCCCCCCl 7a_100000033203_100000210776 [0,0,0,0,0,0|2,0,2]=4 1929 B14R0.392 OCCCOCCCCCCCCCBr 34a_100009813782_100000230001 [0,0,0,0,0,0|2,0,2]=4 1930 B14R0.392 OCCCOCCCCCCCCCBr 7a_100009813782_100011215043 [0,0,0,0,0,0|2,0,2]=4 1931 B14R0.392 OCCCOCCCCCCCCCCl 34a_100009868337_100000230001 [0,0,0,0,0,0|2,0,2]=4 1932 B14R0.392 OCCCOCCCCCCCCCCl 7a_100009868337_100011215043 [0,0,0,0,0,0|2,0,2]=4 1933 B14R0.392 OCCOCCCCCCCCCCBr 34a_100009813290_100000211926 [0,0,0,0,0,0|2,0,2]=4 1934 B14R0.392 OCCOCCCCCCCCCCBr 7a_100009813290_100000211926 [0,0,0,0,0,0|2,0,2]=4 1935 B14R0.392 OCCOCCCCCCCCCCCl 34a_200000033068_100000211926 [0,0,0,0,0,0|2,0,2]=4 1936 B14R0.392 OCCOCCCCCCCCCCCl 7a_200000033068_100000211926 [0,0,0,0,0,0|2,0,2]=4 1937 B14R0.392 [13CH3]NCCCCCCCCCCCCO 2230a_100000066677_200025704644 [0,0,0,0,0,0|1,0,2]=3 1938 B14R0.392 [13CH3]NCCCCCCCCCCCCO 34a_100000066677_200025704644 [0,0,0,0,0,0|1,0,2]=3 1939 B14R0.392 [13CH3]OCCCCCCCCCCCCBr 34a_100009813331_200025704644 [0,0,0,0,0,0|2,0,1]=3 1940 B14R0.392 [13CH3]OCCCCCCCCCCCCBr 7a_100009813331_200025704644 [0,0,0,0,0,0|2,0,1]=3 1941 B14R0.392 [13CH3]OCCCCCCCCCCCCN 34a_100000066677_200025704644 [0,0,0,0,0,0|2,0,1]=3 1942 B14R0.392 [13CH3]OCCCCCOCCCCCCCl 34a_200132310570_200025704644 [0,0,0,0,0,0|3,0,1]=4 1943 B14R0.392 [13CH3]OCCCCCOCCCCCCCl 7a_200132310570_200025704644 [0,0,0,0,0,0|3,0,1]=4 1944 B14R0.392 [13CH3]SCCCCCCCCCCCCO 62a_100009813331_200025704644 [0,0,0,0,0,0|1,0,2]=3 1945 B14R0.392 [13CH3]SCCCCCCOCCCCCO 62a_200025704644_200132310570 [0,0,0,0,0,0|2,0,2]=4 1946 B14R0.392 [13CH3]SCCCCCCOCCCCCO 62a_200132310570_200025704644 [0,0,0,0,0,0|2,0,2]=4 1947 B14R0.392 [N-]=[N+]=NCCCCCCNCCCC=O 2230a_200000049180_200011292268 [0,0,0,0,0,0|4,0,0]=4 1948 B14R0.392 [N-]=[N+]=NCCCCNCCCCCC=O 2230a_100000101370_100000139337 [0,0,0,0,0,0|4,0,0]=4 1949 B13R0.336 C#CCCCCCCCCCCOC 34a_100000054667_200000210301 [1,0,0,0,0,0|1,0,2]=4 1950 B13R0.336 C#CCCCCCCCCCCOC 7a_100000054667_200000210301 [1,0,0,0,0,0|1,0,2]=4 1951 B13R0.336 C#CCCCCCCCCCCO[13CH3] 34a_100000054667_200025704644 [1,0,0,0,0,0|1,0,2]=4 1952 B13R0.336 C#CCCCCCCCCCCO[13CH3] 7a_100000054667_200025704644 [1,0,0,0,0,0|1,0,2]=4 1953 B13R0.336 C#CCCCCCCCCCOCC 34a_100000034437_100000210202 [1,0,0,0,0,0|1,0,2]=4 1954 B13R0.336 C#CCCCCCCCCCOCC 7a_100000034437_100000210202 [1,0,0,0,0,0|1,0,2]=4 1955 B13R0.336 C#CCCCCCCCCOCC=O 34a_100000065265_200009817547 [1,0,0,0,0,0|1,0,2]=4 1956 B13R0.336 C#CCCCCCCCCOCC=O 7a_100000065265_200015260668 [1,0,0,0,0,0|1,0,2]=4 1957 B13R0.336 C#CCCCCCCCCOCCC 34a_100000065265_100000210303 [1,0,0,0,0,0|1,0,2]=4 1958 B13R0.336 C#CCCCCCCCCOCCC 7a_100000065265_100000210303 [1,0,0,0,0,0|1,0,2]=4 1959 B13R0.336 C#CCCCCCCCNCCCC 2230a_100000102301_100153394163 [1,0,0,0,0,0|1,0,2]=4 1960 B13R0.336 C#CCCCCCCCNCCCC 7a_106832991798_100153394163 [1,0,0,0,0,0|1,0,2]=4 1961 B13R0.336 C#CCCCCCCCOCCCC 34a_100000054614_100000210210 [1,0,0,0,0,0|1,0,2]=4 1962 B13R0.336 C#CCCCCCCCOCCCC 34a_100000210227_100153394163 [1,0,0,0,0,0|1,0,2]=4 1963 B13R0.336 C#CCCCCCCCOCCCC 7a_100000054614_100000210211 [1,0,0,0,0,0|1,0,2]=4 1964 B13R0.336 C#CCCCCCCCOCCCC 7a_100000210227_100153394163 [1,0,0,0,0,0|1,0,2]=4 1965 B13R0.336 C#CCCCCCCCSCCCC 62a_100000210211_100153394163 [1,0,0,0,0,0|1,0,2]=4 1966 B13R0.336 C#CCCCCCCCSCCCC 62a_100153394163_100000210210 [1,0,0,0,0,0|1,0,2]=4 1967 B13R0.336 C#CCCCCCCNCCCCC 2230a_100000209983_100012276617 [1,0,0,0,0,0|1,0,2]=4 1968 B13R0.336 C#CCCCCCCOCCCC=O 7a_100011217361_200011292268 [1,0,0,0,0,0|1,0,2]=4 1969 B13R0.336 C#CCCCCCCOCCCCC 34a_100000210253_100012276617 [1,0,0,0,0,0|1,0,2]=4 1970 B13R0.336 C#CCCCCCCOCCCCC 34a_100011217361_100000718602 [1,0,0,0,0,0|1,0,2]=4 1971 B13R0.336 C#CCCCCCCOCCCCC 7a_100000210253_100012276617 [1,0,0,0,0,0|1,0,2]=4 1972 B13R0.336 C#CCCCCCCOCCCCC 7a_100011217361_100000210326 [1,0,0,0,0,0|1,0,2]=4 1973 B13R0.336 C#CCCCCCCSCCCC=O 62a_100012276617_200011292268 [1,0,0,0,0,0|1,0,2]=4 1974 B13R0.336 C#CCCCCCCSCCCC=O 62a_200011292268_100012276617 [1,0,0,0,0,0|1,0,2]=4 1975 B13R0.336 C#CCCCCCCSCCCCC 62a_100000210326_100012276617 [1,0,0,0,0,0|1,0,2]=4 1976 B13R0.336 C#CCCCCCCSCCCCC 62a_100012276617_100000210326 [1,0,0,0,0,0|1,0,2]=4 1977 B13R0.336 C#CCCCCCNCCCCCC 2230a_100000210581_100012094781 [1,0,0,0,0,0|1,0,2]=4 1978 B13R0.336 C#CCCCCCOCCCCC=O 7a_100000766912_100000139335 [1,0,0,0,0,0|1,0,2]=4 1979 B13R0.336 C#CCCCCCOCCCCCC 34a_100000210259_100012094781 [1,0,0,0,0,0|1,0,2]=4 1980 B13R0.336 C#CCCCCCOCCCCCC 34a_100000766912_100000210314 [1,0,0,0,0,0|1,0,2]=4 1981 B13R0.336 C#CCCCCCOCCCCCC 7a_100000210259_100012094781 [1,0,0,0,0,0|1,0,2]=4 1982 B13R0.336 C#CCCCCCOCCCCCC 7a_100000766912_100000210314 [1,0,0,0,0,0|1,0,2]=4 1983 B13R0.336 C#CCCCCCSCCCCC=O 62a_100000139335_100012094781 [1,0,0,0,0,0|1,0,2]=4 1984 B13R0.336 C#CCCCCCSCCCCC=O 62a_100012094781_100000139335 [1,0,0,0,0,0|1,0,2]=4 1985 B13R0.336 C#CCCCCCSCCCCCC 62a_100000210314_100012094781 [1,0,0,0,0,0|1,0,2]=4 1986 B13R0.336 C#CCCCCCSCCCCCC 62a_100012094781_100000210757 [1,0,0,0,0,0|1,0,2]=4 1987 B13R0.336 C#CCCCCNCCCCCC=O 2230a_100000706060_100000139337 [1,0,0,0,0,0|1,0,2]=4 1988 B13R0.336 C#CCCCCNCCCCCCC 2230a_100000229938_100010269958 [1,0,0,0,0,0|1,0,2]=4 1989 B13R0.336 C#CCCCCNCCCCCCC 2230a_100000706060_100000210681 [1,0,0,0,0,0|1,0,2]=4 1990 B13R0.336 C#CCCCCNCCCCCCC 34a_100000706060_100000210614 [1,0,0,0,0,0|1,0,2]=4 1991 B13R0.336 C#CCCCCOCCCCCC=O 7a_100000766709_100000139337 [1,0,0,0,0,0|1,0,2]=4 1992 B13R0.336 C#CCCCCOCCCCCCC 34a_100000210272_100010269958 [1,0,0,0,0,0|1,0,2]=4 1993 B13R0.336 C#CCCCCOCCCCCCC 34a_100000766709_100000210614 [1,0,0,0,0,0|1,0,2]=4 1994 B13R0.336 C#CCCCCOCCCCCCC 7a_100000210272_100010269958 [1,0,0,0,0,0|1,0,2]=4 1995 B13R0.336 C#CCCCCOCCCCCCC 7a_100000766709_100000210614 [1,0,0,0,0,0|1,0,2]=4 1996 B13R0.336 C#CCCCCSCCCCCC=O 62a_100000139337_100010269958 [1,0,0,0,0,0|1,0,2]=4 1997 B13R0.336 C#CCCCCSCCCCCC=O 62a_100010269958_100000139337 [1,0,0,0,0,0|1,0,2]=4 1998 B13R0.336 C#CCCCCSCCCCCCC 62a_100000210614_100010269958 [1,0,0,0,0,0|1,0,2]=4 1999 B13R0.336 C#CCCCCSCCCCCCC 62a_100010269958_100000210316 [1,0,0,0,0,0|1,0,2]=4 2000 B13R0.336 C#CCCCNCCCCCCCC 2230a_100000229939_100000731252 [1,0,0,0,0,0|1,0,2]=4 2001 B13R0.336 C#CCCCNCCCCCCCC 34a_100000229939_100000695029 [1,0,0,0,0,0|1,0,2]=4 2002 B13R0.336 C#CCCCNCCCCCCCC 34a_100000718082_100000210759 [1,0,0,0,0,0|1,0,2]=4 2003 B13R0.336 C#CCCCOCCCCCCCC 34a_100000210232_100000695029 [1,0,0,0,0,0|1,0,2]=4 2004 B13R0.336 C#CCCCOCCCCCCCC 34a_100000215630_100000210759 [1,0,0,0,0,0|1,0,2]=4 2005 B13R0.336 C#CCCCOCCCCCCCC 7a_100000210232_100011215417 [1,0,0,0,0,0|1,0,2]=4 2006 B13R0.336 C#CCCCOCCCCCCCC 7a_100000215630_100000210759 [1,0,0,0,0,0|1,0,2]=4 2007 B13R0.336 C#CCCCSCCCCCCCC 62a_100000210759_100011215417 [1,0,0,0,0,0|1,0,2]=4 2008 B13R0.336 C#CCCCSCCCCCCCC 62a_100011215417_100000210317 [1,0,0,0,0,0|1,0,2]=4 2009 B13R0.336 C#CCCNCCCCCCCCC 2230a_100000212291_100000688953 [1,0,0,0,0,0|1,0,2]=4 2010 B13R0.336 C#CCCNCCCCCCCCC 34a_100000212291_100000688953 [1,0,0,0,0,0|1,0,2]=4 2011 B13R0.336 C#CCCNCCCCCCCCC 34a_100000755551_100011214924 [1,0,0,0,0,0|1,0,2]=4 2012 B13R0.336 C#CCCOCCCCCCCCC 34a_100000210712_100000688953 [1,0,0,0,0,0|1,0,2]=4 2013 B13R0.336 C#CCCOCCCCCCCCC 34a_100011215631_100011214924 [1,0,0,0,0,0|1,0,2]=4 2014 B13R0.336 C#CCCOCCCCCCCCC 7a_100000210712_100000688953 [1,0,0,0,0,0|1,0,2]=4 2015 B13R0.336 C#CCCSCCCCCCCCC 62a_100000688953_100000210670 [1,0,0,0,0,0|1,0,2]=4 2016 B13R0.336 C#CCNCCCCCCCCCC 2230a_100000684558_100000038162 [1,0,0,0,0,0|1,0,2]=4 2017 B13R0.336 C#CCNCCCCCCCCCC 34a_100000212058_100000210320 [1,0,0,0,0,0|1,0,2]=4 2018 B13R0.336 C#CCNCCCCCCCCCC 34a_100000684558_100000184674 [1,0,0,0,0,0|1,0,2]=4 2019 B13R0.336 C#CCOCCCCCCCCCC 34a_100000210247_100000210320 [1,0,0,0,0,0|1,0,2]=4 2020 B13R0.336 C#CCOCCCCCCCCCC 34a_100000210711_100000184674 [1,0,0,0,0,0|1,0,2]=4 2021 B13R0.336 C#CCOCCCCCCCCCC 7a_100000210711_100000038162 [1,0,0,0,0,0|1,0,2]=4 2022 B13R0.336 C#CCSCCCCCCCCCC 62a_100000038162_100000210320 [1,0,0,0,0,0|1,0,2]=4 2023 B13R0.336 C/C=C/CCOCCCCCCCC 34a_100016278192_100000210759 [1,0,0,0,0,0|2,0,1]=4 2024 B13R0.336 C/C=C/CNCCCCCCCCC 34a_100000212291_100102629194 [1,0,0,0,0,0|2,0,1]=4 2025 B13R0.336 C/C=C/COCCCCCCCCC 34a_100000210712_100102629194 [1,0,0,0,0,0|2,0,1]=4 2026 B13R0.336 C/C=C/COCCCCCCCCC 34a_100016270725_100011214924 [1,0,0,0,0,0|2,0,1]=4 2027 B13R0.336 C/C=C/COCCCCCCCCC 7a_100000210712_100102629194 [1,0,0,0,0,0|2,0,1]=4 2028 B13R0.336 C/C=C/CSCCCCCCCCC 62a_100102629194_100000210670 [1,0,0,0,0,0|2,0,1]=4 2029 B13R0.336 C=CCCCCCCCCCCNC 2230a_106832991635_100011093070 [1,0,0,0,0,0|1,0,1]=3 2030 B13R0.336 C=CCCCCCCCCCCNC 34a_100102657272_100011093070 [1,0,0,0,0,0|1,0,1]=3 2031 B13R0.336 C=CCCCCCCCCCCNC 7a_106832991635_100011093070 [1,0,0,0,0,0|1,0,1]=3 2032 B13R0.336 C=CCCCCCCCCCCOC 34a_100138415774_100011093070 [1,0,0,0,0,0|1,0,1]=3 2033 B13R0.336 C=CCCCCCCCCCCSC 62a_100011093070_200000210301 [1,0,0,0,0,0|1,0,1]=3 2034 B13R0.336 C=CCCCCCCCCCCSC 62a_200000210301_100011093070 [1,0,0,0,0,0|1,0,1]=3 2035 B13R0.336 C=CCCCCCCCCCCS[13CH3] 62a_100011093070_200025704644 [1,0,0,0,0,0|1,0,1]=3 2036 B13R0.336 C=CCCCCCCCCCCS[13CH3] 62a_200025704644_100011093070 [1,0,0,0,0,0|1,0,1]=3 2037 B13R0.336 C=CCCCCCCCCCNCC 2230a_100000081888_100000210202 [1,0,0,0,0,0|1,0,1]=3 2038 B13R0.336 C=CCCCCCCCCCNCC 2230a_100015525214_100009814027 [1,0,0,0,0,0|1,0,1]=3 2039 B13R0.336 C=CCCCCCCCCCNCC 34a_100000081888_100000210202 [1,0,0,0,0,0|1,0,1]=3 2040 B13R0.336 C=CCCCCCCCCCNCF 34a_100000081888_100015361967 [1,0,0,0,0,0|2,0,1]=4 2041 B13R0.336 C=CCCCCCCCCCOCC 34a_100000038209_100000210202 [1,0,0,0,0,0|1,0,1]=3 2042 B13R0.336 C=CCCCCCCCCCOCC 34a_100121572206_100009814027 [1,0,0,0,0,0|1,0,1]=3 2043 B13R0.336 C=CCCCCCCCCCOCC 7a_100000038209_100000210202 [1,0,0,0,0,0|1,0,1]=3 2044 B13R0.336 C=CCCCCCCCCCOCF 34a_100000038209_100015361967 [1,0,0,0,0,0|2,0,1]=4 2045 B13R0.336 C=CCCCCCCCCCOCF 7a_100000038209_100015361967 [1,0,0,0,0,0|2,0,1]=4 2046 B13R0.336 C=CCCCCCCCCCSCC 62a_100000210202_100009814027 [1,0,0,0,0,0|1,0,1]=3 2047 B13R0.336 C=CCCCCCCCCCSCC 62a_100009814027_100000210202 [1,0,0,0,0,0|1,0,1]=3 2048 B13R0.336 C=CCCCCCCCCCSCF 62a_100009814027_100015361967 [1,0,0,0,0,0|2,0,1]=4 2049 B13R0.336 C=CCCCCCCCCCSCF 62a_100015361967_100009814027 [1,0,0,0,0,0|2,0,1]=4 2050 B13R0.336 C=CCCCCCCCCNCCF 34a_100000724931_100011933949 [1,0,0,0,0,0|2,0,1]=4 2051 B13R0.336 C=CCCCCCCCCNCCO 2230a_100016997473_100011933949 [1,0,0,0,0,0|2,0,1]=4 2052 B13R0.336 C=CCCCCCCCCNCCO 34a_100016990907_100011933949 [1,0,0,0,0,0|2,0,1]=4 2053 B13R0.336 C=CCCCCCCCCOCC=O 34a_100011215194_200009817547 [1,0,0,0,0,0|1,0,2]=4 2054 B13R0.336 C=CCCCCCCCCOCC=O 7a_100011215194_200015260668 [1,0,0,0,0,0|1,0,2]=4 2055 B13R0.336 C=CCCCCCCCCOCCBr 34a_100000211926_100011933949 [1,0,0,0,0,0|2,0,1]=4 2056 B13R0.336 C=CCCCCCCCCOCCC 34a_100000210258_100011933949 [1,0,0,0,0,0|1,0,1]=3 2057 B13R0.336 C=CCCCCCCCCOCCC 34a_100011215194_100000210303 [1,0,0,0,0,0|1,0,1]=3 2058 B13R0.336 C=CCCCCCCCCOCCC 7a_100011215194_100000210303 [1,0,0,0,0,0|1,0,1]=3 2059 B13R0.336 C=CCCCCCCCCOCCF 34a_100011215194_100011217306 [1,0,0,0,0,0|2,0,1]=4 2060 B13R0.336 C=CCCCCCCCCOCCF 7a_100011215194_100011217306 [1,0,0,0,0,0|2,0,1]=4 2061 B13R0.336 C=CCCCCCCCCOCCN 34a_100000210304_100011933949 [1,0,0,0,0,0|2,0,1]=4 2062 B13R0.336 C=CCCCCCCCCOCCO 34a_100011215194_100000211926 [1,0,0,0,0,0|2,0,1]=4 2063 B13R0.336 C=CCCCCCCCCOCCO 7a_100011215194_100000211926 [1,0,0,0,0,0|2,0,1]=4 2064 B13R0.336 C=CCCCCCCCCOCSC 34a_100011215194_100011218213 [1,0,0,0,0,0|2,0,1]=4 2065 B13R0.336 C=CCCCCCCCCSCC=O 62a_100011933949_200015260668 [1,0,0,0,0,0|1,0,2]=4 2066 B13R0.336 C=CCCCCCCCCSCC=O 62a_200015260668_100011933949 [1,0,0,0,0,0|1,0,2]=4 2067 B13R0.336 C=CCCCCCCCCSCCC 62a_100000210303_100011933949 [1,0,0,0,0,0|1,0,1]=3 2068 B13R0.336 C=CCCCCCCCCSCCC 62a_100011933949_100000210303 [1,0,0,0,0,0|1,0,1]=3 2069 B13R0.336 C=CCCCCCCCCSCCF 62a_100011217306_100011933949 [1,0,0,0,0,0|2,0,1]=4 2070 B13R0.336 C=CCCCCCCCCSCCF 62a_100011933949_100011217306 [1,0,0,0,0,0|2,0,1]=4 2071 B13R0.336 C=CCCCCCCCCSCCO 62a_100000211926_100011933949 [1,0,0,0,0,0|2,0,1]=4 2072 B13R0.336 C=CCCCCCCCCSCCO 62a_100011933949_100000211926 [1,0,0,0,0,0|2,0,1]=4 2073 B13R0.336 C=CCCCCCCCCSCOC 62a_100000766300_100011933949 [1,0,0,0,0,0|2,0,1]=4 2074 B13R0.336 C=CCCCCCCCCSCOC 62a_100011933949_100000766300 [1,0,0,0,0,0|2,0,1]=4 2075 B13R0.336 C=CCCCCCCCCSCSC 62a_100011218213_100011933949 [1,0,0,0,0,0|2,0,1]=4 2076 B13R0.336 C=CCCCCCCCCSCSC 62a_100011933949_100011218213 [1,0,0,0,0,0|2,0,1]=4 2077 B13R0.336 C=CCCCCCCCNCCCC 2230a_100000102301_100012355270 [1,0,0,0,0,0|1,0,1]=3 2078 B13R0.336 C=CCCCCCCCNCCCC 7a_106832991798_100012355270 [1,0,0,0,0,0|1,0,1]=3 2079 B13R0.336 C=CCCCCCCCNCCCF 2230a_100015189416_100012355270 [1,0,0,0,0,0|2,0,1]=4 2080 B13R0.336 C=CCCCCCCCNCCCF 34a_100015189416_100012355270 [1,0,0,0,0,0|2,0,1]=4 2081 B13R0.336 C=CCCCCCCCNCCOC 2230a_100000209980_100012355270 [1,0,0,0,0,0|2,0,1]=4 2082 B13R0.336 C=CCCCCCCCNCCSC 2230a_100020590264_100012355270 [1,0,0,0,0,0|2,0,1]=4 2083 B13R0.336 C=CCCCCCCCOCCCBr 34a_100011217188_100012355270 [1,0,0,0,0,0|2,0,1]=4 2084 B13R0.336 C=CCCCCCCCOCCCC 34a_100000210227_100012355270 [1,0,0,0,0,0|1,0,1]=3 2085 B13R0.336 C=CCCCCCCCOCCCC 34a_100000730831_100000210210 [1,0,0,0,0,0|1,0,1]=3 2086 B13R0.336 C=CCCCCCCCOCCCC 7a_100000210227_100012355270 [1,0,0,0,0,0|1,0,1]=3 2087 B13R0.336 C=CCCCCCCCOCCCC 7a_100000730831_100000210211 [1,0,0,0,0,0|1,0,1]=3 2088 B13R0.336 C=CCCCCCCCOCCCCl 34a_100000230001_100012355270 [1,0,0,0,0,0|2,0,1]=4 2089 B13R0.336 C=CCCCCCCCOCCCF 34a_100000730831_100011934791 [1,0,0,0,0,0|2,0,1]=4 2090 B13R0.336 C=CCCCCCCCOCCCF 34a_100000759539_100012355270 [1,0,0,0,0,0|2,0,1]=4 2091 B13R0.336 C=CCCCCCCCOCCCF 7a_100000730831_100011934791 [1,0,0,0,0,0|2,0,1]=4 2092 B13R0.336 C=CCCCCCCCOCCCN 34a_100000182051_100012355270 [1,0,0,0,0,0|2,0,1]=4 2093 B13R0.336 C=CCCCCCCCOCCCO 34a_100000730831_100000230001 [1,0,0,0,0,0|2,0,1]=4 2094 B13R0.336 C=CCCCCCCCOCCCO 7a_100000730831_100011215043 [1,0,0,0,0,0|2,0,1]=4 2095 B13R0.336 C=CCCCCCCCOCCOC 34a_100000210237_100012355270 [1,0,0,0,0,0|2,0,1]=4 2096 B13R0.336 C=CCCCCCCCOCCOC 34a_100000730831_100011201679 [1,0,0,0,0,0|2,0,1]=4 2097 B13R0.336 C=CCCCCCCCOCCOC 7a_100000730831_100000233755 [1,0,0,0,0,0|2,0,1]=4 2098 B13R0.336 C=CCCCCCCCOCCSC 34a_100000230434_100012355270 [1,0,0,0,0,0|2,0,1]=4 2099 B13R0.336 C=CCCCCCCCOCCSC 34a_100000730831_100000212216 [1,0,0,0,0,0|2,0,1]=4 2100 B13R0.336 C=CCCCCCCCOCCSC 7a_100000230434_100012355270 [1,0,0,0,0,0|2,0,1]=4 2101 B13R0.336 C=CCCCCCCCOCCSC 7a_100000730831_100000212216 [1,0,0,0,0,0|2,0,1]=4 2102 B13R0.336 C=CCCCCCCCSCCCC 62a_100000210211_100012355270 [1,0,0,0,0,0|1,0,1]=3 2103 B13R0.336 C=CCCCCCCCSCCCC 62a_100012355270_100000210210 [1,0,0,0,0,0|1,0,1]=3 2104 B13R0.336 C=CCCCCCCCSCCCF 62a_100011934791_100012355270 [1,0,0,0,0,0|2,0,1]=4 2105 B13R0.336 C=CCCCCCCCSCCCF 62a_100012355270_100011934791 [1,0,0,0,0,0|2,0,1]=4 2106 B13R0.336 C=CCCCCCCCSCCCO 62a_100011215043_100012355270 [1,0,0,0,0,0|2,0,1]=4 2107 B13R0.336 C=CCCCCCCCSCCCO 62a_100012355270_100011215043 [1,0,0,0,0,0|2,0,1]=4 2108 B13R0.336 C=CCCCCCCCSCCOC 62a_100000233755_100012355270 [1,0,0,0,0,0|2,0,1]=4 2109 B13R0.336 C=CCCCCCCCSCCOC 62a_100012355270_100000233755 [1,0,0,0,0,0|2,0,1]=4 2110 B13R0.336 C=CCCCCCCCSCCSC 62a_100000212216_100012355270 [1,0,0,0,0,0|2,0,1]=4 2111 B13R0.336 C=CCCCCCCCSCCSC 62a_100012355270_100000751147 [1,0,0,0,0,0|2,0,1]=4 2112 B13R0.336 C=CCCCCCCCSCOCC 62a_100000739092_100012355270 [1,0,0,0,0,0|2,0,1]=4 2113 B13R0.336 C=CCCCCCCCSCOCC 62a_100012355270_100000739092 [1,0,0,0,0,0|2,0,1]=4 2114 B13R0.336 C=CCCCCCCNCCCCC 2230a_100000209983_100011215473 [1,0,0,0,0,0|1,0,1]=3 2115 B13R0.336 C=CCCCCCCNCCCCO 2230a_100000750430_100011215473 [1,0,0,0,0,0|2,0,1]=4 2116 B13R0.336 C=CCCCCCCNCCCCO 34a_100000750430_100011215473 [1,0,0,0,0,0|2,0,1]=4 2117 B13R0.336 C=CCCCCCCNCCCOC 34a_100150723488_100011215473 [1,0,0,0,0,0|2,0,1]=4 2118 B13R0.336 C=CCCCCCCNCCCSC 2230a_100000749238_100011215473 [1,0,0,0,0,0|2,0,1]=4 2119 B13R0.336 C=CCCCCCCNCCOCC 2230a_102516460346_100011215473 [1,0,0,0,0,0|2,0,1]=4 2120 B13R0.336 C=CCCCCCCNCCOCC 34a_102516460346_100011215473 [1,0,0,0,0,0|2,0,1]=4 2121 B13R0.336 C=CCCCCCCNCCSCC 2230a_100000106463_100011215473 [1,0,0,0,0,0|2,0,1]=4 2122 B13R0.336 C=CCCCCCCOCCCC=O 7a_200011216477_200011292268 [1,0,0,0,0,0|1,0,2]=4 2123 B13R0.336 C=CCCCCCCOCCCCBr 34a_100011216708_100011215473 [1,0,0,0,0,0|2,0,1]=4 2124 B13R0.336 C=CCCCCCCOCCCCC 34a_100000210253_100011215473 [1,0,0,0,0,0|1,0,1]=3 2125 B13R0.336 C=CCCCCCCOCCCCC 34a_200011216477_100000718602 [1,0,0,0,0,0|1,0,1]=3 2126 B13R0.336 C=CCCCCCCOCCCCC 7a_100000210253_100011215473 [1,0,0,0,0,0|1,0,1]=3 2127 B13R0.336 C=CCCCCCCOCCCCC 7a_200011216477_100000210326 [1,0,0,0,0,0|1,0,1]=3 2128 B13R0.336 C=CCCCCCCOCCCCCl 34a_100000210776_100011215473 [1,0,0,0,0,0|2,0,1]=4 2129 B13R0.336 C=CCCCCCCOCCCCCl 7a_100000210776_100011215473 [1,0,0,0,0,0|2,0,1]=4 2130 B13R0.336 C=CCCCCCCOCCCCF 34a_100011995726_100011215473 [1,0,0,0,0,0|2,0,1]=4 2131 B13R0.336 C=CCCCCCCOCCCCF 34a_200011216477_100000729493 [1,0,0,0,0,0|2,0,1]=4 2132 B13R0.336 C=CCCCCCCOCCCCF 7a_100011995726_100011215473 [1,0,0,0,0,0|2,0,1]=4 2133 B13R0.336 C=CCCCCCCOCCCCF 7a_200011216477_100000729493 [1,0,0,0,0,0|2,0,1]=4 2134 B13R0.336 C=CCCCCCCOCCCCI 34a_200012148704_100011215473 [1,0,0,0,0,0|2,0,1]=4 2135 B13R0.336 C=CCCCCCCOCCCCN 34a_100000750430_100011215473 [1,0,0,0,0,0|2,0,1]=4 2136 B13R0.336 C=CCCCCCCOCCCCO 34a_200011216477_100011216708 [1,0,0,0,0,0|2,0,1]=4 2137 B13R0.336 C=CCCCCCCOCCCCO 7a_200011216477_100000210776 [1,0,0,0,0,0|2,0,1]=4 2138 B13R0.336 C=CCCCCCCOCCCNC 34a_100000213112_100011215473 [1,0,0,0,0,0|2,0,1]=4 2139 B13R0.336 C=CCCCCCCOCCCOC 34a_100000740835_100011215473 [1,0,0,0,0,0|2,0,1]=4 2140 B13R0.336 C=CCCCCCCOCCCOC 34a_200011216477_100000740836 [1,0,0,0,0,0|2,0,1]=4 2141 B13R0.336 C=CCCCCCCOCCCOC 7a_200011216477_100000740836 [1,0,0,0,0,0|2,0,1]=4 2142 B13R0.336 C=CCCCCCCOCCCSC 34a_100000690336_100011215473 [1,0,0,0,0,0|2,0,1]=4 2143 B13R0.336 C=CCCCCCCOCCCSC 7a_100000690336_100011215473 [1,0,0,0,0,0|2,0,1]=4 2144 B13R0.336 C=CCCCCCCOCCOCC 34a_100000210136_100011215473 [1,0,0,0,0,0|2,0,1]=4 2145 B13R0.336 C=CCCCCCCOCCOCC 34a_200011216477_100000210147 [1,0,0,0,0,0|2,0,1]=4 2146 B13R0.336 C=CCCCCCCOCCOCC 7a_100000210136_100011215473 [1,0,0,0,0,0|2,0,1]=4 2147 B13R0.336 C=CCCCCCCOCCOCC 7a_200011216477_100011215890 [1,0,0,0,0,0|2,0,1]=4 2148 B13R0.336 C=CCCCCCCOCCSCC 34a_100000212035_100011215473 [1,0,0,0,0,0|2,0,1]=4 2149 B13R0.336 C=CCCCCCCOCCSCC 34a_200011216477_100000757381 [1,0,0,0,0,0|2,0,1]=4 2150 B13R0.336 C=CCCCCCCOCCSCC 7a_100000212035_100011215473 [1,0,0,0,0,0|2,0,1]=4 2151 B13R0.336 C=CCCCCCCOCCSCC 7a_200011216477_100000757381 [1,0,0,0,0,0|2,0,1]=4 2152 B13R0.336 C=CCCCCCCSCCCC=O 62a_100011215473_200011292268 [1,0,0,0,0,0|1,0,2]=4 2153 B13R0.336 C=CCCCCCCSCCCC=O 62a_200011292268_100011215473 [1,0,0,0,0,0|1,0,2]=4 2154 B13R0.336 C=CCCCCCCSCCCCC 62a_100000210326_100011215473 [1,0,0,0,0,0|1,0,1]=3 2155 B13R0.336 C=CCCCCCCSCCCCC 62a_100011215473_100000210326 [1,0,0,0,0,0|1,0,1]=3 2156 B13R0.336 C=CCCCCCCSCCCCF 62a_100000729493_100011215473 [1,0,0,0,0,0|2,0,1]=4 2157 B13R0.336 C=CCCCCCCSCCCCF 62a_100011215473_100000729493 [1,0,0,0,0,0|2,0,1]=4 2158 B13R0.336 C=CCCCCCCSCCCCO 62a_100000210776_100011215473 [1,0,0,0,0,0|2,0,1]=4 2159 B13R0.336 C=CCCCCCCSCCCCO 62a_100011215473_100000210776 [1,0,0,0,0,0|2,0,1]=4 2160 B13R0.336 C=CCCCCCCSCCCOC 62a_100000709357_100011215473 [1,0,0,0,0,0|2,0,1]=4 2161 B13R0.336 C=CCCCCCCSCCCOC 62a_100011215473_100000709357 [1,0,0,0,0,0|2,0,1]=4 2162 B13R0.336 C=CCCCCCCSCCOCC 62a_100000210147_100011215473 [1,0,0,0,0,0|2,0,1]=4 2163 B13R0.336 C=CCCCCCCSCCOCC 62a_100011215473_100011215890 [1,0,0,0,0,0|2,0,1]=4 2164 B13R0.336 C=CCCCCCCSCCSCC 62a_100000757381_100011215473 [1,0,0,0,0,0|2,0,1]=4 2165 B13R0.336 C=CCCCCCCSCCSCC 62a_100011215473_100000757381 [1,0,0,0,0,0|2,0,1]=4 2166 B13R0.336 C=CCCCCCNCCCCCC 2230a_100000210581_100000700193 [1,0,0,0,0,0|1,0,1]=3 2167 B13R0.336 C=CCCCCCNCCCCCO 2230a_100000762737_100000700193 [1,0,0,0,0,0|2,0,1]=4 2168 B13R0.336 C=CCCCCCNCCCCCO 34a_100000762737_100000700193 [1,0,0,0,0,0|2,0,1]=4 2169 B13R0.336 C=CCCCCCNCCCOCC 2230a_100000210961_100000700193 [1,0,0,0,0,0|2,0,1]=4 2170 B13R0.336 C=CCCCCCNCCCOCC 34a_100000210961_100000700193 [1,0,0,0,0,0|2,0,1]=4 2171 B13R0.336 C=CCCCCCNCCOCCC 2230a_100161115042_100000700193 [1,0,0,0,0,0|2,0,1]=4 2172 B13R0.336 C=CCCCCCNCCOCCC 34a_100161115042_100000700193 [1,0,0,0,0,0|2,0,1]=4 2173 B13R0.336 C=CCCCCCNCCSCCC 2230a_100020603323_100000700193 [1,0,0,0,0,0|2,0,1]=4 2174 B13R0.336 C=CCCCCCOCCCCC=O 7a_100011216702_100000139335 [1,0,0,0,0,0|1,0,2]=4 2175 B13R0.336 C=CCCCCCOCCCCCBr 34a_100000746331_100000700193 [1,0,0,0,0,0|2,0,1]=4 2176 B13R0.336 C=CCCCCCOCCCCCBr 7a_100000746331_100000700193 [1,0,0,0,0,0|2,0,1]=4 2177 B13R0.336 C=CCCCCCOCCCCCC 34a_100000210259_100000700193 [1,0,0,0,0,0|1,0,1]=3 2178 B13R0.336 C=CCCCCCOCCCCCC 34a_100011216702_100000210314 [1,0,0,0,0,0|1,0,1]=3 2179 B13R0.336 C=CCCCCCOCCCCCC 7a_100000210259_100000700193 [1,0,0,0,0,0|1,0,1]=3 2180 B13R0.336 C=CCCCCCOCCCCCC 7a_100011216702_100000210314 [1,0,0,0,0,0|1,0,1]=3 2181 B13R0.336 C=CCCCCCOCCCCCCl 34a_100000746330_100000700193 [1,0,0,0,0,0|2,0,1]=4 2182 B13R0.336 C=CCCCCCOCCCCCCl 7a_100000746330_100000700193 [1,0,0,0,0,0|2,0,1]=4 2183 B13R0.336 C=CCCCCCOCCCCCF 34a_100011216702_100000729378 [1,0,0,0,0,0|2,0,1]=4 2184 B13R0.336 C=CCCCCCOCCCCCF 7a_100011216702_100000729378 [1,0,0,0,0,0|2,0,1]=4 2185 B13R0.336 C=CCCCCCOCCCCCI 34a_200012148887_100000700193 [1,0,0,0,0,0|2,0,1]=4 2186 B13R0.336 C=CCCCCCOCCCCCI 7a_200012148887_100000700193 [1,0,0,0,0,0|2,0,1]=4 2187 B13R0.336 C=CCCCCCOCCCCCN 34a_100000762737_100000700193 [1,0,0,0,0,0|2,0,1]=4 2188 B13R0.336 C=CCCCCCOCCCCCO 34a_100011216702_100000746330 [1,0,0,0,0,0|2,0,1]=4 2189 B13R0.336 C=CCCCCCOCCCCCO 7a_100011216702_100000746330 [1,0,0,0,0,0|2,0,1]=4 2190 B13R0.336 C=CCCCCCOCCCCOC 34a_100000740925_100000700193 [1,0,0,0,0,0|2,0,1]=4 2191 B13R0.336 C=CCCCCCOCCCCOC 34a_100011216702_100000755781 [1,0,0,0,0,0|2,0,1]=4 2192 B13R0.336 C=CCCCCCOCCCCOC 7a_100011216702_100000730899 [1,0,0,0,0,0|2,0,1]=4 2193 B13R0.336 C=CCCCCCOCCCCSC 34a_100011217163_100000700193 [1,0,0,0,0,0|2,0,1]=4 2194 B13R0.336 C=CCCCCCOCCCCSC 7a_100011217163_100000700193 [1,0,0,0,0,0|2,0,1]=4 2195 B13R0.336 C=CCCCCCOCCCOCC 34a_100000757476_100000700193 [1,0,0,0,0,0|2,0,1]=4 2196 B13R0.336 C=CCCCCCOCCCOCC 34a_100011216702_100012232248 [1,0,0,0,0,0|2,0,1]=4 2197 B13R0.336 C=CCCCCCOCCCOCC 7a_100000757476_100000700193 [1,0,0,0,0,0|2,0,1]=4 2198 B13R0.336 C=CCCCCCOCCCOCC 7a_100011216702_100012232248 [1,0,0,0,0,0|2,0,1]=4 2199 B13R0.336 C=CCCCCCOCCCSCC 34a_100011216438_100000700193 [1,0,0,0,0,0|2,0,1]=4 2200 B13R0.336 C=CCCCCCOCCCSCC 7a_100011216438_100000700193 [1,0,0,0,0,0|2,0,1]=4 2201 B13R0.336 C=CCCCCCOCCOCCC 34a_100000752267_100000700193 [1,0,0,0,0,0|2,0,1]=4 2202 B13R0.336 C=CCCCCCOCCOCCC 34a_100011216702_100011215938 [1,0,0,0,0,0|2,0,1]=4 2203 B13R0.336 C=CCCCCCOCCOCCC 7a_100000752267_100000700193 [1,0,0,0,0,0|2,0,1]=4 2204 B13R0.336 C=CCCCCCOCCOCCC 7a_100011216702_100011215938 [1,0,0,0,0,0|2,0,1]=4 2205 B13R0.336 C=CCCCCCOCCSCCC 34a_200000230433_100000700193 [1,0,0,0,0,0|2,0,1]=4 2206 B13R0.336 C=CCCCCCOCCSCCC 7a_200000230433_100000700193 [1,0,0,0,0,0|2,0,1]=4 2207 B13R0.336 C=CCCCCCOCOCCCC 34a_100011216702_100011995733 [1,0,0,0,0,0|2,0,1]=4 2208 B13R0.336 C=CCCCCCSCCCCC=O 62a_100000139335_100000700193 [1,0,0,0,0,0|1,0,2]=4 2209 B13R0.336 C=CCCCCCSCCCCC=O 62a_100000700193_100000139335 [1,0,0,0,0,0|1,0,2]=4 2210 B13R0.336 C=CCCCCCSCCCCCC 62a_100000210314_100000700193 [1,0,0,0,0,0|1,0,1]=3 2211 B13R0.336 C=CCCCCCSCCCCCC 62a_100000700193_100000210757 [1,0,0,0,0,0|1,0,1]=3 2212 B13R0.336 C=CCCCCCSCCCCCF 62a_100000700193_100000729378 [1,0,0,0,0,0|2,0,1]=4 2213 B13R0.336 C=CCCCCCSCCCCCF 62a_100000729378_100000700193 [1,0,0,0,0,0|2,0,1]=4 2214 B13R0.336 C=CCCCCCSCCCCCO 62a_100000700193_100000746330 [1,0,0,0,0,0|2,0,1]=4 2215 B13R0.336 C=CCCCCCSCCCCCO 62a_100000746330_100000700193 [1,0,0,0,0,0|2,0,1]=4 2216 B13R0.336 C=CCCCCCSCCCCOC 62a_100000700193_100000730899 [1,0,0,0,0,0|2,0,1]=4 2217 B13R0.336 C=CCCCCCSCCCCOC 62a_100000730899_100000700193 [1,0,0,0,0,0|2,0,1]=4 2218 B13R0.336 C=CCCCCCSCCCOCC 62a_100000700193_100012232248 [1,0,0,0,0,0|2,0,1]=4 2219 B13R0.336 C=CCCCCCSCCCOCC 62a_100012232248_100000700193 [1,0,0,0,0,0|2,0,1]=4 2220 B13R0.336 C=CCCCCCSCCOCCC 62a_100000700193_100011215938 [1,0,0,0,0,0|2,0,1]=4 2221 B13R0.336 C=CCCCCCSCCOCCC 62a_100011215938_100000700193 [1,0,0,0,0,0|2,0,1]=4 2222 B13R0.336 C=CCCCCCSCOCCCC 62a_100000700193_100011995733 [1,0,0,0,0,0|2,0,1]=4 2223 B13R0.336 C=CCCCCCSCOCCCC 62a_100011995733_100000700193 [1,0,0,0,0,0|2,0,1]=4 2224 B13R0.336 C=CCCCCNCCCCCC=O 2230a_100000703577_100000139337 [1,0,0,0,0,0|1,0,2]=4 2225 B13R0.336 C=CCCCCNCCCCCCC 2230a_100000229938_100011215482 [1,0,0,0,0,0|1,0,1]=3 2226 B13R0.336 C=CCCCCNCCCCCCC 2230a_100000703577_100000210681 [1,0,0,0,0,0|1,0,1]=3 2227 B13R0.336 C=CCCCCNCCCCCCC 34a_100000703577_100000210614 [1,0,0,0,0,0|1,0,1]=3 2228 B13R0.336 C=CCCCCNCCCCCCF 2230a_100000703577_100015922095 [1,0,0,0,0,0|2,0,1]=4 2229 B13R0.336 C=CCCCCNCCCCCCF 34a_100000703577_100015922095 [1,0,0,0,0,0|2,0,1]=4 2230 B13R0.336 C=CCCCCNCCCCCCO 2230a_100000686447_100011215482 [1,0,0,0,0,0|2,0,1]=4 2231 B13R0.336 C=CCCCCNCCCCCCO 2230a_100000703577_100000766143 [1,0,0,0,0,0|2,0,1]=4 2232 B13R0.336 C=CCCCCNCCCCCCO 34a_100000686447_100011215482 [1,0,0,0,0,0|2,0,1]=4 2233 B13R0.336 C=CCCCCNCCCCCCO 34a_100000703577_100000766143 [1,0,0,0,0,0|2,0,1]=4 2234 B13R0.336 C=CCCCCNCCCCCOC 2230a_100000747528_100011215482 [1,0,0,0,0,0|2,0,1]=4 2235 B13R0.336 C=CCCCCNCCCCCOC 34a_100000747528_100011215482 [1,0,0,0,0,0|2,0,1]=4 2236 B13R0.336 C=CCCCCNCCCOCCC 2230a_100011217757_100011215482 [1,0,0,0,0,0|2,0,1]=4 2237 B13R0.336 C=CCCCCNCCCOCCC 34a_100011217757_100011215482 [1,0,0,0,0,0|2,0,1]=4 2238 B13R0.336 C=CCCCCNCCOCCCC 2230a_100000703577_100000743108 [1,0,0,0,0,0|2,0,1]=4 2239 B13R0.336 C=CCCCCNCCOCCCC 34a_100000703577_100000743108 [1,0,0,0,0,0|2,0,1]=4 2240 B13R0.336 C=CCCCCNCCSCCCC 2230a_100025743550_100011215482 [1,0,0,0,0,0|2,0,1]=4 2241 B13R0.336 C=CCCCCOCCCCCC=O 7a_100000766645_100000139337 [1,0,0,0,0,0|1,0,2]=4 2242 B13R0.336 C=CCCCCOCCCCCCBr 34a_100011215345_100011215482 [1,0,0,0,0,0|2,0,1]=4 2243 B13R0.336 C=CCCCCOCCCCCCBr 7a_100011215345_100011215482 [1,0,0,0,0,0|2,0,1]=4 2244 B13R0.336 C=CCCCCOCCCCCCC 34a_100000210272_100011215482 [1,0,0,0,0,0|1,0,1]=3 2245 B13R0.336 C=CCCCCOCCCCCCC 34a_100000766645_100000210614 [1,0,0,0,0,0|1,0,1]=3 2246 B13R0.336 C=CCCCCOCCCCCCC 7a_100000210272_100011215482 [1,0,0,0,0,0|1,0,1]=3 2247 B13R0.336 C=CCCCCOCCCCCCC 7a_100000766645_100000210614 [1,0,0,0,0,0|1,0,1]=3 2248 B13R0.336 C=CCCCCOCCCCCCCl 34a_100000766143_100011215482 [1,0,0,0,0,0|2,0,1]=4 2249 B13R0.336 C=CCCCCOCCCCCCCl 7a_100000766143_100011215482 [1,0,0,0,0,0|2,0,1]=4 2250 B13R0.336 C=CCCCCOCCCCCCF 34a_100000732779_100011215482 [1,0,0,0,0,0|2,0,1]=4 2251 B13R0.336 C=CCCCCOCCCCCCF 34a_100000766645_100015922095 [1,0,0,0,0,0|2,0,1]=4 2252 B13R0.336 C=CCCCCOCCCCCCF 7a_100000732779_100011215482 [1,0,0,0,0,0|2,0,1]=4 2253 B13R0.336 C=CCCCCOCCCCCCF 7a_100000766645_100015922095 [1,0,0,0,0,0|2,0,1]=4 2254 B13R0.336 C=CCCCCOCCCCCCN 34a_100000686447_100011215482 [1,0,0,0,0,0|2,0,1]=4 2255 B13R0.336 C=CCCCCOCCCCCCO 34a_100000766645_100000766143 [1,0,0,0,0,0|2,0,1]=4 2256 B13R0.336 C=CCCCCOCCCCCCO 7a_100000766645_100000766143 [1,0,0,0,0,0|2,0,1]=4 2257 B13R0.336 C=CCCCCOCCCCCNC 34a_100000722520_100011215482 [1,0,0,0,0,0|2,0,1]=4 2258 B13R0.336 C=CCCCCOCCOCCCC 34a_100000210238_100011215482 [1,0,0,0,0,0|2,0,1]=4 2259 B13R0.336 C=CCCCCOCCOCCCC 34a_100000766645_100000743108 [1,0,0,0,0,0|2,0,1]=4 2260 B13R0.336 C=CCCCCOCCOCCCC 7a_100000210238_100011215482 [1,0,0,0,0,0|2,0,1]=4 2261 B13R0.336 C=CCCCCOCCOCCCC 7a_100000766645_100000743108 [1,0,0,0,0,0|2,0,1]=4 2262 B13R0.336 C=CCCCCOCCSCCCC 34a_200000230436_100011215482 [1,0,0,0,0,0|2,0,1]=4 2263 B13R0.336 C=CCCCCOCCSCCCC 7a_200000230436_100011215482 [1,0,0,0,0,0|2,0,1]=4 2264 B13R0.336 C=CCCCCSCCCCCC=O 62a_100000139337_100011215482 [1,0,0,0,0,0|1,0,2]=4 2265 B13R0.336 C=CCCCCSCCCCCC=O 62a_100011215482_100000139337 [1,0,0,0,0,0|1,0,2]=4 2266 B13R0.336 C=CCCCCSCCCCCCC 62a_100000210614_100011215482 [1,0,0,0,0,0|1,0,1]=3 2267 B13R0.336 C=CCCCCSCCCCCCC 62a_100011215482_100000210316 [1,0,0,0,0,0|1,0,1]=3 2268 B13R0.336 C=CCCCCSCCCCCCF 62a_100011215482_100015922095 [1,0,0,0,0,0|2,0,1]=4 2269 B13R0.336 C=CCCCCSCCCCCCF 62a_100015922095_100011215482 [1,0,0,0,0,0|2,0,1]=4 2270 B13R0.336 C=CCCCCSCCCCCCO 62a_100000766143_100011215482 [1,0,0,0,0,0|2,0,1]=4 2271 B13R0.336 C=CCCCCSCCCCCCO 62a_100011215482_100000766143 [1,0,0,0,0,0|2,0,1]=4 2272 B13R0.336 C=CCCCCSCCOCCCC 62a_100000743108_100011215482 [1,0,0,0,0,0|2,0,1]=4 2273 B13R0.336 C=CCCCCSCCOCCCC 62a_100011215482_100000743108 [1,0,0,0,0,0|2,0,1]=4 2274 B13R0.336 C=CCCCNCCCCCCCC 2230a_100000229939_100011713584 [1,0,0,0,0,0|1,0,1]=3 2275 B13R0.336 C=CCCCNCCCCCCCC 2230a_100000700776_100000210759 [1,0,0,0,0,0|1,0,1]=3 2276 B13R0.336 C=CCCCNCCCCCCCC 34a_100000229939_100000757094 [1,0,0,0,0,0|1,0,1]=3 2277 B13R0.336 C=CCCCNCCCCCCCC 34a_100000700776_100000210759 [1,0,0,0,0,0|1,0,1]=3 2278 B13R0.336 C=CCCCNCCCCCCCO 2230a_100000700776_100000760002 [1,0,0,0,0,0|2,0,1]=4 2279 B13R0.336 C=CCCCNCCCCCCCO 2230a_100011996573_100011713584 [1,0,0,0,0,0|2,0,1]=4 2280 B13R0.336 C=CCCCNCCCCCCCO 34a_100000700776_100000760002 [1,0,0,0,0,0|2,0,1]=4 2281 B13R0.336 C=CCCCNCCCCCCCO 34a_100011996573_100000757094 [1,0,0,0,0,0|2,0,1]=4 2282 B13R0.336 C=CCCCNCCCCCCOC 2230a_100000700776_100011998445 [1,0,0,0,0,0|2,0,1]=4 2283 B13R0.336 C=CCCCNCCCCCCOC 34a_100000700776_100011998445 [1,0,0,0,0,0|2,0,1]=4 2284 B13R0.336 C=CCCCNCCCOCCCC 2230a_200000211371_100011713584 [1,0,0,0,0,0|2,0,1]=4 2285 B13R0.336 C=CCCCNCCCOCCCC 34a_200000211371_100000757094 [1,0,0,0,0,0|2,0,1]=4 2286 B13R0.336 C=CCCCOCCCCCCCBr 34a_100000760002_100000757094 [1,0,0,0,0,0|2,0,1]=4 2287 B13R0.336 C=CCCCOCCCCCCCBr 7a_100000760002_100000757094 [1,0,0,0,0,0|2,0,1]=4 2288 B13R0.336 C=CCCCOCCCCCCCC 34a_100000210232_100000757094 [1,0,0,0,0,0|1,0,1]=3 2289 B13R0.336 C=CCCCOCCCCCCCC 34a_100000758997_100000210759 [1,0,0,0,0,0|1,0,1]=3 2290 B13R0.336 C=CCCCOCCCCCCCC 7a_100000210232_100000757094 [1,0,0,0,0,0|1,0,1]=3 2291 B13R0.336 C=CCCCOCCCCCCCC 7a_100000758997_100000210759 [1,0,0,0,0,0|1,0,1]=3 2292 B13R0.336 C=CCCCOCCCCCCCN 34a_100011996573_100000757094 [1,0,0,0,0,0|2,0,1]=4 2293 B13R0.336 C=CCCCOCCCCCCCO 34a_100000758997_100000760002 [1,0,0,0,0,0|2,0,1]=4 2294 B13R0.336 C=CCCCOCCCCCCCO 7a_100000758997_100000760002 [1,0,0,0,0,0|2,0,1]=4 2295 B13R0.336 C=CCCCOCCCCCCOC 34a_100000758997_100011998445 [1,0,0,0,0,0|2,0,1]=4 2296 B13R0.336 C=CCCCOCCCCCCOC 34a_200012092642_100000757094 [1,0,0,0,0,0|2,0,1]=4 2297 B13R0.336 C=CCCCOCCCCCCOC 7a_100000758997_100011998445 [1,0,0,0,0,0|2,0,1]=4 2298 B13R0.336 C=CCCCOCCCCCCOC 7a_200012092642_100000757094 [1,0,0,0,0,0|2,0,1]=4 2299 B13R0.336 C=CCCCOCCCOCCCC 34a_200011215613_100000757094 [1,0,0,0,0,0|2,0,1]=4 2300 B13R0.336 C=CCCCOCCCOCCCC 7a_200011215613_100000757094 [1,0,0,0,0,0|2,0,1]=4 2301 B13R0.336 C=CCCCOCCNCCCCC 34a_100000224656_100000757094 [1,0,0,0,0,0|2,0,1]=4 2302 B13R0.336 C=CCCCOCCOCCCCC 34a_100011215259_100000757094 [1,0,0,0,0,0|2,0,1]=4 2303 B13R0.336 C=CCCCOCCOCCCCC 7a_100011215259_100000757094 [1,0,0,0,0,0|2,0,1]=4 2304 B13R0.336 C=CCCCSCCCCCCCC 62a_100000210759_100000757094 [1,0,0,0,0,0|1,0,1]=3 2305 B13R0.336 C=CCCCSCCCCCCCC 62a_100011713584_100000210317 [1,0,0,0,0,0|1,0,1]=3 2306 B13R0.336 C=CCCCSCCCCCCCO 62a_100000760002_100000757094 [1,0,0,0,0,0|2,0,1]=4 2307 B13R0.336 C=CCCCSCCCCCCCO 62a_100011713584_100000760002 [1,0,0,0,0,0|2,0,1]=4 2308 B13R0.336 C=CCCCSCCCCCCOC 62a_100011713584_100011998445 [1,0,0,0,0,0|2,0,1]=4 2309 B13R0.336 C=CCCCSCCCCCCOC 62a_100011998445_100000757094 [1,0,0,0,0,0|2,0,1]=4 2310 B13R0.336 C=CCCNCCCCCCCCC 2230a_100000212291_100000754431 [1,0,0,0,0,0|1,0,1]=3 2311 B13R0.336 C=CCCNCCCCCCCCC 2230a_100015191253_100011214924 [1,0,0,0,0,0|1,0,1]=3 2312 B13R0.336 C=CCCNCCCCCCCCC 34a_100000212291_100000754431 [1,0,0,0,0,0|1,0,1]=3 2313 B13R0.336 C=CCCNCCCCCCCCO 2230a_100015191253_100000033203 [1,0,0,0,0,0|2,0,1]=4 2314 B13R0.336 C=CCCNCCCCCCCCO 2230a_102515433106_100000754431 [1,0,0,0,0,0|2,0,1]=4 2315 B13R0.336 C=CCCNCCCCCCCCO 34a_102515433106_100000754431 [1,0,0,0,0,0|2,0,1]=4 2316 B13R0.336 C=CCCOCCCCCCCCBr 34a_100009813846_100000754431 [1,0,0,0,0,0|2,0,1]=4 2317 B13R0.336 C=CCCOCCCCCCCCBr 7a_100009813846_100000754431 [1,0,0,0,0,0|2,0,1]=4 2318 B13R0.336 C=CCCOCCCCCCCCC 34a_100000210712_100000754431 [1,0,0,0,0,0|1,0,1]=3 2319 B13R0.336 C=CCCOCCCCCCCCC 34a_100011205117_100011214924 [1,0,0,0,0,0|1,0,1]=3 2320 B13R0.336 C=CCCOCCCCCCCCC 7a_100000210712_100000754431 [1,0,0,0,0,0|1,0,1]=3 2321 B13R0.336 C=CCCOCCCCCCCCCl 34a_100000033203_100000754431 [1,0,0,0,0,0|2,0,1]=4 2322 B13R0.336 C=CCCOCCCCCCCCCl 7a_100000033203_100000754431 [1,0,0,0,0,0|2,0,1]=4 2323 B13R0.336 C=CCCOCCCCCCCCN 34a_102515433106_100000754431 [1,0,0,0,0,0|2,0,1]=4 2324 B13R0.336 C=CCCOCCCCCCCCO 34a_100011205117_100000033203 [1,0,0,0,0,0|2,0,1]=4 2325 B13R0.336 C=CCCOCCCCNCCCC 34a_200011216965_100000754431 [1,0,0,0,0,0|2,0,1]=4 2326 B13R0.336 C=CCCOCCCCOCCCC 34a_200000760531_100000754431 [1,0,0,0,0,0|2,0,1]=4 2327 B13R0.336 C=CCCOCCCCOCCCC 7a_200000760531_100000754431 [1,0,0,0,0,0|2,0,1]=4 2328 B13R0.336 C=CCCOCCOCCCCCC 34a_100000691444_100000754431 [1,0,0,0,0,0|2,0,1]=4 2329 B13R0.336 C=CCCOCCOCCCCCC 7a_100000691444_100000754431 [1,0,0,0,0,0|2,0,1]=4 2330 B13R0.336 C=CCCSCCCCCCCCC 62a_100000754431_100000210670 [1,0,0,0,0,0|1,0,1]=3 2331 B13R0.336 C=CCCSCCCCCCCCO 62a_100000033203_100000754431 [1,0,0,0,0,0|2,0,1]=4 2332 B13R0.336 C=CCCSCCCCCCCCO 62a_100000754431_100000033203 [1,0,0,0,0,0|2,0,1]=4 2333 B13R0.336 C=CCNCCCCCCCCCC 2230a_100000684558_100000210623 [1,0,0,0,0,0|1,0,1]=3 2334 B13R0.336 C=CCNCCCCCCCCCC 2230a_100020586998_100000210320 [1,0,0,0,0,0|1,0,1]=3 2335 B13R0.336 C=CCNCCCCCCCCCC 34a_100000684558_100015514636 [1,0,0,0,0,0|1,0,1]=3 2336 B13R0.336 C=CCNCCCCCCCCCO 2230a_100000078944_100000210623 [1,0,0,0,0,0|2,0,1]=4 2337 B13R0.336 C=CCNCCCCCCCCCO 2230a_100020586998_100009813782 [1,0,0,0,0,0|2,0,1]=4 2338 B13R0.336 C=CCNCCCCCCCCCO 34a_100000078944_100015514636 [1,0,0,0,0,0|2,0,1]=4 2339 B13R0.336 C=CCOCCCCCCCCCBr 34a_100009813782_100015514636 [1,0,0,0,0,0|2,0,1]=4 2340 B13R0.336 C=CCOCCCCCCCCCBr 7a_100009813782_100015514636 [1,0,0,0,0,0|2,0,1]=4 2341 B13R0.336 C=CCOCCCCCCCCCC 34a_100000210711_100015514636 [1,0,0,0,0,0|1,0,1]=3 2342 B13R0.336 C=CCOCCCCCCCCCC 34a_200000210373_100000210320 [1,0,0,0,0,0|1,0,1]=3 2343 B13R0.336 C=CCOCCCCCCCCCC 7a_100000210711_100015514636 [1,0,0,0,0,0|1,0,1]=3 2344 B13R0.336 C=CCOCCCCCCCCCCl 34a_100009868337_100015514636 [1,0,0,0,0,0|2,0,1]=4 2345 B13R0.336 C=CCOCCCCCCCCCCl 7a_100009868337_100015514636 [1,0,0,0,0,0|2,0,1]=4 2346 B13R0.336 C=CCOCCCCCCCCCN 34a_100000078944_100015514636 [1,0,0,0,0,0|2,0,1]=4 2347 B13R0.336 C=CCOCCCCCCCCCO 34a_200000210373_100009813782 [1,0,0,0,0,0|2,0,1]=4 2348 B13R0.336 C=CCOCCOCCCCCCC 34a_100000037705_100000210614 [1,0,0,0,0,0|2,0,1]=4 2349 B13R0.336 C=CCOCCOCCCCCCC 7a_100000037705_100000210614 [1,0,0,0,0,0|2,0,1]=4 2350 B13R0.336 C=CCSCCCCCCCCCC 62a_100000210623_100000210320 [1,0,0,0,0,0|1,0,1]=3 2351 B13R0.336 C=CCSCCCCCCCCCO 62a_100000210623_100009813782 [1,0,0,0,0,0|2,0,1]=4 2352 B13R0.336 C=CCSCCCCCCCCCO 62a_100009813782_100000210623 [1,0,0,0,0,0|2,0,1]=4 2353 B13R0.336 C=COCCCCOCCCCCC 34a_100000031558_100000210314 [1,0,0,0,0,0|2,0,1]=4 2354 B13R0.336 C=COCCCCOCCCCCC 7a_100000031558_100000210314 [1,0,0,0,0,0|2,0,1]=4 2355 B13R0.336 C=COCCCNCCCCCCC 2230a_100000210767_100000210681 [1,0,0,0,0,0|2,0,1]=4 2356 B13R0.336 C=COCCCNCCCCCCC 34a_100000210767_100000210614 [1,0,0,0,0,0|2,0,1]=4 2357 B13R0.336 C=COCCNCCCCCCCC 2230a_100000229939_100000039644 [1,0,0,0,0,0|2,0,1]=4 2358 B13R0.336 C=COCCNCCCCCCCC 34a_100000229939_100000039644 [1,0,0,0,0,0|2,0,1]=4 2359 B13R0.336 C=COCCOCCCCCCCC 34a_100000033082_100000210759 [1,0,0,0,0,0|2,0,1]=4 2360 B13R0.336 C=COCCOCCCCCCCC 34a_100000210232_100000039644 [1,0,0,0,0,0|2,0,1]=4 2361 B13R0.336 C=COCCOCCCCCCCC 7a_100000210232_100000039644 [1,0,0,0,0,0|2,0,1]=4 2362 B13R0.336 C=COCCSCCCCCCCC 62a_100000039644_100000210317 [1,0,0,0,0,0|2,0,1]=4 2363 B13R0.336 C=COCCSCCCCCCCC 62a_100000210759_100000039644 [1,0,0,0,0,0|2,0,1]=4 2364 B13R0.336 CC/C=C/CCCOCCCCC=O 7a_100016287902_100000139335 [1,0,0,0,0,0|1,0,2]=4 2365 B13R0.336 CC/C=C\CCCCOCCCC=O 7a_100016287862_200011292268 [1,0,0,0,0,0|1,0,2]=4 2366 B13R0.336 CC/C=C\CCOCCCCCC=O 7a_100016288707_100000139337 [1,0,0,0,0,0|1,0,2]=4 2367 B13R0.336 CC/C=C\CCSCCCCCC=O 62a_100000139337_100015370543 [1,0,0,0,0,0|1,0,2]=4 2368 B13R0.336 CC/C=C\CCSCCCCCC=O 62a_100015370543_100000139337 [1,0,0,0,0,0|1,0,2]=4 2369 B13R0.336 CC=CCCCOCCCCCCC 34a_100020645299_100000210614 [1,0,0,0,0,0|2,0,1]=4 2370 B13R0.336 CC=CCNCCCCCCCCC 2230a_100000212291_100000070051 [1,0,0,0,0,0|2,0,1]=4 2371 B13R0.336 CC=CCNCCCCCCCCC 34a_100000212291_100000070051 [1,0,0,0,0,0|2,0,1]=4 2372 B13R0.336 CC=CCOCCCCCCCCC 34a_100000210712_100000070051 [1,0,0,0,0,0|2,0,1]=4 2373 B13R0.336 CC=CCOCCCCCCCCC 7a_100000210712_100000070051 [1,0,0,0,0,0|2,0,1]=4 2374 B13R0.336 CC=CCSCCCCCCCCC 62a_100000070051_100000210670 [1,0,0,0,0,0|2,0,1]=4 2375 B13R0.336 CCC#CCCCCCCSCC=O 62a_200000036426_200015260668 [1,0,0,0,0,0|1,0,2]=4 2376 B13R0.336 CCC#CCCCCCCSCC=O 62a_200015260668_200000036426 [1,0,0,0,0,0|1,0,2]=4 2377 B13R0.336 CCC#CCCOCCCCCC=O 7a_100000036655_100000139337 [1,0,0,0,0,0|1,0,2]=4 2378 B13R0.336 CCC/C=C/COCCCCCC=O 7a_100016278788_100000139337 [1,0,0,0,0,0|1,0,2]=4 2379 B13R0.336 CCCC#CCCOCCCCC=O 7a_100000042726_100000139335 [1,0,0,0,0,0|1,0,2]=4 2380 B13R0.336 CCCC#CCOCCCCCC=O 7a_100000034806_100000139337 [1,0,0,0,0,0|1,0,2]=4 2381 B13R0.336 CCCC/C=C/CCCCOCC=O 34a_200020645093_200009817547 [1,0,0,0,0,0|1,0,2]=4 2382 B13R0.336 CCCC/C=C/CCCCOCC=O 7a_200020645093_200015260668 [1,0,0,0,0,0|1,0,2]=4 2383 B13R0.336 CCCC/C=C/COCCCCC=O 7a_200016272032_100000139335 [1,0,0,0,0,0|1,0,2]=4 2384 B13R0.336 CCCC/C=C\CCOCCCC=O 7a_200016286491_200011292268 [1,0,0,0,0,0|1,0,2]=4 2385 B13R0.336 CCCCC#CCCCCOCC=O 34a_200000066234_200009817547 [1,0,0,0,0,0|1,0,2]=4 2386 B13R0.336 CCCCC#CCCCCOCC=O 7a_200000066234_200015260668 [1,0,0,0,0,0|1,0,2]=4 2387 B13R0.336 CCCCC#CCCOCCCC=O 7a_100000037610_200011292268 [1,0,0,0,0,0|1,0,2]=4 2388 B13R0.336 CCCCC#CCOCCCCC=O 7a_200000034558_100000139335 [1,0,0,0,0,0|1,0,2]=4 2389 B13R0.336 CCCCC/C=C/COCCCC=O 7a_100016258190_200011292268 [1,0,0,0,0,0|1,0,2]=4 2390 B13R0.336 CCCCC/C=C\CCCOCC=O 34a_100020655193_200009817547 [1,0,0,0,0,0|1,0,2]=4 2391 B13R0.336 CCCCC/C=C\CCCOCC=O 7a_100020655193_200015260668 [1,0,0,0,0,0|1,0,2]=4 2392 B13R0.336 CCCCCC#CCOCCCC=O 7a_200000033628_200011292268 [1,0,0,0,0,0|1,0,2]=4 2393 B13R0.336 CCCCCC#CCSCCCC=O 62a_100009816472_200011292268 [1,0,0,0,0,0|1,0,2]=4 2394 B13R0.336 CCCCCC#CCSCCCC=O 62a_200011292268_100009816472 [1,0,0,0,0,0|1,0,2]=4 2395 B13R0.336 CCCCCCC#CCCOCC=O 34a_200000033163_200009817547 [1,0,0,0,0,0|1,0,2]=4 2396 B13R0.336 CCCCCCC#CCCOCC=O 7a_200000033163_200015260668 [1,0,0,0,0,0|1,0,2]=4 2397 B13R0.336 CCCCCCCC#CCOCC=O 34a_200000061759_200009817547 [1,0,0,0,0,0|1,0,2]=4 2398 B13R0.336 CCCCCCCC#CCOCC=O 7a_200000061759_200015260668 [1,0,0,0,0,0|1,0,2]=4 2399 B13R0.336 CCCCCCCCCCCCNC 2230a_100000210451_200000210301 [1,0,0,0,0,0|1,0,1]=3 2400 B13R0.336 CCCCCCCCCCCCNC 2230a_106832991635_100011215052 [1,0,0,0,0,0|1,0,1]=3 2401 B13R0.336 CCCCCCCCCCCCNC 270004a_106832991635_100011218549 [1,0,0,0,0,0|1,0,1]=3 2402 B13R0.336 CCCCCCCCCCCCNC 34a_100000210451_200000210301 [1,0,0,0,0,0|1,0,1]=3 2403 B13R0.336 CCCCCCCCCCCCNC 34a_100102657272_100000759014 [1,0,0,0,0,0|1,0,1]=3 2404 B13R0.336 CCCCCCCCCCCCNC 7a_106832991635_100000759014 [1,0,0,0,0,0|1,0,1]=3 2405 B13R0.336 CCCCCCCCCCCCN[13CH3] 2230a_100000210451_200025704644 [1,0,0,0,0,0|1,0,1]=3 2406 B13R0.336 CCCCCCCCCCCCN[13CH3] 34a_100000210451_200025704644 [1,0,0,0,0,0|1,0,1]=3 2407 B13R0.336 CCCCCCCCCCCCOC 34a_100000210810_200000210301 [1,0,0,0,0,0|1,0,1]=3 2408 B13R0.336 CCCCCCCCCCCCOC 34a_100138415774_100000759014 [1,0,0,0,0,0|1,0,1]=3 2409 B13R0.336 CCCCCCCCCCCCOC 7a_100000210810_200000210301 [1,0,0,0,0,0|1,0,1]=3 2410 B13R0.336 CCCCCCCCCCCCO[13CH3] 34a_100000210810_200025704644 [1,0,0,0,0,0|1,0,1]=3 2411 B13R0.336 CCCCCCCCCCCCO[13CH3] 7a_100000210810_200025704644 [1,0,0,0,0,0|1,0,1]=3 2412 B13R0.336 CCCCCCCCCCCCSC 62a_200000210301_100000759014 [1,0,0,0,0,0|1,0,1]=3 2413 B13R0.336 CCCCCCCCCCCCS[13CH3] 62a_200025704644_100000759014 [1,0,0,0,0,0|1,0,1]=3 2414 B13R0.336 CCCCCCCCCCCNCC 2230a_100015525214_100011215454 [1,0,0,0,0,0|1,0,1]=3 2415 B13R0.336 CCCCCCCCCCCNCC 2230a_200011215754_100000210202 [1,0,0,0,0,0|1,0,1]=3 2416 B13R0.336 CCCCCCCCCCCNCC 34a_200011215754_100000210202 [1,0,0,0,0,0|1,0,1]=3 2417 B13R0.336 CCCCCCCCCCCNCF 34a_200011215754_100015361967 [1,0,0,0,0,0|2,0,0]=3 2418 B13R0.336 CCCCCCCCCCCOCC 34a_100000210809_100000210202 [1,0,0,0,0,0|1,0,1]=3 2419 B13R0.336 CCCCCCCCCCCOCC 34a_100121572206_100011215454 [1,0,0,0,0,0|1,0,1]=3 2420 B13R0.336 CCCCCCCCCCCOCC 7a_100000210809_100000210202 [1,0,0,0,0,0|1,0,1]=3 2421 B13R0.336 CCCCCCCCCCCOCF 34a_100000210809_100015361967 [1,0,0,0,0,0|2,0,0]=3 2422 B13R0.336 CCCCCCCCCCCOCF 7a_100000210809_100015361967 [1,0,0,0,0,0|2,0,0]=3 2423 B13R0.336 CCCCCCCCCCCSCC 62a_100000210202_100011215454 [1,0,0,0,0,0|1,0,1]=3 2424 B13R0.336 CCCCCCCCCCCSCF 62a_100015361967_100011215454 [1,0,0,0,0,0|2,0,0]=3 2425 B13R0.336 CCCCCCCCCCNCC#N 2230a_100000684558_100011215382 [1,0,0,0,0,0|2,0,1]=4 2426 B13R0.336 CCCCCCCCCCNCC=O 2230a_100000684558_200015260668 [1,0,0,0,0,0|1,0,0]=2 2427 B13R0.336 CCCCCCCCCCNCC=O 34a_100000684558_200009817547 [1,0,0,0,0,0|1,0,0]=2 2428 B13R0.336 CCCCCCCCCCNCCC 2230a_100000684558_100000210303 [1,0,0,0,0,0|1,0,1]=3 2429 B13R0.336 CCCCCCCCCCNCCC 34a_100000684558_100000210303 [1,0,0,0,0,0|1,0,1]=3 2430 B13R0.336 CCCCCCCCCCNCCF 2230a_100000684558_100011217306 [1,0,0,0,0,0|2,0,0]=3 2431 B13R0.336 CCCCCCCCCCNCCF 34a_100000684558_100011217306 [1,0,0,0,0,0|2,0,0]=3 2432 B13R0.336 CCCCCCCCCCNCCF 34a_100000724931_100000210320 [1,0,0,0,0,0|2,0,0]=3 2433 B13R0.336 CCCCCCCCCCNCCO 2230a_100000684558_100000211926 [1,0,0,0,0,0|1,0,1]=3 2434 B13R0.336 CCCCCCCCCCNCCO 2230a_100016997473_100000210320 [1,0,0,0,0,0|1,0,1]=3 2435 B13R0.336 CCCCCCCCCCNCCO 34a_100000684558_100000211926 [1,0,0,0,0,0|1,0,1]=3 2436 B13R0.336 CCCCCCCCCCNCCO 34a_100016990907_100000210320 [1,0,0,0,0,0|1,0,1]=3 2437 B13R0.336 CCCCCCCCCCNCOC 2230a_100000684558_100000766300 [1,0,0,0,0,0|2,0,1]=4 2438 B13R0.336 CCCCCCCCCCNCSC 2230a_100000684558_100011218213 [1,0,0,0,0,0|2,0,1]=4 2439 B13R0.336 CCCCCCCCCCNCSC 34a_100000684558_100011218213 [1,0,0,0,0,0|2,0,1]=4 2440 B13R0.336 CCCCCCCCCCOCC#N 7a_100000210711_100011215382 [1,0,0,0,0,0|2,0,1]=4 2441 B13R0.336 CCCCCCCCCCOCC=O 34a_100000210711_200009817547 [1,0,0,0,0,0|1,0,0]=2 2442 B13R0.336 CCCCCCCCCCOCC=O 7a_100000210711_200015260668 [1,0,0,0,0,0|1,0,0]=2 2443 B13R0.336 CCCCCCCCCCOCCBr 34a_100000211926_100000210320 [1,0,0,0,0,0|2,0,0]=3 2444 B13R0.336 CCCCCCCCCCOCCC 34a_100000210258_100000210320 [1,0,0,0,0,0|1,0,1]=3 2445 B13R0.336 CCCCCCCCCCOCCC 34a_100000210711_100000210303 [1,0,0,0,0,0|1,0,1]=3 2446 B13R0.336 CCCCCCCCCCOCCC 7a_100000210711_100000210303 [1,0,0,0,0,0|1,0,1]=3 2447 B13R0.336 CCCCCCCCCCOCCF 34a_100000210711_100011217306 [1,0,0,0,0,0|2,0,0]=3 2448 B13R0.336 CCCCCCCCCCOCCF 7a_100000210711_100011217306 [1,0,0,0,0,0|2,0,0]=3 2449 B13R0.336 CCCCCCCCCCOCCN 34a_100000210304_100000210320 [1,0,0,0,0,0|2,0,0]=3 2450 B13R0.336 CCCCCCCCCCOCCO 34a_100000210711_100000211926 [1,0,0,0,0,0|1,0,1]=3 2451 B13R0.336 CCCCCCCCCCOCCO 7a_100000210711_100000211926 [1,0,0,0,0,0|1,0,1]=3 2452 B13R0.336 CCCCCCCCCCOCSC 34a_100000210711_100011218213 [1,0,0,0,0,0|2,0,1]=4 2453 B13R0.336 CCCCCCCCCCSCC#N 62a_100011215382_100000210320 [1,0,0,0,0,0|2,0,1]=4 2454 B13R0.336 CCCCCCCCCCSCC=O 62a_200015260668_100000210320 [1,0,0,0,0,0|1,0,0]=2 2455 B13R0.336 CCCCCCCCCCSCCC 62a_100000210303_100000210320 [1,0,0,0,0,0|1,0,1]=3 2456 B13R0.336 CCCCCCCCCCSCCF 62a_100011217306_100000210320 [1,0,0,0,0,0|2,0,0]=3 2457 B13R0.336 CCCCCCCCCCSCCO 62a_100000211926_100000210320 [1,0,0,0,0,0|1,0,1]=3 2458 B13R0.336 CCCCCCCCCCSCOC 62a_100000766300_100000210320 [1,0,0,0,0,0|2,0,1]=4 2459 B13R0.336 CCCCCCCCCCSCSC 62a_100011218213_100000210320 [1,0,0,0,0,0|2,0,1]=4 2460 B13R0.336 CCCCCCCCCNCCC#N 2230a_100000212291_100011215226 [1,0,0,0,0,0|2,0,1]=4 2461 B13R0.336 CCCCCCCCCNCCCC 2230a_100000102301_100011214924 [1,0,0,0,0,0|1,0,1]=3 2462 B13R0.336 CCCCCCCCCNCCCC 2230a_100000212291_100000210211 [1,0,0,0,0,0|1,0,1]=3 2463 B13R0.336 CCCCCCCCCNCCCC 34a_100000212291_100000210210 [1,0,0,0,0,0|1,0,1]=3 2464 B13R0.336 CCCCCCCCCNCCCC 7a_106832991798_100000210328 [1,0,0,0,0,0|1,0,1]=3 2465 B13R0.336 CCCCCCCCCNCCCF 2230a_100000212291_100011934791 [1,0,0,0,0,0|2,0,0]=3 2466 B13R0.336 CCCCCCCCCNCCCF 2230a_100015189416_100011214924 [1,0,0,0,0,0|2,0,0]=3 2467 B13R0.336 CCCCCCCCCNCCCF 34a_100000212291_100011934791 [1,0,0,0,0,0|2,0,0]=3 2468 B13R0.336 CCCCCCCCCNCCCF 34a_100015189416_100011214924 [1,0,0,0,0,0|2,0,0]=3 2469 B13R0.336 CCCCCCCCCNCCCO 2230a_100000212291_100000230001 [1,0,0,0,0,0|1,0,1]=3 2470 B13R0.336 CCCCCCCCCNCCCO 34a_100000212291_100000230001 [1,0,0,0,0,0|1,0,1]=3 2471 B13R0.336 CCCCCCCCCNCCOC 2230a_100000209980_100011214924 [1,0,0,0,0,0|2,0,1]=4 2472 B13R0.336 CCCCCCCCCNCCOC 2230a_100000212291_100011201679 [1,0,0,0,0,0|2,0,1]=4 2473 B13R0.336 CCCCCCCCCNCCOC 34a_100000212291_100011201679 [1,0,0,0,0,0|2,0,1]=4 2474 B13R0.336 CCCCCCCCCNCCSC 2230a_100000212291_100000751147 [1,0,0,0,0,0|2,0,1]=4 2475 B13R0.336 CCCCCCCCCNCCSC 2230a_100020590264_100011214924 [1,0,0,0,0,0|2,0,1]=4 2476 B13R0.336 CCCCCCCCCNCCSC 34a_100000212291_100000212216 [1,0,0,0,0,0|2,0,1]=4 2477 B13R0.336 CCCCCCCCCOCCC#N 7a_100000210712_100000184422 [1,0,0,0,0,0|2,0,1]=4 2478 B13R0.336 CCCCCCCCCOCCCBr 34a_100011217188_100011214924 [1,0,0,0,0,0|2,0,0]=3 2479 B13R0.336 CCCCCCCCCOCCCC 34a_100000210227_100011214924 [1,0,0,0,0,0|1,0,1]=3 2480 B13R0.336 CCCCCCCCCOCCCC 34a_100000210712_100000210210 [1,0,0,0,0,0|1,0,1]=3 2481 B13R0.336 CCCCCCCCCOCCCC 7a_100000210227_100000210328 [1,0,0,0,0,0|1,0,1]=3 2482 B13R0.336 CCCCCCCCCOCCCC 7a_100000210712_100000210211 [1,0,0,0,0,0|1,0,1]=3 2483 B13R0.336 CCCCCCCCCOCCCCl 34a_100000230001_100011214924 [1,0,0,0,0,0|2,0,0]=3 2484 B13R0.336 CCCCCCCCCOCCCF 34a_100000210712_100011934791 [1,0,0,0,0,0|2,0,0]=3 2485 B13R0.336 CCCCCCCCCOCCCF 34a_100000759539_100011214924 [1,0,0,0,0,0|2,0,0]=3 2486 B13R0.336 CCCCCCCCCOCCCF 7a_100000210712_100011934791 [1,0,0,0,0,0|2,0,0]=3 2487 B13R0.336 CCCCCCCCCOCCCN 34a_100000182051_100011214924 [1,0,0,0,0,0|2,0,0]=3 2488 B13R0.336 CCCCCCCCCOCCCO 34a_100000210712_100000230001 [1,0,0,0,0,0|1,0,1]=3 2489 B13R0.336 CCCCCCCCCOCCCO 7a_100000210712_100011215043 [1,0,0,0,0,0|1,0,1]=3 2490 B13R0.336 CCCCCCCCCOCCOC 34a_100000210237_100011214924 [1,0,0,0,0,0|2,0,1]=4 2491 B13R0.336 CCCCCCCCCOCCOC 34a_100000210712_100011201679 [1,0,0,0,0,0|2,0,1]=4 2492 B13R0.336 CCCCCCCCCOCCOC 7a_100000210712_100000233755 [1,0,0,0,0,0|2,0,1]=4 2493 B13R0.336 CCCCCCCCCOCCON 34a_100000700252_100011214924 [1,0,0,0,0,0|3,0,0]=4 2494 B13R0.336 CCCCCCCCCOCCSC 34a_100000210712_100000212216 [1,0,0,0,0,0|2,0,1]=4 2495 B13R0.336 CCCCCCCCCOCCSC 34a_100000230434_100011214924 [1,0,0,0,0,0|2,0,1]=4 2496 B13R0.336 CCCCCCCCCOCCSC 7a_100000210712_100000212216 [1,0,0,0,0,0|2,0,1]=4 2497 B13R0.336 CCCCCCCCCOCCSC 7a_100000230434_100000210328 [1,0,0,0,0,0|2,0,1]=4 2498 B13R0.336 CCCCCCCCCSCCC#N 62a_100011215226_100000210670 [1,0,0,0,0,0|2,0,1]=4 2499 B13R0.336 CCCCCCCCCSCCCC 62a_100000210211_100000210670 [1,0,0,0,0,0|1,0,1]=3 2500 B13R0.336 CCCCCCCCCSCCCF 62a_100011934791_100000210670 [1,0,0,0,0,0|2,0,0]=3 2501 B13R0.336 CCCCCCCCCSCCCO 62a_100011215043_100000210670 [1,0,0,0,0,0|1,0,1]=3 2502 B13R0.336 CCCCCCCCCSCCOC 62a_100000233755_100000210670 [1,0,0,0,0,0|2,0,1]=4 2503 B13R0.336 CCCCCCCCCSCCSC 62a_100000212216_100000210670 [1,0,0,0,0,0|2,0,1]=4 2504 B13R0.336 CCCCCCCCCSCOCC 62a_100000739092_100000210670 [1,0,0,0,0,0|2,0,1]=4 2505 B13R0.336 CCCCCCCCNCCCC#N 2230a_100000229939_100000687738 [1,0,0,0,0,0|2,0,1]=4 2506 B13R0.336 CCCCCCCCNCCCC=O 2230a_100000229939_200011292268 [1,0,0,0,0,0|1,0,0]=2 2507 B13R0.336 CCCCCCCCNCCCCC 2230a_100000209983_100000210759 [1,0,0,0,0,0|1,0,1]=3 2508 B13R0.336 CCCCCCCCNCCCCC 2230a_100000229939_100000210326 [1,0,0,0,0,0|1,0,1]=3 2509 B13R0.336 CCCCCCCCNCCCCC 34a_100000229939_100000718602 [1,0,0,0,0,0|1,0,1]=3 2510 B13R0.336 CCCCCCCCNCCCCF 2230a_100000229939_100000729493 [1,0,0,0,0,0|2,0,0]=3 2511 B13R0.336 CCCCCCCCNCCCCF 34a_100000229939_100000729493 [1,0,0,0,0,0|2,0,0]=3 2512 B13R0.336 CCCCCCCCNCCCCO 2230a_100000229939_100000210776 [1,0,0,0,0,0|1,0,1]=3 2513 B13R0.336 CCCCCCCCNCCCCO 2230a_100000750430_100000210759 [1,0,0,0,0,0|1,0,1]=3 2514 B13R0.336 CCCCCCCCNCCCCO 34a_100000229939_100011216708 [1,0,0,0,0,0|1,0,1]=3 2515 B13R0.336 CCCCCCCCNCCCCO 34a_100000750430_100000210759 [1,0,0,0,0,0|1,0,1]=3 2516 B13R0.336 CCCCCCCCNCCCOC 2230a_100000229939_100000740836 [1,0,0,0,0,0|2,0,1]=4 2517 B13R0.336 CCCCCCCCNCCCOC 34a_100000229939_100000740836 [1,0,0,0,0,0|2,0,1]=4 2518 B13R0.336 CCCCCCCCNCCCOC 34a_100150723488_100000210759 [1,0,0,0,0,0|2,0,1]=4 2519 B13R0.336 CCCCCCCCNCCCSC 2230a_100000749238_100000210759 [1,0,0,0,0,0|2,0,1]=4 2520 B13R0.336 CCCCCCCCNCCOCC 2230a_100000229939_100011215890 [1,0,0,0,0,0|2,0,1]=4 2521 B13R0.336 CCCCCCCCNCCOCC 2230a_102516460346_100000210759 [1,0,0,0,0,0|2,0,1]=4 2522 B13R0.336 CCCCCCCCNCCOCC 34a_100000229939_100000210147 [1,0,0,0,0,0|2,0,1]=4 2523 B13R0.336 CCCCCCCCNCCOCC 34a_102516460346_100000210759 [1,0,0,0,0,0|2,0,1]=4 2524 B13R0.336 CCCCCCCCNCCSCC 2230a_100000106463_100000210759 [1,0,0,0,0,0|2,0,1]=4 2525 B13R0.336 CCCCCCCCNCCSCC 2230a_100000229939_100000757381 [1,0,0,0,0,0|2,0,1]=4 2526 B13R0.336 CCCCCCCCNCCSCC 34a_100000229939_100000757381 [1,0,0,0,0,0|2,0,1]=4 2527 B13R0.336 CCCCCCCCOCCCC#N 7a_100000210232_100000687738 [1,0,0,0,0,0|2,0,1]=4 2528 B13R0.336 CCCCCCCCOCCCC=O 7a_100000210232_200011292268 [1,0,0,0,0,0|1,0,0]=2 2529 B13R0.336 CCCCCCCCOCCCCBr 34a_100011216708_100000210759 [1,0,0,0,0,0|2,0,0]=3 2530 B13R0.336 CCCCCCCCOCCCCC 34a_100000210232_100000718602 [1,0,0,0,0,0|1,0,1]=3 2531 B13R0.336 CCCCCCCCOCCCCC 34a_100000210253_100000210759 [1,0,0,0,0,0|1,0,1]=3 2532 B13R0.336 CCCCCCCCOCCCCC 7a_100000210232_100000210326 [1,0,0,0,0,0|1,0,1]=3 2533 B13R0.336 CCCCCCCCOCCCCC 7a_100000210253_100000210759 [1,0,0,0,0,0|1,0,1]=3 2534 B13R0.336 CCCCCCCCOCCCCCl 34a_100000210776_100000210759 [1,0,0,0,0,0|2,0,0]=3 2535 B13R0.336 CCCCCCCCOCCCCCl 7a_100000210776_100000210759 [1,0,0,0,0,0|2,0,0]=3 2536 B13R0.336 CCCCCCCCOCCCCF 34a_100000210232_100000729493 [1,0,0,0,0,0|2,0,0]=3 2537 B13R0.336 CCCCCCCCOCCCCF 34a_100011995726_100000210759 [1,0,0,0,0,0|2,0,0]=3 2538 B13R0.336 CCCCCCCCOCCCCF 7a_100000210232_100000729493 [1,0,0,0,0,0|2,0,0]=3 2539 B13R0.336 CCCCCCCCOCCCCF 7a_100011995726_100000210759 [1,0,0,0,0,0|2,0,0]=3 2540 B13R0.336 CCCCCCCCOCCCCI 34a_200012148704_100000210759 [1,0,0,0,0,0|2,0,0]=3 2541 B13R0.336 CCCCCCCCOCCCCN 34a_100000750430_100000210759 [1,0,0,0,0,0|2,0,0]=3 2542 B13R0.336 CCCCCCCCOCCCCO 34a_100000210232_100011216708 [1,0,0,0,0,0|1,0,1]=3 2543 B13R0.336 CCCCCCCCOCCCCO 7a_100000210232_100000210776 [1,0,0,0,0,0|1,0,1]=3 2544 B13R0.336 CCCCCCCCOCCCNC 34a_100000213112_100000210759 [1,0,0,0,0,0|2,0,1]=4 2545 B13R0.336 CCCCCCCCOCCCOC 34a_100000210232_100000740836 [1,0,0,0,0,0|2,0,1]=4 2546 B13R0.336 CCCCCCCCOCCCOC 34a_100000740835_100000210759 [1,0,0,0,0,0|2,0,1]=4 2547 B13R0.336 CCCCCCCCOCCCOC 7a_100000210232_100000740836 [1,0,0,0,0,0|2,0,1]=4 2548 B13R0.336 CCCCCCCCOCCCSC 34a_100000690336_100000210759 [1,0,0,0,0,0|2,0,1]=4 2549 B13R0.336 CCCCCCCCOCCCSC 7a_100000690336_100000210759 [1,0,0,0,0,0|2,0,1]=4 2550 B13R0.336 CCCCCCCCOCCOCC 34a_100000210136_100000210759 [1,0,0,0,0,0|2,0,1]=4 2551 B13R0.336 CCCCCCCCOCCOCC 34a_100000210232_100000210147 [1,0,0,0,0,0|2,0,1]=4 2552 B13R0.336 CCCCCCCCOCCOCC 7a_100000210136_100000210759 [1,0,0,0,0,0|2,0,1]=4 2553 B13R0.336 CCCCCCCCOCCOCC 7a_100000210232_100011215890 [1,0,0,0,0,0|2,0,1]=4 2554 B13R0.336 CCCCCCCCOCCSCC 34a_100000210232_100000757381 [1,0,0,0,0,0|2,0,1]=4 2555 B13R0.336 CCCCCCCCOCCSCC 34a_100000212035_100000210759 [1,0,0,0,0,0|2,0,1]=4 2556 B13R0.336 CCCCCCCCOCCSCC 7a_100000210232_100000757381 [1,0,0,0,0,0|2,0,1]=4 2557 B13R0.336 CCCCCCCCOCCSCC 7a_100000212035_100000210759 [1,0,0,0,0,0|2,0,1]=4 2558 B13R0.336 CCCCCCCCSCCCC#N 62a_100000210759_100000687738 [1,0,0,0,0,0|2,0,1]=4 2559 B13R0.336 CCCCCCCCSCCCC#N 62a_100000687738_100000210317 [1,0,0,0,0,0|2,0,1]=4 2560 B13R0.336 CCCCCCCCSCCCC=O 62a_100000210759_200011292268 [1,0,0,0,0,0|1,0,0]=2 2561 B13R0.336 CCCCCCCCSCCCC=O 62a_200011292268_100000210317 [1,0,0,0,0,0|1,0,0]=2 2562 B13R0.336 CCCCCCCCSCCCCC 62a_100000210326_100000210317 [1,0,0,0,0,0|1,0,1]=3 2563 B13R0.336 CCCCCCCCSCCCCC 62a_100000210759_100000210326 [1,0,0,0,0,0|1,0,1]=3 2564 B13R0.336 CCCCCCCCSCCCCF 62a_100000210759_100000729493 [1,0,0,0,0,0|2,0,0]=3 2565 B13R0.336 CCCCCCCCSCCCCF 62a_100000729493_100000210317 [1,0,0,0,0,0|2,0,0]=3 2566 B13R0.336 CCCCCCCCSCCCCO 62a_100000210759_100000210776 [1,0,0,0,0,0|1,0,1]=3 2567 B13R0.336 CCCCCCCCSCCCCO 62a_100000210776_100000210317 [1,0,0,0,0,0|1,0,1]=3 2568 B13R0.336 CCCCCCCCSCCCOC 62a_100000210759_100000709357 [1,0,0,0,0,0|2,0,1]=4 2569 B13R0.336 CCCCCCCCSCCCOC 62a_100000709357_100000210317 [1,0,0,0,0,0|2,0,1]=4 2570 B13R0.336 CCCCCCCCSCCOCC 62a_100000210147_100000210317 [1,0,0,0,0,0|2,0,1]=4 2571 B13R0.336 CCCCCCCCSCCOCC 62a_100000210759_100011215890 [1,0,0,0,0,0|2,0,1]=4 2572 B13R0.336 CCCCCCCCSCCSCC 62a_100000210759_100000757381 [1,0,0,0,0,0|2,0,1]=4 2573 B13R0.336 CCCCCCCCSCCSCC 62a_100000757381_100000210317 [1,0,0,0,0,0|2,0,1]=4 2574 B13R0.336 CCCCCCCNCCCCC#N 2230a_100000229938_100000211819 [1,0,0,0,0,0|2,0,1]=4 2575 B13R0.336 CCCCCCCNCCCCC=O 2230a_100000229938_100000139335 [1,0,0,0,0,0|1,0,0]=2 2576 B13R0.336 CCCCCCCNCCCCCC 2230a_100000210581_100000210681 [1,0,0,0,0,0|1,0,1]=3 2577 B13R0.336 CCCCCCCNCCCCCC 2230a_100000229938_100000210314 [1,0,0,0,0,0|1,0,1]=3 2578 B13R0.336 CCCCCCCNCCCCCF 2230a_100000229938_100000729378 [1,0,0,0,0,0|2,0,0]=3 2579 B13R0.336 CCCCCCCNCCCCCO 2230a_100000229938_100000746330 [1,0,0,0,0,0|1,0,1]=3 2580 B13R0.336 CCCCCCCNCCCCCO 2230a_100000762737_100000210681 [1,0,0,0,0,0|1,0,1]=3 2581 B13R0.336 CCCCCCCNCCCCCO 34a_100000762737_100000210614 [1,0,0,0,0,0|1,0,1]=3 2582 B13R0.336 CCCCCCCNCCCCOC 2230a_100000229938_100000730899 [1,0,0,0,0,0|2,0,1]=4 2583 B13R0.336 CCCCCCCNCCCOCC 2230a_100000210961_100000210681 [1,0,0,0,0,0|2,0,1]=4 2584 B13R0.336 CCCCCCCNCCCOCC 2230a_100000229938_100012232248 [1,0,0,0,0,0|2,0,1]=4 2585 B13R0.336 CCCCCCCNCCCOCC 34a_100000210961_100000210614 [1,0,0,0,0,0|2,0,1]=4 2586 B13R0.336 CCCCCCCNCCOCCC 2230a_100000229938_100011215938 [1,0,0,0,0,0|2,0,1]=4 2587 B13R0.336 CCCCCCCNCCOCCC 2230a_100161115042_100000210681 [1,0,0,0,0,0|2,0,1]=4 2588 B13R0.336 CCCCCCCNCCOCCC 34a_100161115042_100000210614 [1,0,0,0,0,0|2,0,1]=4 2589 B13R0.336 CCCCCCCNCCOCCO 2230a_100000211614_100000210681 [1,0,0,0,0,0|2,0,1]=4 2590 B13R0.336 CCCCCCCNCCOCCO 2230a_100000229938_100011215305 [1,0,0,0,0,0|2,0,1]=4 2591 B13R0.336 CCCCCCCNCCOCCO 34a_100000211614_100000210614 [1,0,0,0,0,0|2,0,1]=4 2592 B13R0.336 CCCCCCCNCCSCCC 2230a_100020603323_100000210681 [1,0,0,0,0,0|2,0,1]=4 2593 B13R0.336 CCCCCCCNCCSCCO 2230a_100011219999_100000210681 [1,0,0,0,0,0|2,0,1]=4 2594 B13R0.336 CCCCCCCNCOCCCC 2230a_100000229938_100011995733 [1,0,0,0,0,0|2,0,1]=4 2595 B13R0.336 CCCCCCCOCCCCC#N 7a_100000210272_100000211819 [1,0,0,0,0,0|2,0,1]=4 2596 B13R0.336 CCCCCCCOCCCCC=O 7a_100000210272_100000139335 [1,0,0,0,0,0|1,0,0]=2 2597 B13R0.336 CCCCCCCOCCCCCBr 34a_100000746331_100000210614 [1,0,0,0,0,0|2,0,0]=3 2598 B13R0.336 CCCCCCCOCCCCCBr 7a_100000746331_100000210614 [1,0,0,0,0,0|2,0,0]=3 2599 B13R0.336 CCCCCCCOCCCCCC 34a_100000210259_100000210614 [1,0,0,0,0,0|1,0,1]=3 2600 B13R0.336 CCCCCCCOCCCCCC 34a_100000210272_100000210314 [1,0,0,0,0,0|1,0,1]=3 2601 B13R0.336 CCCCCCCOCCCCCC 7a_100000210259_100000210614 [1,0,0,0,0,0|1,0,1]=3 2602 B13R0.336 CCCCCCCOCCCCCC 7a_100000210272_100000210314 [1,0,0,0,0,0|1,0,1]=3 2603 B13R0.336 CCCCCCCOCCCCCCl 34a_100000746330_100000210614 [1,0,0,0,0,0|2,0,0]=3 2604 B13R0.336 CCCCCCCOCCCCCCl 7a_100000746330_100000210614 [1,0,0,0,0,0|2,0,0]=3 2605 B13R0.336 CCCCCCCOCCCCCF 34a_100000210272_100000729378 [1,0,0,0,0,0|2,0,0]=3 2606 B13R0.336 CCCCCCCOCCCCCF 7a_100000210272_100000729378 [1,0,0,0,0,0|2,0,0]=3 2607 B13R0.336 CCCCCCCOCCCCCI 34a_200012148887_100000210614 [1,0,0,0,0,0|2,0,0]=3 2608 B13R0.336 CCCCCCCOCCCCCI 7a_200012148887_100000210614 [1,0,0,0,0,0|2,0,0]=3 2609 B13R0.336 CCCCCCCOCCCCCN 34a_100000762737_100000210614 [1,0,0,0,0,0|2,0,0]=3 2610 B13R0.336 CCCCCCCOCCCCCO 34a_100000210272_100000746330 [1,0,0,0,0,0|1,0,1]=3 2611 B13R0.336 CCCCCCCOCCCCCO 7a_100000210272_100000746330 [1,0,0,0,0,0|1,0,1]=3 2612 B13R0.336 CCCCCCCOCCCCOC 34a_100000210272_100000755781 [1,0,0,0,0,0|2,0,1]=4 2613 B13R0.336 CCCCCCCOCCCCOC 34a_100000740925_100000210614 [1,0,0,0,0,0|2,0,1]=4 2614 B13R0.336 CCCCCCCOCCCCOC 7a_100000210272_100000730899 [1,0,0,0,0,0|2,0,1]=4 2615 B13R0.336 CCCCCCCOCCCCSC 34a_100011217163_100000210614 [1,0,0,0,0,0|2,0,1]=4 2616 B13R0.336 CCCCCCCOCCCCSC 7a_100011217163_100000210614 [1,0,0,0,0,0|2,0,1]=4 2617 B13R0.336 CCCCCCCOCCCOCC 34a_100000210272_100012232248 [1,0,0,0,0,0|2,0,1]=4 2618 B13R0.336 CCCCCCCOCCCOCC 34a_100000757476_100000210614 [1,0,0,0,0,0|2,0,1]=4 2619 B13R0.336 CCCCCCCOCCCOCC 7a_100000210272_100012232248 [1,0,0,0,0,0|2,0,1]=4 2620 B13R0.336 CCCCCCCOCCCOCC 7a_100000757476_100000210614 [1,0,0,0,0,0|2,0,1]=4 2621 B13R0.336 CCCCCCCOCCCSCC 34a_100011216438_100000210614 [1,0,0,0,0,0|2,0,1]=4 2622 B13R0.336 CCCCCCCOCCCSCC 7a_100011216438_100000210614 [1,0,0,0,0,0|2,0,1]=4 2623 B13R0.336 CCCCCCCOCCOCCBr 34a_100000692535_100000210614 [1,0,0,0,0,0|3,0,0]=4 2624 B13R0.336 CCCCCCCOCCOCCBr 7a_100000692535_100000210614 [1,0,0,0,0,0|3,0,0]=4 2625 B13R0.336 CCCCCCCOCCOCCC 34a_100000210272_100011215938 [1,0,0,0,0,0|2,0,1]=4 2626 B13R0.336 CCCCCCCOCCOCCC 34a_100000752267_100000210614 [1,0,0,0,0,0|2,0,1]=4 2627 B13R0.336 CCCCCCCOCCOCCC 7a_100000210272_100011215938 [1,0,0,0,0,0|2,0,1]=4 2628 B13R0.336 CCCCCCCOCCOCCC 7a_100000752267_100000210614 [1,0,0,0,0,0|2,0,1]=4 2629 B13R0.336 CCCCCCCOCCOCCCl 34a_100011215305_100000210614 [1,0,0,0,0,0|3,0,0]=4 2630 B13R0.336 CCCCCCCOCCOCCCl 7a_100011215305_100000210614 [1,0,0,0,0,0|3,0,0]=4 2631 B13R0.336 CCCCCCCOCCOCCF 34a_200015357709_100000210614 [1,0,0,0,0,0|3,0,0]=4 2632 B13R0.336 CCCCCCCOCCOCCF 7a_200015357709_100000210614 [1,0,0,0,0,0|3,0,0]=4 2633 B13R0.336 CCCCCCCOCCOCCI 34a_100012149058_100000210614 [1,0,0,0,0,0|3,0,0]=4 2634 B13R0.336 CCCCCCCOCCOCCI 7a_100012149058_100000210614 [1,0,0,0,0,0|3,0,0]=4 2635 B13R0.336 CCCCCCCOCCOCCN 34a_100000211614_100000210614 [1,0,0,0,0,0|3,0,0]=4 2636 B13R0.336 CCCCCCCOCCOCCO 34a_100000210272_100000692535 [1,0,0,0,0,0|2,0,1]=4 2637 B13R0.336 CCCCCCCOCCOCCO 7a_100000210272_100011215305 [1,0,0,0,0,0|2,0,1]=4 2638 B13R0.336 CCCCCCCOCCSCCC 34a_200000230433_100000210614 [1,0,0,0,0,0|2,0,1]=4 2639 B13R0.336 CCCCCCCOCCSCCC 7a_200000230433_100000210614 [1,0,0,0,0,0|2,0,1]=4 2640 B13R0.336 CCCCCCCOCOCCCC 34a_100000210272_100011995733 [1,0,0,0,0,0|2,0,1]=4 2641 B13R0.336 CCCCCCCSCCCCC#N 62a_100000210614_100000211819 [1,0,0,0,0,0|2,0,1]=4 2642 B13R0.336 CCCCCCCSCCCCC#N 62a_100011219923_100000210316 [1,0,0,0,0,0|2,0,1]=4 2643 B13R0.336 CCCCCCCSCCCCC=O 62a_100000139335_100000210316 [1,0,0,0,0,0|1,0,0]=2 2644 B13R0.336 CCCCCCCSCCCCC=O 62a_100000210614_100000139335 [1,0,0,0,0,0|1,0,0]=2 2645 B13R0.336 CCCCCCCSCCCCCC 62a_100000210314_100000210316 [1,0,0,0,0,0|1,0,1]=3 2646 B13R0.336 CCCCCCCSCCCCCC 62a_100000210614_100000210757 [1,0,0,0,0,0|1,0,1]=3 2647 B13R0.336 CCCCCCCSCCCCCF 62a_100000210614_100000729378 [1,0,0,0,0,0|2,0,0]=3 2648 B13R0.336 CCCCCCCSCCCCCF 62a_100000729378_100000210316 [1,0,0,0,0,0|2,0,0]=3 2649 B13R0.336 CCCCCCCSCCCCCO 62a_100000210614_100000746330 [1,0,0,0,0,0|1,0,1]=3 2650 B13R0.336 CCCCCCCSCCCCCO 62a_100000746330_100000210316 [1,0,0,0,0,0|1,0,1]=3 2651 B13R0.336 CCCCCCCSCCCCOC 62a_100000210614_100000730899 [1,0,0,0,0,0|2,0,1]=4 2652 B13R0.336 CCCCCCCSCCCCOC 62a_100000730899_100000210316 [1,0,0,0,0,0|2,0,1]=4 2653 B13R0.336 CCCCCCCSCCCOCC 62a_100000210614_100012232248 [1,0,0,0,0,0|2,0,1]=4 2654 B13R0.336 CCCCCCCSCCCOCC 62a_100012232248_100000210316 [1,0,0,0,0,0|2,0,1]=4 2655 B13R0.336 CCCCCCCSCCOCCC 62a_100000210614_100011215938 [1,0,0,0,0,0|2,0,1]=4 2656 B13R0.336 CCCCCCCSCCOCCC 62a_100011215938_100000210316 [1,0,0,0,0,0|2,0,1]=4 2657 B13R0.336 CCCCCCCSCCOCCO 62a_100000210614_100011215305 [1,0,0,0,0,0|2,0,1]=4 2658 B13R0.336 CCCCCCCSCCOCCO 62a_100011215305_100000210316 [1,0,0,0,0,0|2,0,1]=4 2659 B13R0.336 CCCCCCCSCOCCCC 62a_100000210614_100011995733 [1,0,0,0,0,0|2,0,1]=4 2660 B13R0.336 CCCCCCCSCOCCCC 62a_100011995733_100000210316 [1,0,0,0,0,0|2,0,1]=4 2661 B13R0.336 CCCCCCNCCCCCC#N 2230a_100000210581_100009813376 [1,0,0,0,0,0|2,0,1]=4 2662 B13R0.336 CCCCCCNCCCCCC=O 2230a_100000210581_100000139337 [1,0,0,0,0,0|1,0,0]=2 2663 B13R0.336 CCCCCCNCCCCCCF 2230a_100000210581_100015922095 [1,0,0,0,0,0|2,0,0]=3 2664 B13R0.336 CCCCCCNCCCCCCO 2230a_100000210581_100000766143 [1,0,0,0,0,0|1,0,1]=3 2665 B13R0.336 CCCCCCNCCCCCCO 2230a_100000686447_100000210314 [1,0,0,0,0,0|1,0,1]=3 2666 B13R0.336 CCCCCCNCCCCCCO 34a_100000686447_100000210314 [1,0,0,0,0,0|1,0,1]=3 2667 B13R0.336 CCCCCCNCCCCCOC 2230a_100000747528_100000210314 [1,0,0,0,0,0|2,0,1]=4 2668 B13R0.336 CCCCCCNCCCCCOC 34a_100000747528_100000210314 [1,0,0,0,0,0|2,0,1]=4 2669 B13R0.336 CCCCCCNCCCOCCC 2230a_100011217757_100000210314 [1,0,0,0,0,0|2,0,1]=4 2670 B13R0.336 CCCCCCNCCCOCCC 34a_100011217757_100000210314 [1,0,0,0,0,0|2,0,1]=4 2671 B13R0.336 CCCCCCNCCOCCCC 2230a_100000210581_100000743108 [1,0,0,0,0,0|2,0,1]=4 2672 B13R0.336 CCCCCCNCCSCCCC 2230a_100025743550_100000210314 [1,0,0,0,0,0|2,0,1]=4 2673 B13R0.336 CCCCCCOCCCCCC#N 7a_100000210259_100009813376 [1,0,0,0,0,0|2,0,1]=4 2674 B13R0.336 CCCCCCOCCCCCC=O 7a_100000210259_100000139337 [1,0,0,0,0,0|1,0,0]=2 2675 B13R0.336 CCCCCCOCCCCCCBr 34a_100011215345_100000210314 [1,0,0,0,0,0|2,0,0]=3 2676 B13R0.336 CCCCCCOCCCCCCBr 7a_100011215345_100000210314 [1,0,0,0,0,0|2,0,0]=3 2677 B13R0.336 CCCCCCOCCCCCCCl 34a_100000766143_100000210314 [1,0,0,0,0,0|2,0,0]=3 2678 B13R0.336 CCCCCCOCCCCCCCl 7a_100000766143_100000210314 [1,0,0,0,0,0|2,0,0]=3 2679 B13R0.336 CCCCCCOCCCCCCF 34a_100000210259_100015922095 [1,0,0,0,0,0|2,0,0]=3 2680 B13R0.336 CCCCCCOCCCCCCF 34a_100000732779_100000210314 [1,0,0,0,0,0|2,0,0]=3 2681 B13R0.336 CCCCCCOCCCCCCF 7a_100000210259_100015922095 [1,0,0,0,0,0|2,0,0]=3 2682 B13R0.336 CCCCCCOCCCCCCF 7a_100000732779_100000210314 [1,0,0,0,0,0|2,0,0]=3 2683 B13R0.336 CCCCCCOCCCCCCN 34a_100000686447_100000210314 [1,0,0,0,0,0|2,0,0]=3 2684 B13R0.336 CCCCCCOCCCCCCO 34a_100000210259_100000766143 [1,0,0,0,0,0|1,0,1]=3 2685 B13R0.336 CCCCCCOCCCCCCO 7a_100000210259_100000766143 [1,0,0,0,0,0|1,0,1]=3 2686 B13R0.336 CCCCCCOCCCCCNC 34a_100000722520_100000210314 [1,0,0,0,0,0|2,0,1]=4 2687 B13R0.336 CCCCCCOCCOCCCC 34a_100000210238_100000210314 [1,0,0,0,0,0|2,0,1]=4 2688 B13R0.336 CCCCCCOCCOCCCC 34a_100000210259_100000743108 [1,0,0,0,0,0|2,0,1]=4 2689 B13R0.336 CCCCCCOCCOCCCC 34a_100000691444_100000210210 [1,0,0,0,0,0|2,0,1]=4 2690 B13R0.336 CCCCCCOCCOCCCC 7a_100000210238_100000210314 [1,0,0,0,0,0|2,0,1]=4 2691 B13R0.336 CCCCCCOCCOCCCC 7a_100000210259_100000743108 [1,0,0,0,0,0|2,0,1]=4 2692 B13R0.336 CCCCCCOCCOCCCC 7a_100000691444_100000210211 [1,0,0,0,0,0|2,0,1]=4 2693 B13R0.336 CCCCCCOCCOCCCF 34a_100000691444_100011934791 [1,0,0,0,0,0|3,0,0]=4 2694 B13R0.336 CCCCCCOCCOCCCF 7a_100000691444_100011934791 [1,0,0,0,0,0|3,0,0]=4 2695 B13R0.336 CCCCCCOCCOCCCO 34a_100000691444_100000230001 [1,0,0,0,0,0|2,0,1]=4 2696 B13R0.336 CCCCCCOCCOCCCO 7a_100000691444_100011215043 [1,0,0,0,0,0|2,0,1]=4 2697 B13R0.336 CCCCCCOCCSCCCC 34a_200000230436_100000210314 [1,0,0,0,0,0|2,0,1]=4 2698 B13R0.336 CCCCCCOCCSCCCC 7a_200000230436_100000210314 [1,0,0,0,0,0|2,0,1]=4 2699 B13R0.336 CCCCCCSCCCCCC#N 62a_100000210314_100009813376 [1,0,0,0,0,0|2,0,1]=4 2700 B13R0.336 CCCCCCSCCCCCC#N 62a_100009813376_100000210757 [1,0,0,0,0,0|2,0,1]=4 2701 B13R0.336 CCCCCCSCCCCCC=O 62a_100000139337_100000210757 [1,0,0,0,0,0|1,0,0]=2 2702 B13R0.336 CCCCCCSCCCCCC=O 62a_100000210314_100000139337 [1,0,0,0,0,0|1,0,0]=2 2703 B13R0.336 CCCCCCSCCCCCCF 62a_100000210314_100015922095 [1,0,0,0,0,0|2,0,0]=3 2704 B13R0.336 CCCCCCSCCCCCCF 62a_100015922095_100000210757 [1,0,0,0,0,0|2,0,0]=3 2705 B13R0.336 CCCCCCSCCCCCCO 62a_100000210314_100000766143 [1,0,0,0,0,0|1,0,1]=3 2706 B13R0.336 CCCCCCSCCCCCCO 62a_100000766143_100000210757 [1,0,0,0,0,0|1,0,1]=3 2707 B13R0.336 CCCCCCSCCOCCCC 62a_100000210314_100000743108 [1,0,0,0,0,0|2,0,1]=4 2708 B13R0.336 CCCCCCSCCOCCCC 62a_100000743108_100000210757 [1,0,0,0,0,0|2,0,1]=4 2709 B13R0.336 CCCCCNCCCCCCC#N 2230a_100000209983_100009813337 [1,0,0,0,0,0|2,0,1]=4 2710 B13R0.336 CCCCCNCCCCCCCO 2230a_100000209983_100000760002 [1,0,0,0,0,0|1,0,1]=3 2711 B13R0.336 CCCCCNCCCCCCCO 2230a_100011996573_100000210326 [1,0,0,0,0,0|1,0,1]=3 2712 B13R0.336 CCCCCNCCCCCCCO 34a_100011996573_100000718602 [1,0,0,0,0,0|1,0,1]=3 2713 B13R0.336 CCCCCNCCCCCCOC 2230a_100000209983_100011998445 [1,0,0,0,0,0|2,0,1]=4 2714 B13R0.336 CCCCCNCCCOCCCC 2230a_200000211371_100000210326 [1,0,0,0,0,0|2,0,1]=4 2715 B13R0.336 CCCCCNCCCOCCCC 34a_200000211371_100000718602 [1,0,0,0,0,0|2,0,1]=4 2716 B13R0.336 CCCCCNCCCOCCCO 2230a_100011310245_100000210326 [1,0,0,0,0,0|2,0,1]=4 2717 B13R0.336 CCCCCNCCCOCCCO 34a_100011310245_100000718602 [1,0,0,0,0,0|2,0,1]=4 2718 B13R0.336 CCCCCNCCOCCCCC 34a_100000224656_100000718602 [1,0,0,0,0,0|2,0,1]=4 2719 B13R0.336 CCCCCNCCOCCCCF 34a_100000224656_100000729493 [1,0,0,0,0,0|3,0,0]=4 2720 B13R0.336 CCCCCNCCOCCCCO 34a_100000224656_100011216708 [1,0,0,0,0,0|2,0,1]=4 2721 B13R0.336 CCCCCOCCCCCCC#N 7a_100000210253_100009813337 [1,0,0,0,0,0|2,0,1]=4 2722 B13R0.336 CCCCCOCCCCCCCBr 34a_100000760002_100000718602 [1,0,0,0,0,0|2,0,0]=3 2723 B13R0.336 CCCCCOCCCCCCCBr 7a_100000760002_100000210326 [1,0,0,0,0,0|2,0,0]=3 2724 B13R0.336 CCCCCOCCCCCCCN 34a_100011996573_100000718602 [1,0,0,0,0,0|2,0,0]=3 2725 B13R0.336 CCCCCOCCCCCCCO 34a_100000210253_100000760002 [1,0,0,0,0,0|1,0,1]=3 2726 B13R0.336 CCCCCOCCCCCCCO 7a_100000210253_100000760002 [1,0,0,0,0,0|1,0,1]=3 2727 B13R0.336 CCCCCOCCCCCCOC 34a_100000210253_100011998445 [1,0,0,0,0,0|2,0,1]=4 2728 B13R0.336 CCCCCOCCCCCCOC 34a_200012092642_100000718602 [1,0,0,0,0,0|2,0,1]=4 2729 B13R0.336 CCCCCOCCCCCCOC 7a_100000210253_100011998445 [1,0,0,0,0,0|2,0,1]=4 2730 B13R0.336 CCCCCOCCCCCCOC 7a_200012092642_100000210326 [1,0,0,0,0,0|2,0,1]=4 2731 B13R0.336 CCCCCOCCCOCCCC 34a_200011215613_100000718602 [1,0,0,0,0,0|2,0,1]=4 2732 B13R0.336 CCCCCOCCCOCCCC 7a_200011215613_100000210326 [1,0,0,0,0,0|2,0,1]=4 2733 B13R0.336 CCCCCOCCCOCCCN 34a_100011310245_100000718602 [1,0,0,0,0,0|3,0,0]=4 2734 B13R0.336 CCCCCOCCOCCCC=O 7a_100011215259_200011292268 [1,0,0,0,0,0|2,0,0]=3 2735 B13R0.336 CCCCCOCCOCCCCC 34a_100011215259_100000718602 [1,0,0,0,0,0|2,0,1]=4 2736 B13R0.336 CCCCCOCCOCCCCC 7a_100011215259_100000210326 [1,0,0,0,0,0|2,0,1]=4 2737 B13R0.336 CCCCCOCCOCCCCF 34a_100011215259_100000729493 [1,0,0,0,0,0|3,0,0]=4 2738 B13R0.336 CCCCCOCCOCCCCF 7a_100011215259_100000729493 [1,0,0,0,0,0|3,0,0]=4 2739 B13R0.336 CCCCCOCCOCCCCO 34a_100011215259_100011216708 [1,0,0,0,0,0|2,0,1]=4 2740 B13R0.336 CCCCCOCCOCCCCO 7a_100011215259_100000210776 [1,0,0,0,0,0|2,0,1]=4 2741 B13R0.336 CCCCCSCCCCCCC#N 62a_100000210326_100009813337 [1,0,0,0,0,0|2,0,1]=4 2742 B13R0.336 CCCCCSCCCCCCC#N 62a_100009813337_100000210326 [1,0,0,0,0,0|2,0,1]=4 2743 B13R0.336 CCCCCSCCCCCCCO 62a_100000210326_100000760002 [1,0,0,0,0,0|1,0,1]=3 2744 B13R0.336 CCCCCSCCCCCCCO 62a_100000760002_100000210326 [1,0,0,0,0,0|1,0,1]=3 2745 B13R0.336 CCCCCSCCCCCCOC 62a_100000210326_100011998445 [1,0,0,0,0,0|2,0,1]=4 2746 B13R0.336 CCCCCSCCCCCCOC 62a_100011998445_100000210326 [1,0,0,0,0,0|2,0,1]=4 2747 B13R0.336 CCCCNCCCCCCCCO 2230a_100000102301_100000033203 [1,0,0,0,0,0|1,0,1]=3 2748 B13R0.336 CCCCNCCCCCCCCO 2230a_102515433106_100000210211 [1,0,0,0,0,0|1,0,1]=3 2749 B13R0.336 CCCCNCCCCCCCCO 34a_102515433106_100000210210 [1,0,0,0,0,0|1,0,1]=3 2750 B13R0.336 CCCCNCCCCCCCCO 7a_106832991798_100000033203 [1,0,0,0,0,0|1,0,1]=3 2751 B13R0.336 CCCCNCCCCOCCCC 34a_200011216965_100000210210 [1,0,0,0,0,0|2,0,1]=4 2752 B13R0.336 CCCCNCCCCOCCCF 34a_200011216965_100011934791 [1,0,0,0,0,0|3,0,0]=4 2753 B13R0.336 CCCCNCCCCOCCCO 34a_200011216965_100000230001 [1,0,0,0,0,0|2,0,1]=4 2754 B13R0.336 CCCCOCCCCCCCCBr 34a_100009813846_100000210210 [1,0,0,0,0,0|2,0,0]=3 2755 B13R0.336 CCCCOCCCCCCCCBr 7a_100009813846_100000210211 [1,0,0,0,0,0|2,0,0]=3 2756 B13R0.336 CCCCOCCCCCCCCCl 34a_100000033203_100000210210 [1,0,0,0,0,0|2,0,0]=3 2757 B13R0.336 CCCCOCCCCCCCCCl 7a_100000033203_100000210211 [1,0,0,0,0,0|2,0,0]=3 2758 B13R0.336 CCCCOCCCCCCCCN 34a_102515433106_100000210210 [1,0,0,0,0,0|2,0,0]=3 2759 B13R0.336 CCCCOCCCCCCCCO 34a_100000210227_100000033203 [1,0,0,0,0,0|1,0,1]=3 2760 B13R0.336 CCCCOCCCCCCCCO 7a_100000210227_100000033203 [1,0,0,0,0,0|1,0,1]=3 2761 B13R0.336 CCCCOCCCCCNCCN 34a_103619048469_100000210210 [1,0,0,0,0,0|3,0,0]=4 2762 B13R0.336 CCCCOCCCCOCCCC 34a_200000760531_100000210210 [1,0,0,0,0,0|2,0,1]=4 2763 B13R0.336 CCCCOCCCCOCCCC 7a_200000760531_100000210211 [1,0,0,0,0,0|2,0,1]=4 2764 B13R0.336 CCCCOCCCCOCCCF 34a_200000760531_100011934791 [1,0,0,0,0,0|3,0,0]=4 2765 B13R0.336 CCCCOCCCCOCCCF 7a_200000760531_100011934791 [1,0,0,0,0,0|3,0,0]=4 2766 B13R0.336 CCCCOCCCCOCCCO 34a_200000760531_100000230001 [1,0,0,0,0,0|2,0,1]=4 2767 B13R0.336 CCCCOCCCCOCCCO 7a_200000760531_100011215043 [1,0,0,0,0,0|2,0,1]=4 2768 B13R0.336 CCCCOCCCNCCCC=O 2230a_200000211371_200011292268 [1,0,0,0,0,0|2,0,0]=3 2769 B13R0.336 CCCCOCCCNCCCCF 2230a_200000211371_100000729493 [1,0,0,0,0,0|3,0,0]=4 2770 B13R0.336 CCCCOCCCNCCCCF 34a_200000211371_100000729493 [1,0,0,0,0,0|3,0,0]=4 2771 B13R0.336 CCCCOCCCNCCCCO 2230a_200000211371_100000210776 [1,0,0,0,0,0|2,0,1]=4 2772 B13R0.336 CCCCOCCCNCCCCO 34a_200000211371_100011216708 [1,0,0,0,0,0|2,0,1]=4 2773 B13R0.336 CCCCOCCCOCCCC=O 7a_200011215613_200011292268 [1,0,0,0,0,0|2,0,0]=3 2774 B13R0.336 CCCCOCCCOCCCCF 34a_200011215613_100000729493 [1,0,0,0,0,0|3,0,0]=4 2775 B13R0.336 CCCCOCCCOCCCCF 7a_200011215613_100000729493 [1,0,0,0,0,0|3,0,0]=4 2776 B13R0.336 CCCCOCCCOCCCCO 34a_200011215613_100011216708 [1,0,0,0,0,0|2,0,1]=4 2777 B13R0.336 CCCCOCCCOCCCCO 7a_200011215613_100000210776 [1,0,0,0,0,0|2,0,1]=4 2778 B13R0.336 CCCCOCCNCCCCCO 2230a_100000762737_100000743108 [1,0,0,0,0,0|2,0,1]=4 2779 B13R0.336 CCCCOCCNCCCCCO 34a_100000762737_100000743108 [1,0,0,0,0,0|2,0,1]=4 2780 B13R0.336 CCCCOCCOCCCCC=O 7a_100000210238_100000139335 [1,0,0,0,0,0|2,0,0]=3 2781 B13R0.336 CCCCOCCOCCCCCBr 34a_100000746331_100000743108 [1,0,0,0,0,0|3,0,0]=4 2782 B13R0.336 CCCCOCCOCCCCCBr 7a_100000746331_100000743108 [1,0,0,0,0,0|3,0,0]=4 2783 B13R0.336 CCCCOCCOCCCCCCl 34a_100000746330_100000743108 [1,0,0,0,0,0|3,0,0]=4 2784 B13R0.336 CCCCOCCOCCCCCCl 7a_100000746330_100000743108 [1,0,0,0,0,0|3,0,0]=4 2785 B13R0.336 CCCCOCCOCCCCCF 34a_100000210238_100000729378 [1,0,0,0,0,0|3,0,0]=4 2786 B13R0.336 CCCCOCCOCCCCCF 7a_100000210238_100000729378 [1,0,0,0,0,0|3,0,0]=4 2787 B13R0.336 CCCCOCCOCCCCCI 34a_200012148887_100000743108 [1,0,0,0,0,0|3,0,0]=4 2788 B13R0.336 CCCCOCCOCCCCCI 7a_200012148887_100000743108 [1,0,0,0,0,0|3,0,0]=4 2789 B13R0.336 CCCCOCCOCCCCCN 34a_100000762737_100000743108 [1,0,0,0,0,0|3,0,0]=4 2790 B13R0.336 CCCCOCCOCCCCCO 34a_100000210238_100000746330 [1,0,0,0,0,0|2,0,1]=4 2791 B13R0.336 CCCCOCCOCCCCCO 7a_100000210238_100000746330 [1,0,0,0,0,0|2,0,1]=4 2792 B13R0.336 CCCCOCCOCCOCC=O 34a_100011215186_200009817547 [1,0,0,0,0,0|3,0,0]=4 2793 B13R0.336 CCCCOCCOCCOCC=O 7a_100011215186_200015260668 [1,0,0,0,0,0|3,0,0]=4 2794 B13R0.336 CCCCOCCSCCCCC=O 62a_100000139335_100000743108 [1,0,0,0,0,0|2,0,0]=3 2795 B13R0.336 CCCCOCCSCCCCC=O 62a_100000743108_100000139335 [1,0,0,0,0,0|2,0,0]=3 2796 B13R0.336 CCCCOCCSCCCCCF 62a_100000729378_100000743108 [1,0,0,0,0,0|3,0,0]=4 2797 B13R0.336 CCCCOCCSCCCCCF 62a_100000743108_100000729378 [1,0,0,0,0,0|3,0,0]=4 2798 B13R0.336 CCCCOCCSCCCCCO 62a_100000743108_100000746330 [1,0,0,0,0,0|2,0,1]=4 2799 B13R0.336 CCCCOCCSCCCCCO 62a_100000746330_100000743108 [1,0,0,0,0,0|2,0,1]=4 2800 B13R0.336 CCCCOCNCCCCCCO 2230a_100000686447_100011995733 [1,0,0,0,0,0|2,0,1]=4 2801 B13R0.336 CCCCOCNCCCCCCO 34a_100000686447_100011995733 [1,0,0,0,0,0|2,0,1]=4 2802 B13R0.336 CCCCOCOCCCCCCBr 34a_100011215345_100011995733 [1,0,0,0,0,0|3,0,0]=4 2803 B13R0.336 CCCCOCOCCCCCCCl 34a_100000766143_100011995733 [1,0,0,0,0,0|3,0,0]=4 2804 B13R0.336 CCCCOCOCCCCCCF 34a_100000732779_100011995733 [1,0,0,0,0,0|3,0,0]=4 2805 B13R0.336 CCCCOCOCCCCCCN 34a_100000686447_100011995733 [1,0,0,0,0,0|3,0,0]=4 2806 B13R0.336 CCCCOCSCCCCCC=O 62a_100000139337_100011995733 [1,0,0,0,0,0|2,0,0]=3 2807 B13R0.336 CCCCOCSCCCCCC=O 62a_100011995733_100000139337 [1,0,0,0,0,0|2,0,0]=3 2808 B13R0.336 CCCCOCSCCCCCCF 62a_100011995733_100015922095 [1,0,0,0,0,0|3,0,0]=4 2809 B13R0.336 CCCCOCSCCCCCCF 62a_100015922095_100011995733 [1,0,0,0,0,0|3,0,0]=4 2810 B13R0.336 CCCCOCSCCCCCCO 62a_100000766143_100011995733 [1,0,0,0,0,0|2,0,1]=4 2811 B13R0.336 CCCCOCSCCCCCCO 62a_100011995733_100000766143 [1,0,0,0,0,0|2,0,1]=4 2812 B13R0.336 CCCCSCCCCCCCCO 62a_100000033203_100000210210 [1,0,0,0,0,0|1,0,1]=3 2813 B13R0.336 CCCCSCCCCCCCCO 62a_100000210211_100000033203 [1,0,0,0,0,0|1,0,1]=3 2814 B13R0.336 CCCCSCCNCCCCC=O 2230a_100025743550_100000139335 [1,0,0,0,0,0|2,0,0]=3 2815 B13R0.336 CCCCSCCNCCCCCF 2230a_100025743550_100000729378 [1,0,0,0,0,0|3,0,0]=4 2816 B13R0.336 CCCCSCCNCCCCCO 2230a_100025743550_100000746330 [1,0,0,0,0,0|2,0,1]=4 2817 B13R0.336 CCCCSCCOCCCCC=O 7a_200000230436_100000139335 [1,0,0,0,0,0|2,0,0]=3 2818 B13R0.336 CCCCSCCOCCCCCF 34a_200000230436_100000729378 [1,0,0,0,0,0|3,0,0]=4 2819 B13R0.336 CCCCSCCOCCCCCF 7a_200000230436_100000729378 [1,0,0,0,0,0|3,0,0]=4 2820 B13R0.336 CCCCSCCOCCCCCO 34a_200000230436_100000746330 [1,0,0,0,0,0|2,0,1]=4 2821 B13R0.336 CCCCSCCOCCCCCO 7a_200000230436_100000746330 [1,0,0,0,0,0|2,0,1]=4 2822 B13R0.336 CCCNCCCCCCCCCO 2230a_100000078944_100000210303 [1,0,0,0,0,0|1,0,1]=3 2823 B13R0.336 CCCNCCCCCCCCCO 34a_100000078944_100000210303 [1,0,0,0,0,0|1,0,1]=3 2824 B13R0.336 CCCOCCCCCCCCCBr 34a_100009813782_100000210303 [1,0,0,0,0,0|2,0,0]=3 2825 B13R0.336 CCCOCCCCCCCCCBr 7a_100009813782_100000210303 [1,0,0,0,0,0|2,0,0]=3 2826 B13R0.336 CCCOCCCCCCCCCCl 34a_100009868337_100000210303 [1,0,0,0,0,0|2,0,0]=3 2827 B13R0.336 CCCOCCCCCCCCCCl 7a_100009868337_100000210303 [1,0,0,0,0,0|2,0,0]=3 2828 B13R0.336 CCCOCCCCCCCCCN 34a_100000078944_100000210303 [1,0,0,0,0,0|2,0,0]=3 2829 B13R0.336 CCCOCCCCCCCCCO 34a_100000210258_100009813782 [1,0,0,0,0,0|1,0,1]=3 2830 B13R0.336 CCCOCCCNCCCCC=O 2230a_100011217757_100000139335 [1,0,0,0,0,0|2,0,0]=3 2831 B13R0.336 CCCOCCCNCCCCCF 2230a_100011217757_100000729378 [1,0,0,0,0,0|3,0,0]=4 2832 B13R0.336 CCCOCCCNCCCCCF 34a_100011217757_100000729378 [1,0,0,0,0,0|3,0,0]=4 2833 B13R0.336 CCCOCCCNCCCCCO 2230a_100011217757_100000746330 [1,0,0,0,0,0|2,0,1]=4 2834 B13R0.336 CCCOCCCNCCCCCO 34a_100011217757_100000746330 [1,0,0,0,0,0|2,0,1]=4 2835 B13R0.336 CCCOCCNCCCCCC=O 2230a_100161115042_100000139337 [1,0,0,0,0,0|2,0,0]=3 2836 B13R0.336 CCCOCCNCCCCCCF 2230a_100161115042_100015922095 [1,0,0,0,0,0|3,0,0]=4 2837 B13R0.336 CCCOCCNCCCCCCF 34a_100161115042_100015922095 [1,0,0,0,0,0|3,0,0]=4 2838 B13R0.336 CCCOCCNCCCCCCO 2230a_100000686447_100011215938 [1,0,0,0,0,0|2,0,1]=4 2839 B13R0.336 CCCOCCNCCCCCCO 2230a_100161115042_100000766143 [1,0,0,0,0,0|2,0,1]=4 2840 B13R0.336 CCCOCCNCCCCCCO 34a_100000686447_100011215938 [1,0,0,0,0,0|2,0,1]=4 2841 B13R0.336 CCCOCCNCCCCCCO 34a_100161115042_100000766143 [1,0,0,0,0,0|2,0,1]=4 2842 B13R0.336 CCCOCCOCCCCCC=O 7a_100000752267_100000139337 [1,0,0,0,0,0|2,0,0]=3 2843 B13R0.336 CCCOCCOCCCCCCBr 34a_100011215345_100011215938 [1,0,0,0,0,0|3,0,0]=4 2844 B13R0.336 CCCOCCOCCCCCCBr 7a_100011215345_100011215938 [1,0,0,0,0,0|3,0,0]=4 2845 B13R0.336 CCCOCCOCCCCCCCl 34a_100000766143_100011215938 [1,0,0,0,0,0|3,0,0]=4 2846 B13R0.336 CCCOCCOCCCCCCCl 7a_100000766143_100011215938 [1,0,0,0,0,0|3,0,0]=4 2847 B13R0.336 CCCOCCOCCCCCCF 34a_100000732779_100011215938 [1,0,0,0,0,0|3,0,0]=4 2848 B13R0.336 CCCOCCOCCCCCCF 34a_100000752267_100015922095 [1,0,0,0,0,0|3,0,0]=4 2849 B13R0.336 CCCOCCOCCCCCCF 7a_100000732779_100011215938 [1,0,0,0,0,0|3,0,0]=4 2850 B13R0.336 CCCOCCOCCCCCCF 7a_100000752267_100015922095 [1,0,0,0,0,0|3,0,0]=4 2851 B13R0.336 CCCOCCOCCCCCCN 34a_100000686447_100011215938 [1,0,0,0,0,0|3,0,0]=4 2852 B13R0.336 CCCOCCOCCCCCCO 34a_100000752267_100000766143 [1,0,0,0,0,0|2,0,1]=4 2853 B13R0.336 CCCOCCOCCCCCCO 7a_100000752267_100000766143 [1,0,0,0,0,0|2,0,1]=4 2854 B13R0.336 CCCOCCSCCCCCC=O 62a_100000139337_100011215938 [1,0,0,0,0,0|2,0,0]=3 2855 B13R0.336 CCCOCCSCCCCCC=O 62a_100011215938_100000139337 [1,0,0,0,0,0|2,0,0]=3 2856 B13R0.336 CCCOCCSCCCCCCF 62a_100011215938_100015922095 [1,0,0,0,0,0|3,0,0]=4 2857 B13R0.336 CCCOCCSCCCCCCF 62a_100015922095_100011215938 [1,0,0,0,0,0|3,0,0]=4 2858 B13R0.336 CCCOCCSCCCCCCO 62a_100000766143_100011215938 [1,0,0,0,0,0|2,0,1]=4 2859 B13R0.336 CCCOCCSCCCCCCO 62a_100011215938_100000766143 [1,0,0,0,0,0|2,0,1]=4 2860 B13R0.336 CCCSCCCCCCCCCO 62a_100000210303_100009813782 [1,0,0,0,0,0|1,0,1]=3 2861 B13R0.336 CCCSCCCCCCCCCO 62a_100009813782_100000210303 [1,0,0,0,0,0|1,0,1]=3 2862 B13R0.336 CCCSCCNCCCCCC=O 2230a_100020603323_100000139337 [1,0,0,0,0,0|2,0,0]=3 2863 B13R0.336 CCCSCCNCCCCCCF 2230a_100020603323_100015922095 [1,0,0,0,0,0|3,0,0]=4 2864 B13R0.336 CCCSCCNCCCCCCO 2230a_100020603323_100000766143 [1,0,0,0,0,0|2,0,1]=4 2865 B13R0.336 CCCSCCOCCCCCC=O 7a_200000230433_100000139337 [1,0,0,0,0,0|2,0,0]=3 2866 B13R0.336 CCCSCCOCCCCCCF 34a_200000230433_100015922095 [1,0,0,0,0,0|3,0,0]=4 2867 B13R0.336 CCCSCCOCCCCCCF 7a_200000230433_100015922095 [1,0,0,0,0,0|3,0,0]=4 2868 B13R0.336 CCCSCCOCCCCCCO 34a_200000230433_100000766143 [1,0,0,0,0,0|2,0,1]=4 2869 B13R0.336 CCCSCCOCCCCCCO 7a_200000230433_100000766143 [1,0,0,0,0,0|2,0,1]=4 2870 B13R0.336 CCNCCCCCCCCCCO 2230a_100000066964_100000210202 [1,0,0,0,0,0|1,0,1]=3 2871 B13R0.336 CCNCCCCCCCCCCO 2230a_100015525214_100009813290 [1,0,0,0,0,0|1,0,1]=3 2872 B13R0.336 CCNCCCCCCCCCCO 34a_100000066964_100000210202 [1,0,0,0,0,0|1,0,1]=3 2873 B13R0.336 CCOCCCCCCCCCCBr 34a_100009813290_100000210202 [1,0,0,0,0,0|2,0,0]=3 2874 B13R0.336 CCOCCCCCCCCCCBr 7a_100009813290_100000210202 [1,0,0,0,0,0|2,0,0]=3 2875 B13R0.336 CCOCCCCCCCCCCCl 34a_200000033068_100000210202 [1,0,0,0,0,0|2,0,0]=3 2876 B13R0.336 CCOCCCCCCCCCCCl 7a_200000033068_100000210202 [1,0,0,0,0,0|2,0,0]=3 2877 B13R0.336 CCOCCCCCCCCCCN 34a_100000066964_100000210202 [1,0,0,0,0,0|2,0,0]=3 2878 B13R0.336 CCOCCCCCCCCCCO 34a_100121572206_100009813290 [1,0,0,0,0,0|1,0,1]=3 2879 B13R0.336 CCOCCCCCCCCCOC 34a_100009875440_200000210301 [1,0,0,0,0,0|2,0,1]=4 2880 B13R0.336 CCOCCCCCCCCCOC 7a_100009875440_200000210301 [1,0,0,0,0,0|2,0,1]=4 2881 B13R0.336 CCOCCCCCCCCCO[13CH3] 34a_100009875440_200025704644 [1,0,0,0,0,0|2,0,1]=4 2882 B13R0.336 CCOCCCCCCCCCO[13CH3] 7a_100009875440_200025704644 [1,0,0,0,0,0|2,0,1]=4 2883 B13R0.336 CCOCCCNCCCCCC=O 2230a_100000210961_100000139337 [1,0,0,0,0,0|2,0,0]=3 2884 B13R0.336 CCOCCCNCCCCCCF 2230a_100000210961_100015922095 [1,0,0,0,0,0|3,0,0]=4 2885 B13R0.336 CCOCCCNCCCCCCF 34a_100000210961_100015922095 [1,0,0,0,0,0|3,0,0]=4 2886 B13R0.336 CCOCCCNCCCCCCO 2230a_100000210961_100000766143 [1,0,0,0,0,0|2,0,1]=4 2887 B13R0.336 CCOCCCNCCCCCCO 2230a_100000686447_100012232248 [1,0,0,0,0,0|2,0,1]=4 2888 B13R0.336 CCOCCCNCCCCCCO 34a_100000210961_100000766143 [1,0,0,0,0,0|2,0,1]=4 2889 B13R0.336 CCOCCCNCCCCCCO 34a_100000686447_100012232248 [1,0,0,0,0,0|2,0,1]=4 2890 B13R0.336 CCOCCCOCCCCCC=O 7a_100000757476_100000139337 [1,0,0,0,0,0|2,0,0]=3 2891 B13R0.336 CCOCCCOCCCCCCBr 34a_100011215345_100012232248 [1,0,0,0,0,0|3,0,0]=4 2892 B13R0.336 CCOCCCOCCCCCCBr 7a_100011215345_100012232248 [1,0,0,0,0,0|3,0,0]=4 2893 B13R0.336 CCOCCCOCCCCCCCl 34a_100000766143_100012232248 [1,0,0,0,0,0|3,0,0]=4 2894 B13R0.336 CCOCCCOCCCCCCCl 7a_100000766143_100012232248 [1,0,0,0,0,0|3,0,0]=4 2895 B13R0.336 CCOCCCOCCCCCCF 34a_100000732779_100012232248 [1,0,0,0,0,0|3,0,0]=4 2896 B13R0.336 CCOCCCOCCCCCCF 34a_100000757476_100015922095 [1,0,0,0,0,0|3,0,0]=4 2897 B13R0.336 CCOCCCOCCCCCCF 7a_100000732779_100012232248 [1,0,0,0,0,0|3,0,0]=4 2898 B13R0.336 CCOCCCOCCCCCCF 7a_100000757476_100015922095 [1,0,0,0,0,0|3,0,0]=4 2899 B13R0.336 CCOCCCOCCCCCCN 34a_100000686447_100012232248 [1,0,0,0,0,0|3,0,0]=4 2900 B13R0.336 CCOCCCOCCCCCCO 34a_100000757476_100000766143 [1,0,0,0,0,0|2,0,1]=4 2901 B13R0.336 CCOCCCOCCCCCCO 7a_100000757476_100000766143 [1,0,0,0,0,0|2,0,1]=4 2902 B13R0.336 CCOCCCSCCCCCC=O 62a_100000139337_100012232248 [1,0,0,0,0,0|2,0,0]=3 2903 B13R0.336 CCOCCCSCCCCCC=O 62a_100012232248_100000139337 [1,0,0,0,0,0|2,0,0]=3 2904 B13R0.336 CCOCCCSCCCCCCF 62a_100012232248_100015922095 [1,0,0,0,0,0|3,0,0]=4 2905 B13R0.336 CCOCCCSCCCCCCF 62a_100015922095_100012232248 [1,0,0,0,0,0|3,0,0]=4 2906 B13R0.336 CCOCCCSCCCCCCO 62a_100000766143_100012232248 [1,0,0,0,0,0|2,0,1]=4 2907 B13R0.336 CCOCCCSCCCCCCO 62a_100012232248_100000766143 [1,0,0,0,0,0|2,0,1]=4 2908 B13R0.336 CCOCCNCCCCCCCO 2230a_100011996573_100011215890 [1,0,0,0,0,0|2,0,1]=4 2909 B13R0.336 CCOCCNCCCCCCCO 2230a_102516460346_100000760002 [1,0,0,0,0,0|2,0,1]=4 2910 B13R0.336 CCOCCNCCCCCCCO 34a_100011996573_100000210147 [1,0,0,0,0,0|2,0,1]=4 2911 B13R0.336 CCOCCNCCCCCCCO 34a_102516460346_100000760002 [1,0,0,0,0,0|2,0,1]=4 2912 B13R0.336 CCOCCOCCCCCCCBr 34a_100000760002_100000210147 [1,0,0,0,0,0|3,0,0]=4 2913 B13R0.336 CCOCCOCCCCCCCBr 7a_100000760002_100011215890 [1,0,0,0,0,0|3,0,0]=4 2914 B13R0.336 CCOCCOCCCCCCCN 34a_100011996573_100000210147 [1,0,0,0,0,0|3,0,0]=4 2915 B13R0.336 CCOCCOCCCCCCCO 34a_100000210136_100000760002 [1,0,0,0,0,0|2,0,1]=4 2916 B13R0.336 CCOCCOCCCCCCCO 7a_100000210136_100000760002 [1,0,0,0,0,0|2,0,1]=4 2917 B13R0.336 CCOCCOCCNCCCC=O 2230a_100102712874_200011292268 [1,0,0,0,0,0|3,0,0]=4 2918 B13R0.336 CCOCCOCCOCCCC=O 7a_100000210240_200011292268 [1,0,0,0,0,0|3,0,0]=4 2919 B13R0.336 CCOCCOCCSCCCC=O 62a_100011211534_200011292268 [1,0,0,0,0,0|3,0,0]=4 2920 B13R0.336 CCOCCOCCSCCCC=O 62a_200011292268_100011211534 [1,0,0,0,0,0|3,0,0]=4 2921 B13R0.336 CCOCCSCCCCCCCO 62a_100000210147_100000760002 [1,0,0,0,0,0|2,0,1]=4 2922 B13R0.336 CCOCCSCCCCCCCO 62a_100000760002_100011215890 [1,0,0,0,0,0|2,0,1]=4 2923 B13R0.336 CCOCSCCCCCCCCO 62a_100000033203_100000739092 [1,0,0,0,0,0|2,0,1]=4 2924 B13R0.336 CCOCSCCCCCCCCO 62a_100000739092_100000033203 [1,0,0,0,0,0|2,0,1]=4 2925 B13R0.336 CCSCCCCCCCCCCO 62a_100000210202_200000033068 [1,0,0,0,0,0|1,0,1]=3 2926 B13R0.336 CCSCCCCCCCCCCO 62a_100009813290_100000210202 [1,0,0,0,0,0|1,0,1]=3 2927 B13R0.336 CCSCCCOCCCCCC=O 7a_100011216438_100000139337 [1,0,0,0,0,0|2,0,0]=3 2928 B13R0.336 CCSCCCOCCCCCCF 34a_100011216438_100015922095 [1,0,0,0,0,0|3,0,0]=4 2929 B13R0.336 CCSCCCOCCCCCCF 7a_100011216438_100015922095 [1,0,0,0,0,0|3,0,0]=4 2930 B13R0.336 CCSCCCOCCCCCCO 34a_100011216438_100000766143 [1,0,0,0,0,0|2,0,1]=4 2931 B13R0.336 CCSCCCOCCCCCCO 7a_100011216438_100000766143 [1,0,0,0,0,0|2,0,1]=4 2932 B13R0.336 CCSCCNCCCCCCCO 2230a_100000106463_100000760002 [1,0,0,0,0,0|2,0,1]=4 2933 B13R0.336 CCSCCNCCCCCCCO 2230a_100011996573_100000757381 [1,0,0,0,0,0|2,0,1]=4 2934 B13R0.336 CCSCCNCCCCCCCO 34a_100011996573_100000757381 [1,0,0,0,0,0|2,0,1]=4 2935 B13R0.336 CCSCCOCCCCCCCBr 34a_100000760002_100000757381 [1,0,0,0,0,0|3,0,0]=4 2936 B13R0.336 CCSCCOCCCCCCCBr 7a_100000760002_100000757381 [1,0,0,0,0,0|3,0,0]=4 2937 B13R0.336 CCSCCOCCCCCCCN 34a_100011996573_100000757381 [1,0,0,0,0,0|3,0,0]=4 2938 B13R0.336 CCSCCOCCCCCCCO 34a_100000212035_100000760002 [1,0,0,0,0,0|2,0,1]=4 2939 B13R0.336 CCSCCOCCCCCCCO 7a_100000212035_100000760002 [1,0,0,0,0,0|2,0,1]=4 2940 B13R0.336 CCSCCSCCCCCCCO 62a_100000757381_100000760002 [1,0,0,0,0,0|2,0,1]=4 2941 B13R0.336 CCSCCSCCCCCCCO 62a_100000760002_100000757381 [1,0,0,0,0,0|2,0,1]=4 2942 B13R0.336 CNCCCCCCCCCCCO 2230a_106832991635_100009812471 [1,0,0,0,0,0|1,0,1]=3 2943 B13R0.336 CNCCCCCCCCCCCO 34a_100102657272_100009812471 [1,0,0,0,0,0|1,0,1]=3 2944 B13R0.336 CNCCCCCCCCCCCO 7a_106832991635_100009812471 [1,0,0,0,0,0|1,0,1]=3 2945 B13R0.336 CNCCCCCOCCCCCF 34a_100000722520_100000729378 [1,0,0,0,0,0|3,0,0]=4 2946 B13R0.336 CNCCCCCOCCCCCO 34a_100000722520_100000746330 [1,0,0,0,0,0|2,0,1]=4 2947 B13R0.336 CNCCCOCCCCCCCO 34a_100000213112_100000760002 [1,0,0,0,0,0|2,0,1]=4 2948 B13R0.336 COCCCCCCCCCCCBr 34a_100009812471_200000210301 [1,0,0,0,0,0|2,0,0]=3 2949 B13R0.336 COCCCCCCCCCCCBr 7a_100009812471_200000210301 [1,0,0,0,0,0|2,0,0]=3 2950 B13R0.336 COCCCCCCCCCCCO 34a_100138415774_100009812471 [1,0,0,0,0,0|1,0,1]=3 2951 B13R0.336 COCCCCCCNCCCCO 2230a_100000750430_100011998445 [1,0,0,0,0,0|2,0,1]=4 2952 B13R0.336 COCCCCCCNCCCCO 34a_100000750430_100011998445 [1,0,0,0,0,0|2,0,1]=4 2953 B13R0.336 COCCCCCCOCCCC=O 7a_200012092642_200011292268 [1,0,0,0,0,0|2,0,0]=3 2954 B13R0.336 COCCCCCCOCCCCBr 34a_100011216708_100011998445 [1,0,0,0,0,0|3,0,0]=4 2955 B13R0.336 COCCCCCCOCCCCCl 34a_100000210776_100011998445 [1,0,0,0,0,0|3,0,0]=4 2956 B13R0.336 COCCCCCCOCCCCCl 7a_100000210776_100011998445 [1,0,0,0,0,0|3,0,0]=4 2957 B13R0.336 COCCCCCCOCCCCF 34a_100011995726_100011998445 [1,0,0,0,0,0|3,0,0]=4 2958 B13R0.336 COCCCCCCOCCCCF 34a_200012092642_100000729493 [1,0,0,0,0,0|3,0,0]=4 2959 B13R0.336 COCCCCCCOCCCCF 7a_100011995726_100011998445 [1,0,0,0,0,0|3,0,0]=4 2960 B13R0.336 COCCCCCCOCCCCF 7a_200012092642_100000729493 [1,0,0,0,0,0|3,0,0]=4 2961 B13R0.336 COCCCCCCOCCCCI 34a_200012148704_100011998445 [1,0,0,0,0,0|3,0,0]=4 2962 B13R0.336 COCCCCCCOCCCCN 34a_100000750430_100011998445 [1,0,0,0,0,0|3,0,0]=4 2963 B13R0.336 COCCCCCCOCCCCO 34a_200012092642_100011216708 [1,0,0,0,0,0|2,0,1]=4 2964 B13R0.336 COCCCCCCOCCCCO 7a_200012092642_100000210776 [1,0,0,0,0,0|2,0,1]=4 2965 B13R0.336 COCCCCCCSCCCC=O 62a_100011998445_200011292268 [1,0,0,0,0,0|2,0,0]=3 2966 B13R0.336 COCCCCCCSCCCC=O 62a_200011292268_100011998445 [1,0,0,0,0,0|2,0,0]=3 2967 B13R0.336 COCCCCCCSCCCCF 62a_100000729493_100011998445 [1,0,0,0,0,0|3,0,0]=4 2968 B13R0.336 COCCCCCCSCCCCF 62a_100011998445_100000729493 [1,0,0,0,0,0|3,0,0]=4 2969 B13R0.336 COCCCCCCSCCCCO 62a_100000210776_100011998445 [1,0,0,0,0,0|2,0,1]=4 2970 B13R0.336 COCCCCCCSCCCCO 62a_100011998445_100000210776 [1,0,0,0,0,0|2,0,1]=4 2971 B13R0.336 COCCCCCNCCCCC=O 2230a_100000747528_100000139335 [1,0,0,0,0,0|2,0,0]=3 2972 B13R0.336 COCCCCCNCCCCCF 2230a_100000747528_100000729378 [1,0,0,0,0,0|3,0,0]=4 2973 B13R0.336 COCCCCCNCCCCCF 34a_100000747528_100000729378 [1,0,0,0,0,0|3,0,0]=4 2974 B13R0.336 COCCCCCNCCCCCO 2230a_100000747528_100000746330 [1,0,0,0,0,0|2,0,1]=4 2975 B13R0.336 COCCCCCNCCCCCO 34a_100000747528_100000746330 [1,0,0,0,0,0|2,0,1]=4 2976 B13R0.336 COCCCCNCCCCCCO 2230a_100000686447_100000730899 [1,0,0,0,0,0|2,0,1]=4 2977 B13R0.336 COCCCCNCCCCCCO 34a_100000686447_100000755781 [1,0,0,0,0,0|2,0,1]=4 2978 B13R0.336 COCCCCOCCCCCCBr 34a_100011215345_100000755781 [1,0,0,0,0,0|3,0,0]=4 2979 B13R0.336 COCCCCOCCCCCCBr 7a_100011215345_100000730899 [1,0,0,0,0,0|3,0,0]=4 2980 B13R0.336 COCCCCOCCCCCCCl 34a_100000766143_100000755781 [1,0,0,0,0,0|3,0,0]=4 2981 B13R0.336 COCCCCOCCCCCCCl 7a_100000766143_100000730899 [1,0,0,0,0,0|3,0,0]=4 2982 B13R0.336 COCCCCOCCCCCCF 34a_100000732779_100000755781 [1,0,0,0,0,0|3,0,0]=4 2983 B13R0.336 COCCCCOCCCCCCF 34a_100000740925_100015922095 [1,0,0,0,0,0|3,0,0]=4 2984 B13R0.336 COCCCCOCCCCCCF 7a_100000732779_100000730899 [1,0,0,0,0,0|3,0,0]=4 2985 B13R0.336 COCCCCOCCCCCCN 34a_100000686447_100000755781 [1,0,0,0,0,0|3,0,0]=4 2986 B13R0.336 COCCCCOCCCCCCO 34a_100000740925_100000766143 [1,0,0,0,0,0|2,0,1]=4 2987 B13R0.336 COCCCCSCCCCCC=O 62a_100000139337_100000730899 [1,0,0,0,0,0|2,0,0]=3 2988 B13R0.336 COCCCCSCCCCCC=O 62a_100000730899_100000139337 [1,0,0,0,0,0|2,0,0]=3 2989 B13R0.336 COCCCCSCCCCCCF 62a_100000730899_100015922095 [1,0,0,0,0,0|3,0,0]=4 2990 B13R0.336 COCCCCSCCCCCCF 62a_100015922095_100000730899 [1,0,0,0,0,0|3,0,0]=4 2991 B13R0.336 COCCCCSCCCCCCO 62a_100000730899_100000766143 [1,0,0,0,0,0|2,0,1]=4 2992 B13R0.336 COCCCCSCCCCCCO 62a_100000766143_100000730899 [1,0,0,0,0,0|2,0,1]=4 2993 B13R0.336 COCCCNCCCCCCCO 2230a_100011996573_100000740836 [1,0,0,0,0,0|2,0,1]=4 2994 B13R0.336 COCCCNCCCCCCCO 34a_100011996573_100000740836 [1,0,0,0,0,0|2,0,1]=4 2995 B13R0.336 COCCCNCCCCCCCO 34a_100150723488_100000760002 [1,0,0,0,0,0|2,0,1]=4 2996 B13R0.336 COCCCOCCCCCCCBr 34a_100000760002_100000740836 [1,0,0,0,0,0|3,0,0]=4 2997 B13R0.336 COCCCOCCCCCCCBr 7a_100000760002_100000740836 [1,0,0,0,0,0|3,0,0]=4 2998 B13R0.336 COCCCOCCCCCCCN 34a_100011996573_100000740836 [1,0,0,0,0,0|3,0,0]=4 2999 B13R0.336 COCCCOCCCCCCCO 34a_100000740835_100000760002 [1,0,0,0,0,0|2,0,1]=4 3000 B13R0.336 COCCCSCCCCCCCO 62a_100000709357_100000760002 [1,0,0,0,0,0|2,0,1]=4 3001 B13R0.336 COCCCSCCCCCCCO 62a_100000760002_100000709357 [1,0,0,0,0,0|2,0,1]=4 3002 B13R0.336 COCCNCCCCCCCCO 2230a_100000209980_100000033203 [1,0,0,0,0,0|2,0,1]=4 3003 B13R0.336 COCCNCCCCCCCCO 2230a_102515433106_100011201679 [1,0,0,0,0,0|2,0,1]=4 3004 B13R0.336 COCCNCCCCCCCCO 34a_102515433106_100011201679 [1,0,0,0,0,0|2,0,1]=4 3005 B13R0.336 COCCOCCCCCCCCBr 34a_100009813846_100011201679 [1,0,0,0,0,0|3,0,0]=4 3006 B13R0.336 COCCOCCCCCCCCBr 7a_100009813846_100000233755 [1,0,0,0,0,0|3,0,0]=4 3007 B13R0.336 COCCOCCCCCCCCCl 34a_100000033203_100011201679 [1,0,0,0,0,0|3,0,0]=4 3008 B13R0.336 COCCOCCCCCCCCCl 7a_100000033203_100000233755 [1,0,0,0,0,0|3,0,0]=4 3009 B13R0.336 COCCOCCCCCCCCN 34a_102515433106_100011201679 [1,0,0,0,0,0|3,0,0]=4 3010 B13R0.336 COCCOCCCCCCCCO 34a_100000210237_100000033203 [1,0,0,0,0,0|2,0,1]=4 3011 B13R0.336 COCCOCCCNCCCC=O 2230a_100000206027_200011292268 [1,0,0,0,0,0|3,0,0]=4 3012 B13R0.336 COCCOCCCSCCCC=O 62a_100011216529_200011292268 [1,0,0,0,0,0|3,0,0]=4 3013 B13R0.336 COCCOCCCSCCCC=O 62a_200011292268_100011216529 [1,0,0,0,0,0|3,0,0]=4 3014 B13R0.336 COCCOCCNCCCCC=O 2230a_100000745349_100000139335 [1,0,0,0,0,0|3,0,0]=4 3015 B13R0.336 COCCOCCOCCCCC=O 7a_100011215163_100000139335 [1,0,0,0,0,0|3,0,0]=4 3016 B13R0.336 COCCOCCSCCCCC=O 62a_100000139335_100000695917 [1,0,0,0,0,0|3,0,0]=4 3017 B13R0.336 COCCOCCSCCCCC=O 62a_100000695917_100000139335 [1,0,0,0,0,0|3,0,0]=4 3018 B13R0.336 COCCOCSCCCCCC=O 62a_100000139337_100000231047 [1,0,0,0,0,0|3,0,0]=4 3019 B13R0.336 COCCOCSCCCCCC=O 62a_100000231047_100000139337 [1,0,0,0,0,0|3,0,0]=4 3020 B13R0.336 COCCSCCCCCCCCO 62a_100000033203_100000233755 [1,0,0,0,0,0|2,0,1]=4 3021 B13R0.336 COCCSCCCCCCCCO 62a_100000233755_100000033203 [1,0,0,0,0,0|2,0,1]=4 3022 B13R0.336 COCNCCCCCCCCCO 2230a_100000078944_100000766300 [1,0,0,0,0,0|2,0,1]=4 3023 B13R0.336 COCSCCCCCCCCCO 62a_100000766300_100009813782 [1,0,0,0,0,0|2,0,1]=4 3024 B13R0.336 COCSCCCCCCCCCO 62a_100009813782_100000766300 [1,0,0,0,0,0|2,0,1]=4 3025 B13R0.336 CSCCCCCCCCCCCO 62a_100009812471_200000210301 [1,0,0,0,0,0|1,0,1]=3 3026 B13R0.336 CSCCCCOCCCCCC=O 7a_100011217163_100000139337 [1,0,0,0,0,0|2,0,0]=3 3027 B13R0.336 CSCCCCOCCCCCCF 34a_100011217163_100015922095 [1,0,0,0,0,0|3,0,0]=4 3028 B13R0.336 CSCCCCOCCCCCCF 7a_100011217163_100015922095 [1,0,0,0,0,0|3,0,0]=4 3029 B13R0.336 CSCCCCOCCCCCCO 34a_100011217163_100000766143 [1,0,0,0,0,0|2,0,1]=4 3030 B13R0.336 CSCCCCOCCCCCCO 7a_100011217163_100000766143 [1,0,0,0,0,0|2,0,1]=4 3031 B13R0.336 CSCCCNCCCCCCCO 2230a_100000749238_100000760002 [1,0,0,0,0,0|2,0,1]=4 3032 B13R0.336 CSCCCOCCCCCCCO 34a_100000690336_100000760002 [1,0,0,0,0,0|2,0,1]=4 3033 B13R0.336 CSCCCOCCCCCCCO 7a_100000690336_100000760002 [1,0,0,0,0,0|2,0,1]=4 3034 B13R0.336 CSCCNCCCCCCCCO 2230a_100020590264_100000033203 [1,0,0,0,0,0|2,0,1]=4 3035 B13R0.336 CSCCNCCCCCCCCO 2230a_102515433106_100000751147 [1,0,0,0,0,0|2,0,1]=4 3036 B13R0.336 CSCCNCCCCCCCCO 34a_102515433106_100000212216 [1,0,0,0,0,0|2,0,1]=4 3037 B13R0.336 CSCCOCCCCCCCCBr 34a_100009813846_100000212216 [1,0,0,0,0,0|3,0,0]=4 3038 B13R0.336 CSCCOCCCCCCCCBr 7a_100009813846_100000212216 [1,0,0,0,0,0|3,0,0]=4 3039 B13R0.336 CSCCOCCCCCCCCCl 34a_100000033203_100000212216 [1,0,0,0,0,0|3,0,0]=4 3040 B13R0.336 CSCCOCCCCCCCCCl 7a_100000033203_100000212216 [1,0,0,0,0,0|3,0,0]=4 3041 B13R0.336 CSCCOCCCCCCCCN 34a_102515433106_100000212216 [1,0,0,0,0,0|3,0,0]=4 3042 B13R0.336 CSCCOCCCCCCCCO 34a_100000230434_100000033203 [1,0,0,0,0,0|2,0,1]=4 3043 B13R0.336 CSCCOCCCCCCCCO 7a_100000230434_100000033203 [1,0,0,0,0,0|2,0,1]=4 3044 B13R0.336 CSCCSCCCCCCCCO 62a_100000033203_100000751147 [1,0,0,0,0,0|2,0,1]=4 3045 B13R0.336 CSCCSCCCCCCCCO 62a_100000212216_100000033203 [1,0,0,0,0,0|2,0,1]=4 3046 B13R0.336 CSCNCCCCCCCCCO 2230a_100000078944_100011218213 [1,0,0,0,0,0|2,0,1]=4 3047 B13R0.336 CSCNCCCCCCCCCO 34a_100000078944_100011218213 [1,0,0,0,0,0|2,0,1]=4 3048 B13R0.336 CSCOCCCCCCCCCBr 34a_100009813782_100011218213 [1,0,0,0,0,0|3,0,0]=4 3049 B13R0.336 CSCOCCCCCCCCCCl 34a_100009868337_100011218213 [1,0,0,0,0,0|3,0,0]=4 3050 B13R0.336 CSCOCCCCCCCCCN 34a_100000078944_100011218213 [1,0,0,0,0,0|3,0,0]=4 3051 B13R0.336 CSCSCCCCCCCCCO 62a_100009813782_100011218213 [1,0,0,0,0,0|2,0,1]=4 3052 B13R0.336 CSCSCCCCCCCCCO 62a_100011218213_100009813782 [1,0,0,0,0,0|2,0,1]=4 3053 B13R0.336 FCCCCCCOCCCCCBr 34a_100000746331_100015922095 [1,0,0,0,0,0|3,0,0]=4 3054 B13R0.336 FCCCCCCOCCCCCBr 7a_100000746331_100015922095 [1,0,0,0,0,0|3,0,0]=4 3055 B13R0.336 FCCCCCCOCCCCCCl 34a_100000746330_100015922095 [1,0,0,0,0,0|3,0,0]=4 3056 B13R0.336 FCCCCCCOCCCCCCl 7a_100000746330_100015922095 [1,0,0,0,0,0|3,0,0]=4 3057 B13R0.336 FCCCCCCOCCCCCF 34a_100000732779_100000729378 [1,0,0,0,0,0|3,0,0]=4 3058 B13R0.336 FCCCCCCOCCCCCF 7a_100000732779_100000729378 [1,0,0,0,0,0|3,0,0]=4 3059 B13R0.336 FCCCCCCOCCCCCI 34a_200012148887_100015922095 [1,0,0,0,0,0|3,0,0]=4 3060 B13R0.336 FCCCCCCOCCCCCI 7a_200012148887_100015922095 [1,0,0,0,0,0|3,0,0]=4 3061 B13R0.336 FCCCCCCSCCCCCF 62a_100000729378_100015922095 [1,0,0,0,0,0|3,0,0]=4 3062 B13R0.336 FCCCCCCSCCCCCF 62a_100015922095_100000729378 [1,0,0,0,0,0|3,0,0]=4 3063 B13R0.336 FCCCCCOCCCCCCBr 34a_100011215345_100000729378 [1,0,0,0,0,0|3,0,0]=4 3064 B13R0.336 FCCCCCOCCCCCCBr 7a_100011215345_100000729378 [1,0,0,0,0,0|3,0,0]=4 3065 B13R0.336 FCCCCCOCCCCCCCl 34a_100000766143_100000729378 [1,0,0,0,0,0|3,0,0]=4 3066 B13R0.336 FCCCCCOCCCCCCCl 7a_100000766143_100000729378 [1,0,0,0,0,0|3,0,0]=4 3067 B13R0.336 FCCCCOCCCCCCCBr 34a_100000760002_100000729493 [1,0,0,0,0,0|3,0,0]=4 3068 B13R0.336 FCCCCOCCCCCCCBr 7a_100000760002_100000729493 [1,0,0,0,0,0|3,0,0]=4 3069 B13R0.336 FCCCOCCCCCCCCBr 34a_100009813846_100011934791 [1,0,0,0,0,0|3,0,0]=4 3070 B13R0.336 FCCCOCCCCCCCCBr 7a_100009813846_100011934791 [1,0,0,0,0,0|3,0,0]=4 3071 B13R0.336 FCCCOCCCCCCCCCl 34a_100000033203_100011934791 [1,0,0,0,0,0|3,0,0]=4 3072 B13R0.336 FCCCOCCCCCCCCCl 7a_100000033203_100011934791 [1,0,0,0,0,0|3,0,0]=4 3073 B13R0.336 FCCOCCCCCCCCCBr 34a_100009813782_100011217306 [1,0,0,0,0,0|3,0,0]=4 3074 B13R0.336 FCCOCCCCCCCCCBr 7a_100009813782_100011217306 [1,0,0,0,0,0|3,0,0]=4 3075 B13R0.336 FCCOCCCCCCCCCCl 34a_100009868337_100011217306 [1,0,0,0,0,0|3,0,0]=4 3076 B13R0.336 FCCOCCCCCCCCCCl 7a_100009868337_100011217306 [1,0,0,0,0,0|3,0,0]=4 3077 B13R0.336 FCOCCCCCCCCCCBr 34a_100009813290_100015361967 [1,0,0,0,0,0|3,0,0]=4 3078 B13R0.336 FCOCCCCCCCCCCBr 7a_100009813290_100015361967 [1,0,0,0,0,0|3,0,0]=4 3079 B13R0.336 FCOCCCCCCCCCCCl 34a_200000033068_100015361967 [1,0,0,0,0,0|3,0,0]=4 3080 B13R0.336 FCOCCCCCCCCCCCl 7a_200000033068_100015361967 [1,0,0,0,0,0|3,0,0]=4 3081 B13R0.336 N#CCCCCCCSCCCC=O 62a_100009813337_200011292268 [1,0,0,0,0,0|2,0,1]=4 3082 B13R0.336 N#CCCCCCCSCCCC=O 62a_200011292268_100009813337 [1,0,0,0,0,0|2,0,1]=4 3083 B13R0.336 N#CCCCCCSCCCCC=O 62a_100000139335_100009813376 [1,0,0,0,0,0|2,0,1]=4 3084 B13R0.336 N#CCCCCCSCCCCC=O 62a_100009813376_100000139335 [1,0,0,0,0,0|2,0,1]=4 3085 B13R0.336 N#CCCCCSCCCCCC=O 62a_100000139337_100000211819 [1,0,0,0,0,0|2,0,1]=4 3086 B13R0.336 N#CCCCCSCCCCCC=O 62a_100011219923_100000139337 [1,0,0,0,0,0|2,0,1]=4 3087 B13R0.336 NCCCCCCCCCCOCF 34a_100000066964_100015361967 [1,0,0,0,0,0|3,0,0]=4 3088 B13R0.336 NCCCCCCCCCOCC=O 34a_100000078944_200009817547 [1,0,0,0,0,0|2,0,0]=3 3089 B13R0.336 NCCCCCCCCCOCCF 34a_100000078944_100011217306 [1,0,0,0,0,0|3,0,0]=4 3090 B13R0.336 NCCCCCCCCCOCCO 34a_100000078944_100000211926 [1,0,0,0,0,0|2,0,1]=4 3091 B13R0.336 NCCCCCCCCOCCCF 34a_102515433106_100011934791 [1,0,0,0,0,0|3,0,0]=4 3092 B13R0.336 NCCCCCCCCOCCCO 34a_102515433106_100000230001 [1,0,0,0,0,0|2,0,1]=4 3093 B13R0.336 NCCCCCCCOCCCCF 34a_100011996573_100000729493 [1,0,0,0,0,0|3,0,0]=4 3094 B13R0.336 NCCCCCCCOCCCCO 34a_100011996573_100011216708 [1,0,0,0,0,0|2,0,1]=4 3095 B13R0.336 NCCCCCCOCCCCCF 34a_100000686447_100000729378 [1,0,0,0,0,0|3,0,0]=4 3096 B13R0.336 NCCCCCCOCCCCCO 34a_100000686447_100000746330 [1,0,0,0,0,0|2,0,1]=4 3097 B13R0.336 NCCCCCOCCCCCCF 34a_100000762737_100015922095 [1,0,0,0,0,0|3,0,0]=4 3098 B13R0.336 NCCCCCOCCCCCCO 34a_100000762737_100000766143 [1,0,0,0,0,0|2,0,1]=4 3099 B13R0.336 NCCCCOCCCCCCCO 34a_100000750430_100000760002 [1,0,0,0,0,0|2,0,1]=4 3100 B13R0.336 NCCCOCCCCCCCCO 34a_100000182051_100000033203 [1,0,0,0,0,0|2,0,1]=4 3101 B13R0.336 NCCOCCCCCCCCCO 34a_100000210304_100009813782 [1,0,0,0,0,0|2,0,1]=4 3102 B13R0.336 O=CCCCCCNCCCCCO 2230a_100000762737_100000139337 [1,0,0,0,0,0|2,0,0]=3 3103 B13R0.336 O=CCCCCCNCCOCCO 2230a_100000211614_100000139337 [1,0,0,0,0,0|3,0,0]=4 3104 B13R0.336 O=CCCCCCNCCSCCO 2230a_100011219999_100000139337 [1,0,0,0,0,0|3,0,0]=4 3105 B13R0.336 O=CCCCCCOCCCCCBr 7a_100000746331_100000139337 [1,0,0,0,0,0|2,0,0]=3 3106 B13R0.336 O=CCCCCCOCCCCCCl 7a_100000746330_100000139337 [1,0,0,0,0,0|2,0,0]=3 3107 B13R0.336 O=CCCCCCOCCCCCI 7a_200012148887_100000139337 [1,0,0,0,0,0|2,0,0]=3 3108 B13R0.336 O=CCCCCCOCCOCCBr 7a_100000692535_100000139337 [1,0,0,0,0,0|3,0,0]=4 3109 B13R0.336 O=CCCCCCOCCOCCCl 7a_100011215305_100000139337 [1,0,0,0,0,0|3,0,0]=4 3110 B13R0.336 O=CCCCCCOCCOCCF 7a_200015357709_100000139337 [1,0,0,0,0,0|3,0,0]=4 3111 B13R0.336 O=CCCCCCOCCOCCI 7a_100012149058_100000139337 [1,0,0,0,0,0|3,0,0]=4 3112 B13R0.336 O=CCCCCCSCCCCC=O 62a_100000139335_100000139337 [1,0,0,0,0,0|2,0,1]=4 3113 B13R0.336 O=CCCCCCSCCCCC=O 62a_100000139337_100000139335 [1,0,0,0,0,0|2,0,1]=4 3114 B13R0.336 O=CCCCCCSCCCCCF 62a_100000139337_100000729378 [1,0,0,0,0,0|2,0,0]=3 3115 B13R0.336 O=CCCCCCSCCCCCF 62a_100000729378_100000139337 [1,0,0,0,0,0|2,0,0]=3 3116 B13R0.336 O=CCCCCCSCCCCCO 62a_100000139337_100000746330 [1,0,0,0,0,0|2,0,0]=3 3117 B13R0.336 O=CCCCCCSCCCCCO 62a_100000746330_100000139337 [1,0,0,0,0,0|2,0,0]=3 3118 B13R0.336 O=CCCCCCSCCOCCO 62a_100000139337_100011215305 [1,0,0,0,0,0|3,0,0]=4 3119 B13R0.336 O=CCCCCCSCCOCCO 62a_100011215305_100000139337 [1,0,0,0,0,0|3,0,0]=4 3120 B13R0.336 O=CCCCCNCCCCCCO 2230a_100000686447_100000139335 [1,0,0,0,0,0|2,0,0]=3 3121 B13R0.336 O=CCCCCOCCCCCCBr 7a_100011215345_100000139335 [1,0,0,0,0,0|2,0,0]=3 3122 B13R0.336 O=CCCCCOCCCCCCCl 7a_100000766143_100000139335 [1,0,0,0,0,0|2,0,0]=3 3123 B13R0.336 O=CCCCCOCCCCCCF 7a_100000732779_100000139335 [1,0,0,0,0,0|2,0,0]=3 3124 B13R0.336 O=CCCCCSCCCCCCF 62a_100000139335_100015922095 [1,0,0,0,0,0|2,0,0]=3 3125 B13R0.336 O=CCCCCSCCCCCCF 62a_100015922095_100000139335 [1,0,0,0,0,0|2,0,0]=3 3126 B13R0.336 O=CCCCCSCCCCCCO 62a_100000139335_100000766143 [1,0,0,0,0,0|2,0,0]=3 3127 B13R0.336 O=CCCCCSCCCCCCO 62a_100000766143_100000139335 [1,0,0,0,0,0|2,0,0]=3 3128 B13R0.336 O=CCCCNCCCCCCCO 2230a_100011996573_200011292268 [1,0,0,0,0,0|2,0,0]=3 3129 B13R0.336 O=CCCCNCCCOCCCO 2230a_100011310245_200011292268 [1,0,0,0,0,0|3,0,0]=4 3130 B13R0.336 O=CCCCOCCCCCCCBr 7a_100000760002_200011292268 [1,0,0,0,0,0|2,0,0]=3 3131 B13R0.336 O=CCCCSCCCCCCCO 62a_100000760002_200011292268 [1,0,0,0,0,0|2,0,0]=3 3132 B13R0.336 O=CCCCSCCCCCCCO 62a_200011292268_100000760002 [1,0,0,0,0,0|2,0,0]=3 3133 B13R0.336 O=CCNCCCCCCCCCO 2230a_100000078944_200015260668 [1,0,0,0,0,0|2,0,0]=3 3134 B13R0.336 O=CCNCCCCCCCCCO 34a_100000078944_200009817547 [1,0,0,0,0,0|2,0,0]=3 3135 B13R0.336 O=CCOCCCCCCCCCBr 34a_100009813782_200009817547 [1,0,0,0,0,0|2,0,0]=3 3136 B13R0.336 O=CCOCCCCCCCCCBr 7a_100009813782_200015260668 [1,0,0,0,0,0|2,0,0]=3 3137 B13R0.336 O=CCOCCCCCCCCCCl 34a_100009868337_200009817547 [1,0,0,0,0,0|2,0,0]=3 3138 B13R0.336 O=CCOCCCCCCCCCCl 7a_100009868337_200015260668 [1,0,0,0,0,0|2,0,0]=3 3139 B13R0.336 O=CCSCCCCCCCCCO 62a_100009813782_200015260668 [1,0,0,0,0,0|2,0,0]=3 3140 B13R0.336 O=CCSCCCCCCCCCO 62a_200015260668_100009813782 [1,0,0,0,0,0|2,0,0]=3 3141 B13R0.336 OCCCCCCCCCCNCF 34a_100000066964_100015361967 [1,0,0,0,0,0|2,0,1]=4 3142 B13R0.336 OCCCCCCCCCCSCF 62a_100009813290_100015361967 [1,0,0,0,0,0|2,0,1]=4 3143 B13R0.336 OCCCCCCCCCCSCF 62a_100015361967_200000033068 [1,0,0,0,0,0|2,0,1]=4 3144 B13R0.336 OCCCCCCCCCNCCF 2230a_100000078944_100011217306 [1,0,0,0,0,0|2,0,1]=4 3145 B13R0.336 OCCCCCCCCCNCCF 34a_100000078944_100011217306 [1,0,0,0,0,0|2,0,1]=4 3146 B13R0.336 OCCCCCCCCCNCCF 34a_100000724931_100009813782 [1,0,0,0,0,0|2,0,1]=4 3147 B13R0.336 OCCCCCCCCCNCCO 2230a_100000078944_100000211926 [1,0,0,0,0,0|2,0,1]=4 3148 B13R0.336 OCCCCCCCCCNCCO 2230a_100016997473_100009813782 [1,0,0,0,0,0|2,0,1]=4 3149 B13R0.336 OCCCCCCCCCNCCO 34a_100000078944_100000211926 [1,0,0,0,0,0|2,0,1]=4 3150 B13R0.336 OCCCCCCCCCNCCO 34a_100016990907_100009813782 [1,0,0,0,0,0|2,0,1]=4 3151 B13R0.336 OCCCCCCCCCOCCBr 34a_100000211926_100009813782 [1,0,0,0,0,0|2,0,1]=4 3152 B13R0.336 OCCCCCCCCCSCCF 62a_100009813782_100011217306 [1,0,0,0,0,0|2,0,1]=4 3153 B13R0.336 OCCCCCCCCCSCCF 62a_100011217306_100009813782 [1,0,0,0,0,0|2,0,1]=4 3154 B13R0.336 OCCCCCCCCCSCCO 62a_100000211926_100009813782 [1,0,0,0,0,0|2,0,1]=4 3155 B13R0.336 OCCCCCCCCCSCCO 62a_100009813782_100000211926 [1,0,0,0,0,0|2,0,1]=4 3156 B13R0.336 OCCCCCCCCNCCCF 2230a_100015189416_100000033203 [1,0,0,0,0,0|2,0,1]=4 3157 B13R0.336 OCCCCCCCCNCCCF 2230a_102515433106_100011934791 [1,0,0,0,0,0|2,0,1]=4 3158 B13R0.336 OCCCCCCCCNCCCF 34a_100015189416_100000033203 [1,0,0,0,0,0|2,0,1]=4 3159 B13R0.336 OCCCCCCCCNCCCF 34a_102515433106_100011934791 [1,0,0,0,0,0|2,0,1]=4 3160 B13R0.336 OCCCCCCCCNCCCO 2230a_102515433106_100000230001 [1,0,0,0,0,0|2,0,1]=4 3161 B13R0.336 OCCCCCCCCNCCCO 34a_102515433106_100000230001 [1,0,0,0,0,0|2,0,1]=4 3162 B13R0.336 OCCCCCCCCOCCCBr 34a_100011217188_100000033203 [1,0,0,0,0,0|2,0,1]=4 3163 B13R0.336 OCCCCCCCCOCCCCl 34a_100000230001_100000033203 [1,0,0,0,0,0|2,0,1]=4 3164 B13R0.336 OCCCCCCCCOCCCF 34a_100000759539_100000033203 [1,0,0,0,0,0|2,0,1]=4 3165 B13R0.336 OCCCCCCCCSCCCF 62a_100000033203_100011934791 [1,0,0,0,0,0|2,0,1]=4 3166 B13R0.336 OCCCCCCCCSCCCF 62a_100011934791_100000033203 [1,0,0,0,0,0|2,0,1]=4 3167 B13R0.336 OCCCCCCCCSCCCO 62a_100000033203_100011215043 [1,0,0,0,0,0|2,0,1]=4 3168 B13R0.336 OCCCCCCCCSCCCO 62a_100011215043_100000033203 [1,0,0,0,0,0|2,0,1]=4 3169 B13R0.336 OCCCCCCCNCCCCF 2230a_100011996573_100000729493 [1,0,0,0,0,0|2,0,1]=4 3170 B13R0.336 OCCCCCCCNCCCCF 34a_100011996573_100000729493 [1,0,0,0,0,0|2,0,1]=4 3171 B13R0.336 OCCCCCCCNCCCCO 2230a_100000750430_100000760002 [1,0,0,0,0,0|2,0,1]=4 3172 B13R0.336 OCCCCCCCNCCCCO 2230a_100011996573_100000210776 [1,0,0,0,0,0|2,0,1]=4 3173 B13R0.336 OCCCCCCCNCCCCO 34a_100000750430_100000760002 [1,0,0,0,0,0|2,0,1]=4 3174 B13R0.336 OCCCCCCCNCCCCO 34a_100011996573_100011216708 [1,0,0,0,0,0|2,0,1]=4 3175 B13R0.336 OCCCCCCCOCCCCBr 34a_100011216708_100000760002 [1,0,0,0,0,0|2,0,1]=4 3176 B13R0.336 OCCCCCCCOCCCCCl 34a_100000210776_100000760002 [1,0,0,0,0,0|2,0,1]=4 3177 B13R0.336 OCCCCCCCOCCCCCl 7a_100000210776_100000760002 [1,0,0,0,0,0|2,0,1]=4 3178 B13R0.336 OCCCCCCCOCCCCF 34a_100011995726_100000760002 [1,0,0,0,0,0|2,0,1]=4 3179 B13R0.336 OCCCCCCCOCCCCF 7a_100011995726_100000760002 [1,0,0,0,0,0|2,0,1]=4 3180 B13R0.336 OCCCCCCCOCCCCI 34a_200012148704_100000760002 [1,0,0,0,0,0|2,0,1]=4 3181 B13R0.336 OCCCCCCCSCCCCF 62a_100000729493_100000760002 [1,0,0,0,0,0|2,0,1]=4 3182 B13R0.336 OCCCCCCCSCCCCF 62a_100000760002_100000729493 [1,0,0,0,0,0|2,0,1]=4 3183 B13R0.336 OCCCCCCCSCCCCO 62a_100000210776_100000760002 [1,0,0,0,0,0|2,0,1]=4 3184 B13R0.336 OCCCCCCCSCCCCO 62a_100000760002_100000210776 [1,0,0,0,0,0|2,0,1]=4 3185 B13R0.336 OCCCCCCNCCCCCF 2230a_100000686447_100000729378 [1,0,0,0,0,0|2,0,1]=4 3186 B13R0.336 OCCCCCCNCCCCCF 34a_100000686447_100000729378 [1,0,0,0,0,0|2,0,1]=4 3187 B13R0.336 OCCCCCCNCCCCCO 2230a_100000686447_100000746330 [1,0,0,0,0,0|2,0,1]=4 3188 B13R0.336 OCCCCCCNCCCCCO 2230a_100000762737_100000766143 [1,0,0,0,0,0|2,0,1]=4 3189 B13R0.336 OCCCCCCNCCCCCO 34a_100000686447_100000746330 [1,0,0,0,0,0|2,0,1]=4 3190 B13R0.336 OCCCCCCNCCCCCO 34a_100000762737_100000766143 [1,0,0,0,0,0|2,0,1]=4 3191 B13R0.336 OCCCCCCOCCCCCBr 34a_100000746331_100000766143 [1,0,0,0,0,0|2,0,1]=4 3192 B13R0.336 OCCCCCCOCCCCCBr 7a_100000746331_100000766143 [1,0,0,0,0,0|2,0,1]=4 3193 B13R0.336 OCCCCCCOCCCCCCl 34a_100000746330_100000766143 [1,0,0,0,0,0|2,0,1]=4 3194 B13R0.336 OCCCCCCOCCCCCCl 7a_100000746330_100000766143 [1,0,0,0,0,0|2,0,1]=4 3195 B13R0.336 OCCCCCCOCCCCCI 34a_200012148887_100000766143 [1,0,0,0,0,0|2,0,1]=4 3196 B13R0.336 OCCCCCCOCCCCCI 7a_200012148887_100000766143 [1,0,0,0,0,0|2,0,1]=4 3197 B13R0.336 OCCCCCCSCCCCCF 62a_100000729378_100000766143 [1,0,0,0,0,0|2,0,1]=4 3198 B13R0.336 OCCCCCCSCCCCCF 62a_100000766143_100000729378 [1,0,0,0,0,0|2,0,1]=4 3199 B13R0.336 OCCCCCCSCCCCCO 62a_100000746330_100000766143 [1,0,0,0,0,0|2,0,1]=4 3200 B13R0.336 OCCCCCCSCCCCCO 62a_100000766143_100000746330 [1,0,0,0,0,0|2,0,1]=4 3201 B13R0.336 OCCCCCNCCCCCCF 2230a_100000762737_100015922095 [1,0,0,0,0,0|2,0,1]=4 3202 B13R0.336 OCCCCCNCCCCCCF 34a_100000762737_100015922095 [1,0,0,0,0,0|2,0,1]=4 3203 B13R0.336 OCCCCCOCCCCCCBr 34a_100011215345_100000746330 [1,0,0,0,0,0|2,0,1]=4 3204 B13R0.336 OCCCCCOCCCCCCBr 7a_100011215345_100000746330 [1,0,0,0,0,0|2,0,1]=4 3205 B13R0.336 OCCCCCOCCCCCCCl 34a_100000766143_100000746330 [1,0,0,0,0,0|2,0,1]=4 3206 B13R0.336 OCCCCCOCCCCCCCl 7a_100000766143_100000746330 [1,0,0,0,0,0|2,0,1]=4 3207 B13R0.336 OCCCCCOCCCCCCF 34a_100000732779_100000746330 [1,0,0,0,0,0|2,0,1]=4 3208 B13R0.336 OCCCCCOCCCCCCF 7a_100000732779_100000746330 [1,0,0,0,0,0|2,0,1]=4 3209 B13R0.336 OCCCCCSCCCCCCF 62a_100000746330_100015922095 [1,0,0,0,0,0|2,0,1]=4 3210 B13R0.336 OCCCCCSCCCCCCF 62a_100015922095_100000746330 [1,0,0,0,0,0|2,0,1]=4 3211 B13R0.336 OCCCCOCCCCCCCBr 34a_100000760002_100011216708 [1,0,0,0,0,0|2,0,1]=4 3212 B13R0.336 OCCCCOCCCCCCCBr 7a_100000760002_100000210776 [1,0,0,0,0,0|2,0,1]=4 3213 B13R0.336 OCCCOCCCCCCCCBr 34a_100009813846_100000230001 [1,0,0,0,0,0|2,0,1]=4 3214 B13R0.336 OCCCOCCCCCCCCBr 7a_100009813846_100011215043 [1,0,0,0,0,0|2,0,1]=4 3215 B13R0.336 OCCCOCCCCCCCCCl 34a_100000033203_100000230001 [1,0,0,0,0,0|2,0,1]=4 3216 B13R0.336 OCCCOCCCCCCCCCl 7a_100000033203_100011215043 [1,0,0,0,0,0|2,0,1]=4 3217 B13R0.336 OCCOCCCCCCCCCBr 34a_100009813782_100000211926 [1,0,0,0,0,0|2,0,1]=4 3218 B13R0.336 OCCOCCCCCCCCCBr 7a_100009813782_100000211926 [1,0,0,0,0,0|2,0,1]=4 3219 B13R0.336 OCCOCCCCCCCCCCl 34a_100009868337_100000211926 [1,0,0,0,0,0|2,0,1]=4 3220 B13R0.336 OCCOCCCCCCCCCCl 7a_100009868337_100000211926 [1,0,0,0,0,0|2,0,1]=4 3221 B13R0.336 [13CH3]OCCCCCCCCCCCBr 34a_100009812471_200025704644 [1,0,0,0,0,0|2,0,0]=3 3222 B13R0.336 [13CH3]OCCCCCCCCCCCBr 7a_100009812471_200025704644 [1,0,0,0,0,0|2,0,0]=3 3223 B13R0.336 [13CH3]SCCCCCCCCCCCO 62a_100009812471_200025704644 [1,0,0,0,0,0|1,0,1]=3 3224 B15R0.70 C#CCCCCCCCCCCOCC=C 34a_100000054667_100015514636 [0,1,0,0,0,0|1,0,2]=4 3225 B15R0.70 C#CCCCCCCCCCCOCC=C 7a_100000054667_100015514636 [0,1,0,0,0,0|1,0,2]=4 3226 B15R0.70 C#CCCCCCCCCCCOCC=O 34a_100000054667_200009817547 [0,1,0,0,0,0|0,0,2]=3 3227 B15R0.70 C#CCCCCCCCCCCOCC=O 7a_100000054667_200015260668 [0,1,0,0,0,0|0,0,2]=3 3228 B15R0.70 C#CCCCCCCCCCCOCCC 34a_100000054667_100000210303 [0,1,0,0,0,0|1,0,1]=3 3229 B15R0.70 C#CCCCCCCCCCCOCCC 7a_100000054667_100000210303 [0,1,0,0,0,0|1,0,1]=3 3230 B15R0.70 C#CCCCCCCCCCCOCCF 34a_100000054667_100011217306 [0,1,0,0,0,0|2,0,1]=4 3231 B15R0.70 C#CCCCCCCCCCCOCCF 7a_100000054667_100011217306 [0,1,0,0,0,0|2,0,1]=4 3232 B15R0.70 C#CCCCCCCCCCCOCCO 34a_100000054667_100000211926 [0,1,0,0,0,0|2,0,1]=4 3233 B15R0.70 C#CCCCCCCCCCCOCCO 7a_100000054667_100000211926 [0,1,0,0,0,0|2,0,1]=4 3234 B15R0.70 C#CCCCCCCCCCCOCSC 34a_100000054667_100011218213 [0,1,0,0,0,0|2,0,1]=4 3235 B15R0.70 C#CCCCCCCCCCOCCC=C 34a_100000034437_100000754431 [0,1,0,0,0,0|1,0,2]=4 3236 B15R0.70 C#CCCCCCCCCCOCCC=C 7a_100000034437_100000754431 [0,1,0,0,0,0|1,0,2]=4 3237 B15R0.70 C#CCCCCCCCCCOCCCC 34a_100000034437_100000210210 [0,1,0,0,0,0|1,0,1]=3 3238 B15R0.70 C#CCCCCCCCCCOCCCC 7a_100000034437_100000210211 [0,1,0,0,0,0|1,0,1]=3 3239 B15R0.70 C#CCCCCCCCCCOCCCF 34a_100000034437_100011934791 [0,1,0,0,0,0|2,0,1]=4 3240 B15R0.70 C#CCCCCCCCCCOCCCF 7a_100000034437_100011934791 [0,1,0,0,0,0|2,0,1]=4 3241 B15R0.70 C#CCCCCCCCCCOCCCO 34a_100000034437_100000230001 [0,1,0,0,0,0|2,0,1]=4 3242 B15R0.70 C#CCCCCCCCCCOCCCO 7a_100000034437_100011215043 [0,1,0,0,0,0|2,0,1]=4 3243 B15R0.70 C#CCCCCCCCCCOCCOC 34a_100000034437_100011201679 [0,1,0,0,0,0|2,0,1]=4 3244 B15R0.70 C#CCCCCCCCCCOCCOC 7a_100000034437_100000233755 [0,1,0,0,0,0|2,0,1]=4 3245 B15R0.70 C#CCCCCCCCCCOCCSC 34a_100000034437_100000212216 [0,1,0,0,0,0|2,0,1]=4 3246 B15R0.70 C#CCCCCCCCCCOCCSC 7a_100000034437_100000212216 [0,1,0,0,0,0|2,0,1]=4 3247 B15R0.70 C#CCCCCCCCCOCCCC=C 34a_100000065265_100000757094 [0,1,0,0,0,0|1,0,2]=4 3248 B15R0.70 C#CCCCCCCCCOCCCC=C 7a_100000065265_100000757094 [0,1,0,0,0,0|1,0,2]=4 3249 B15R0.70 C#CCCCCCCCCOCCCC=O 7a_100000065265_200011292268 [0,1,0,0,0,0|0,0,2]=3 3250 B15R0.70 C#CCCCCCCCCOCCCCC 34a_100000065265_100000718602 [0,1,0,0,0,0|1,0,1]=3 3251 B15R0.70 C#CCCCCCCCCOCCCCC 7a_100000065265_100000210326 [0,1,0,0,0,0|1,0,1]=3 3252 B15R0.70 C#CCCCCCCCCOCCCCF 34a_100000065265_100000729493 [0,1,0,0,0,0|2,0,1]=4 3253 B15R0.70 C#CCCCCCCCCOCCCCF 7a_100000065265_100000729493 [0,1,0,0,0,0|2,0,1]=4 3254 B15R0.70 C#CCCCCCCCCOCCCCO 34a_100000065265_100011216708 [0,1,0,0,0,0|2,0,1]=4 3255 B15R0.70 C#CCCCCCCCCOCCCCO 7a_100000065265_100000210776 [0,1,0,0,0,0|2,0,1]=4 3256 B15R0.70 C#CCCCCCCCCOCCCOC 34a_100000065265_100000740836 [0,1,0,0,0,0|2,0,1]=4 3257 B15R0.70 C#CCCCCCCCCOCCCOC 7a_100000065265_100000740836 [0,1,0,0,0,0|2,0,1]=4 3258 B15R0.70 C#CCCCCCCCCOCCOCC 34a_100000065265_100000210147 [0,1,0,0,0,0|2,0,1]=4 3259 B15R0.70 C#CCCCCCCCCOCCOCC 7a_100000065265_100011215890 [0,1,0,0,0,0|2,0,1]=4 3260 B15R0.70 C#CCCCCCCCCOCCSCC 34a_100000065265_100000757381 [0,1,0,0,0,0|2,0,1]=4 3261 B15R0.70 C#CCCCCCCCCOCCSCC 7a_100000065265_100000757381 [0,1,0,0,0,0|2,0,1]=4 3262 B15R0.70 C#CCCCCCCCNCCCCC=C 2230a_100000703577_100153394163 [0,1,0,0,0,0|1,0,2]=4 3263 B15R0.70 C#CCCCCCCCNCCCCC=C 34a_100000703577_100153394163 [0,1,0,0,0,0|1,0,2]=4 3264 B15R0.70 C#CCCCCCCCNCCCCCC 2230a_100000210581_100153394163 [0,1,0,0,0,0|1,0,1]=3 3265 B15R0.70 C#CCCCCCCCNCCCCCO 2230a_100000762737_100153394163 [0,1,0,0,0,0|2,0,1]=4 3266 B15R0.70 C#CCCCCCCCNCCCCCO 34a_100000762737_100153394163 [0,1,0,0,0,0|2,0,1]=4 3267 B15R0.70 C#CCCCCCCCNCCCOCC 2230a_100000210961_100153394163 [0,1,0,0,0,0|2,0,1]=4 3268 B15R0.70 C#CCCCCCCCNCCCOCC 34a_100000210961_100153394163 [0,1,0,0,0,0|2,0,1]=4 3269 B15R0.70 C#CCCCCCCCNCCOCCC 2230a_100161115042_100153394163 [0,1,0,0,0,0|2,0,1]=4 3270 B15R0.70 C#CCCCCCCCNCCOCCC 34a_100161115042_100153394163 [0,1,0,0,0,0|2,0,1]=4 3271 B15R0.70 C#CCCCCCCCNCCSCCC 2230a_100020603323_100153394163 [0,1,0,0,0,0|2,0,1]=4 3272 B15R0.70 C#CCCCCCCCOCCCCC=C 34a_100000054614_100011215482 [0,1,0,0,0,0|1,0,2]=4 3273 B15R0.70 C#CCCCCCCCOCCCCC=C 34a_100000766645_100153394163 [0,1,0,0,0,0|1,0,2]=4 3274 B15R0.70 C#CCCCCCCCOCCCCC=C 7a_100000054614_100011215482 [0,1,0,0,0,0|1,0,2]=4 3275 B15R0.70 C#CCCCCCCCOCCCCC=C 7a_100000766645_100153394163 [0,1,0,0,0,0|1,0,2]=4 3276 B15R0.70 C#CCCCCCCCOCCCCC=O 7a_100000054614_100000139335 [0,1,0,0,0,0|0,0,2]=3 3277 B15R0.70 C#CCCCCCCCOCCCCCBr 34a_100000746331_100153394163 [0,1,0,0,0,0|2,0,1]=4 3278 B15R0.70 C#CCCCCCCCOCCCCCBr 7a_100000746331_100153394163 [0,1,0,0,0,0|2,0,1]=4 3279 B15R0.70 C#CCCCCCCCOCCCCCC 34a_100000054614_100000210314 [0,1,0,0,0,0|1,0,1]=3 3280 B15R0.70 C#CCCCCCCCOCCCCCC 34a_100000210259_100153394163 [0,1,0,0,0,0|1,0,1]=3 3281 B15R0.70 C#CCCCCCCCOCCCCCC 7a_100000054614_100000210314 [0,1,0,0,0,0|1,0,1]=3 3282 B15R0.70 C#CCCCCCCCOCCCCCC 7a_100000210259_100153394163 [0,1,0,0,0,0|1,0,1]=3 3283 B15R0.70 C#CCCCCCCCOCCCCCCl 34a_100000746330_100153394163 [0,1,0,0,0,0|2,0,1]=4 3284 B15R0.70 C#CCCCCCCCOCCCCCCl 7a_100000746330_100153394163 [0,1,0,0,0,0|2,0,1]=4 3285 B15R0.70 C#CCCCCCCCOCCCCCF 34a_100000054614_100000729378 [0,1,0,0,0,0|2,0,1]=4 3286 B15R0.70 C#CCCCCCCCOCCCCCF 7a_100000054614_100000729378 [0,1,0,0,0,0|2,0,1]=4 3287 B15R0.70 C#CCCCCCCCOCCCCCI 34a_200012148887_100153394163 [0,1,0,0,0,0|2,0,1]=4 3288 B15R0.70 C#CCCCCCCCOCCCCCI 7a_200012148887_100153394163 [0,1,0,0,0,0|2,0,1]=4 3289 B15R0.70 C#CCCCCCCCOCCCCCN 34a_100000762737_100153394163 [0,1,0,0,0,0|2,0,1]=4 3290 B15R0.70 C#CCCCCCCCOCCCCCO 34a_100000054614_100000746330 [0,1,0,0,0,0|2,0,1]=4 3291 B15R0.70 C#CCCCCCCCOCCCCCO 7a_100000054614_100000746330 [0,1,0,0,0,0|2,0,1]=4 3292 B15R0.70 C#CCCCCCCCOCCCCOC 34a_100000054614_100000755781 [0,1,0,0,0,0|2,0,1]=4 3293 B15R0.70 C#CCCCCCCCOCCCCOC 34a_100000740925_100153394163 [0,1,0,0,0,0|2,0,1]=4 3294 B15R0.70 C#CCCCCCCCOCCCCOC 7a_100000054614_100000730899 [0,1,0,0,0,0|2,0,1]=4 3295 B15R0.70 C#CCCCCCCCOCCCCSC 34a_100011217163_100153394163 [0,1,0,0,0,0|2,0,1]=4 3296 B15R0.70 C#CCCCCCCCOCCCCSC 7a_100011217163_100153394163 [0,1,0,0,0,0|2,0,1]=4 3297 B15R0.70 C#CCCCCCCCOCCCOCC 34a_100000054614_100012232248 [0,1,0,0,0,0|2,0,1]=4 3298 B15R0.70 C#CCCCCCCCOCCCOCC 34a_100000757476_100153394163 [0,1,0,0,0,0|2,0,1]=4 3299 B15R0.70 C#CCCCCCCCOCCCOCC 7a_100000054614_100012232248 [0,1,0,0,0,0|2,0,1]=4 3300 B15R0.70 C#CCCCCCCCOCCCOCC 7a_100000757476_100153394163 [0,1,0,0,0,0|2,0,1]=4 3301 B15R0.70 C#CCCCCCCCOCCCSCC 34a_100011216438_100153394163 [0,1,0,0,0,0|2,0,1]=4 3302 B15R0.70 C#CCCCCCCCOCCCSCC 7a_100011216438_100153394163 [0,1,0,0,0,0|2,0,1]=4 3303 B15R0.70 C#CCCCCCCCOCCOCCC 34a_100000054614_100011215938 [0,1,0,0,0,0|2,0,1]=4 3304 B15R0.70 C#CCCCCCCCOCCOCCC 34a_100000752267_100153394163 [0,1,0,0,0,0|2,0,1]=4 3305 B15R0.70 C#CCCCCCCCOCCOCCC 7a_100000054614_100011215938 [0,1,0,0,0,0|2,0,1]=4 3306 B15R0.70 C#CCCCCCCCOCCOCCC 7a_100000752267_100153394163 [0,1,0,0,0,0|2,0,1]=4 3307 B15R0.70 C#CCCCCCCCOCCSCCC 34a_200000230433_100153394163 [0,1,0,0,0,0|2,0,1]=4 3308 B15R0.70 C#CCCCCCCCOCCSCCC 7a_200000230433_100153394163 [0,1,0,0,0,0|2,0,1]=4 3309 B15R0.70 C#CCCCCCCCOCOCCCC 34a_100000054614_100011995733 [0,1,0,0,0,0|2,0,1]=4 3310 B15R0.70 C#CCCCCCCCSCCCCC=C 62a_100011215482_100153394163 [0,1,0,0,0,0|1,0,2]=4 3311 B15R0.70 C#CCCCCCCCSCCCCC=C 62a_100153394163_100011215482 [0,1,0,0,0,0|1,0,2]=4 3312 B15R0.70 C#CCCCCCCCSCCCCC=O 62a_100000139335_100153394163 [0,1,0,0,0,0|0,0,2]=3 3313 B15R0.70 C#CCCCCCCCSCCCCC=O 62a_100153394163_100000139335 [0,1,0,0,0,0|0,0,2]=3 3314 B15R0.70 C#CCCCCCCCSCCCCCC 62a_100000210314_100153394163 [0,1,0,0,0,0|1,0,1]=3 3315 B15R0.70 C#CCCCCCCCSCCCCCC 62a_100153394163_100000210757 [0,1,0,0,0,0|1,0,1]=3 3316 B15R0.70 C#CCCCCCCCSCCCCCF 62a_100000729378_100153394163 [0,1,0,0,0,0|2,0,1]=4 3317 B15R0.70 C#CCCCCCCCSCCCCCF 62a_100153394163_100000729378 [0,1,0,0,0,0|2,0,1]=4 3318 B15R0.70 C#CCCCCCCCSCCCCCO 62a_100000746330_100153394163 [0,1,0,0,0,0|2,0,1]=4 3319 B15R0.70 C#CCCCCCCCSCCCCCO 62a_100153394163_100000746330 [0,1,0,0,0,0|2,0,1]=4 3320 B15R0.70 C#CCCCCCCCSCCCCOC 62a_100000730899_100153394163 [0,1,0,0,0,0|2,0,1]=4 3321 B15R0.70 C#CCCCCCCCSCCCCOC 62a_100153394163_100000730899 [0,1,0,0,0,0|2,0,1]=4 3322 B15R0.70 C#CCCCCCCCSCCCOCC 62a_100012232248_100153394163 [0,1,0,0,0,0|2,0,1]=4 3323 B15R0.70 C#CCCCCCCCSCCCOCC 62a_100153394163_100012232248 [0,1,0,0,0,0|2,0,1]=4 3324 B15R0.70 C#CCCCCCCCSCCOCCC 62a_100011215938_100153394163 [0,1,0,0,0,0|2,0,1]=4 3325 B15R0.70 C#CCCCCCCCSCCOCCC 62a_100153394163_100011215938 [0,1,0,0,0,0|2,0,1]=4 3326 B15R0.70 C#CCCCCCCCSCOCCCC 62a_100011995733_100153394163 [0,1,0,0,0,0|2,0,1]=4 3327 B15R0.70 C#CCCCCCCCSCOCCCC 62a_100153394163_100011995733 [0,1,0,0,0,0|2,0,1]=4 3328 B15R0.70 C#CCCCCCCNCCCCCCC 2230a_100000229938_100012276617 [0,1,0,0,0,0|1,0,1]=3 3329 B15R0.70 C#CCCCCCCNCCCCCCO 2230a_100000686447_100012276617 [0,1,0,0,0,0|2,0,1]=4 3330 B15R0.70 C#CCCCCCCNCCCCCCO 34a_100000686447_100012276617 [0,1,0,0,0,0|2,0,1]=4 3331 B15R0.70 C#CCCCCCCNCCCCCOC 2230a_100000747528_100012276617 [0,1,0,0,0,0|2,0,1]=4 3332 B15R0.70 C#CCCCCCCNCCCCCOC 34a_100000747528_100012276617 [0,1,0,0,0,0|2,0,1]=4 3333 B15R0.70 C#CCCCCCCNCCCOCCC 2230a_100011217757_100012276617 [0,1,0,0,0,0|2,0,1]=4 3334 B15R0.70 C#CCCCCCCNCCCOCCC 34a_100011217757_100012276617 [0,1,0,0,0,0|2,0,1]=4 3335 B15R0.70 C#CCCCCCCNCCSCCCC 2230a_100025743550_100012276617 [0,1,0,0,0,0|2,0,1]=4 3336 B15R0.70 C#CCCCCCCOCCCCCC=C 34a_100011216702_100012276617 [0,1,0,0,0,0|1,0,2]=4 3337 B15R0.70 C#CCCCCCCOCCCCCC=C 34a_100011217361_100000700193 [0,1,0,0,0,0|1,0,2]=4 3338 B15R0.70 C#CCCCCCCOCCCCCC=C 7a_100011216702_100012276617 [0,1,0,0,0,0|1,0,2]=4 3339 B15R0.70 C#CCCCCCCOCCCCCC=C 7a_100011217361_100000700193 [0,1,0,0,0,0|1,0,2]=4 3340 B15R0.70 C#CCCCCCCOCCCCCC=O 7a_100011217361_100000139337 [0,1,0,0,0,0|0,0,2]=3 3341 B15R0.70 C#CCCCCCCOCCCCCCBr 34a_100011215345_100012276617 [0,1,0,0,0,0|2,0,1]=4 3342 B15R0.70 C#CCCCCCCOCCCCCCBr 7a_100011215345_100012276617 [0,1,0,0,0,0|2,0,1]=4 3343 B15R0.70 C#CCCCCCCOCCCCCCC 34a_100000210272_100012276617 [0,1,0,0,0,0|1,0,1]=3 3344 B15R0.70 C#CCCCCCCOCCCCCCC 34a_100011217361_100000210614 [0,1,0,0,0,0|1,0,1]=3 3345 B15R0.70 C#CCCCCCCOCCCCCCC 7a_100000210272_100012276617 [0,1,0,0,0,0|1,0,1]=3 3346 B15R0.70 C#CCCCCCCOCCCCCCC 7a_100011217361_100000210614 [0,1,0,0,0,0|1,0,1]=3 3347 B15R0.70 C#CCCCCCCOCCCCCCCl 34a_100000766143_100012276617 [0,1,0,0,0,0|2,0,1]=4 3348 B15R0.70 C#CCCCCCCOCCCCCCCl 7a_100000766143_100012276617 [0,1,0,0,0,0|2,0,1]=4 3349 B15R0.70 C#CCCCCCCOCCCCCCF 34a_100000732779_100012276617 [0,1,0,0,0,0|2,0,1]=4 3350 B15R0.70 C#CCCCCCCOCCCCCCF 34a_100011217361_100015922095 [0,1,0,0,0,0|2,0,1]=4 3351 B15R0.70 C#CCCCCCCOCCCCCCF 7a_100000732779_100012276617 [0,1,0,0,0,0|2,0,1]=4 3352 B15R0.70 C#CCCCCCCOCCCCCCF 7a_100011217361_100015922095 [0,1,0,0,0,0|2,0,1]=4 3353 B15R0.70 C#CCCCCCCOCCCCCCN 34a_100000686447_100012276617 [0,1,0,0,0,0|2,0,1]=4 3354 B15R0.70 C#CCCCCCCOCCCCCCO 34a_100011217361_100000766143 [0,1,0,0,0,0|2,0,1]=4 3355 B15R0.70 C#CCCCCCCOCCCCCCO 7a_100011217361_100000766143 [0,1,0,0,0,0|2,0,1]=4 3356 B15R0.70 C#CCCCCCCOCCCCCNC 34a_100000722520_100012276617 [0,1,0,0,0,0|2,0,1]=4 3357 B15R0.70 C#CCCCCCCOCCOCCCC 34a_100000210238_100012276617 [0,1,0,0,0,0|2,0,1]=4 3358 B15R0.70 C#CCCCCCCOCCOCCCC 34a_100011217361_100000743108 [0,1,0,0,0,0|2,0,1]=4 3359 B15R0.70 C#CCCCCCCOCCOCCCC 7a_100000210238_100012276617 [0,1,0,0,0,0|2,0,1]=4 3360 B15R0.70 C#CCCCCCCOCCOCCCC 7a_100011217361_100000743108 [0,1,0,0,0,0|2,0,1]=4 3361 B15R0.70 C#CCCCCCCOCCSCCCC 34a_200000230436_100012276617 [0,1,0,0,0,0|2,0,1]=4 3362 B15R0.70 C#CCCCCCCOCCSCCCC 7a_200000230436_100012276617 [0,1,0,0,0,0|2,0,1]=4 3363 B15R0.70 C#CCCCCCCSCCCCCC=C 62a_100000700193_100012276617 [0,1,0,0,0,0|1,0,2]=4 3364 B15R0.70 C#CCCCCCCSCCCCCC=C 62a_100012276617_100000700193 [0,1,0,0,0,0|1,0,2]=4 3365 B15R0.70 C#CCCCCCCSCCCCCC=O 62a_100000139337_100012276617 [0,1,0,0,0,0|0,0,2]=3 3366 B15R0.70 C#CCCCCCCSCCCCCC=O 62a_100012276617_100000139337 [0,1,0,0,0,0|0,0,2]=3 3367 B15R0.70 C#CCCCCCCSCCCCCCC 62a_100000210614_100012276617 [0,1,0,0,0,0|1,0,1]=3 3368 B15R0.70 C#CCCCCCCSCCCCCCC 62a_100012276617_100000210316 [0,1,0,0,0,0|1,0,1]=3 3369 B15R0.70 C#CCCCCCCSCCCCCCF 62a_100012276617_100015922095 [0,1,0,0,0,0|2,0,1]=4 3370 B15R0.70 C#CCCCCCCSCCCCCCF 62a_100015922095_100012276617 [0,1,0,0,0,0|2,0,1]=4 3371 B15R0.70 C#CCCCCCCSCCCCCCO 62a_100000766143_100012276617 [0,1,0,0,0,0|2,0,1]=4 3372 B15R0.70 C#CCCCCCCSCCCCCCO 62a_100012276617_100000766143 [0,1,0,0,0,0|2,0,1]=4 3373 B15R0.70 C#CCCCCCCSCCOCCCC 62a_100000743108_100012276617 [0,1,0,0,0,0|2,0,1]=4 3374 B15R0.70 C#CCCCCCCSCCOCCCC 62a_100012276617_100000743108 [0,1,0,0,0,0|2,0,1]=4 3375 B15R0.70 C#CCCCCCNCCCCCCCC 2230a_100000229939_100012094781 [0,1,0,0,0,0|1,0,1]=3 3376 B15R0.70 C#CCCCCCNCCCCCCCC 34a_100000229939_100012094781 [0,1,0,0,0,0|1,0,1]=3 3377 B15R0.70 C#CCCCCCNCCCCCCCO 2230a_100011996573_100012094781 [0,1,0,0,0,0|2,0,1]=4 3378 B15R0.70 C#CCCCCCNCCCCCCCO 34a_100011996573_100012094781 [0,1,0,0,0,0|2,0,1]=4 3379 B15R0.70 C#CCCCCCNCCCOCCCC 2230a_200000211371_100012094781 [0,1,0,0,0,0|2,0,1]=4 3380 B15R0.70 C#CCCCCCNCCCOCCCC 34a_200000211371_100012094781 [0,1,0,0,0,0|2,0,1]=4 3381 B15R0.70 C#CCCCCCOCCCCCCC=C 34a_100000766912_100011215473 [0,1,0,0,0,0|1,0,2]=4 3382 B15R0.70 C#CCCCCCOCCCCCCC=C 34a_200011216477_100012094781 [0,1,0,0,0,0|1,0,2]=4 3383 B15R0.70 C#CCCCCCOCCCCCCC=C 7a_100000766912_100011215473 [0,1,0,0,0,0|1,0,2]=4 3384 B15R0.70 C#CCCCCCOCCCCCCC=C 7a_200011216477_100012094781 [0,1,0,0,0,0|1,0,2]=4 3385 B15R0.70 C#CCCCCCOCCCCCCCBr 34a_100000760002_100012094781 [0,1,0,0,0,0|2,0,1]=4 3386 B15R0.70 C#CCCCCCOCCCCCCCBr 7a_100000760002_100012094781 [0,1,0,0,0,0|2,0,1]=4 3387 B15R0.70 C#CCCCCCOCCCCCCCC 34a_100000210232_100012094781 [0,1,0,0,0,0|1,0,1]=3 3388 B15R0.70 C#CCCCCCOCCCCCCCC 34a_100000766912_100000210759 [0,1,0,0,0,0|1,0,1]=3 3389 B15R0.70 C#CCCCCCOCCCCCCCC 7a_100000210232_100012094781 [0,1,0,0,0,0|1,0,1]=3 3390 B15R0.70 C#CCCCCCOCCCCCCCC 7a_100000766912_100000210759 [0,1,0,0,0,0|1,0,1]=3 3391 B15R0.70 C#CCCCCCOCCCCCCCN 34a_100011996573_100012094781 [0,1,0,0,0,0|2,0,1]=4 3392 B15R0.70 C#CCCCCCOCCCCCCCO 34a_100000766912_100000760002 [0,1,0,0,0,0|2,0,1]=4 3393 B15R0.70 C#CCCCCCOCCCCCCCO 7a_100000766912_100000760002 [0,1,0,0,0,0|2,0,1]=4 3394 B15R0.70 C#CCCCCCOCCCCCCOC 34a_100000766912_100011998445 [0,1,0,0,0,0|2,0,1]=4 3395 B15R0.70 C#CCCCCCOCCCCCCOC 34a_200012092642_100012094781 [0,1,0,0,0,0|2,0,1]=4 3396 B15R0.70 C#CCCCCCOCCCCCCOC 7a_100000766912_100011998445 [0,1,0,0,0,0|2,0,1]=4 3397 B15R0.70 C#CCCCCCOCCCCCCOC 7a_200012092642_100012094781 [0,1,0,0,0,0|2,0,1]=4 3398 B15R0.70 C#CCCCCCOCCCOCCCC 34a_200011215613_100012094781 [0,1,0,0,0,0|2,0,1]=4 3399 B15R0.70 C#CCCCCCOCCCOCCCC 7a_200011215613_100012094781 [0,1,0,0,0,0|2,0,1]=4 3400 B15R0.70 C#CCCCCCOCCNCCCCC 34a_100000224656_100012094781 [0,1,0,0,0,0|2,0,1]=4 3401 B15R0.70 C#CCCCCCOCCOCCCCC 34a_100011215259_100012094781 [0,1,0,0,0,0|2,0,1]=4 3402 B15R0.70 C#CCCCCCOCCOCCCCC 7a_100011215259_100012094781 [0,1,0,0,0,0|2,0,1]=4 3403 B15R0.70 C#CCCCCCSCCCCCCC=C 62a_100011215473_100012094781 [0,1,0,0,0,0|1,0,2]=4 3404 B15R0.70 C#CCCCCCSCCCCCCC=C 62a_100012094781_100011215473 [0,1,0,0,0,0|1,0,2]=4 3405 B15R0.70 C#CCCCCCSCCCCCCCC 62a_100000210759_100012094781 [0,1,0,0,0,0|1,0,1]=3 3406 B15R0.70 C#CCCCCCSCCCCCCCC 62a_100012094781_100000210317 [0,1,0,0,0,0|1,0,1]=3 3407 B15R0.70 C#CCCCCCSCCCCCCCO 62a_100000760002_100012094781 [0,1,0,0,0,0|2,0,1]=4 3408 B15R0.70 C#CCCCCCSCCCCCCCO 62a_100012094781_100000760002 [0,1,0,0,0,0|2,0,1]=4 3409 B15R0.70 C#CCCCCCSCCCCCCOC 62a_100011998445_100012094781 [0,1,0,0,0,0|2,0,1]=4 3410 B15R0.70 C#CCCCCCSCCCCCCOC 62a_100012094781_100011998445 [0,1,0,0,0,0|2,0,1]=4 3411 B15R0.70 C#CCCCCNCCCCCCCC=C 2230a_100000706060_100012355270 [0,1,0,0,0,0|1,0,2]=4 3412 B15R0.70 C#CCCCCNCCCCCCCC=C 34a_100000706060_100012355270 [0,1,0,0,0,0|1,0,2]=4 3413 B15R0.70 C#CCCCCNCCCCCCCCC 2230a_100000212291_100010269958 [0,1,0,0,0,0|1,0,1]=3 3414 B15R0.70 C#CCCCCNCCCCCCCCC 2230a_100000706060_100011214924 [0,1,0,0,0,0|1,0,1]=3 3415 B15R0.70 C#CCCCCNCCCCCCCCC 34a_100000212291_100010269958 [0,1,0,0,0,0|1,0,1]=3 3416 B15R0.70 C#CCCCCNCCCCCCCCC 34a_100000706060_100011214924 [0,1,0,0,0,0|1,0,1]=3 3417 B15R0.70 C#CCCCCNCCCCCCCCO 2230a_100000706060_100000033203 [0,1,0,0,0,0|2,0,1]=4 3418 B15R0.70 C#CCCCCNCCCCCCCCO 2230a_102515433106_100010269958 [0,1,0,0,0,0|2,0,1]=4 3419 B15R0.70 C#CCCCCNCCCCCCCCO 34a_100000706060_100000033203 [0,1,0,0,0,0|2,0,1]=4 3420 B15R0.70 C#CCCCCNCCCCCCCCO 34a_102515433106_100010269958 [0,1,0,0,0,0|2,0,1]=4 3421 B15R0.70 C#CCCCCOCCCCCCCC=C 34a_100000730831_100010269958 [0,1,0,0,0,0|1,0,2]=4 3422 B15R0.70 C#CCCCCOCCCCCCCC=C 34a_100000766709_100012355270 [0,1,0,0,0,0|1,0,2]=4 3423 B15R0.70 C#CCCCCOCCCCCCCC=C 7a_100000730831_100010269958 [0,1,0,0,0,0|1,0,2]=4 3424 B15R0.70 C#CCCCCOCCCCCCCC=C 7a_100000766709_100012355270 [0,1,0,0,0,0|1,0,2]=4 3425 B15R0.70 C#CCCCCOCCCCCCCCBr 34a_100009813846_100010269958 [0,1,0,0,0,0|2,0,1]=4 3426 B15R0.70 C#CCCCCOCCCCCCCCBr 7a_100009813846_100010269958 [0,1,0,0,0,0|2,0,1]=4 3427 B15R0.70 C#CCCCCOCCCCCCCCC 34a_100000210712_100010269958 [0,1,0,0,0,0|1,0,1]=3 3428 B15R0.70 C#CCCCCOCCCCCCCCC 34a_100000766709_100011214924 [0,1,0,0,0,0|1,0,1]=3 3429 B15R0.70 C#CCCCCOCCCCCCCCC 7a_100000210712_100010269958 [0,1,0,0,0,0|1,0,1]=3 3430 B15R0.70 C#CCCCCOCCCCCCCCC 7a_100000766709_100000210328 [0,1,0,0,0,0|1,0,1]=3 3431 B15R0.70 C#CCCCCOCCCCCCCCCl 34a_100000033203_100010269958 [0,1,0,0,0,0|2,0,1]=4 3432 B15R0.70 C#CCCCCOCCCCCCCCCl 7a_100000033203_100010269958 [0,1,0,0,0,0|2,0,1]=4 3433 B15R0.70 C#CCCCCOCCCCCCCCN 34a_102515433106_100010269958 [0,1,0,0,0,0|2,0,1]=4 3434 B15R0.70 C#CCCCCOCCCCCCCCO 34a_100000766709_100000033203 [0,1,0,0,0,0|2,0,1]=4 3435 B15R0.70 C#CCCCCOCCCCCCCCO 7a_100000766709_100000033203 [0,1,0,0,0,0|2,0,1]=4 3436 B15R0.70 C#CCCCCOCCCCNCCCC 34a_200011216965_100010269958 [0,1,0,0,0,0|2,0,1]=4 3437 B15R0.70 C#CCCCCOCCCCOCCCC 34a_200000760531_100010269958 [0,1,0,0,0,0|2,0,1]=4 3438 B15R0.70 C#CCCCCOCCCCOCCCC 7a_200000760531_100010269958 [0,1,0,0,0,0|2,0,1]=4 3439 B15R0.70 C#CCCCCOCCOCCCCCC 34a_100000691444_100010269958 [0,1,0,0,0,0|2,0,1]=4 3440 B15R0.70 C#CCCCCOCCOCCCCCC 7a_100000691444_100010269958 [0,1,0,0,0,0|2,0,1]=4 3441 B15R0.70 C#CCCCCSCCCCCCCC=C 62a_100010269958_100012355270 [0,1,0,0,0,0|1,0,2]=4 3442 B15R0.70 C#CCCCCSCCCCCCCC=C 62a_100012355270_100010269958 [0,1,0,0,0,0|1,0,2]=4 3443 B15R0.70 C#CCCCCSCCCCCCCCC 62a_100010269958_100000210670 [0,1,0,0,0,0|1,0,1]=3 3444 B15R0.70 C#CCCCCSCCCCCCCCO 62a_100000033203_100010269958 [0,1,0,0,0,0|2,0,1]=4 3445 B15R0.70 C#CCCCCSCCCCCCCCO 62a_100010269958_100000033203 [0,1,0,0,0,0|2,0,1]=4 3446 B15R0.70 C#CCCCNCCCCCCCCC=C 34a_100000718082_100011933949 [0,1,0,0,0,0|1,0,2]=4 3447 B15R0.70 C#CCCCNCCCCCCCCCC 2230a_100000684558_100000731252 [0,1,0,0,0,0|1,0,1]=3 3448 B15R0.70 C#CCCCNCCCCCCCCCC 34a_100000684558_100000695029 [0,1,0,0,0,0|1,0,1]=3 3449 B15R0.70 C#CCCCNCCCCCCCCCC 34a_100000718082_100000210320 [0,1,0,0,0,0|1,0,1]=3 3450 B15R0.70 C#CCCCNCCCCCCCCCO 2230a_100000078944_100000731252 [0,1,0,0,0,0|2,0,1]=4 3451 B15R0.70 C#CCCCNCCCCCCCCCO 34a_100000078944_100000695029 [0,1,0,0,0,0|2,0,1]=4 3452 B15R0.70 C#CCCCNCCCCCCCCCO 34a_100000718082_100009813782 [0,1,0,0,0,0|2,0,1]=4 3453 B15R0.70 C#CCCCOCCCCCCCCC=C 34a_100000215630_100011933949 [0,1,0,0,0,0|1,0,2]=4 3454 B15R0.70 C#CCCCOCCCCCCCCC=C 34a_100011215194_100000695029 [0,1,0,0,0,0|1,0,2]=4 3455 B15R0.70 C#CCCCOCCCCCCCCC=C 7a_100000215630_100011933949 [0,1,0,0,0,0|1,0,2]=4 3456 B15R0.70 C#CCCCOCCCCCCCCC=C 7a_100011215194_100011215417 [0,1,0,0,0,0|1,0,2]=4 3457 B15R0.70 C#CCCCOCCCCCCCCCBr 34a_100009813782_100000695029 [0,1,0,0,0,0|2,0,1]=4 3458 B15R0.70 C#CCCCOCCCCCCCCCBr 7a_100009813782_100011215417 [0,1,0,0,0,0|2,0,1]=4 3459 B15R0.70 C#CCCCOCCCCCCCCCC 34a_100000210711_100000695029 [0,1,0,0,0,0|1,0,1]=3 3460 B15R0.70 C#CCCCOCCCCCCCCCC 34a_100000215630_100000210320 [0,1,0,0,0,0|1,0,1]=3 3461 B15R0.70 C#CCCCOCCCCCCCCCC 7a_100000210711_100011215417 [0,1,0,0,0,0|1,0,1]=3 3462 B15R0.70 C#CCCCOCCCCCCCCCC 7a_100000215630_100000210320 [0,1,0,0,0,0|1,0,1]=3 3463 B15R0.70 C#CCCCOCCCCCCCCCCl 34a_100009868337_100000695029 [0,1,0,0,0,0|2,0,1]=4 3464 B15R0.70 C#CCCCOCCCCCCCCCCl 7a_100009868337_100011215417 [0,1,0,0,0,0|2,0,1]=4 3465 B15R0.70 C#CCCCOCCCCCCCCCN 34a_100000078944_100000695029 [0,1,0,0,0,0|2,0,1]=4 3466 B15R0.70 C#CCCCOCCCCCCCCCO 34a_100000215630_100009813782 [0,1,0,0,0,0|2,0,1]=4 3467 B15R0.70 C#CCCCOCCCCCCCCCO 7a_100000215630_100009813782 [0,1,0,0,0,0|2,0,1]=4 3468 B15R0.70 C#CCCCSCCCCCCCCC=C 62a_100011215417_100011933949 [0,1,0,0,0,0|1,0,2]=4 3469 B15R0.70 C#CCCCSCCCCCCCCC=C 62a_100011933949_100011215417 [0,1,0,0,0,0|1,0,2]=4 3470 B15R0.70 C#CCCCSCCCCCCCCCC 62a_100011215417_100000210320 [0,1,0,0,0,0|1,0,1]=3 3471 B15R0.70 C#CCCCSCCCCCCCCCO 62a_100009813782_100011215417 [0,1,0,0,0,0|2,0,1]=4 3472 B15R0.70 C#CCCCSCCCCCCCCCO 62a_100011215417_100009813782 [0,1,0,0,0,0|2,0,1]=4 3473 B15R0.70 C#CCCNCCCCCCCCCC=C 2230a_100000081888_100000688953 [0,1,0,0,0,0|1,0,2]=4 3474 B15R0.70 C#CCCNCCCCCCCCCC=C 34a_100000081888_100000688953 [0,1,0,0,0,0|1,0,2]=4 3475 B15R0.70 C#CCCNCCCCCCCCCC=C 34a_100000755551_100009814027 [0,1,0,0,0,0|1,0,2]=4 3476 B15R0.70 C#CCCNCCCCCCCCCCC 2230a_200011215754_100000688953 [0,1,0,0,0,0|1,0,1]=3 3477 B15R0.70 C#CCCNCCCCCCCCCCC 34a_100000755551_100011215454 [0,1,0,0,0,0|1,0,1]=3 3478 B15R0.70 C#CCCNCCCCCCCCCCC 34a_200011215754_100000688953 [0,1,0,0,0,0|1,0,1]=3 3479 B15R0.70 C#CCCNCCCCCCCCCCO 2230a_100000066964_100000688953 [0,1,0,0,0,0|2,0,1]=4 3480 B15R0.70 C#CCCNCCCCCCCCCCO 34a_100000066964_100000688953 [0,1,0,0,0,0|2,0,1]=4 3481 B15R0.70 C#CCCNCCCCCCCCCCO 34a_100000755551_100009813290 [0,1,0,0,0,0|2,0,1]=4 3482 B15R0.70 C#CCCOCCCCCCCCCC=C 34a_100000038209_100000688953 [0,1,0,0,0,0|1,0,2]=4 3483 B15R0.70 C#CCCOCCCCCCCCCC=C 34a_100011215631_100009814027 [0,1,0,0,0,0|1,0,2]=4 3484 B15R0.70 C#CCCOCCCCCCCCCC=C 7a_100000038209_100000688953 [0,1,0,0,0,0|1,0,2]=4 3485 B15R0.70 C#CCCOCCCCCCCCCCBr 34a_100009813290_100000688953 [0,1,0,0,0,0|2,0,1]=4 3486 B15R0.70 C#CCCOCCCCCCCCCCBr 7a_100009813290_100000688953 [0,1,0,0,0,0|2,0,1]=4 3487 B15R0.70 C#CCCOCCCCCCCCCCC 34a_100000210809_100000688953 [0,1,0,0,0,0|1,0,1]=3 3488 B15R0.70 C#CCCOCCCCCCCCCCC 34a_100011215631_100011215454 [0,1,0,0,0,0|1,0,1]=3 3489 B15R0.70 C#CCCOCCCCCCCCCCC 7a_100000210809_100000688953 [0,1,0,0,0,0|1,0,1]=3 3490 B15R0.70 C#CCCOCCCCCCCCCCCl 34a_200000033068_100000688953 [0,1,0,0,0,0|2,0,1]=4 3491 B15R0.70 C#CCCOCCCCCCCCCCCl 7a_200000033068_100000688953 [0,1,0,0,0,0|2,0,1]=4 3492 B15R0.70 C#CCCOCCCCCCCCCCN 34a_100000066964_100000688953 [0,1,0,0,0,0|2,0,1]=4 3493 B15R0.70 C#CCCOCCCCCCCCCCO 34a_100011215631_100009813290 [0,1,0,0,0,0|2,0,1]=4 3494 B15R0.70 C#CCCSCCCCCCCCCC=C 62a_100000688953_100009814027 [0,1,0,0,0,0|1,0,2]=4 3495 B15R0.70 C#CCCSCCCCCCCCCC=C 62a_100009814027_100000688953 [0,1,0,0,0,0|1,0,2]=4 3496 B15R0.70 C#CCCSCCCCCCCCCCC 62a_100000688953_100011215454 [0,1,0,0,0,0|1,0,1]=3 3497 B15R0.70 C#CCCSCCCCCCCCCCO 62a_100000688953_200000033068 [0,1,0,0,0,0|2,0,1]=4 3498 B15R0.70 C#CCCSCCCCCCCCCCO 62a_100009813290_100000688953 [0,1,0,0,0,0|2,0,1]=4 3499 B15R0.70 C#CCNCCCCCCCCCCC=C 34a_100000212058_100011093070 [0,1,0,0,0,0|1,0,2]=4 3500 B15R0.70 C#CCNCCCCCCCCCCCC 2230a_100000210451_100000038162 [0,1,0,0,0,0|1,0,1]=3 3501 B15R0.70 C#CCNCCCCCCCCCCCC 34a_100000210451_100000184674 [0,1,0,0,0,0|1,0,1]=3 3502 B15R0.70 C#CCNCCCCCCCCCCCC 34a_100000212058_100000759014 [0,1,0,0,0,0|1,0,1]=3 3503 B15R0.70 C#CCNCCCCCCCCCCCO 34a_100000212058_100009812471 [0,1,0,0,0,0|2,0,1]=4 3504 B15R0.70 C#CCOCCCCCCCCCCC=C 34a_100000210247_100011093070 [0,1,0,0,0,0|1,0,2]=4 3505 B15R0.70 C#CCOCCCCCCCCCCCBr 34a_100009812471_100000184674 [0,1,0,0,0,0|2,0,1]=4 3506 B15R0.70 C#CCOCCCCCCCCCCCBr 7a_100009812471_100000038162 [0,1,0,0,0,0|2,0,1]=4 3507 B15R0.70 C#CCOCCCCCCCCCCCC 34a_100000210247_100000759014 [0,1,0,0,0,0|1,0,1]=3 3508 B15R0.70 C#CCOCCCCCCCCCCCC 34a_100000210810_100000184674 [0,1,0,0,0,0|1,0,1]=3 3509 B15R0.70 C#CCOCCCCCCCCCCCC 7a_100000210810_100000038162 [0,1,0,0,0,0|1,0,1]=3 3510 B15R0.70 C#CCOCCCCCCCCCCCO 34a_100000210247_100009812471 [0,1,0,0,0,0|2,0,1]=4 3511 B15R0.70 C#CCOCCCCCCCCCOCC 34a_100009875440_100000184674 [0,1,0,0,0,0|2,0,1]=4 3512 B15R0.70 C#CCOCCCCCCCCCOCC 7a_100009875440_100000038162 [0,1,0,0,0,0|2,0,1]=4 3513 B15R0.70 C#CCOCCCCCCOCCCC=O 7a_200011021349_200011292268 [0,1,0,0,0,0|1,0,2]=4 3514 B15R0.70 C#CCOCCCCCCOCCCCC 34a_200011021349_100000718602 [0,1,0,0,0,0|2,0,1]=4 3515 B15R0.70 C#CCOCCCCCCOCCCCC 7a_200011021349_100000210326 [0,1,0,0,0,0|2,0,1]=4 3516 B15R0.70 C#CCOCCNCCCCCCCCC 2230a_100000212291_100010402529 [0,1,0,0,0,0|2,0,1]=4 3517 B15R0.70 C#CCOCCNCCCCCCCCC 2230a_100000700922_100011214924 [0,1,0,0,0,0|2,0,1]=4 3518 B15R0.70 C#CCOCCNCCCCCCCCC 34a_100000212291_100010402529 [0,1,0,0,0,0|2,0,1]=4 3519 B15R0.70 C#CCOCCNCCCCCCCCC 34a_100000700922_100011214924 [0,1,0,0,0,0|2,0,1]=4 3520 B15R0.70 C#CCOCCOCCCCCCCCC 34a_100000054580_100011214924 [0,1,0,0,0,0|2,0,1]=4 3521 B15R0.70 C#CCOCCOCCCCCCCCC 34a_100000210712_100010402529 [0,1,0,0,0,0|2,0,1]=4 3522 B15R0.70 C#CCOCCOCCCCCCCCC 7a_100000054580_100000210328 [0,1,0,0,0,0|2,0,1]=4 3523 B15R0.70 C#CCOCCOCCCCCCCCC 7a_100000210712_100010402529 [0,1,0,0,0,0|2,0,1]=4 3524 B15R0.70 C#CCOCCSCCCCCCCCC 62a_100010402529_100000210670 [0,1,0,0,0,0|2,0,1]=4 3525 B15R0.70 C#CCSCCCCCCCCCCC=C 62a_100000038162_100011093070 [0,1,0,0,0,0|1,0,2]=4 3526 B15R0.70 C#CCSCCCCCCCCCCCC 62a_100000038162_100000759014 [0,1,0,0,0,0|1,0,1]=3 3527 B15R0.70 C/C=C/CCOCCCCCCCCCC 34a_100016278192_100000210320 [0,1,0,0,0,0|1,0,1]=3 3528 B15R0.70 C/C=C/CCOCCCCCCCCCO 34a_100016278192_100009813782 [0,1,0,0,0,0|2,0,1]=4 3529 B15R0.70 C/C=C/CNCCCCCCCCCCC 34a_200011215754_100102629194 [0,1,0,0,0,0|1,0,1]=3 3530 B15R0.70 C/C=C/CNCCCCCCCCCCO 34a_100000066964_100102629194 [0,1,0,0,0,0|2,0,1]=4 3531 B15R0.70 C/C=C/COCCCCCCCCCCBr 34a_100009813290_100102629194 [0,1,0,0,0,0|2,0,1]=4 3532 B15R0.70 C/C=C/COCCCCCCCCCCBr 7a_100009813290_100102629194 [0,1,0,0,0,0|2,0,1]=4 3533 B15R0.70 C/C=C/COCCCCCCCCCCC 34a_100000210809_100102629194 [0,1,0,0,0,0|1,0,1]=3 3534 B15R0.70 C/C=C/COCCCCCCCCCCC 34a_100016270725_100011215454 [0,1,0,0,0,0|1,0,1]=3 3535 B15R0.70 C/C=C/COCCCCCCCCCCC 7a_100000210809_100102629194 [0,1,0,0,0,0|1,0,1]=3 3536 B15R0.70 C/C=C/COCCCCCCCCCCCl 34a_200000033068_100102629194 [0,1,0,0,0,0|2,0,1]=4 3537 B15R0.70 C/C=C/COCCCCCCCCCCCl 7a_200000033068_100102629194 [0,1,0,0,0,0|2,0,1]=4 3538 B15R0.70 C/C=C/COCCCCCCCCCCN 34a_100000066964_100102629194 [0,1,0,0,0,0|2,0,1]=4 3539 B15R0.70 C/C=C/COCCCCCCCCCCO 34a_100016270725_100009813290 [0,1,0,0,0,0|2,0,1]=4 3540 B15R0.70 C/C=C/CSCCCCCCCCCCC 62a_100102629194_100011215454 [0,1,0,0,0,0|1,0,1]=3 3541 B15R0.70 C/C=C/CSCCCCCCCCCCO 62a_100009813290_100102629194 [0,1,0,0,0,0|2,0,1]=4 3542 B15R0.70 C/C=C/CSCCCCCCCCCCO 62a_100102629194_200000033068 [0,1,0,0,0,0|2,0,1]=4 3543 B15R0.70 C=CCCC/C=C/COCCCCCCC 34a_200016268473_100000210614 [0,1,0,0,0,0|1,0,2]=4 3544 B15R0.70 C=CCCC/C=C/COCCCCCCC 7a_200016268473_100000210614 [0,1,0,0,0,0|1,0,2]=4 3545 B15R0.70 C=CCCCCCCCCC=NNCCC 4a_100000740057_100000039675 [0,1,0,0,0,0|2,0,1]=4 3546 B15R0.70 C=CCCCCCCCCCCCNCC 2230a_100015525214_102130925996 [0,1,0,0,0,0|1,0,0]=2 3547 B15R0.70 C=CCCCCCCCCCCCOCC 34a_100121572206_102130925996 [0,1,0,0,0,0|1,0,0]=2 3548 B15R0.70 C=CCCCCCCCCCCCSCC 62a_100000210202_102130925996 [0,1,0,0,0,0|1,0,0]=2 3549 B15R0.70 C=CCCCCCCCCCCCSCC 62a_102130925996_100000210202 [0,1,0,0,0,0|1,0,0]=2 3550 B15R0.70 C=CCCCCCCCCCCCSCF 62a_100015361967_102130925996 [0,1,0,0,0,0|2,0,0]=3 3551 B15R0.70 C=CCCCCCCCCCCCSCF 62a_102130925996_100015361967 [0,1,0,0,0,0|2,0,0]=3 3552 B15R0.70 C=CCCCCCCCCCCNCC=C 2230a_100020586998_100011093070 [0,1,0,0,0,0|1,0,2]=4 3553 B15R0.70 C=CCCCCCCCCCCNCCF 34a_100000724931_100011093070 [0,1,0,0,0,0|2,0,0]=3 3554 B15R0.70 C=CCCCCCCCCCCNCCO 2230a_100016997473_100011093070 [0,1,0,0,0,0|2,0,0]=3 3555 B15R0.70 C=CCCCCCCCCCCNCCO 34a_100016990907_100011093070 [0,1,0,0,0,0|2,0,0]=3 3556 B15R0.70 C=CCCCCCCCCCCOCC=C 34a_200000210373_100011093070 [0,1,0,0,0,0|1,0,2]=4 3557 B15R0.70 C=CCCCCCCCCCCOCCBr 34a_100000211926_100011093070 [0,1,0,0,0,0|2,0,0]=3 3558 B15R0.70 C=CCCCCCCCCCCOCCC 34a_100000210258_100011093070 [0,1,0,0,0,0|1,0,0]=2 3559 B15R0.70 C=CCCCCCCCCCCOCCN 34a_100000210304_100011093070 [0,1,0,0,0,0|2,0,0]=3 3560 B15R0.70 C=CCCCCCCCCCCSCC#N 62a_100011093070_100011215382 [0,1,0,0,0,0|2,0,1]=4 3561 B15R0.70 C=CCCCCCCCCCCSCC#N 62a_100011215382_100011093070 [0,1,0,0,0,0|2,0,1]=4 3562 B15R0.70 C=CCCCCCCCCCCSCC=C 62a_100000210623_100011093070 [0,1,0,0,0,0|1,0,2]=4 3563 B15R0.70 C=CCCCCCCCCCCSCC=C 62a_100011093070_100000210623 [0,1,0,0,0,0|1,0,2]=4 3564 B15R0.70 C=CCCCCCCCCCCSCC=O 62a_100011093070_200015260668 [0,1,0,0,0,0|0,0,2]=3 3565 B15R0.70 C=CCCCCCCCCCCSCC=O 62a_200015260668_100011093070 [0,1,0,0,0,0|0,0,2]=3 3566 B15R0.70 C=CCCCCCCCCCCSCCC 62a_100000210303_100011093070 [0,1,0,0,0,0|1,0,0]=2 3567 B15R0.70 C=CCCCCCCCCCCSCCC 62a_100011093070_100000210303 [0,1,0,0,0,0|1,0,0]=2 3568 B15R0.70 C=CCCCCCCCCCCSCCF 62a_100011093070_100011217306 [0,1,0,0,0,0|2,0,0]=3 3569 B15R0.70 C=CCCCCCCCCCCSCCF 62a_100011217306_100011093070 [0,1,0,0,0,0|2,0,0]=3 3570 B15R0.70 C=CCCCCCCCCCCSCCO 62a_100000211926_100011093070 [0,1,0,0,0,0|2,0,0]=3 3571 B15R0.70 C=CCCCCCCCCCCSCCO 62a_100011093070_100000211926 [0,1,0,0,0,0|2,0,0]=3 3572 B15R0.70 C=CCCCCCCCCCCSCOC 62a_100000766300_100011093070 [0,1,0,0,0,0|2,0,0]=3 3573 B15R0.70 C=CCCCCCCCCCCSCOC 62a_100011093070_100000766300 [0,1,0,0,0,0|2,0,0]=3 3574 B15R0.70 C=CCCCCCCCCCCSCSC 62a_100011093070_100011218213 [0,1,0,0,0,0|2,0,0]=3 3575 B15R0.70 C=CCCCCCCCCCCSCSC 62a_100011218213_100011093070 [0,1,0,0,0,0|2,0,0]=3 3576 B15R0.70 C=CCCCCCCCCCNC/C=C/C 34a_100000081888_100102629194 [0,1,0,0,0,0|1,0,2]=4 3577 B15R0.70 C=CCCCCCCCCCNCC#CC 2230a_100000081888_100000748600 [0,1,0,0,0,0|1,0,2]=4 3578 B15R0.70 C=CCCCCCCCCCNCC#CC 2230a_100000685387_100009814027 [0,1,0,0,0,0|1,0,2]=4 3579 B15R0.70 C=CCCCCCCCCCNCC#CC 34a_100000081888_100000748600 [0,1,0,0,0,0|1,0,2]=4 3580 B15R0.70 C=CCCCCCCCCCNCC#CC 34a_100000685387_100009814027 [0,1,0,0,0,0|1,0,2]=4 3581 B15R0.70 C=CCCCCCCCCCNCC=CC 2230a_100000081888_100000070051 [0,1,0,0,0,0|1,0,2]=4 3582 B15R0.70 C=CCCCCCCCCCNCC=CC 34a_100000081888_100000070051 [0,1,0,0,0,0|1,0,2]=4 3583 B15R0.70 C=CCCCCCCCCCNCCC#N 2230a_100000081888_100011215226 [0,1,0,0,0,0|2,0,1]=4 3584 B15R0.70 C=CCCCCCCCCCNCCC=C 2230a_100000081888_100000754431 [0,1,0,0,0,0|1,0,2]=4 3585 B15R0.70 C=CCCCCCCCCCNCCC=C 2230a_100015191253_100009814027 [0,1,0,0,0,0|1,0,2]=4 3586 B15R0.70 C=CCCCCCCCCCNCCC=C 34a_100000081888_100000754431 [0,1,0,0,0,0|1,0,2]=4 3587 B15R0.70 C=CCCCCCCCCCNCCCC 2230a_100000081888_100000210211 [0,1,0,0,0,0|1,0,0]=2 3588 B15R0.70 C=CCCCCCCCCCNCCCC 2230a_100000102301_100009814027 [0,1,0,0,0,0|1,0,0]=2 3589 B15R0.70 C=CCCCCCCCCCNCCCC 34a_100000081888_100000210210 [0,1,0,0,0,0|1,0,0]=2 3590 B15R0.70 C=CCCCCCCCCCNCCCC 7a_106832991798_100009814027 [0,1,0,0,0,0|1,0,0]=2 3591 B15R0.70 C=CCCCCCCCCCNCCCF 2230a_100000081888_100011934791 [0,1,0,0,0,0|2,0,0]=3 3592 B15R0.70 C=CCCCCCCCCCNCCCF 2230a_100015189416_100009814027 [0,1,0,0,0,0|2,0,0]=3 3593 B15R0.70 C=CCCCCCCCCCNCCCF 34a_100000081888_100011934791 [0,1,0,0,0,0|2,0,0]=3 3594 B15R0.70 C=CCCCCCCCCCNCCCF 34a_100015189416_100009814027 [0,1,0,0,0,0|2,0,0]=3 3595 B15R0.70 C=CCCCCCCCCCNCCCO 2230a_100000081888_100000230001 [0,1,0,0,0,0|2,0,0]=3 3596 B15R0.70 C=CCCCCCCCCCNCCCO 34a_100000081888_100000230001 [0,1,0,0,0,0|2,0,0]=3 3597 B15R0.70 C=CCCCCCCCCCNCCOC 2230a_100000081888_100011201679 [0,1,0,0,0,0|2,0,0]=3 3598 B15R0.70 C=CCCCCCCCCCNCCOC 2230a_100000209980_100009814027 [0,1,0,0,0,0|2,0,0]=3 3599 B15R0.70 C=CCCCCCCCCCNCCOC 34a_100000081888_100011201679 [0,1,0,0,0,0|2,0,0]=3 3600 B15R0.70 C=CCCCCCCCCCNCCSC 2230a_100000081888_100000751147 [0,1,0,0,0,0|2,0,0]=3 3601 B15R0.70 C=CCCCCCCCCCNCCSC 2230a_100020590264_100009814027 [0,1,0,0,0,0|2,0,0]=3 3602 B15R0.70 C=CCCCCCCCCCNCCSC 34a_100000081888_100000212216 [0,1,0,0,0,0|2,0,0]=3 3603 B15R0.70 C=CCCCCCCCCCOC/C=C/C 34a_100000038209_100102629194 [0,1,0,0,0,0|1,0,2]=4 3604 B15R0.70 C=CCCCCCCCCCOC/C=C/C 34a_100016270725_100009814027 [0,1,0,0,0,0|1,0,2]=4 3605 B15R0.70 C=CCCCCCCCCCOC/C=C/C 7a_100000038209_100102629194 [0,1,0,0,0,0|1,0,2]=4 3606 B15R0.70 C=CCCCCCCCCCOCC#CC 34a_100000038209_100000748600 [0,1,0,0,0,0|1,0,2]=4 3607 B15R0.70 C=CCCCCCCCCCOCC#CC 34a_100000761923_100009814027 [0,1,0,0,0,0|1,0,2]=4 3608 B15R0.70 C=CCCCCCCCCCOCC#CC 7a_100000038209_100000748600 [0,1,0,0,0,0|1,0,2]=4 3609 B15R0.70 C=CCCCCCCCCCOCC=CC 34a_100000038209_100000070051 [0,1,0,0,0,0|1,0,2]=4 3610 B15R0.70 C=CCCCCCCCCCOCC=CC 7a_100000038209_100000070051 [0,1,0,0,0,0|1,0,2]=4 3611 B15R0.70 C=CCCCCCCCCCOCCC#N 7a_100000038209_100000184422 [0,1,0,0,0,0|2,0,1]=4 3612 B15R0.70 C=CCCCCCCCCCOCCC=C 34a_100000038209_100000754431 [0,1,0,0,0,0|1,0,2]=4 3613 B15R0.70 C=CCCCCCCCCCOCCC=C 34a_100011205117_100009814027 [0,1,0,0,0,0|1,0,2]=4 3614 B15R0.70 C=CCCCCCCCCCOCCC=C 7a_100000038209_100000754431 [0,1,0,0,0,0|1,0,2]=4 3615 B15R0.70 C=CCCCCCCCCCOCCCBr 34a_100011217188_100009814027 [0,1,0,0,0,0|2,0,0]=3 3616 B15R0.70 C=CCCCCCCCCCOCCCC 34a_100000038209_100000210210 [0,1,0,0,0,0|1,0,0]=2 3617 B15R0.70 C=CCCCCCCCCCOCCCC 34a_100000210227_100009814027 [0,1,0,0,0,0|1,0,0]=2 3618 B15R0.70 C=CCCCCCCCCCOCCCC 7a_100000038209_100000210211 [0,1,0,0,0,0|1,0,0]=2 3619 B15R0.70 C=CCCCCCCCCCOCCCC 7a_100000210227_100009814027 [0,1,0,0,0,0|1,0,0]=2 3620 B15R0.70 C=CCCCCCCCCCOCCCCl 34a_100000230001_100009814027 [0,1,0,0,0,0|2,0,0]=3 3621 B15R0.70 C=CCCCCCCCCCOCCCF 34a_100000038209_100011934791 [0,1,0,0,0,0|2,0,0]=3 3622 B15R0.70 C=CCCCCCCCCCOCCCF 34a_100000759539_100009814027 [0,1,0,0,0,0|2,0,0]=3 3623 B15R0.70 C=CCCCCCCCCCOCCCF 7a_100000038209_100011934791 [0,1,0,0,0,0|2,0,0]=3 3624 B15R0.70 C=CCCCCCCCCCOCCCN 34a_100000182051_100009814027 [0,1,0,0,0,0|2,0,0]=3 3625 B15R0.70 C=CCCCCCCCCCOCCCO 34a_100000038209_100000230001 [0,1,0,0,0,0|2,0,0]=3 3626 B15R0.70 C=CCCCCCCCCCOCCCO 7a_100000038209_100011215043 [0,1,0,0,0,0|2,0,0]=3 3627 B15R0.70 C=CCCCCCCCCCOCCOC 34a_100000038209_100011201679 [0,1,0,0,0,0|2,0,0]=3 3628 B15R0.70 C=CCCCCCCCCCOCCOC 34a_100000210237_100009814027 [0,1,0,0,0,0|2,0,0]=3 3629 B15R0.70 C=CCCCCCCCCCOCCOC 7a_100000038209_100000233755 [0,1,0,0,0,0|2,0,0]=3 3630 B15R0.70 C=CCCCCCCCCCOCCON 34a_100000700252_100009814027 [0,1,0,0,0,0|3,0,0]=4 3631 B15R0.70 C=CCCCCCCCCCOCCSC 34a_100000038209_100000212216 [0,1,0,0,0,0|2,0,0]=3 3632 B15R0.70 C=CCCCCCCCCCOCCSC 34a_100000230434_100009814027 [0,1,0,0,0,0|2,0,0]=3 3633 B15R0.70 C=CCCCCCCCCCOCCSC 7a_100000038209_100000212216 [0,1,0,0,0,0|2,0,0]=3 3634 B15R0.70 C=CCCCCCCCCCOCCSC 7a_100000230434_100009814027 [0,1,0,0,0,0|2,0,0]=3 3635 B15R0.70 C=CCCCCCCCCCSC/C=C/C 62a_100009814027_100102629194 [0,1,0,0,0,0|1,0,2]=4 3636 B15R0.70 C=CCCCCCCCCCSC/C=C/C 62a_100102629194_100009814027 [0,1,0,0,0,0|1,0,2]=4 3637 B15R0.70 C=CCCCCCCCCCSCC#CC 62a_100000748600_100009814027 [0,1,0,0,0,0|1,0,2]=4 3638 B15R0.70 C=CCCCCCCCCCSCC#CC 62a_100009814027_100000748600 [0,1,0,0,0,0|1,0,2]=4 3639 B15R0.70 C=CCCCCCCCCCSCC=CC 62a_100000070051_100009814027 [0,1,0,0,0,0|1,0,2]=4 3640 B15R0.70 C=CCCCCCCCCCSCC=CC 62a_100009814027_100000070051 [0,1,0,0,0,0|1,0,2]=4 3641 B15R0.70 C=CCCCCCCCCCSCCC#N 62a_100009814027_100011215226 [0,1,0,0,0,0|2,0,1]=4 3642 B15R0.70 C=CCCCCCCCCCSCCC#N 62a_100011215226_100009814027 [0,1,0,0,0,0|2,0,1]=4 3643 B15R0.70 C=CCCCCCCCCCSCCC=C 62a_100000754431_100009814027 [0,1,0,0,0,0|1,0,2]=4 3644 B15R0.70 C=CCCCCCCCCCSCCC=C 62a_100009814027_100000754431 [0,1,0,0,0,0|1,0,2]=4 3645 B15R0.70 C=CCCCCCCCCCSCCCC 62a_100000210211_100009814027 [0,1,0,0,0,0|1,0,0]=2 3646 B15R0.70 C=CCCCCCCCCCSCCCC 62a_100009814027_100000210210 [0,1,0,0,0,0|1,0,0]=2 3647 B15R0.70 C=CCCCCCCCCCSCCCF 62a_100009814027_100011934791 [0,1,0,0,0,0|2,0,0]=3 3648 B15R0.70 C=CCCCCCCCCCSCCCF 62a_100011934791_100009814027 [0,1,0,0,0,0|2,0,0]=3 3649 B15R0.70 C=CCCCCCCCCCSCCCO 62a_100009814027_100011215043 [0,1,0,0,0,0|2,0,0]=3 3650 B15R0.70 C=CCCCCCCCCCSCCCO 62a_100011215043_100009814027 [0,1,0,0,0,0|2,0,0]=3 3651 B15R0.70 C=CCCCCCCCCCSCCOC 62a_100000233755_100009814027 [0,1,0,0,0,0|2,0,0]=3 3652 B15R0.70 C=CCCCCCCCCCSCCOC 62a_100009814027_100000233755 [0,1,0,0,0,0|2,0,0]=3 3653 B15R0.70 C=CCCCCCCCCCSCCSC 62a_100000212216_100009814027 [0,1,0,0,0,0|2,0,0]=3 3654 B15R0.70 C=CCCCCCCCCCSCCSC 62a_100009814027_100000751147 [0,1,0,0,0,0|2,0,0]=3 3655 B15R0.70 C=CCCCCCCCCCSCOCC 62a_100000739092_100009814027 [0,1,0,0,0,0|2,0,0]=3 3656 B15R0.70 C=CCCCCCCCCCSCOCC 62a_100009814027_100000739092 [0,1,0,0,0,0|2,0,0]=3 3657 B15R0.70 C=CCCCCCCCCNCCCC=C 2230a_100000700776_100011933949 [0,1,0,0,0,0|1,0,2]=4 3658 B15R0.70 C=CCCCCCCCCNCCCC=C 34a_100000700776_100011933949 [0,1,0,0,0,0|1,0,2]=4 3659 B15R0.70 C=CCCCCCCCCNCCCCC 2230a_100000209983_100011933949 [0,1,0,0,0,0|1,0,0]=2 3660 B15R0.70 C=CCCCCCCCCNCCCCO 2230a_100000750430_100011933949 [0,1,0,0,0,0|2,0,0]=3 3661 B15R0.70 C=CCCCCCCCCNCCCCO 34a_100000750430_100011933949 [0,1,0,0,0,0|2,0,0]=3 3662 B15R0.70 C=CCCCCCCCCNCCCOC 34a_100150723488_100011933949 [0,1,0,0,0,0|2,0,0]=3 3663 B15R0.70 C=CCCCCCCCCNCCCSC 2230a_100000749238_100011933949 [0,1,0,0,0,0|2,0,0]=3 3664 B15R0.70 C=CCCCCCCCCNCCOCC 2230a_102516460346_100011933949 [0,1,0,0,0,0|2,0,0]=3 3665 B15R0.70 C=CCCCCCCCCNCCOCC 34a_102516460346_100011933949 [0,1,0,0,0,0|2,0,0]=3 3666 B15R0.70 C=CCCCCCCCCNCCSCC 2230a_100000106463_100011933949 [0,1,0,0,0,0|2,0,0]=3 3667 B15R0.70 C=CCCCCCCCCOC/C=C\CC 34a_100011215194_100103147603 [0,1,0,0,0,0|1,0,2]=4 3668 B15R0.70 C=CCCCCCCCCOC/C=C\CC 34a_100016268518_100011933949 [0,1,0,0,0,0|1,0,2]=4 3669 B15R0.70 C=CCCCCCCCCOC/C=C\CC 7a_100011215194_100103147603 [0,1,0,0,0,0|1,0,2]=4 3670 B15R0.70 C=CCCCCCCCCOCC#CCC 34a_100000032950_100011933949 [0,1,0,0,0,0|1,0,2]=4 3671 B15R0.70 C=CCCCCCCCCOCC#CCC 34a_100011215194_100009813939 [0,1,0,0,0,0|1,0,2]=4 3672 B15R0.70 C=CCCCCCCCCOCC#CCC 7a_100011215194_100009813939 [0,1,0,0,0,0|1,0,2]=4 3673 B15R0.70 C=CCCCCCCCCOCC/C=C/C 34a_100016278192_100011933949 [0,1,0,0,0,0|1,0,2]=4 3674 B15R0.70 C=CCCCCCCCCOCCC#CC 34a_100000750427_100011933949 [0,1,0,0,0,0|1,0,2]=4 3675 B15R0.70 C=CCCCCCCCCOCCCC#N 7a_100011215194_100000687738 [0,1,0,0,0,0|2,0,1]=4 3676 B15R0.70 C=CCCCCCCCCOCCCC=C 34a_100000758997_100011933949 [0,1,0,0,0,0|1,0,2]=4 3677 B15R0.70 C=CCCCCCCCCOCCCC=C 34a_100011215194_100000757094 [0,1,0,0,0,0|1,0,2]=4 3678 B15R0.70 C=CCCCCCCCCOCCCC=C 7a_100000758997_100011933949 [0,1,0,0,0,0|1,0,2]=4 3679 B15R0.70 C=CCCCCCCCCOCCCC=C 7a_100011215194_100000757094 [0,1,0,0,0,0|1,0,2]=4 3680 B15R0.70 C=CCCCCCCCCOCCCC=O 7a_100011215194_200011292268 [0,1,0,0,0,0|0,0,2]=3 3681 B15R0.70 C=CCCCCCCCCOCCCCBr 34a_100011216708_100011933949 [0,1,0,0,0,0|2,0,0]=3 3682 B15R0.70 C=CCCCCCCCCOCCCCC 34a_100000210253_100011933949 [0,1,0,0,0,0|1,0,0]=2 3683 B15R0.70 C=CCCCCCCCCOCCCCC 34a_100011215194_100000718602 [0,1,0,0,0,0|1,0,0]=2 3684 B15R0.70 C=CCCCCCCCCOCCCCC 7a_100000210253_100011933949 [0,1,0,0,0,0|1,0,0]=2 3685 B15R0.70 C=CCCCCCCCCOCCCCC 7a_100011215194_100000210326 [0,1,0,0,0,0|1,0,0]=2 3686 B15R0.70 C=CCCCCCCCCOCCCCCl 34a_100000210776_100011933949 [0,1,0,0,0,0|2,0,0]=3 3687 B15R0.70 C=CCCCCCCCCOCCCCCl 7a_100000210776_100011933949 [0,1,0,0,0,0|2,0,0]=3 3688 B15R0.70 C=CCCCCCCCCOCCCCF 34a_100011215194_100000729493 [0,1,0,0,0,0|2,0,0]=3 3689 B15R0.70 C=CCCCCCCCCOCCCCF 34a_100011995726_100011933949 [0,1,0,0,0,0|2,0,0]=3 3690 B15R0.70 C=CCCCCCCCCOCCCCF 7a_100011215194_100000729493 [0,1,0,0,0,0|2,0,0]=3 3691 B15R0.70 C=CCCCCCCCCOCCCCF 7a_100011995726_100011933949 [0,1,0,0,0,0|2,0,0]=3 3692 B15R0.70 C=CCCCCCCCCOCCCCI 34a_200012148704_100011933949 [0,1,0,0,0,0|2,0,0]=3 3693 B15R0.70 C=CCCCCCCCCOCCCCN 34a_100000750430_100011933949 [0,1,0,0,0,0|2,0,0]=3 3694 B15R0.70 C=CCCCCCCCCOCCCCO 34a_100011215194_100011216708 [0,1,0,0,0,0|2,0,0]=3 3695 B15R0.70 C=CCCCCCCCCOCCCCO 7a_100011215194_100000210776 [0,1,0,0,0,0|2,0,0]=3 3696 B15R0.70 C=CCCCCCCCCOCCCNC 34a_100000213112_100011933949 [0,1,0,0,0,0|2,0,0]=3 3697 B15R0.70 C=CCCCCCCCCOCCCOC 34a_100000740835_100011933949 [0,1,0,0,0,0|2,0,0]=3 3698 B15R0.70 C=CCCCCCCCCOCCCOC 34a_100011215194_100000740836 [0,1,0,0,0,0|2,0,0]=3 3699 B15R0.70 C=CCCCCCCCCOCCCOC 7a_100011215194_100000740836 [0,1,0,0,0,0|2,0,0]=3 3700 B15R0.70 C=CCCCCCCCCOCCCSC 34a_100000690336_100011933949 [0,1,0,0,0,0|2,0,0]=3 3701 B15R0.70 C=CCCCCCCCCOCCCSC 7a_100000690336_100011933949 [0,1,0,0,0,0|2,0,0]=3 3702 B15R0.70 C=CCCCCCCCCOCCOCC 34a_100000210136_100011933949 [0,1,0,0,0,0|2,0,0]=3 3703 B15R0.70 C=CCCCCCCCCOCCOCC 34a_100011215194_100000210147 [0,1,0,0,0,0|2,0,0]=3 3704 B15R0.70 C=CCCCCCCCCOCCOCC 7a_100000210136_100011933949 [0,1,0,0,0,0|2,0,0]=3 3705 B15R0.70 C=CCCCCCCCCOCCOCC 7a_100011215194_100011215890 [0,1,0,0,0,0|2,0,0]=3 3706 B15R0.70 C=CCCCCCCCCOCCSCC 34a_100000212035_100011933949 [0,1,0,0,0,0|2,0,0]=3 3707 B15R0.70 C=CCCCCCCCCOCCSCC 34a_100011215194_100000757381 [0,1,0,0,0,0|2,0,0]=3 3708 B15R0.70 C=CCCCCCCCCOCCSCC 7a_100000212035_100011933949 [0,1,0,0,0,0|2,0,0]=3 3709 B15R0.70 C=CCCCCCCCCOCCSCC 7a_100011215194_100000757381 [0,1,0,0,0,0|2,0,0]=3 3710 B15R0.70 C=CCCCCCCCCSC/C=C\CC 62a_100011933949_100103147603 [0,1,0,0,0,0|1,0,2]=4 3711 B15R0.70 C=CCCCCCCCCSC/C=C\CC 62a_100103147603_100011933949 [0,1,0,0,0,0|1,0,2]=4 3712 B15R0.70 C=CCCCCCCCCSCC#CCC 62a_100009813939_100011933949 [0,1,0,0,0,0|1,0,2]=4 3713 B15R0.70 C=CCCCCCCCCSCC#CCC 62a_100011933949_100009813939 [0,1,0,0,0,0|1,0,2]=4 3714 B15R0.70 C=CCCCCCCCCSCCCC#N 62a_100000687738_100011933949 [0,1,0,0,0,0|2,0,1]=4 3715 B15R0.70 C=CCCCCCCCCSCCCC#N 62a_100011933949_100000687738 [0,1,0,0,0,0|2,0,1]=4 3716 B15R0.70 C=CCCCCCCCCSCCCC=C 62a_100011713584_100011933949 [0,1,0,0,0,0|1,0,2]=4 3717 B15R0.70 C=CCCCCCCCCSCCCC=C 62a_100011933949_100000757094 [0,1,0,0,0,0|1,0,2]=4 3718 B15R0.70 C=CCCCCCCCCSCCCC=O 62a_100011933949_200011292268 [0,1,0,0,0,0|0,0,2]=3 3719 B15R0.70 C=CCCCCCCCCSCCCC=O 62a_200011292268_100011933949 [0,1,0,0,0,0|0,0,2]=3 3720 B15R0.70 C=CCCCCCCCCSCCCCC 62a_100000210326_100011933949 [0,1,0,0,0,0|1,0,0]=2 3721 B15R0.70 C=CCCCCCCCCSCCCCC 62a_100011933949_100000210326 [0,1,0,0,0,0|1,0,0]=2 3722 B15R0.70 C=CCCCCCCCCSCCCCF 62a_100000729493_100011933949 [0,1,0,0,0,0|2,0,0]=3 3723 B15R0.70 C=CCCCCCCCCSCCCCF 62a_100011933949_100000729493 [0,1,0,0,0,0|2,0,0]=3 3724 B15R0.70 C=CCCCCCCCCSCCCCO 62a_100000210776_100011933949 [0,1,0,0,0,0|2,0,0]=3 3725 B15R0.70 C=CCCCCCCCCSCCCCO 62a_100011933949_100000210776 [0,1,0,0,0,0|2,0,0]=3 3726 B15R0.70 C=CCCCCCCCCSCCCOC 62a_100000709357_100011933949 [0,1,0,0,0,0|2,0,0]=3 3727 B15R0.70 C=CCCCCCCCCSCCCOC 62a_100011933949_100000709357 [0,1,0,0,0,0|2,0,0]=3 3728 B15R0.70 C=CCCCCCCCCSCCOCC 62a_100000210147_100011933949 [0,1,0,0,0,0|2,0,0]=3 3729 B15R0.70 C=CCCCCCCCCSCCOCC 62a_100011933949_100011215890 [0,1,0,0,0,0|2,0,0]=3 3730 B15R0.70 C=CCCCCCCCCSCCSCC 62a_100000757381_100011933949 [0,1,0,0,0,0|2,0,0]=3 3731 B15R0.70 C=CCCCCCCCCSCCSCC 62a_100011933949_100000757381 [0,1,0,0,0,0|2,0,0]=3 3732 B15R0.70 C=CCCCCCCCNCCCCC=C 2230a_100000703577_100012355270 [0,1,0,0,0,0|1,0,2]=4 3733 B15R0.70 C=CCCCCCCCNCCCCC=C 34a_100000703577_100012355270 [0,1,0,0,0,0|1,0,2]=4 3734 B15R0.70 C=CCCCCCCCNCCCCCC 2230a_100000210581_100012355270 [0,1,0,0,0,0|1,0,0]=2 3735 B15R0.70 C=CCCCCCCCNCCCCCO 2230a_100000762737_100012355270 [0,1,0,0,0,0|2,0,0]=3 3736 B15R0.70 C=CCCCCCCCNCCCCCO 34a_100000762737_100012355270 [0,1,0,0,0,0|2,0,0]=3 3737 B15R0.70 C=CCCCCCCCNCCCOCC 2230a_100000210961_100012355270 [0,1,0,0,0,0|2,0,0]=3 3738 B15R0.70 C=CCCCCCCCNCCCOCC 34a_100000210961_100012355270 [0,1,0,0,0,0|2,0,0]=3 3739 B15R0.70 C=CCCCCCCCNCCOCCC 2230a_100161115042_100012355270 [0,1,0,0,0,0|2,0,0]=3 3740 B15R0.70 C=CCCCCCCCNCCOCCC 34a_100161115042_100012355270 [0,1,0,0,0,0|2,0,0]=3 3741 B15R0.70 C=CCCCCCCCNCCOCCO 2230a_100000211614_100012355270 [0,1,0,0,0,0|3,0,0]=4 3742 B15R0.70 C=CCCCCCCCNCCOCCO 34a_100000211614_100012355270 [0,1,0,0,0,0|3,0,0]=4 3743 B15R0.70 C=CCCCCCCCNCCSCCC 2230a_100020603323_100012355270 [0,1,0,0,0,0|2,0,0]=3 3744 B15R0.70 C=CCCCCCCCNCCSCCO 2230a_100011219999_100012355270 [0,1,0,0,0,0|3,0,0]=4 3745 B15R0.70 C=CCCCCCCCOC/C=C/CCC 34a_100016278788_100012355270 [0,1,0,0,0,0|1,0,2]=4 3746 B15R0.70 C=CCCCCCCCOC/C=C/CCC 7a_100016278788_100012355270 [0,1,0,0,0,0|1,0,2]=4 3747 B15R0.70 C=CCCCCCCCOCC#CCCC 34a_100000034806_100012355270 [0,1,0,0,0,0|1,0,2]=4 3748 B15R0.70 C=CCCCCCCCOCC#CCCC 7a_100000034806_100012355270 [0,1,0,0,0,0|1,0,2]=4 3749 B15R0.70 C=CCCCCCCCOCC/C=C\CC 34a_100000730831_100015370543 [0,1,0,0,0,0|1,0,2]=4 3750 B15R0.70 C=CCCCCCCCOCC/C=C\CC 34a_100016288707_100012355270 [0,1,0,0,0,0|1,0,2]=4 3751 B15R0.70 C=CCCCCCCCOCC/C=C\CC 7a_100000730831_100015370543 [0,1,0,0,0,0|1,0,2]=4 3752 B15R0.70 C=CCCCCCCCOCC/C=C\CC 7a_100016288707_100012355270 [0,1,0,0,0,0|1,0,2]=4 3753 B15R0.70 C=CCCCCCCCOCCC#CCC 34a_100000036655_100012355270 [0,1,0,0,0,0|1,0,2]=4 3754 B15R0.70 C=CCCCCCCCOCCC#CCC 7a_100000036655_100012355270 [0,1,0,0,0,0|1,0,2]=4 3755 B15R0.70 C=CCCCCCCCOCCCC=CC 34a_100020645299_100012355270 [0,1,0,0,0,0|1,0,2]=4 3756 B15R0.70 C=CCCCCCCCOCCCCC#N 7a_100000730831_100000211819 [0,1,0,0,0,0|2,0,1]=4 3757 B15R0.70 C=CCCCCCCCOCCCCC=C 34a_100000730831_100011215482 [0,1,0,0,0,0|1,0,2]=4 3758 B15R0.70 C=CCCCCCCCOCCCCC=C 34a_100000766645_100012355270 [0,1,0,0,0,0|1,0,2]=4 3759 B15R0.70 C=CCCCCCCCOCCCCC=C 7a_100000730831_100011215482 [0,1,0,0,0,0|1,0,2]=4 3760 B15R0.70 C=CCCCCCCCOCCCCC=C 7a_100000766645_100012355270 [0,1,0,0,0,0|1,0,2]=4 3761 B15R0.70 C=CCCCCCCCOCCCCC=O 7a_100000730831_100000139335 [0,1,0,0,0,0|0,0,2]=3 3762 B15R0.70 C=CCCCCCCCOCCCCCBr 34a_100000746331_100012355270 [0,1,0,0,0,0|2,0,0]=3 3763 B15R0.70 C=CCCCCCCCOCCCCCBr 7a_100000746331_100012355270 [0,1,0,0,0,0|2,0,0]=3 3764 B15R0.70 C=CCCCCCCCOCCCCCC 34a_100000210259_100012355270 [0,1,0,0,0,0|1,0,0]=2 3765 B15R0.70 C=CCCCCCCCOCCCCCC 34a_100000730831_100000210314 [0,1,0,0,0,0|1,0,0]=2 3766 B15R0.70 C=CCCCCCCCOCCCCCC 7a_100000210259_100012355270 [0,1,0,0,0,0|1,0,0]=2 3767 B15R0.70 C=CCCCCCCCOCCCCCC 7a_100000730831_100000210314 [0,1,0,0,0,0|1,0,0]=2 3768 B15R0.70 C=CCCCCCCCOCCCCCCl 34a_100000746330_100012355270 [0,1,0,0,0,0|2,0,0]=3 3769 B15R0.70 C=CCCCCCCCOCCCCCCl 7a_100000746330_100012355270 [0,1,0,0,0,0|2,0,0]=3 3770 B15R0.70 C=CCCCCCCCOCCCCCF 34a_100000730831_100000729378 [0,1,0,0,0,0|2,0,0]=3 3771 B15R0.70 C=CCCCCCCCOCCCCCF 7a_100000730831_100000729378 [0,1,0,0,0,0|2,0,0]=3 3772 B15R0.70 C=CCCCCCCCOCCCCCI 34a_200012148887_100012355270 [0,1,0,0,0,0|2,0,0]=3 3773 B15R0.70 C=CCCCCCCCOCCCCCI 7a_200012148887_100012355270 [0,1,0,0,0,0|2,0,0]=3 3774 B15R0.70 C=CCCCCCCCOCCCCCN 34a_100000762737_100012355270 [0,1,0,0,0,0|2,0,0]=3 3775 B15R0.70 C=CCCCCCCCOCCCCCO 34a_100000730831_100000746330 [0,1,0,0,0,0|2,0,0]=3 3776 B15R0.70 C=CCCCCCCCOCCCCCO 7a_100000730831_100000746330 [0,1,0,0,0,0|2,0,0]=3 3777 B15R0.70 C=CCCCCCCCOCCCCOC 34a_100000730831_100000755781 [0,1,0,0,0,0|2,0,0]=3 3778 B15R0.70 C=CCCCCCCCOCCCCOC 34a_100000740925_100012355270 [0,1,0,0,0,0|2,0,0]=3 3779 B15R0.70 C=CCCCCCCCOCCCCOC 7a_100000730831_100000730899 [0,1,0,0,0,0|2,0,0]=3 3780 B15R0.70 C=CCCCCCCCOCCCCSC 34a_100011217163_100012355270 [0,1,0,0,0,0|2,0,0]=3 3781 B15R0.70 C=CCCCCCCCOCCCCSC 7a_100011217163_100012355270 [0,1,0,0,0,0|2,0,0]=3 3782 B15R0.70 C=CCCCCCCCOCCCOCC 34a_100000730831_100012232248 [0,1,0,0,0,0|2,0,0]=3 3783 B15R0.70 C=CCCCCCCCOCCCOCC 34a_100000757476_100012355270 [0,1,0,0,0,0|2,0,0]=3 3784 B15R0.70 C=CCCCCCCCOCCCOCC 7a_100000730831_100012232248 [0,1,0,0,0,0|2,0,0]=3 3785 B15R0.70 C=CCCCCCCCOCCCOCC 7a_100000757476_100012355270 [0,1,0,0,0,0|2,0,0]=3 3786 B15R0.70 C=CCCCCCCCOCCCSCC 34a_100011216438_100012355270 [0,1,0,0,0,0|2,0,0]=3 3787 B15R0.70 C=CCCCCCCCOCCCSCC 7a_100011216438_100012355270 [0,1,0,0,0,0|2,0,0]=3 3788 B15R0.70 C=CCCCCCCCOCCOCCBr 34a_100000692535_100012355270 [0,1,0,0,0,0|3,0,0]=4 3789 B15R0.70 C=CCCCCCCCOCCOCCBr 7a_100000692535_100012355270 [0,1,0,0,0,0|3,0,0]=4 3790 B15R0.70 C=CCCCCCCCOCCOCCC 34a_100000730831_100011215938 [0,1,0,0,0,0|2,0,0]=3 3791 B15R0.70 C=CCCCCCCCOCCOCCC 34a_100000752267_100012355270 [0,1,0,0,0,0|2,0,0]=3 3792 B15R0.70 C=CCCCCCCCOCCOCCC 7a_100000730831_100011215938 [0,1,0,0,0,0|2,0,0]=3 3793 B15R0.70 C=CCCCCCCCOCCOCCC 7a_100000752267_100012355270 [0,1,0,0,0,0|2,0,0]=3 3794 B15R0.70 C=CCCCCCCCOCCOCCCl 34a_100011215305_100012355270 [0,1,0,0,0,0|3,0,0]=4 3795 B15R0.70 C=CCCCCCCCOCCOCCCl 7a_100011215305_100012355270 [0,1,0,0,0,0|3,0,0]=4 3796 B15R0.70 C=CCCCCCCCOCCOCCF 34a_200015357709_100012355270 [0,1,0,0,0,0|3,0,0]=4 3797 B15R0.70 C=CCCCCCCCOCCOCCF 7a_200015357709_100012355270 [0,1,0,0,0,0|3,0,0]=4 3798 B15R0.70 C=CCCCCCCCOCCOCCI 34a_100012149058_100012355270 [0,1,0,0,0,0|3,0,0]=4 3799 B15R0.70 C=CCCCCCCCOCCOCCI 7a_100012149058_100012355270 [0,1,0,0,0,0|3,0,0]=4 3800 B15R0.70 C=CCCCCCCCOCCOCCN 34a_100000211614_100012355270 [0,1,0,0,0,0|3,0,0]=4 3801 B15R0.70 C=CCCCCCCCOCCOCCO 34a_100000730831_100000692535 [0,1,0,0,0,0|3,0,0]=4 3802 B15R0.70 C=CCCCCCCCOCCOCCO 7a_100000730831_100011215305 [0,1,0,0,0,0|3,0,0]=4 3803 B15R0.70 C=CCCCCCCCOCCSCCC 34a_200000230433_100012355270 [0,1,0,0,0,0|2,0,0]=3 3804 B15R0.70 C=CCCCCCCCOCCSCCC 7a_200000230433_100012355270 [0,1,0,0,0,0|2,0,0]=3 3805 B15R0.70 C=CCCCCCCCOCOCCCC 34a_100000730831_100011995733 [0,1,0,0,0,0|2,0,0]=3 3806 B15R0.70 C=CCCCCCCCSCC/C=C\CC 62a_100012355270_100015370543 [0,1,0,0,0,0|1,0,2]=4 3807 B15R0.70 C=CCCCCCCCSCC/C=C\CC 62a_100015370543_100012355270 [0,1,0,0,0,0|1,0,2]=4 3808 B15R0.70 C=CCCCCCCCSCCCCC#N 62a_100011219923_100012355270 [0,1,0,0,0,0|2,0,1]=4 3809 B15R0.70 C=CCCCCCCCSCCCCC#N 62a_100012355270_100000211819 [0,1,0,0,0,0|2,0,1]=4 3810 B15R0.70 C=CCCCCCCCSCCCCC=C 62a_100011215482_100012355270 [0,1,0,0,0,0|1,0,2]=4 3811 B15R0.70 C=CCCCCCCCSCCCCC=C 62a_100012355270_100011215482 [0,1,0,0,0,0|1,0,2]=4 3812 B15R0.70 C=CCCCCCCCSCCCCC=O 62a_100000139335_100012355270 [0,1,0,0,0,0|0,0,2]=3 3813 B15R0.70 C=CCCCCCCCSCCCCC=O 62a_100012355270_100000139335 [0,1,0,0,0,0|0,0,2]=3 3814 B15R0.70 C=CCCCCCCCSCCCCCC 62a_100000210314_100012355270 [0,1,0,0,0,0|1,0,0]=2 3815 B15R0.70 C=CCCCCCCCSCCCCCC 62a_100012355270_100000210757 [0,1,0,0,0,0|1,0,0]=2 3816 B15R0.70 C=CCCCCCCCSCCCCCF 62a_100000729378_100012355270 [0,1,0,0,0,0|2,0,0]=3 3817 B15R0.70 C=CCCCCCCCSCCCCCF 62a_100012355270_100000729378 [0,1,0,0,0,0|2,0,0]=3 3818 B15R0.70 C=CCCCCCCCSCCCCCO 62a_100000746330_100012355270 [0,1,0,0,0,0|2,0,0]=3 3819 B15R0.70 C=CCCCCCCCSCCCCCO 62a_100012355270_100000746330 [0,1,0,0,0,0|2,0,0]=3 3820 B15R0.70 C=CCCCCCCCSCCCCOC 62a_100000730899_100012355270 [0,1,0,0,0,0|2,0,0]=3 3821 B15R0.70 C=CCCCCCCCSCCCCOC 62a_100012355270_100000730899 [0,1,0,0,0,0|2,0,0]=3 3822 B15R0.70 C=CCCCCCCCSCCCOCC 62a_100012232248_100012355270 [0,1,0,0,0,0|2,0,0]=3 3823 B15R0.70 C=CCCCCCCCSCCCOCC 62a_100012355270_100012232248 [0,1,0,0,0,0|2,0,0]=3 3824 B15R0.70 C=CCCCCCCCSCCOCCC 62a_100011215938_100012355270 [0,1,0,0,0,0|2,0,0]=3 3825 B15R0.70 C=CCCCCCCCSCCOCCC 62a_100012355270_100011215938 [0,1,0,0,0,0|2,0,0]=3 3826 B15R0.70 C=CCCCCCCCSCCOCCO 62a_100011215305_100012355270 [0,1,0,0,0,0|3,0,0]=4 3827 B15R0.70 C=CCCCCCCCSCCOCCO 62a_100012355270_100011215305 [0,1,0,0,0,0|3,0,0]=4 3828 B15R0.70 C=CCCCCCCCSCOCCCC 62a_100011995733_100012355270 [0,1,0,0,0,0|2,0,0]=3 3829 B15R0.70 C=CCCCCCCCSCOCCCC 62a_100012355270_100011995733 [0,1,0,0,0,0|2,0,0]=3 3830 B15R0.70 C=CCCCCCCCSCOCCOC 62a_100000231047_100012355270 [0,1,0,0,0,0|3,0,0]=4 3831 B15R0.70 C=CCCCCCCCSCOCCOC 62a_100012355270_100000231047 [0,1,0,0,0,0|3,0,0]=4 3832 B15R0.70 C=CCCCCCCNCCCCCCC 2230a_100000229938_100011215473 [0,1,0,0,0,0|1,0,0]=2 3833 B15R0.70 C=CCCCCCCNCCCCCCO 2230a_100000686447_100011215473 [0,1,0,0,0,0|2,0,0]=3 3834 B15R0.70 C=CCCCCCCNCCCCCCO 34a_100000686447_100011215473 [0,1,0,0,0,0|2,0,0]=3 3835 B15R0.70 C=CCCCCCCNCCCCCOC 2230a_100000747528_100011215473 [0,1,0,0,0,0|2,0,0]=3 3836 B15R0.70 C=CCCCCCCNCCCCCOC 34a_100000747528_100011215473 [0,1,0,0,0,0|2,0,0]=3 3837 B15R0.70 C=CCCCCCCNCCCOCCC 2230a_100011217757_100011215473 [0,1,0,0,0,0|2,0,0]=3 3838 B15R0.70 C=CCCCCCCNCCCOCCC 34a_100011217757_100011215473 [0,1,0,0,0,0|2,0,0]=3 3839 B15R0.70 C=CCCCCCCNCCOCCOC 2230a_100000745349_100011215473 [0,1,0,0,0,0|3,0,0]=4 3840 B15R0.70 C=CCCCCCCNCCOCCOC 34a_100000745349_100011215473 [0,1,0,0,0,0|3,0,0]=4 3841 B15R0.70 C=CCCCCCCNCCSCCCC 2230a_100025743550_100011215473 [0,1,0,0,0,0|2,0,0]=3 3842 B15R0.70 C=CCCCCCCOC/C=C/CCCC 34a_200016272032_100011215473 [0,1,0,0,0,0|1,0,2]=4 3843 B15R0.70 C=CCCCCCCOC/C=C/CCCC 7a_200016272032_100011215473 [0,1,0,0,0,0|1,0,2]=4 3844 B15R0.70 C=CCCCCCCOCC#CCCCC 34a_200000034558_100011215473 [0,1,0,0,0,0|1,0,2]=4 3845 B15R0.70 C=CCCCCCCOCC#CCCCC 7a_200000034558_100011215473 [0,1,0,0,0,0|1,0,2]=4 3846 B15R0.70 C=CCCCCCCOCCC#CCCC 34a_100000042726_100011215473 [0,1,0,0,0,0|1,0,2]=4 3847 B15R0.70 C=CCCCCCCOCCC#CCCC 7a_100000042726_100011215473 [0,1,0,0,0,0|1,0,2]=4 3848 B15R0.70 C=CCCCCCCOCCC/C=C/CC 34a_100016287902_100011215473 [0,1,0,0,0,0|1,0,2]=4 3849 B15R0.70 C=CCCCCCCOCCC/C=C/CC 7a_100016287902_100011215473 [0,1,0,0,0,0|1,0,2]=4 3850 B15R0.70 C=CCCCCCCOCCCCCC#N 7a_200011216477_100009813376 [0,1,0,0,0,0|2,0,1]=4 3851 B15R0.70 C=CCCCCCCOCCCCCC=C 34a_100011216702_100011215473 [0,1,0,0,0,0|1,0,2]=4 3852 B15R0.70 C=CCCCCCCOCCCCCC=C 34a_200011216477_100000700193 [0,1,0,0,0,0|1,0,2]=4 3853 B15R0.70 C=CCCCCCCOCCCCCC=C 7a_100011216702_100011215473 [0,1,0,0,0,0|1,0,2]=4 3854 B15R0.70 C=CCCCCCCOCCCCCC=C 7a_200011216477_100000700193 [0,1,0,0,0,0|1,0,2]=4 3855 B15R0.70 C=CCCCCCCOCCCCCC=O 7a_200011216477_100000139337 [0,1,0,0,0,0|0,0,2]=3 3856 B15R0.70 C=CCCCCCCOCCCCCCBr 34a_100011215345_100011215473 [0,1,0,0,0,0|2,0,0]=3 3857 B15R0.70 C=CCCCCCCOCCCCCCBr 7a_100011215345_100011215473 [0,1,0,0,0,0|2,0,0]=3 3858 B15R0.70 C=CCCCCCCOCCCCCCC 34a_100000210272_100011215473 [0,1,0,0,0,0|1,0,0]=2 3859 B15R0.70 C=CCCCCCCOCCCCCCC 34a_200011216477_100000210614 [0,1,0,0,0,0|1,0,0]=2 3860 B15R0.70 C=CCCCCCCOCCCCCCC 7a_100000210272_100011215473 [0,1,0,0,0,0|1,0,0]=2 3861 B15R0.70 C=CCCCCCCOCCCCCCC 7a_200011216477_100000210614 [0,1,0,0,0,0|1,0,0]=2 3862 B15R0.70 C=CCCCCCCOCCCCCCCl 34a_100000766143_100011215473 [0,1,0,0,0,0|2,0,0]=3 3863 B15R0.70 C=CCCCCCCOCCCCCCCl 7a_100000766143_100011215473 [0,1,0,0,0,0|2,0,0]=3 3864 B15R0.70 C=CCCCCCCOCCCCCCF 34a_100000732779_100011215473 [0,1,0,0,0,0|2,0,0]=3 3865 B15R0.70 C=CCCCCCCOCCCCCCF 34a_200011216477_100015922095 [0,1,0,0,0,0|2,0,0]=3 3866 B15R0.70 C=CCCCCCCOCCCCCCF 7a_100000732779_100011215473 [0,1,0,0,0,0|2,0,0]=3 3867 B15R0.70 C=CCCCCCCOCCCCCCF 7a_200011216477_100015922095 [0,1,0,0,0,0|2,0,0]=3 3868 B15R0.70 C=CCCCCCCOCCCCCCN 34a_100000686447_100011215473 [0,1,0,0,0,0|2,0,0]=3 3869 B15R0.70 C=CCCCCCCOCCCCCCO 34a_200011216477_100000766143 [0,1,0,0,0,0|2,0,0]=3 3870 B15R0.70 C=CCCCCCCOCCCCCCO 7a_200011216477_100000766143 [0,1,0,0,0,0|2,0,0]=3 3871 B15R0.70 C=CCCCCCCOCCCCCNC 34a_100000722520_100011215473 [0,1,0,0,0,0|2,0,0]=3 3872 B15R0.70 C=CCCCCCCOCCOCCCC 34a_100000210238_100011215473 [0,1,0,0,0,0|2,0,0]=3 3873 B15R0.70 C=CCCCCCCOCCOCCCC 34a_200011216477_100000743108 [0,1,0,0,0,0|2,0,0]=3 3874 B15R0.70 C=CCCCCCCOCCOCCCC 7a_100000210238_100011215473 [0,1,0,0,0,0|2,0,0]=3 3875 B15R0.70 C=CCCCCCCOCCOCCCC 7a_200011216477_100000743108 [0,1,0,0,0,0|2,0,0]=3 3876 B15R0.70 C=CCCCCCCOCCOCCNC 34a_100000228057_100011215473 [0,1,0,0,0,0|3,0,0]=4 3877 B15R0.70 C=CCCCCCCOCCOCCOC 34a_100011215163_100011215473 [0,1,0,0,0,0|3,0,0]=4 3878 B15R0.70 C=CCCCCCCOCCOCCOC 34a_200011216477_100000695917 [0,1,0,0,0,0|3,0,0]=4 3879 B15R0.70 C=CCCCCCCOCCOCCOC 7a_100011215163_100011215473 [0,1,0,0,0,0|3,0,0]=4 3880 B15R0.70 C=CCCCCCCOCCOCCOC 7a_200011216477_100000695917 [0,1,0,0,0,0|3,0,0]=4 3881 B15R0.70 C=CCCCCCCOCCSCCCC 34a_200000230436_100011215473 [0,1,0,0,0,0|2,0,0]=3 3882 B15R0.70 C=CCCCCCCOCCSCCCC 7a_200000230436_100011215473 [0,1,0,0,0,0|2,0,0]=3 3883 B15R0.70 C=CCCCCCCSCCCCCC#N 62a_100009813376_100011215473 [0,1,0,0,0,0|2,0,1]=4 3884 B15R0.70 C=CCCCCCCSCCCCCC#N 62a_100011215473_100009813376 [0,1,0,0,0,0|2,0,1]=4 3885 B15R0.70 C=CCCCCCCSCCCCCC=C 62a_100000700193_100011215473 [0,1,0,0,0,0|1,0,2]=4 3886 B15R0.70 C=CCCCCCCSCCCCCC=C 62a_100011215473_100000700193 [0,1,0,0,0,0|1,0,2]=4 3887 B15R0.70 C=CCCCCCCSCCCCCC=O 62a_100000139337_100011215473 [0,1,0,0,0,0|0,0,2]=3 3888 B15R0.70 C=CCCCCCCSCCCCCC=O 62a_100011215473_100000139337 [0,1,0,0,0,0|0,0,2]=3 3889 B15R0.70 C=CCCCCCCSCCCCCCC 62a_100000210614_100011215473 [0,1,0,0,0,0|1,0,0]=2 3890 B15R0.70 C=CCCCCCCSCCCCCCC 62a_100011215473_100000210316 [0,1,0,0,0,0|1,0,0]=2 3891 B15R0.70 C=CCCCCCCSCCCCCCF 62a_100011215473_100015922095 [0,1,0,0,0,0|2,0,0]=3 3892 B15R0.70 C=CCCCCCCSCCCCCCF 62a_100015922095_100011215473 [0,1,0,0,0,0|2,0,0]=3 3893 B15R0.70 C=CCCCCCCSCCCCCCO 62a_100000766143_100011215473 [0,1,0,0,0,0|2,0,0]=3 3894 B15R0.70 C=CCCCCCCSCCCCCCO 62a_100011215473_100000766143 [0,1,0,0,0,0|2,0,0]=3 3895 B15R0.70 C=CCCCCCCSCCOCCCC 62a_100000743108_100011215473 [0,1,0,0,0,0|2,0,0]=3 3896 B15R0.70 C=CCCCCCCSCCOCCCC 62a_100011215473_100000743108 [0,1,0,0,0,0|2,0,0]=3 3897 B15R0.70 C=CCCCCCCSCCOCCOC 62a_100000695917_100011215473 [0,1,0,0,0,0|3,0,0]=4 3898 B15R0.70 C=CCCCCCCSCCOCCOC 62a_100011215473_100000695917 [0,1,0,0,0,0|3,0,0]=4 3899 B15R0.70 C=CCCCCCNCCCCCCCC 2230a_100000229939_100000700193 [0,1,0,0,0,0|1,0,0]=2 3900 B15R0.70 C=CCCCCCNCCCCCCCC 34a_100000229939_100000700193 [0,1,0,0,0,0|1,0,0]=2 3901 B15R0.70 C=CCCCCCNCCCCCCCO 2230a_100011996573_100000700193 [0,1,0,0,0,0|2,0,0]=3 3902 B15R0.70 C=CCCCCCNCCCCCCCO 34a_100011996573_100000700193 [0,1,0,0,0,0|2,0,0]=3 3903 B15R0.70 C=CCCCCCNCCCOCCCC 2230a_200000211371_100000700193 [0,1,0,0,0,0|2,0,0]=3 3904 B15R0.70 C=CCCCCCNCCCOCCCC 34a_200000211371_100000700193 [0,1,0,0,0,0|2,0,0]=3 3905 B15R0.70 C=CCCCCCNCCCOCCCO 2230a_100011310245_100000700193 [0,1,0,0,0,0|3,0,0]=4 3906 B15R0.70 C=CCCCCCNCCCOCCCO 34a_100011310245_100000700193 [0,1,0,0,0,0|3,0,0]=4 3907 B15R0.70 C=CCCCCCNCCCOCCOC 2230a_100000206027_100000700193 [0,1,0,0,0,0|3,0,0]=4 3908 B15R0.70 C=CCCCCCNCCCOCCOC 34a_100000206027_100000700193 [0,1,0,0,0,0|3,0,0]=4 3909 B15R0.70 C=CCCCCCNCCOCCOCC 2230a_100102712874_100000700193 [0,1,0,0,0,0|3,0,0]=4 3910 B15R0.70 C=CCCCCCNCCOCCOCC 34a_100102712874_100000700193 [0,1,0,0,0,0|3,0,0]=4 3911 B15R0.70 C=CCCCCCOC/C=C/CCCCC 34a_100016258190_100000700193 [0,1,0,0,0,0|1,0,2]=4 3912 B15R0.70 C=CCCCCCOC/C=C/CCCCC 7a_100016258190_100000700193 [0,1,0,0,0,0|1,0,2]=4 3913 B15R0.70 C=CCCCCCOCC#CCCCCC 34a_100011216702_100009816472 [0,1,0,0,0,0|1,0,2]=4 3914 B15R0.70 C=CCCCCCOCC#CCCCCC 34a_200000033628_100000700193 [0,1,0,0,0,0|1,0,2]=4 3915 B15R0.70 C=CCCCCCOCC#CCCCCC 7a_100011216702_100009816472 [0,1,0,0,0,0|1,0,2]=4 3916 B15R0.70 C=CCCCCCOCC#CCCCCC 7a_200000033628_100000700193 [0,1,0,0,0,0|1,0,2]=4 3917 B15R0.70 C=CCCCCCOCC/C=C\CCCC 34a_200016286491_100000700193 [0,1,0,0,0,0|1,0,2]=4 3918 B15R0.70 C=CCCCCCOCC/C=C\CCCC 7a_200016286491_100000700193 [0,1,0,0,0,0|1,0,2]=4 3919 B15R0.70 C=CCCCCCOCCC#CCCCC 34a_100000037610_100000700193 [0,1,0,0,0,0|1,0,2]=4 3920 B15R0.70 C=CCCCCCOCCC#CCCCC 7a_100000037610_100000700193 [0,1,0,0,0,0|1,0,2]=4 3921 B15R0.70 C=CCCCCCOCCCC/C=C\CC 34a_100016287862_100000700193 [0,1,0,0,0,0|1,0,2]=4 3922 B15R0.70 C=CCCCCCOCCCC/C=C\CC 7a_100016287862_100000700193 [0,1,0,0,0,0|1,0,2]=4 3923 B15R0.70 C=CCCCCCOCCCCCCC#N 7a_100011216702_100009813337 [0,1,0,0,0,0|2,0,1]=4 3924 B15R0.70 C=CCCCCCOCCCCCCCBr 34a_100000760002_100000700193 [0,1,0,0,0,0|2,0,0]=3 3925 B15R0.70 C=CCCCCCOCCCCCCCBr 7a_100000760002_100000700193 [0,1,0,0,0,0|2,0,0]=3 3926 B15R0.70 C=CCCCCCOCCCCCCCC 34a_100000210232_100000700193 [0,1,0,0,0,0|1,0,0]=2 3927 B15R0.70 C=CCCCCCOCCCCCCCC 34a_100011216702_100000210759 [0,1,0,0,0,0|1,0,0]=2 3928 B15R0.70 C=CCCCCCOCCCCCCCC 7a_100000210232_100000700193 [0,1,0,0,0,0|1,0,0]=2 3929 B15R0.70 C=CCCCCCOCCCCCCCC 7a_100011216702_100000210759 [0,1,0,0,0,0|1,0,0]=2 3930 B15R0.70 C=CCCCCCOCCCCCCCN 34a_100011996573_100000700193 [0,1,0,0,0,0|2,0,0]=3 3931 B15R0.70 C=CCCCCCOCCCCCCCO 34a_100011216702_100000760002 [0,1,0,0,0,0|2,0,0]=3 3932 B15R0.70 C=CCCCCCOCCCCCCCO 7a_100011216702_100000760002 [0,1,0,0,0,0|2,0,0]=3 3933 B15R0.70 C=CCCCCCOCCCCCCOC 34a_100011216702_100011998445 [0,1,0,0,0,0|2,0,0]=3 3934 B15R0.70 C=CCCCCCOCCCCCCOC 34a_200012092642_100000700193 [0,1,0,0,0,0|2,0,0]=3 3935 B15R0.70 C=CCCCCCOCCCCCCOC 7a_100011216702_100011998445 [0,1,0,0,0,0|2,0,0]=3 3936 B15R0.70 C=CCCCCCOCCCCCCOC 7a_200012092642_100000700193 [0,1,0,0,0,0|2,0,0]=3 3937 B15R0.70 C=CCCCCCOCCCOCCCC 34a_200011215613_100000700193 [0,1,0,0,0,0|2,0,0]=3 3938 B15R0.70 C=CCCCCCOCCCOCCCC 7a_200011215613_100000700193 [0,1,0,0,0,0|2,0,0]=3 3939 B15R0.70 C=CCCCCCOCCCOCCCN 34a_100011310245_100000700193 [0,1,0,0,0,0|3,0,0]=4 3940 B15R0.70 C=CCCCCCOCCCOCCOC 34a_100011216702_100011216529 [0,1,0,0,0,0|3,0,0]=4 3941 B15R0.70 C=CCCCCCOCCCOCCOC 7a_100011216702_100011216529 [0,1,0,0,0,0|3,0,0]=4 3942 B15R0.70 C=CCCCCCOCCNCCCCC 34a_100000224656_100000700193 [0,1,0,0,0,0|2,0,0]=3 3943 B15R0.70 C=CCCCCCOCCOCCCCC 34a_100011215259_100000700193 [0,1,0,0,0,0|2,0,0]=3 3944 B15R0.70 C=CCCCCCOCCOCCCCC 7a_100011215259_100000700193 [0,1,0,0,0,0|2,0,0]=3 3945 B15R0.70 C=CCCCCCOCCOCCOCC 34a_100000210240_100000700193 [0,1,0,0,0,0|3,0,0]=4 3946 B15R0.70 C=CCCCCCOCCOCCOCC 34a_100011216702_100011211534 [0,1,0,0,0,0|3,0,0]=4 3947 B15R0.70 C=CCCCCCOCCOCCOCC 7a_100000210240_100000700193 [0,1,0,0,0,0|3,0,0]=4 3948 B15R0.70 C=CCCCCCOCCOCCOCC 7a_100011216702_100011211534 [0,1,0,0,0,0|3,0,0]=4 3949 B15R0.70 C=CCCCCCSCC#CCCCCC 62a_100000700193_100009816472 [0,1,0,0,0,0|1,0,2]=4 3950 B15R0.70 C=CCCCCCSCC#CCCCCC 62a_100009816472_100000700193 [0,1,0,0,0,0|1,0,2]=4 3951 B15R0.70 C=CCCCCCSCCCCCCC#N 62a_100000700193_100009813337 [0,1,0,0,0,0|2,0,1]=4 3952 B15R0.70 C=CCCCCCSCCCCCCC#N 62a_100009813337_100000700193 [0,1,0,0,0,0|2,0,1]=4 3953 B15R0.70 C=CCCCCCSCCCCCCCC 62a_100000210759_100000700193 [0,1,0,0,0,0|1,0,0]=2 3954 B15R0.70 C=CCCCCCSCCCCCCCC 62a_100000700193_100000210317 [0,1,0,0,0,0|1,0,0]=2 3955 B15R0.70 C=CCCCCCSCCCCCCCO 62a_100000700193_100000760002 [0,1,0,0,0,0|2,0,0]=3 3956 B15R0.70 C=CCCCCCSCCCCCCCO 62a_100000760002_100000700193 [0,1,0,0,0,0|2,0,0]=3 3957 B15R0.70 C=CCCCCCSCCCCCCOC 62a_100000700193_100011998445 [0,1,0,0,0,0|2,0,0]=3 3958 B15R0.70 C=CCCCCCSCCCCCCOC 62a_100011998445_100000700193 [0,1,0,0,0,0|2,0,0]=3 3959 B15R0.70 C=CCCCCCSCCCOCCOC 62a_100000700193_100011216529 [0,1,0,0,0,0|3,0,0]=4 3960 B15R0.70 C=CCCCCCSCCCOCCOC 62a_100011216529_100000700193 [0,1,0,0,0,0|3,0,0]=4 3961 B15R0.70 C=CCCCCCSCCOCCOCC 62a_100000700193_100011211534 [0,1,0,0,0,0|3,0,0]=4 3962 B15R0.70 C=CCCCCCSCCOCCOCC 62a_100011211534_100000700193 [0,1,0,0,0,0|3,0,0]=4 3963 B15R0.70 C=CCCCCNCCCC#CCCCC 2230a_100000703577_200000047210 [0,1,0,0,0,0|1,0,2]=4 3964 B15R0.70 C=CCCCCNCCCC#CCCCC 34a_100000703577_200000047210 [0,1,0,0,0,0|1,0,2]=4 3965 B15R0.70 C=CCCCCNCCCCC/C=C\CC 269862a_100000703577_100016288537 [0,1,0,0,0,0|1,0,2]=4 3966 B15R0.70 C=CCCCCNCCCCCCCCC 2230a_100000212291_100011215482 [0,1,0,0,0,0|1,0,0]=2 3967 B15R0.70 C=CCCCCNCCCCCCCCC 2230a_100000703577_100011214924 [0,1,0,0,0,0|1,0,0]=2 3968 B15R0.70 C=CCCCCNCCCCCCCCC 34a_100000212291_100011215482 [0,1,0,0,0,0|1,0,0]=2 3969 B15R0.70 C=CCCCCNCCCCCCCCC 34a_100000703577_100011214924 [0,1,0,0,0,0|1,0,0]=2 3970 B15R0.70 C=CCCCCNCCCCCCCCO 2230a_100000703577_100000033203 [0,1,0,0,0,0|2,0,0]=3 3971 B15R0.70 C=CCCCCNCCCCCCCCO 2230a_102515433106_100011215482 [0,1,0,0,0,0|2,0,0]=3 3972 B15R0.70 C=CCCCCNCCCCCCCCO 34a_100000703577_100000033203 [0,1,0,0,0,0|2,0,0]=3 3973 B15R0.70 C=CCCCCNCCCCCCCCO 34a_102515433106_100011215482 [0,1,0,0,0,0|2,0,0]=3 3974 B15R0.70 C=CCCCCNCCOCCOCCC 2230a_200011904461_100011215482 [0,1,0,0,0,0|3,0,0]=4 3975 B15R0.70 C=CCCCCNCCOCCOCCC 34a_200011904461_100011215482 [0,1,0,0,0,0|3,0,0]=4 3976 B15R0.70 C=CCCCCOC/C=C/CCCCCC 34a_200016276170_100011215482 [0,1,0,0,0,0|1,0,2]=4 3977 B15R0.70 C=CCCCCOC/C=C/CCCCCC 7a_200016276170_100011215482 [0,1,0,0,0,0|1,0,2]=4 3978 B15R0.70 C=CCCCCOCC#CCCCCCC 34a_200000037284_100011215482 [0,1,0,0,0,0|1,0,2]=4 3979 B15R0.70 C=CCCCCOCC#CCCCCCC 7a_200000037284_100011215482 [0,1,0,0,0,0|1,0,2]=4 3980 B15R0.70 C=CCCCCOCC/C=C\CCCCC 34a_100016277358_100011215482 [0,1,0,0,0,0|1,0,2]=4 3981 B15R0.70 C=CCCCCOCC/C=C\CCCCC 7a_100016277358_100011215482 [0,1,0,0,0,0|1,0,2]=4 3982 B15R0.70 C=CCCCCOCCC#CCCCCC 34a_200000042877_100011215482 [0,1,0,0,0,0|1,0,2]=4 3983 B15R0.70 C=CCCCCOCCC#CCCCCC 7a_200000042877_100011215482 [0,1,0,0,0,0|1,0,2]=4 3984 B15R0.70 C=CCCCCOCCCC#CCCCC 34a_100000766645_200000047210 [0,1,0,0,0,0|1,0,2]=4 3985 B15R0.70 C=CCCCCOCCCC#CCCCC 7a_100000766645_200000047210 [0,1,0,0,0,0|1,0,2]=4 3986 B15R0.70 C=CCCCCOCCCCC/C=C\CC 34a_100016268722_100011215482 [0,1,0,0,0,0|1,0,2]=4 3987 B15R0.70 C=CCCCCOCCCCC/C=C\CC 7a_100016268722_100011215482 [0,1,0,0,0,0|1,0,2]=4 3988 B15R0.70 C=CCCCCOCCCCCCCCBr 34a_100009813846_100011215482 [0,1,0,0,0,0|2,0,0]=3 3989 B15R0.70 C=CCCCCOCCCCCCCCBr 7a_100009813846_100011215482 [0,1,0,0,0,0|2,0,0]=3 3990 B15R0.70 C=CCCCCOCCCCCCCCC 34a_100000210712_100011215482 [0,1,0,0,0,0|1,0,0]=2 3991 B15R0.70 C=CCCCCOCCCCCCCCC 34a_100000766645_100011214924 [0,1,0,0,0,0|1,0,0]=2 3992 B15R0.70 C=CCCCCOCCCCCCCCC 7a_100000210712_100011215482 [0,1,0,0,0,0|1,0,0]=2 3993 B15R0.70 C=CCCCCOCCCCCCCCC 7a_100000766645_100000210328 [0,1,0,0,0,0|1,0,0]=2 3994 B15R0.70 C=CCCCCOCCCCCCCCCl 34a_100000033203_100011215482 [0,1,0,0,0,0|2,0,0]=3 3995 B15R0.70 C=CCCCCOCCCCCCCCCl 7a_100000033203_100011215482 [0,1,0,0,0,0|2,0,0]=3 3996 B15R0.70 C=CCCCCOCCCCCCCCN 34a_102515433106_100011215482 [0,1,0,0,0,0|2,0,0]=3 3997 B15R0.70 C=CCCCCOCCCCCCCCO 34a_100000766645_100000033203 [0,1,0,0,0,0|2,0,0]=3 3998 B15R0.70 C=CCCCCOCCCCCCCCO 7a_100000766645_100000033203 [0,1,0,0,0,0|2,0,0]=3 3999 B15R0.70 C=CCCCCOCCCCCNCCN 34a_103619048469_100011215482 [0,1,0,0,0,0|3,0,0]=4 4000 B15R0.70 C=CCCCCOCCCCNCCCC 34a_200011216965_100011215482 [0,1,0,0,0,0|2,0,0]=3 4001 B15R0.70 C=CCCCCOCCCCOCCCC 34a_200000760531_100011215482 [0,1,0,0,0,0|2,0,0]=3 4002 B15R0.70 C=CCCCCOCCCCOCCCC 7a_200000760531_100011215482 [0,1,0,0,0,0|2,0,0]=3 4003 B15R0.70 C=CCCCCOCCCOCCCOC 34a_200011215475_100011215482 [0,1,0,0,0,0|3,0,0]=4 4004 B15R0.70 C=CCCCCOCCCOCCCOC 7a_200011215475_100011215482 [0,1,0,0,0,0|3,0,0]=4 4005 B15R0.70 C=CCCCCOCCOCCCCCC 34a_100000691444_100011215482 [0,1,0,0,0,0|2,0,0]=3 4006 B15R0.70 C=CCCCCOCCOCCCCCC 7a_100000691444_100011215482 [0,1,0,0,0,0|2,0,0]=3 4007 B15R0.70 C=CCCCCSCCCC#CCCCC 62a_100011215482_200000047210 [0,1,0,0,0,0|1,0,2]=4 4008 B15R0.70 C=CCCCCSCCCC#CCCCC 62a_200000047210_100011215482 [0,1,0,0,0,0|1,0,2]=4 4009 B15R0.70 C=CCCCCSCCCCCCCCC 62a_100011215482_100000210670 [0,1,0,0,0,0|1,0,0]=2 4010 B15R0.70 C=CCCCCSCCCCCCCCO 62a_100000033203_100011215482 [0,1,0,0,0,0|2,0,0]=3 4011 B15R0.70 C=CCCCCSCCCCCCCCO 62a_100011215482_100000033203 [0,1,0,0,0,0|2,0,0]=3 4012 B15R0.70 C=CCCCNCCCCCCC#CCC 2230a_100000700776_200000036426 [0,1,0,0,0,0|1,0,2]=4 4013 B15R0.70 C=CCCCNCCCCCCC#CCC 34a_100000700776_200000036426 [0,1,0,0,0,0|1,0,2]=4 4014 B15R0.70 C=CCCCNCCCCCCCCCC 2230a_100000684558_100011713584 [0,1,0,0,0,0|1,0,0]=2 4015 B15R0.70 C=CCCCNCCCCCCCCCC 2230a_100000700776_100000210320 [0,1,0,0,0,0|1,0,0]=2 4016 B15R0.70 C=CCCCNCCCCCCCCCC 34a_100000684558_100000757094 [0,1,0,0,0,0|1,0,0]=2 4017 B15R0.70 C=CCCCNCCCCCCCCCC 34a_100000700776_100000210320 [0,1,0,0,0,0|1,0,0]=2 4018 B15R0.70 C=CCCCNCCCCCCCCCO 2230a_100000078944_100011713584 [0,1,0,0,0,0|2,0,0]=3 4019 B15R0.70 C=CCCCNCCCCCCCCCO 2230a_100000700776_100009813782 [0,1,0,0,0,0|2,0,0]=3 4020 B15R0.70 C=CCCCNCCCCCCCCCO 34a_100000078944_100000757094 [0,1,0,0,0,0|2,0,0]=3 4021 B15R0.70 C=CCCCNCCCCCCCCCO 34a_100000700776_100009813782 [0,1,0,0,0,0|2,0,0]=3 4022 B15R0.70 C=CCCCOCC#CCCCCCCC 34a_200000061759_100000757094 [0,1,0,0,0,0|1,0,2]=4 4023 B15R0.70 C=CCCCOCC#CCCCCCCC 7a_200000061759_100000757094 [0,1,0,0,0,0|1,0,2]=4 4024 B15R0.70 C=CCCCOCCC#CCCCCCC 34a_200000033163_100000757094 [0,1,0,0,0,0|1,0,2]=4 4025 B15R0.70 C=CCCCOCCC#CCCCCCC 7a_200000033163_100000757094 [0,1,0,0,0,0|1,0,2]=4 4026 B15R0.70 C=CCCCOCCC/C=C\CCCCC 34a_100020655193_100000757094 [0,1,0,0,0,0|1,0,2]=4 4027 B15R0.70 C=CCCCOCCC/C=C\CCCCC 7a_100020655193_100000757094 [0,1,0,0,0,0|1,0,2]=4 4028 B15R0.70 C=CCCCOCCCC/C=C/CCCC 34a_200020645093_100000757094 [0,1,0,0,0,0|1,0,2]=4 4029 B15R0.70 C=CCCCOCCCC/C=C/CCCC 7a_200020645093_100000757094 [0,1,0,0,0,0|1,0,2]=4 4030 B15R0.70 C=CCCCOCCCCC#CCCCC 34a_200000066234_100000757094 [0,1,0,0,0,0|1,0,2]=4 4031 B15R0.70 C=CCCCOCCCCC#CCCCC 7a_200000066234_100000757094 [0,1,0,0,0,0|1,0,2]=4 4032 B15R0.70 C=CCCCOCCCCCCC#CCC 34a_100000758997_200000036426 [0,1,0,0,0,0|1,0,2]=4 4033 B15R0.70 C=CCCCOCCCCCCC#CCC 7a_100000758997_200000036426 [0,1,0,0,0,0|1,0,2]=4 4034 B15R0.70 C=CCCCOCCCCCCCCCBr 34a_100009813782_100000757094 [0,1,0,0,0,0|2,0,0]=3 4035 B15R0.70 C=CCCCOCCCCCCCCCBr 7a_100009813782_100000757094 [0,1,0,0,0,0|2,0,0]=3 4036 B15R0.70 C=CCCCOCCCCCCCCCC 34a_100000210711_100000757094 [0,1,0,0,0,0|1,0,0]=2 4037 B15R0.70 C=CCCCOCCCCCCCCCC 34a_100000758997_100000210320 [0,1,0,0,0,0|1,0,0]=2 4038 B15R0.70 C=CCCCOCCCCCCCCCC 7a_100000210711_100000757094 [0,1,0,0,0,0|1,0,0]=2 4039 B15R0.70 C=CCCCOCCCCCCCCCC 7a_100000758997_100000210320 [0,1,0,0,0,0|1,0,0]=2 4040 B15R0.70 C=CCCCOCCCCCCCCCCl 34a_100009868337_100000757094 [0,1,0,0,0,0|2,0,0]=3 4041 B15R0.70 C=CCCCOCCCCCCCCCCl 7a_100009868337_100000757094 [0,1,0,0,0,0|2,0,0]=3 4042 B15R0.70 C=CCCCOCCCCCCCCCN 34a_100000078944_100000757094 [0,1,0,0,0,0|2,0,0]=3 4043 B15R0.70 C=CCCCOCCCCCCCCCO 34a_100000758997_100009813782 [0,1,0,0,0,0|2,0,0]=3 4044 B15R0.70 C=CCCCOCCCCCCCCCO 7a_100000758997_100009813782 [0,1,0,0,0,0|2,0,0]=3 4045 B15R0.70 C=CCCCOCCOCCOCCCC 34a_100011215186_100000757094 [0,1,0,0,0,0|3,0,0]=4 4046 B15R0.70 C=CCCCOCCOCCOCCCC 7a_100011215186_100000757094 [0,1,0,0,0,0|3,0,0]=4 4047 B15R0.70 C=CCCCSCCCCCCC#CCC 62a_100011713584_200000036426 [0,1,0,0,0,0|1,0,2]=4 4048 B15R0.70 C=CCCCSCCCCCCC#CCC 62a_200000036426_100000757094 [0,1,0,0,0,0|1,0,2]=4 4049 B15R0.70 C=CCCCSCCCCCCCCCC 62a_100011713584_100000210320 [0,1,0,0,0,0|1,0,0]=2 4050 B15R0.70 C=CCCCSCCCCCCCCCO 62a_100009813782_100000757094 [0,1,0,0,0,0|2,0,0]=3 4051 B15R0.70 C=CCCCSCCCCCCCCCO 62a_100011713584_100009813782 [0,1,0,0,0,0|2,0,0]=3 4052 B15R0.70 C=CCCNCCCCCCC/C=C\CC 269862a_100015191253_200025770492 [0,1,0,0,0,0|1,0,2]=4 4053 B15R0.70 C=CCCNCCCCCCCCCCC 2230a_100015191253_100011215454 [0,1,0,0,0,0|1,0,0]=2 4054 B15R0.70 C=CCCNCCCCCCCCCCC 2230a_200011215754_100000754431 [0,1,0,0,0,0|1,0,0]=2 4055 B15R0.70 C=CCCNCCCCCCCCCCC 34a_200011215754_100000754431 [0,1,0,0,0,0|1,0,0]=2 4056 B15R0.70 C=CCCNCCCCCCCCCCO 2230a_100000066964_100000754431 [0,1,0,0,0,0|2,0,0]=3 4057 B15R0.70 C=CCCNCCCCCCCCCCO 2230a_100015191253_100009813290 [0,1,0,0,0,0|2,0,0]=3 4058 B15R0.70 C=CCCNCCCCCCCCCCO 34a_100000066964_100000754431 [0,1,0,0,0,0|2,0,0]=3 4059 B15R0.70 C=CCCOC/C=C/CCCCCCCC 34a_200020667288_100000754431 [0,1,0,0,0,0|1,0,2]=4 4060 B15R0.70 C=CCCOC/C=C/CCCCCCCC 7a_200020667288_100000754431 [0,1,0,0,0,0|1,0,2]=4 4061 B15R0.70 C=CCCOCCCCCCCCCCBr 34a_100009813290_100000754431 [0,1,0,0,0,0|2,0,0]=3 4062 B15R0.70 C=CCCOCCCCCCCCCCBr 7a_100009813290_100000754431 [0,1,0,0,0,0|2,0,0]=3 4063 B15R0.70 C=CCCOCCCCCCCCCCC 34a_100000210809_100000754431 [0,1,0,0,0,0|1,0,0]=2 4064 B15R0.70 C=CCCOCCCCCCCCCCC 34a_100011205117_100011215454 [0,1,0,0,0,0|1,0,0]=2 4065 B15R0.70 C=CCCOCCCCCCCCCCC 7a_100000210809_100000754431 [0,1,0,0,0,0|1,0,0]=2 4066 B15R0.70 C=CCCOCCCCCCCCCCCl 34a_200000033068_100000754431 [0,1,0,0,0,0|2,0,0]=3 4067 B15R0.70 C=CCCOCCCCCCCCCCCl 7a_200000033068_100000754431 [0,1,0,0,0,0|2,0,0]=3 4068 B15R0.70 C=CCCOCCCCCCCCCCN 34a_100000066964_100000754431 [0,1,0,0,0,0|2,0,0]=3 4069 B15R0.70 C=CCCOCCCCCCCCCCO 34a_100011205117_100009813290 [0,1,0,0,0,0|2,0,0]=3 4070 B15R0.70 C=CCCSCCCCCCCCCCC 62a_100000754431_100011215454 [0,1,0,0,0,0|1,0,0]=2 4071 B15R0.70 C=CCCSCCCCCCCCCCO 62a_100000754431_200000033068 [0,1,0,0,0,0|2,0,0]=3 4072 B15R0.70 C=CCCSCCCCCCCCCCO 62a_100009813290_100000754431 [0,1,0,0,0,0|2,0,0]=3 4073 B15R0.70 C=CCNCCCCCCC#CCCCC 2230a_100020586998_200000043322 [0,1,0,0,0,0|1,0,2]=4 4074 B15R0.70 C=CCNCCCCCCCCCCCC 2230a_100000210451_100000210623 [0,1,0,0,0,0|1,0,0]=2 4075 B15R0.70 C=CCNCCCCCCCCCCCC 2230a_100020586998_100011215052 [0,1,0,0,0,0|1,0,0]=2 4076 B15R0.70 C=CCNCCCCCCCCCCCC 270004a_100020586998_100011218549 [0,1,0,0,0,0|1,0,0]=2 4077 B15R0.70 C=CCNCCCCCCCCCCCC 34a_100000210451_100015514636 [0,1,0,0,0,0|1,0,0]=2 4078 B15R0.70 C=CCNCCCCCCCCCCCO 2230a_100020586998_100009812471 [0,1,0,0,0,0|2,0,0]=3 4079 B15R0.70 C=CCOC/C=C/CCCCCCCCC 34a_100015232335_100015514636 [0,1,0,0,0,0|1,0,2]=4 4080 B15R0.70 C=CCOC/C=C/CCCCCCCCC 7a_100015232335_100015514636 [0,1,0,0,0,0|1,0,2]=4 4081 B15R0.70 C=CCOCCCCCCC#CCCCC 34a_200000210373_200000043322 [0,1,0,0,0,0|1,0,2]=4 4082 B15R0.70 C=CCOCCCCCCCCC#CCC 34a_200000031908_100015514636 [0,1,0,0,0,0|1,0,2]=4 4083 B15R0.70 C=CCOCCCCCCCCC#CCC 7a_200000031908_100015514636 [0,1,0,0,0,0|1,0,2]=4 4084 B15R0.70 C=CCOCCCCCCCCCCCBr 34a_100009812471_100015514636 [0,1,0,0,0,0|2,0,0]=3 4085 B15R0.70 C=CCOCCCCCCCCCCCBr 7a_100009812471_100015514636 [0,1,0,0,0,0|2,0,0]=3 4086 B15R0.70 C=CCOCCCCCCCCCCCC 34a_100000210810_100015514636 [0,1,0,0,0,0|1,0,0]=2 4087 B15R0.70 C=CCOCCCCCCCCCCCC 34a_200000210373_100000759014 [0,1,0,0,0,0|1,0,0]=2 4088 B15R0.70 C=CCOCCCCCCCCCCCC 7a_100000210810_100015514636 [0,1,0,0,0,0|1,0,0]=2 4089 B15R0.70 C=CCOCCCCCCCCCCCO 34a_200000210373_100009812471 [0,1,0,0,0,0|2,0,0]=3 4090 B15R0.70 C=CCOCCCCCCCCCOCC 34a_100009875440_100015514636 [0,1,0,0,0,0|2,0,0]=3 4091 B15R0.70 C=CCOCCCCCCCCCOCC 7a_100009875440_100015514636 [0,1,0,0,0,0|2,0,0]=3 4092 B15R0.70 C=CCOCCOCCCCCCCCC 34a_100000037705_100011214924 [0,1,0,0,0,0|2,0,0]=3 4093 B15R0.70 C=CCOCCOCCCCCCCCC 7a_100000037705_100000210328 [0,1,0,0,0,0|2,0,0]=3 4094 B15R0.70 C=CCOCCOCCCCCCCCO 34a_100000037705_100000033203 [0,1,0,0,0,0|3,0,0]=4 4095 B15R0.70 C=CCOCCOCCCCCCCCO 7a_100000037705_100000033203 [0,1,0,0,0,0|3,0,0]=4 4096 B15R0.70 C=CCOCCOCCOCCCCCC 34a_100000032842_100015514636 [0,1,0,0,0,0|3,0,0]=4 4097 B15R0.70 C=CCOCCOCCOCCCCCC 34a_100000065479_100000210314 [0,1,0,0,0,0|3,0,0]=4 4098 B15R0.70 C=CCOCCOCCOCCCCCC 7a_100000032842_100015514636 [0,1,0,0,0,0|3,0,0]=4 4099 B15R0.70 C=CCOCCOCCOCCCCCC 7a_100000065479_100000210314 [0,1,0,0,0,0|3,0,0]=4 4100 B15R0.70 C=CCSCCCCCCC#CCCCC 62a_100000210623_200000043322 [0,1,0,0,0,0|1,0,2]=4 4101 B15R0.70 C=CCSCCCCCCC#CCCCC 62a_200000043322_100000210623 [0,1,0,0,0,0|1,0,2]=4 4102 B15R0.70 C=CCSCCCCCCCCCCCC 62a_100000210623_100000759014 [0,1,0,0,0,0|1,0,0]=2 4103 B15R0.70 C=CCSCCCCCCCCCCCO 62a_100009812471_100000210623 [0,1,0,0,0,0|2,0,0]=3 4104 B15R0.70 C=COCCCCOCCCCCCCC 34a_100000031558_100000210759 [0,1,0,0,0,0|2,0,0]=3 4105 B15R0.70 C=COCCCCOCCCCCCCC 7a_100000031558_100000210759 [0,1,0,0,0,0|2,0,0]=3 4106 B15R0.70 C=COCCCCOCCCCCCCO 34a_100000031558_100000760002 [0,1,0,0,0,0|3,0,0]=4 4107 B15R0.70 C=COCCCCOCCCCCCCO 7a_100000031558_100000760002 [0,1,0,0,0,0|3,0,0]=4 4108 B15R0.70 C=COCCCCOCCCCCCOC 34a_100000031558_100011998445 [0,1,0,0,0,0|3,0,0]=4 4109 B15R0.70 C=COCCCCOCCCCCCOC 7a_100000031558_100011998445 [0,1,0,0,0,0|3,0,0]=4 4110 B15R0.70 C=COCCCNCCCCCCCCC 2230a_100000210767_100011214924 [0,1,0,0,0,0|2,0,0]=3 4111 B15R0.70 C=COCCCNCCCCCCCCC 34a_100000210767_100011214924 [0,1,0,0,0,0|2,0,0]=3 4112 B15R0.70 C=COCCCNCCCCCCCCO 2230a_100000210767_100000033203 [0,1,0,0,0,0|3,0,0]=4 4113 B15R0.70 C=COCCCNCCCCCCCCO 34a_100000210767_100000033203 [0,1,0,0,0,0|3,0,0]=4 4114 B15R0.70 C=COCCNCCCCCCCCCC 2230a_100000684558_100000039644 [0,1,0,0,0,0|2,0,0]=3 4115 B15R0.70 C=COCCNCCCCCCCCCC 34a_100000684558_100000039644 [0,1,0,0,0,0|2,0,0]=3 4116 B15R0.70 C=COCCNCCCCCCCCCO 2230a_100000078944_100000039644 [0,1,0,0,0,0|3,0,0]=4 4117 B15R0.70 C=COCCNCCCCCCCCCO 34a_100000078944_100000039644 [0,1,0,0,0,0|3,0,0]=4 4118 B15R0.70 C=COCCOCCCCCCCCCBr 34a_100009813782_100000039644 [0,1,0,0,0,0|3,0,0]=4 4119 B15R0.70 C=COCCOCCCCCCCCCBr 7a_100009813782_100000039644 [0,1,0,0,0,0|3,0,0]=4 4120 B15R0.70 C=COCCOCCCCCCCCCC 34a_100000033082_100000210320 [0,1,0,0,0,0|2,0,0]=3 4121 B15R0.70 C=COCCOCCCCCCCCCC 34a_100000210711_100000039644 [0,1,0,0,0,0|2,0,0]=3 4122 B15R0.70 C=COCCOCCCCCCCCCC 7a_100000210711_100000039644 [0,1,0,0,0,0|2,0,0]=3 4123 B15R0.70 C=COCCOCCCCCCCCCCl 34a_100009868337_100000039644 [0,1,0,0,0,0|3,0,0]=4 4124 B15R0.70 C=COCCOCCCCCCCCCCl 7a_100009868337_100000039644 [0,1,0,0,0,0|3,0,0]=4 4125 B15R0.70 C=COCCOCCCCCCCCCN 34a_100000078944_100000039644 [0,1,0,0,0,0|3,0,0]=4 4126 B15R0.70 C=COCCOCCCCCCCCCO 34a_100000033082_100009813782 [0,1,0,0,0,0|3,0,0]=4 4127 B15R0.70 C=COCCOCCOCCCCCCC 34a_100000039918_100000210614 [0,1,0,0,0,0|3,0,0]=4 4128 B15R0.70 C=COCCOCCOCCCCCCC 7a_100000039918_100000210614 [0,1,0,0,0,0|3,0,0]=4 4129 B15R0.70 C=COCCSCCCCCCCCCC 62a_100000039644_100000210320 [0,1,0,0,0,0|2,0,0]=3 4130 B15R0.70 C=COCCSCCCCCCCCCO 62a_100000039644_100009813782 [0,1,0,0,0,0|3,0,0]=4 4131 B15R0.70 C=COCCSCCCCCCCCCO 62a_100009813782_100000039644 [0,1,0,0,0,0|3,0,0]=4 4132 B15R0.70 CC#CCCOCCCCCCCCCC 34a_100000750427_100000210320 [0,1,0,0,0,0|1,0,2]=4 4133 B15R0.70 CC#CCNCCCCCCCCCCC 2230a_100000685387_100011215454 [0,1,0,0,0,0|1,0,2]=4 4134 B15R0.70 CC#CCNCCCCCCCCCCC 2230a_200011215754_100000748600 [0,1,0,0,0,0|1,0,2]=4 4135 B15R0.70 CC#CCNCCCCCCCCCCC 34a_100000685387_100011215454 [0,1,0,0,0,0|1,0,2]=4 4136 B15R0.70 CC#CCNCCCCCCCCCCC 34a_200011215754_100000748600 [0,1,0,0,0,0|1,0,2]=4 4137 B15R0.70 CC#CCOCCCCCCCCCCC 34a_100000210809_100000748600 [0,1,0,0,0,0|1,0,2]=4 4138 B15R0.70 CC#CCOCCCCCCCCCCC 34a_100000761923_100011215454 [0,1,0,0,0,0|1,0,2]=4 4139 B15R0.70 CC#CCOCCCCCCCCCCC 7a_100000210809_100000748600 [0,1,0,0,0,0|1,0,2]=4 4140 B15R0.70 CC#CCSCCCCCCCCCCC 62a_100000748600_100011215454 [0,1,0,0,0,0|1,0,2]=4 4141 B15R0.70 CC/C=C/CCCCCCCCCCOC 34a_200025759790_200000210301 [0,1,0,0,0,0|2,0,1]=4 4142 B15R0.70 CC/C=C/CCCCCCCCCCOC 7a_200025759790_200000210301 [0,1,0,0,0,0|2,0,1]=4 4143 B15R0.70 CC/C=C/CCCCCCCCCCO[13CH3] 34a_200025759790_200025704644 [0,1,0,0,0,0|2,0,1]=4 4144 B15R0.70 CC/C=C/CCCCCCCCCCO[13CH3] 7a_200025759790_200025704644 [0,1,0,0,0,0|2,0,1]=4 4145 B15R0.70 CC/C=C/CCCOCCCCCCCC 34a_100016287902_100000210759 [0,1,0,0,0,0|2,0,1]=4 4146 B15R0.70 CC/C=C/CCCOCCCCCCCC 7a_100016287902_100000210759 [0,1,0,0,0,0|2,0,1]=4 4147 B15R0.70 CC/C=C\CCCCCCCNCCCC 269862a_100000102301_200025770492 [0,1,0,0,0,0|2,0,1]=4 4148 B15R0.70 CC/C=C\CCCCCNCCCCCC 269862a_100000210581_100016288537 [0,1,0,0,0,0|2,0,1]=4 4149 B15R0.70 CC/C=C\CCCCCOCCCCC=O 7a_100016268722_100000139335 [0,1,0,0,0,0|0,0,2]=3 4150 B15R0.70 CC/C=C\CCCCCOCCCCCC 34a_100016268722_100000210314 [0,1,0,0,0,0|2,0,1]=4 4151 B15R0.70 CC/C=C\CCCCCOCCCCCC 7a_100016268722_100000210314 [0,1,0,0,0,0|2,0,1]=4 4152 B15R0.70 CC/C=C\CCCCOCCCCCC=O 7a_100016287862_100000139337 [0,1,0,0,0,0|0,0,2]=3 4153 B15R0.70 CC/C=C\CCCCOCCCCCCC 34a_100016287862_100000210614 [0,1,0,0,0,0|2,0,1]=4 4154 B15R0.70 CC/C=C\CCCCOCCCCCCC 7a_100016287862_100000210614 [0,1,0,0,0,0|2,0,1]=4 4155 B15R0.70 CC/C=C\CCNCCCCCCCCC 2230a_100000212291_100015370543 [0,1,0,0,0,0|2,0,1]=4 4156 B15R0.70 CC/C=C\CCNCCCCCCCCC 34a_100000212291_100015370543 [0,1,0,0,0,0|2,0,1]=4 4157 B15R0.70 CC/C=C\CCOCCCCCCCCC 34a_100000210712_100015370543 [0,1,0,0,0,0|2,0,1]=4 4158 B15R0.70 CC/C=C\CCOCCCCCCCCC 34a_100016288707_100011214924 [0,1,0,0,0,0|2,0,1]=4 4159 B15R0.70 CC/C=C\CCOCCCCCCCCC 7a_100000210712_100015370543 [0,1,0,0,0,0|2,0,1]=4 4160 B15R0.70 CC/C=C\CCOCCCCCCCCC 7a_100016288707_100000210328 [0,1,0,0,0,0|2,0,1]=4 4161 B15R0.70 CC/C=C\CCSCCCCCCCCC 62a_100015370543_100000210670 [0,1,0,0,0,0|2,0,1]=4 4162 B15R0.70 CC/C=C\CNCCCCCCCCCC 2230a_100000684558_100103147603 [0,1,0,0,0,0|2,0,1]=4 4163 B15R0.70 CC/C=C\CNCCCCCCCCCC 34a_100000684558_100103147603 [0,1,0,0,0,0|2,0,1]=4 4164 B15R0.70 CC/C=C\COCCCCCCCCCC 34a_100000210711_100103147603 [0,1,0,0,0,0|2,0,1]=4 4165 B15R0.70 CC/C=C\COCCCCCCCCCC 34a_100016268518_100000210320 [0,1,0,0,0,0|2,0,1]=4 4166 B15R0.70 CC/C=C\COCCCCCCCCCC 7a_100000210711_100103147603 [0,1,0,0,0,0|2,0,1]=4 4167 B15R0.70 CC/C=C\CSCCCCCCCCCC 62a_100103147603_100000210320 [0,1,0,0,0,0|2,0,1]=4 4168 B15R0.70 CC=C=CCCOCCCCCCCCC 34a_100011020354_100011214924 [0,1,0,0,0,0|1,0,2]=4 4169 B15R0.70 CC=CCCCOCCCCCCCCC 34a_100020645299_100011214924 [0,1,0,0,0,0|1,0,1]=3 4170 B15R0.70 CC=CCCCOCCCCCCCCO 34a_100020645299_100000033203 [0,1,0,0,0,0|2,0,1]=4 4171 B15R0.70 CC=CCNCCCCCCCCCCC 2230a_200011215754_100000070051 [0,1,0,0,0,0|1,0,1]=3 4172 B15R0.70 CC=CCNCCCCCCCCCCC 34a_200011215754_100000070051 [0,1,0,0,0,0|1,0,1]=3 4173 B15R0.70 CC=CCNCCCCCCCCCCO 2230a_100000066964_100000070051 [0,1,0,0,0,0|2,0,1]=4 4174 B15R0.70 CC=CCNCCCCCCCCCCO 34a_100000066964_100000070051 [0,1,0,0,0,0|2,0,1]=4 4175 B15R0.70 CC=CCOCCCCCCCCCCBr 34a_100009813290_100000070051 [0,1,0,0,0,0|2,0,1]=4 4176 B15R0.70 CC=CCOCCCCCCCCCCBr 7a_100009813290_100000070051 [0,1,0,0,0,0|2,0,1]=4 4177 B15R0.70 CC=CCOCCCCCCCCCCC 34a_100000210809_100000070051 [0,1,0,0,0,0|1,0,1]=3 4178 B15R0.70 CC=CCOCCCCCCCCCCC 7a_100000210809_100000070051 [0,1,0,0,0,0|1,0,1]=3 4179 B15R0.70 CC=CCOCCCCCCCCCCCl 34a_200000033068_100000070051 [0,1,0,0,0,0|2,0,1]=4 4180 B15R0.70 CC=CCOCCCCCCCCCCCl 7a_200000033068_100000070051 [0,1,0,0,0,0|2,0,1]=4 4181 B15R0.70 CC=CCOCCCCCCCCCCN 34a_100000066964_100000070051 [0,1,0,0,0,0|2,0,1]=4 4182 B15R0.70 CC=CCSCCCCCCCCCCC 62a_100000070051_100011215454 [0,1,0,0,0,0|1,0,1]=3 4183 B15R0.70 CC=CCSCCCCCCCCCCO 62a_100000070051_200000033068 [0,1,0,0,0,0|2,0,1]=4 4184 B15R0.70 CC=CCSCCCCCCCCCCO 62a_100009813290_100000070051 [0,1,0,0,0,0|2,0,1]=4 4185 B15R0.70 CCC#CCCCCCCCCOCC=O 34a_200000031908_200009817547 [0,1,0,0,0,0|0,0,2]=3 4186 B15R0.70 CCC#CCCCCCCCCOCC=O 7a_200000031908_200015260668 [0,1,0,0,0,0|0,0,2]=3 4187 B15R0.70 CCC#CCCCCCCSCCCC=O 62a_200000036426_200011292268 [0,1,0,0,0,0|0,0,2]=3 4188 B15R0.70 CCC#CCCCCCCSCCCC=O 62a_200011292268_200000036426 [0,1,0,0,0,0|0,0,2]=3 4189 B15R0.70 CCCC/C=C/CCCCOCCCC=O 7a_200020645093_200011292268 [0,1,0,0,0,0|0,0,2]=3 4190 B15R0.70 CCCC/C=C\CCCCCCCCOC 34a_100020587526_200000210301 [0,1,0,0,0,0|2,0,1]=4 4191 B15R0.70 CCCC/C=C\CCCCCCCCOC 7a_100020587526_200000210301 [0,1,0,0,0,0|2,0,1]=4 4192 B15R0.70 CCCC/C=C\CCCCCCCCO[13CH3] 34a_100020587526_200025704644 [0,1,0,0,0,0|2,0,1]=4 4193 B15R0.70 CCCC/C=C\CCCCCCCCO[13CH3] 7a_100020587526_200025704644 [0,1,0,0,0,0|2,0,1]=4 4194 B15R0.70 CCCC/C=C\CCOCCCCCC=O 7a_200016286491_100000139337 [0,1,0,0,0,0|0,0,2]=3 4195 B15R0.70 CCCCC#CCCCCCCSCC=O 62a_200000043322_200015260668 [0,1,0,0,0,0|0,0,2]=3 4196 B15R0.70 CCCCC#CCCCCCCSCC=O 62a_200015260668_200000043322 [0,1,0,0,0,0|0,0,2]=3 4197 B15R0.70 CCCCC#CCCCCOCCCC=O 7a_200000066234_200011292268 [0,1,0,0,0,0|0,0,2]=3 4198 B15R0.70 CCCCC#CCCCSCCCCC=O 62a_100000139335_200000047210 [0,1,0,0,0,0|0,0,2]=3 4199 B15R0.70 CCCCC#CCCCSCCCCC=O 62a_200000047210_100000139335 [0,1,0,0,0,0|0,0,2]=3 4200 B15R0.70 CCCCC#CCCOCCCCCC=O 7a_100000037610_100000139337 [0,1,0,0,0,0|0,0,2]=3 4201 B15R0.70 CCCCC/C=C/COCCCCCC=O 7a_100016258190_100000139337 [0,1,0,0,0,0|0,0,2]=3 4202 B15R0.70 CCCCC/C=C\CCCOCCCC=O 7a_100020655193_200011292268 [0,1,0,0,0,0|0,0,2]=3 4203 B15R0.70 CCCCC/C=C\CCOCCCCC=O 7a_100016277358_100000139335 [0,1,0,0,0,0|0,0,2]=3 4204 B15R0.70 CCCCCC#CCCOCCCCC=O 7a_200000042877_100000139335 [0,1,0,0,0,0|0,0,2]=3 4205 B15R0.70 CCCCCC#CCOCCCCCC=O 7a_200000033628_100000139337 [0,1,0,0,0,0|0,0,2]=3 4206 B15R0.70 CCCCCC#CCSCCCCCC=O 62a_100000139337_100009816472 [0,1,0,0,0,0|0,0,2]=3 4207 B15R0.70 CCCCCC#CCSCCCCCC=O 62a_100009816472_100000139337 [0,1,0,0,0,0|0,0,2]=3 4208 B15R0.70 CCCCCC/C=C/COCCCCC=O 7a_200016276170_100000139335 [0,1,0,0,0,0|0,0,2]=3 4209 B15R0.70 CCCCCCC#CCCOCCCC=O 7a_200000033163_200011292268 [0,1,0,0,0,0|0,0,2]=3 4210 B15R0.70 CCCCCCC#CCOCCCCC=O 7a_200000037284_100000139335 [0,1,0,0,0,0|0,0,2]=3 4211 B15R0.70 CCCCCCCC#CCOCCCC=O 7a_200000061759_200011292268 [0,1,0,0,0,0|0,0,2]=3 4212 B15R0.70 CCCCCCCCC/C=C/COCC=O 34a_100015232335_200009817547 [0,1,0,0,0,0|0,0,2]=3 4213 B15R0.70 CCCCCCCCC/C=C/COCC=O 7a_100015232335_200015260668 [0,1,0,0,0,0|0,0,2]=3 4214 B15R0.70 CCCCCCCCCCCCCCNC 2230a_100011217771_200000210301 [0,1,0,0,0,0|1,0,1]=3 4215 B15R0.70 CCCCCCCCCCCCCCNC 2230a_106832991635_100011215471 [0,1,0,0,0,0|1,0,1]=3 4216 B15R0.70 CCCCCCCCCCCCCCNC 270004a_106832991635_200011216147 [0,1,0,0,0,0|1,0,1]=3 4217 B15R0.70 CCCCCCCCCCCCCCNC 34a_100011217771_200000210301 [0,1,0,0,0,0|1,0,1]=3 4218 B15R0.70 CCCCCCCCCCCCCCNC 34a_100102657272_100011215471 [0,1,0,0,0,0|1,0,1]=3 4219 B15R0.70 CCCCCCCCCCCCCCNC 7a_106832991635_100011215471 [0,1,0,0,0,0|1,0,1]=3 4220 B15R0.70 CCCCCCCCCCCCCCN[13CH3] 2230a_100011217771_200025704644 [0,1,0,0,0,0|1,0,1]=3 4221 B15R0.70 CCCCCCCCCCCCCCN[13CH3] 34a_100011217771_200025704644 [0,1,0,0,0,0|1,0,1]=3 4222 B15R0.70 CCCCCCCCCCCCCCOC 34a_100000210739_200000210301 [0,1,0,0,0,0|0,0,2]=3 4223 B15R0.70 CCCCCCCCCCCCCCOC 34a_100138415774_100011215471 [0,1,0,0,0,0|0,0,2]=3 4224 B15R0.70 CCCCCCCCCCCCCCOC 7a_100000210739_200000210301 [0,1,0,0,0,0|0,0,2]=3 4225 B15R0.70 CCCCCCCCCCCCCCO[13CH3] 34a_100000210739_200025704644 [0,1,0,0,0,0|0,0,2]=3 4226 B15R0.70 CCCCCCCCCCCCCCO[13CH3] 7a_100000210739_200025704644 [0,1,0,0,0,0|0,0,2]=3 4227 B15R0.70 CCCCCCCCCCCCCNCC 2230a_100011215765_100000210202 [0,1,0,0,0,0|1,0,1]=3 4228 B15R0.70 CCCCCCCCCCCCCNCC 2230a_100015525214_100000210684 [0,1,0,0,0,0|1,0,1]=3 4229 B15R0.70 CCCCCCCCCCCCCNCC 270004a_100015525214_200011215488 [0,1,0,0,0,0|1,0,1]=3 4230 B15R0.70 CCCCCCCCCCCCCNCC 34a_100011215765_100000210202 [0,1,0,0,0,0|1,0,1]=3 4231 B15R0.70 CCCCCCCCCCCCCNCF 34a_100011215765_100015361967 [0,1,0,0,0,0|1,0,1]=3 4232 B15R0.70 CCCCCCCCCCCCCOCC 34a_100000185773_100000210202 [0,1,0,0,0,0|1,0,1]=3 4233 B15R0.70 CCCCCCCCCCCCCOCC 34a_100121572206_100000210684 [0,1,0,0,0,0|1,0,1]=3 4234 B15R0.70 CCCCCCCCCCCCCOCC 7a_100000185773_100000210202 [0,1,0,0,0,0|1,0,1]=3 4235 B15R0.70 CCCCCCCCCCCCCOCF 34a_100000185773_100015361967 [0,1,0,0,0,0|1,0,1]=3 4236 B15R0.70 CCCCCCCCCCCCCOCF 7a_100000185773_100015361967 [0,1,0,0,0,0|1,0,1]=3 4237 B15R0.70 CCCCCCCCCCCCCSCF 62a_100015361967_100011934334 [0,1,0,0,0,0|1,0,1]=3 4238 B15R0.70 CCCCCCCCCCCCNCC#N 2230a_100000210451_100011215382 [0,1,0,0,0,0|1,0,1]=3 4239 B15R0.70 CCCCCCCCCCCCNCC=O 2230a_100000210451_200015260668 [0,1,0,0,0,0|0,0,0]=1 4240 B15R0.70 CCCCCCCCCCCCNCC=O 34a_100000210451_200009817547 [0,1,0,0,0,0|0,0,0]=1 4241 B15R0.70 CCCCCCCCCCCCNCCC 2230a_100000210451_100000210303 [0,1,0,0,0,0|1,0,1]=3 4242 B15R0.70 CCCCCCCCCCCCNCCC 270004a_100020643023_100011218549 [0,1,0,0,0,0|1,0,1]=3 4243 B15R0.70 CCCCCCCCCCCCNCCC 34a_100000210451_100000210303 [0,1,0,0,0,0|1,0,1]=3 4244 B15R0.70 CCCCCCCCCCCCNCCF 2230a_100000210451_100011217306 [0,1,0,0,0,0|1,0,1]=3 4245 B15R0.70 CCCCCCCCCCCCNCCF 34a_100000210451_100011217306 [0,1,0,0,0,0|1,0,1]=3 4246 B15R0.70 CCCCCCCCCCCCNCCF 34a_100000724931_100000759014 [0,1,0,0,0,0|1,0,1]=3 4247 B15R0.70 CCCCCCCCCCCCNCCO 2230a_100000210451_100000211926 [0,1,0,0,0,0|0,0,2]=3 4248 B15R0.70 CCCCCCCCCCCCNCCO 2230a_100016997473_100011215052 [0,1,0,0,0,0|0,0,2]=3 4249 B15R0.70 CCCCCCCCCCCCNCCO 270004a_100000210304_100011218549 [0,1,0,0,0,0|0,0,2]=3 4250 B15R0.70 CCCCCCCCCCCCNCCO 34a_100000210451_100000211926 [0,1,0,0,0,0|0,0,2]=3 4251 B15R0.70 CCCCCCCCCCCCNCCO 34a_100016990907_100000759014 [0,1,0,0,0,0|0,0,2]=3 4252 B15R0.70 CCCCCCCCCCCCNCOC 2230a_100000210451_100000766300 [0,1,0,0,0,0|2,0,0]=3 4253 B15R0.70 CCCCCCCCCCCCNCSC 2230a_100000210451_100011218213 [0,1,0,0,0,0|2,0,0]=3 4254 B15R0.70 CCCCCCCCCCCCNCSC 34a_100000210451_100011218213 [0,1,0,0,0,0|2,0,0]=3 4255 B15R0.70 CCCCCCCCCCCCOCC#N 7a_100000210810_100011215382 [0,1,0,0,0,0|1,0,1]=3 4256 B15R0.70 CCCCCCCCCCCCOCC=O 34a_100000210810_200009817547 [0,1,0,0,0,0|0,0,0]=1 4257 B15R0.70 CCCCCCCCCCCCOCC=O 7a_100000210810_200015260668 [0,1,0,0,0,0|0,0,0]=1 4258 B15R0.70 CCCCCCCCCCCCOCCBr 34a_100000211926_100000759014 [0,1,0,0,0,0|1,0,1]=3 4259 B15R0.70 CCCCCCCCCCCCOCCC 34a_100000210258_100000759014 [0,1,0,0,0,0|1,0,1]=3 4260 B15R0.70 CCCCCCCCCCCCOCCC 34a_100000210810_100000210303 [0,1,0,0,0,0|1,0,1]=3 4261 B15R0.70 CCCCCCCCCCCCOCCC 7a_100000210810_100000210303 [0,1,0,0,0,0|1,0,1]=3 4262 B15R0.70 CCCCCCCCCCCCOCCF 34a_100000210810_100011217306 [0,1,0,0,0,0|1,0,1]=3 4263 B15R0.70 CCCCCCCCCCCCOCCF 7a_100000210810_100011217306 [0,1,0,0,0,0|1,0,1]=3 4264 B15R0.70 CCCCCCCCCCCCOCCN 34a_100000210304_100000759014 [0,1,0,0,0,0|1,0,1]=3 4265 B15R0.70 CCCCCCCCCCCCOCCO 34a_100000210810_100000211926 [0,1,0,0,0,0|0,0,2]=3 4266 B15R0.70 CCCCCCCCCCCCOCCO 7a_100000210810_100000211926 [0,1,0,0,0,0|0,0,2]=3 4267 B15R0.70 CCCCCCCCCCCCOCSC 34a_100000210810_100011218213 [0,1,0,0,0,0|2,0,0]=3 4268 B15R0.70 CCCCCCCCCCCCSCC#N 62a_100011215382_100000759014 [0,1,0,0,0,0|1,0,1]=3 4269 B15R0.70 CCCCCCCCCCCCSCC=O 62a_200015260668_100000759014 [0,1,0,0,0,0|0,0,0]=1 4270 B15R0.70 CCCCCCCCCCCCSCCF 62a_100011217306_100000759014 [0,1,0,0,0,0|1,0,1]=3 4271 B15R0.70 CCCCCCCCCCCCSCCO 62a_100000211926_100000759014 [0,1,0,0,0,0|0,0,2]=3 4272 B15R0.70 CCCCCCCCCCCCSCOC 62a_100000766300_100000759014 [0,1,0,0,0,0|2,0,0]=3 4273 B15R0.70 CCCCCCCCCCCCSCSC 62a_100011218213_100000759014 [0,1,0,0,0,0|2,0,0]=3 4274 B15R0.70 CCCCCCCCCCCNCCC#N 2230a_200011215754_100011215226 [0,1,0,0,0,0|1,0,1]=3 4275 B15R0.70 CCCCCCCCCCCNCCCC 2230a_100000102301_100011215454 [0,1,0,0,0,0|1,0,1]=3 4276 B15R0.70 CCCCCCCCCCCNCCCC 2230a_200011215754_100000210211 [0,1,0,0,0,0|1,0,1]=3 4277 B15R0.70 CCCCCCCCCCCNCCCC 34a_200011215754_100000210210 [0,1,0,0,0,0|1,0,1]=3 4278 B15R0.70 CCCCCCCCCCCNCCCC 7a_106832991798_100011215454 [0,1,0,0,0,0|1,0,1]=3 4279 B15R0.70 CCCCCCCCCCCNCCCF 2230a_100015189416_100011215454 [0,1,0,0,0,0|1,0,1]=3 4280 B15R0.70 CCCCCCCCCCCNCCCF 2230a_200011215754_100011934791 [0,1,0,0,0,0|1,0,1]=3 4281 B15R0.70 CCCCCCCCCCCNCCCF 34a_100015189416_100011215454 [0,1,0,0,0,0|1,0,1]=3 4282 B15R0.70 CCCCCCCCCCCNCCCF 34a_200011215754_100011934791 [0,1,0,0,0,0|1,0,1]=3 4283 B15R0.70 CCCCCCCCCCCNCCCO 2230a_200011215754_100000230001 [0,1,0,0,0,0|0,0,2]=3 4284 B15R0.70 CCCCCCCCCCCNCCCO 34a_200011215754_100000230001 [0,1,0,0,0,0|0,0,2]=3 4285 B15R0.70 CCCCCCCCCCCNCCOC 2230a_100000209980_100011215454 [0,1,0,0,0,0|2,0,0]=3 4286 B15R0.70 CCCCCCCCCCCNCCOC 2230a_200011215754_100011201679 [0,1,0,0,0,0|2,0,0]=3 4287 B15R0.70 CCCCCCCCCCCNCCOC 34a_200011215754_100011201679 [0,1,0,0,0,0|2,0,0]=3 4288 B15R0.70 CCCCCCCCCCCNCCSC 2230a_100020590264_100011215454 [0,1,0,0,0,0|2,0,0]=3 4289 B15R0.70 CCCCCCCCCCCNCCSC 2230a_200011215754_100000751147 [0,1,0,0,0,0|2,0,0]=3 4290 B15R0.70 CCCCCCCCCCCNCCSC 34a_200011215754_100000212216 [0,1,0,0,0,0|2,0,0]=3 4291 B15R0.70 CCCCCCCCCCCOCCC#N 7a_100000210809_100000184422 [0,1,0,0,0,0|1,0,1]=3 4292 B15R0.70 CCCCCCCCCCCOCCCBr 34a_100011217188_100011215454 [0,1,0,0,0,0|1,0,1]=3 4293 B15R0.70 CCCCCCCCCCCOCCCC 34a_100000210227_100011215454 [0,1,0,0,0,0|1,0,1]=3 4294 B15R0.70 CCCCCCCCCCCOCCCC 34a_100000210809_100000210210 [0,1,0,0,0,0|1,0,1]=3 4295 B15R0.70 CCCCCCCCCCCOCCCC 7a_100000210227_100011215454 [0,1,0,0,0,0|1,0,1]=3 4296 B15R0.70 CCCCCCCCCCCOCCCC 7a_100000210809_100000210211 [0,1,0,0,0,0|1,0,1]=3 4297 B15R0.70 CCCCCCCCCCCOCCCCl 34a_100000230001_100011215454 [0,1,0,0,0,0|1,0,1]=3 4298 B15R0.70 CCCCCCCCCCCOCCCF 34a_100000210809_100011934791 [0,1,0,0,0,0|1,0,1]=3 4299 B15R0.70 CCCCCCCCCCCOCCCF 34a_100000759539_100011215454 [0,1,0,0,0,0|1,0,1]=3 4300 B15R0.70 CCCCCCCCCCCOCCCF 7a_100000210809_100011934791 [0,1,0,0,0,0|1,0,1]=3 4301 B15R0.70 CCCCCCCCCCCOCCCN 34a_100000182051_100011215454 [0,1,0,0,0,0|1,0,1]=3 4302 B15R0.70 CCCCCCCCCCCOCCCO 34a_100000210809_100000230001 [0,1,0,0,0,0|0,0,2]=3 4303 B15R0.70 CCCCCCCCCCCOCCCO 7a_100000210809_100011215043 [0,1,0,0,0,0|0,0,2]=3 4304 B15R0.70 CCCCCCCCCCCOCCOC 34a_100000210237_100011215454 [0,1,0,0,0,0|2,0,0]=3 4305 B15R0.70 CCCCCCCCCCCOCCOC 34a_100000210809_100011201679 [0,1,0,0,0,0|2,0,0]=3 4306 B15R0.70 CCCCCCCCCCCOCCOC 34a_100010166600_200000210301 [0,1,0,0,0,0|2,0,0]=3 4307 B15R0.70 CCCCCCCCCCCOCCOC 7a_100000210809_100000233755 [0,1,0,0,0,0|2,0,0]=3 4308 B15R0.70 CCCCCCCCCCCOCCOC 7a_100010166600_200000210301 [0,1,0,0,0,0|2,0,0]=3 4309 B15R0.70 CCCCCCCCCCCOCCON 34a_100000700252_100011215454 [0,1,0,0,0,0|2,0,0]=3 4310 B15R0.70 CCCCCCCCCCCOCCO[13CH3] 34a_100010166600_200025704644 [0,1,0,0,0,0|2,0,0]=3 4311 B15R0.70 CCCCCCCCCCCOCCO[13CH3] 7a_100010166600_200025704644 [0,1,0,0,0,0|2,0,0]=3 4312 B15R0.70 CCCCCCCCCCCOCCSC 34a_100000210809_100000212216 [0,1,0,0,0,0|2,0,0]=3 4313 B15R0.70 CCCCCCCCCCCOCCSC 34a_100000230434_100011215454 [0,1,0,0,0,0|2,0,0]=3 4314 B15R0.70 CCCCCCCCCCCOCCSC 7a_100000210809_100000212216 [0,1,0,0,0,0|2,0,0]=3 4315 B15R0.70 CCCCCCCCCCCOCCSC 7a_100000230434_100011215454 [0,1,0,0,0,0|2,0,0]=3 4316 B15R0.70 CCCCCCCCCCCSCCC#N 62a_100011215226_100011215454 [0,1,0,0,0,0|1,0,1]=3 4317 B15R0.70 CCCCCCCCCCCSCCCF 62a_100011934791_100011215454 [0,1,0,0,0,0|1,0,1]=3 4318 B15R0.70 CCCCCCCCCCCSCCCO 62a_100011215043_100011215454 [0,1,0,0,0,0|0,0,2]=3 4319 B15R0.70 CCCCCCCCCCCSCCOC 62a_100000233755_100011215454 [0,1,0,0,0,0|2,0,0]=3 4320 B15R0.70 CCCCCCCCCCCSCCSC 62a_100000212216_100011215454 [0,1,0,0,0,0|2,0,0]=3 4321 B15R0.70 CCCCCCCCCCCSCOCC 62a_100000739092_100011215454 [0,1,0,0,0,0|2,0,1]=4 4322 B15R0.70 CCCCCCCCCCCSCSC#N 62a_100000211825_100011215454 [0,1,0,0,0,0|2,0,1]=4 4323 B15R0.70 CCCCCCCCCCNCCCC#N 2230a_100000684558_100000687738 [0,1,0,0,0,0|1,0,1]=3 4324 B15R0.70 CCCCCCCCCCNCCCC=O 2230a_100000684558_200011292268 [0,1,0,0,0,0|0,0,0]=1 4325 B15R0.70 CCCCCCCCCCNCCCCC 2230a_100000209983_100000210320 [0,1,0,0,0,0|1,0,1]=3 4326 B15R0.70 CCCCCCCCCCNCCCCC 2230a_100000684558_100000210326 [0,1,0,0,0,0|1,0,1]=3 4327 B15R0.70 CCCCCCCCCCNCCCCC 34a_100000684558_100000718602 [0,1,0,0,0,0|1,0,1]=3 4328 B15R0.70 CCCCCCCCCCNCCCCF 2230a_100000684558_100000729493 [0,1,0,0,0,0|1,0,1]=3 4329 B15R0.70 CCCCCCCCCCNCCCCF 34a_100000684558_100000729493 [0,1,0,0,0,0|1,0,1]=3 4330 B15R0.70 CCCCCCCCCCNCCCCO 2230a_100000684558_100000210776 [0,1,0,0,0,0|0,0,2]=3 4331 B15R0.70 CCCCCCCCCCNCCCCO 2230a_100000750430_100000210320 [0,1,0,0,0,0|0,0,2]=3 4332 B15R0.70 CCCCCCCCCCNCCCCO 34a_100000684558_100011216708 [0,1,0,0,0,0|0,0,2]=3 4333 B15R0.70 CCCCCCCCCCNCCCCO 34a_100000750430_100000210320 [0,1,0,0,0,0|0,0,2]=3 4334 B15R0.70 CCCCCCCCCCNCCCOC 2230a_100000684558_100000740836 [0,1,0,0,0,0|2,0,0]=3 4335 B15R0.70 CCCCCCCCCCNCCCOC 34a_100000684558_100000740836 [0,1,0,0,0,0|2,0,0]=3 4336 B15R0.70 CCCCCCCCCCNCCCOC 34a_100150723488_100000210320 [0,1,0,0,0,0|2,0,0]=3 4337 B15R0.70 CCCCCCCCCCNCCCSC 2230a_100000749238_100000210320 [0,1,0,0,0,0|2,0,0]=3 4338 B15R0.70 CCCCCCCCCCNCCOCC 2230a_100000684558_100011215890 [0,1,0,0,0,0|2,0,1]=4 4339 B15R0.70 CCCCCCCCCCNCCOCC 2230a_102516460346_100000210320 [0,1,0,0,0,0|2,0,1]=4 4340 B15R0.70 CCCCCCCCCCNCCOCC 34a_100000684558_100000210147 [0,1,0,0,0,0|2,0,1]=4 4341 B15R0.70 CCCCCCCCCCNCCOCC 34a_102516460346_100000210320 [0,1,0,0,0,0|2,0,1]=4 4342 B15R0.70 CCCCCCCCCCNCCSCC 2230a_100000106463_100000210320 [0,1,0,0,0,0|2,0,1]=4 4343 B15R0.70 CCCCCCCCCCNCCSCC 2230a_100000684558_100000757381 [0,1,0,0,0,0|2,0,1]=4 4344 B15R0.70 CCCCCCCCCCNCCSCC 34a_100000684558_100000757381 [0,1,0,0,0,0|2,0,1]=4 4345 B15R0.70 CCCCCCCCCCOCCCC#N 7a_100000210711_100000687738 [0,1,0,0,0,0|1,0,1]=3 4346 B15R0.70 CCCCCCCCCCOCCCC=O 7a_100000210711_200011292268 [0,1,0,0,0,0|0,0,0]=1 4347 B15R0.70 CCCCCCCCCCOCCCCBr 34a_100011216708_100000210320 [0,1,0,0,0,0|1,0,1]=3 4348 B15R0.70 CCCCCCCCCCOCCCCC 34a_100000210253_100000210320 [0,1,0,0,0,0|1,0,1]=3 4349 B15R0.70 CCCCCCCCCCOCCCCC 34a_100000210711_100000718602 [0,1,0,0,0,0|1,0,1]=3 4350 B15R0.70 CCCCCCCCCCOCCCCC 7a_100000210253_100000210320 [0,1,0,0,0,0|1,0,1]=3 4351 B15R0.70 CCCCCCCCCCOCCCCC 7a_100000210711_100000210326 [0,1,0,0,0,0|1,0,1]=3 4352 B15R0.70 CCCCCCCCCCOCCCCCl 34a_100000210776_100000210320 [0,1,0,0,0,0|1,0,1]=3 4353 B15R0.70 CCCCCCCCCCOCCCCCl 7a_100000210776_100000210320 [0,1,0,0,0,0|1,0,1]=3 4354 B15R0.70 CCCCCCCCCCOCCCCF 34a_100000210711_100000729493 [0,1,0,0,0,0|1,0,1]=3 4355 B15R0.70 CCCCCCCCCCOCCCCF 34a_100011995726_100000210320 [0,1,0,0,0,0|1,0,1]=3 4356 B15R0.70 CCCCCCCCCCOCCCCF 7a_100000210711_100000729493 [0,1,0,0,0,0|1,0,1]=3 4357 B15R0.70 CCCCCCCCCCOCCCCF 7a_100011995726_100000210320 [0,1,0,0,0,0|1,0,1]=3 4358 B15R0.70 CCCCCCCCCCOCCCCI 34a_200012148704_100000210320 [0,1,0,0,0,0|1,0,1]=3 4359 B15R0.70 CCCCCCCCCCOCCCCN 34a_100000750430_100000210320 [0,1,0,0,0,0|1,0,1]=3 4360 B15R0.70 CCCCCCCCCCOCCCCO 34a_100000210711_100011216708 [0,1,0,0,0,0|0,0,2]=3 4361 B15R0.70 CCCCCCCCCCOCCCCO 7a_100000210711_100000210776 [0,1,0,0,0,0|0,0,2]=3 4362 B15R0.70 CCCCCCCCCCOCCCNC 34a_100000213112_100000210320 [0,1,0,0,0,0|2,0,0]=3 4363 B15R0.70 CCCCCCCCCCOCCCOC 34a_100000210711_100000740836 [0,1,0,0,0,0|2,0,0]=3 4364 B15R0.70 CCCCCCCCCCOCCCOC 34a_100000740835_100000210320 [0,1,0,0,0,0|2,0,0]=3 4365 B15R0.70 CCCCCCCCCCOCCCOC 7a_100000210711_100000740836 [0,1,0,0,0,0|2,0,0]=3 4366 B15R0.70 CCCCCCCCCCOCCCSC 34a_100000690336_100000210320 [0,1,0,0,0,0|2,0,0]=3 4367 B15R0.70 CCCCCCCCCCOCCCSC 7a_100000690336_100000210320 [0,1,0,0,0,0|2,0,0]=3 4368 B15R0.70 CCCCCCCCCCOCCOCC 34a_100000210136_100000210320 [0,1,0,0,0,0|2,0,1]=4 4369 B15R0.70 CCCCCCCCCCOCCOCC 34a_100000210711_100000210147 [0,1,0,0,0,0|2,0,1]=4 4370 B15R0.70 CCCCCCCCCCOCCOCC 7a_100000210136_100000210320 [0,1,0,0,0,0|2,0,1]=4 4371 B15R0.70 CCCCCCCCCCOCCOCC 7a_100000210711_100011215890 [0,1,0,0,0,0|2,0,1]=4 4372 B15R0.70 CCCCCCCCCCOCCSCC 34a_100000210711_100000757381 [0,1,0,0,0,0|2,0,1]=4 4373 B15R0.70 CCCCCCCCCCOCCSCC 34a_100000212035_100000210320 [0,1,0,0,0,0|2,0,1]=4 4374 B15R0.70 CCCCCCCCCCOCCSCC 7a_100000210711_100000757381 [0,1,0,0,0,0|2,0,1]=4 4375 B15R0.70 CCCCCCCCCCOCCSCC 7a_100000212035_100000210320 [0,1,0,0,0,0|2,0,1]=4 4376 B15R0.70 CCCCCCCCCCSCCCC#N 62a_100000687738_100000210320 [0,1,0,0,0,0|1,0,1]=3 4377 B15R0.70 CCCCCCCCCCSCCCC=O 62a_200011292268_100000210320 [0,1,0,0,0,0|0,0,0]=1 4378 B15R0.70 CCCCCCCCCCSCCCCF 62a_100000729493_100000210320 [0,1,0,0,0,0|1,0,1]=3 4379 B15R0.70 CCCCCCCCCCSCCCCO 62a_100000210776_100000210320 [0,1,0,0,0,0|0,0,2]=3 4380 B15R0.70 CCCCCCCCCCSCCCOC 62a_100000709357_100000210320 [0,1,0,0,0,0|2,0,0]=3 4381 B15R0.70 CCCCCCCCCCSCCOCC 34a_100011628728_100000210202 [0,1,0,0,0,0|2,0,1]=4 4382 B15R0.70 CCCCCCCCCCSCCOCC 62a_100000210147_100000210320 [0,1,0,0,0,0|2,0,1]=4 4383 B15R0.70 CCCCCCCCCCSCCOCC 7a_100011628728_100000210202 [0,1,0,0,0,0|2,0,1]=4 4384 B15R0.70 CCCCCCCCCCSCCOCF 34a_100011628728_100015361967 [0,1,0,0,0,0|2,0,1]=4 4385 B15R0.70 CCCCCCCCCCSCCOCF 7a_100011628728_100015361967 [0,1,0,0,0,0|2,0,1]=4 4386 B15R0.70 CCCCCCCCCCSCCSC#N 62a_100000034367_100000210320 [0,1,0,0,0,0|2,0,1]=4 4387 B15R0.70 CCCCCCCCCCSCCSCC 62a_100000757381_100000210320 [0,1,0,0,0,0|2,0,1]=4 4388 B15R0.70 CCCCCCCCCNCCCCC#N 2230a_100000212291_100000211819 [0,1,0,0,0,0|1,0,1]=3 4389 B15R0.70 CCCCCCCCCNCCCCC=O 2230a_100000212291_100000139335 [0,1,0,0,0,0|0,0,0]=1 4390 B15R0.70 CCCCCCCCCNCCCCCC 2230a_100000210581_100011214924 [0,1,0,0,0,0|1,0,1]=3 4391 B15R0.70 CCCCCCCCCNCCCCCC 2230a_100000212291_100000210314 [0,1,0,0,0,0|1,0,1]=3 4392 B15R0.70 CCCCCCCCCNCCCCCC 34a_100000212291_100000210314 [0,1,0,0,0,0|1,0,1]=3 4393 B15R0.70 CCCCCCCCCNCCCCCF 2230a_100000212291_100000729378 [0,1,0,0,0,0|1,0,1]=3 4394 B15R0.70 CCCCCCCCCNCCCCCF 34a_100000212291_100000729378 [0,1,0,0,0,0|1,0,1]=3 4395 B15R0.70 CCCCCCCCCNCCCCCO 2230a_100000212291_100000746330 [0,1,0,0,0,0|0,0,2]=3 4396 B15R0.70 CCCCCCCCCNCCCCCO 2230a_100000762737_100011214924 [0,1,0,0,0,0|0,0,2]=3 4397 B15R0.70 CCCCCCCCCNCCCCCO 34a_100000212291_100000746330 [0,1,0,0,0,0|0,0,2]=3 4398 B15R0.70 CCCCCCCCCNCCCCCO 34a_100000762737_100011214924 [0,1,0,0,0,0|0,0,2]=3 4399 B15R0.70 CCCCCCCCCNCCCCOC 2230a_100000212291_100000730899 [0,1,0,0,0,0|2,0,0]=3 4400 B15R0.70 CCCCCCCCCNCCCCOC 34a_100000212291_100000755781 [0,1,0,0,0,0|2,0,0]=3 4401 B15R0.70 CCCCCCCCCNCCCN=[N+]=[N-] 2230a_100000744732_100011214924 [0,1,0,0,0,0|3,0,0]=4 4402 B15R0.70 CCCCCCCCCNCCCOCC 2230a_100000210961_100011214924 [0,1,0,0,0,0|2,0,1]=4 4403 B15R0.70 CCCCCCCCCNCCCOCC 2230a_100000212291_100012232248 [0,1,0,0,0,0|2,0,1]=4 4404 B15R0.70 CCCCCCCCCNCCCOCC 34a_100000210961_100011214924 [0,1,0,0,0,0|2,0,1]=4 4405 B15R0.70 CCCCCCCCCNCCCOCC 34a_100000212291_100012232248 [0,1,0,0,0,0|2,0,1]=4 4406 B15R0.70 CCCCCCCCCNCCOCC#N 2230a_100000212291_200000047693 [0,1,0,0,0,0|2,0,1]=4 4407 B15R0.70 CCCCCCCCCNCCOCCC 2230a_100000212291_100011215938 [0,1,0,0,0,0|2,0,1]=4 4408 B15R0.70 CCCCCCCCCNCCOCCC 2230a_100161115042_100011214924 [0,1,0,0,0,0|2,0,1]=4 4409 B15R0.70 CCCCCCCCCNCCOCCC 34a_100000212291_100011215938 [0,1,0,0,0,0|2,0,1]=4 4410 B15R0.70 CCCCCCCCCNCCOCCC 34a_100161115042_100011214924 [0,1,0,0,0,0|2,0,1]=4 4411 B15R0.70 CCCCCCCCCNCCOCCO 2230a_100000211614_100011214924 [0,1,0,0,0,0|1,0,2]=4 4412 B15R0.70 CCCCCCCCCNCCOCCO 2230a_100000212291_100011215305 [0,1,0,0,0,0|1,0,2]=4 4413 B15R0.70 CCCCCCCCCNCCOCCO 34a_100000211614_100011214924 [0,1,0,0,0,0|1,0,2]=4 4414 B15R0.70 CCCCCCCCCNCCOCCO 34a_100000212291_100000692535 [0,1,0,0,0,0|1,0,2]=4 4415 B15R0.70 CCCCCCCCCNCCSCCC 2230a_100020603323_100011214924 [0,1,0,0,0,0|2,0,1]=4 4416 B15R0.70 CCCCCCCCCNCCSCCO 2230a_100011219999_100011214924 [0,1,0,0,0,0|1,0,2]=4 4417 B15R0.70 CCCCCCCCCNCOCCCC 2230a_100000212291_100011995733 [0,1,0,0,0,0|2,0,1]=4 4418 B15R0.70 CCCCCCCCCNCOCCCC 34a_100000212291_100011995733 [0,1,0,0,0,0|2,0,1]=4 4419 B15R0.70 CCCCCCCCCNCOCCOC 2230a_100000212291_100000231047 [0,1,0,0,0,0|3,0,0]=4 4420 B15R0.70 CCCCCCCCCOCCCCC#N 7a_100000210712_100000211819 [0,1,0,0,0,0|1,0,1]=3 4421 B15R0.70 CCCCCCCCCOCCCCC=O 7a_100000210712_100000139335 [0,1,0,0,0,0|0,0,0]=1 4422 B15R0.70 CCCCCCCCCOCCCCCBr 34a_100000746331_100011214924 [0,1,0,0,0,0|1,0,1]=3 4423 B15R0.70 CCCCCCCCCOCCCCCBr 7a_100000746331_100000210328 [0,1,0,0,0,0|1,0,1]=3 4424 B15R0.70 CCCCCCCCCOCCCCCC 34a_100000210259_100011214924 [0,1,0,0,0,0|1,0,1]=3 4425 B15R0.70 CCCCCCCCCOCCCCCC 34a_100000210712_100000210314 [0,1,0,0,0,0|1,0,1]=3 4426 B15R0.70 CCCCCCCCCOCCCCCC 7a_100000210259_100000210328 [0,1,0,0,0,0|1,0,1]=3 4427 B15R0.70 CCCCCCCCCOCCCCCC 7a_100000210712_100000210314 [0,1,0,0,0,0|1,0,1]=3 4428 B15R0.70 CCCCCCCCCOCCCCCCl 34a_100000746330_100011214924 [0,1,0,0,0,0|1,0,1]=3 4429 B15R0.70 CCCCCCCCCOCCCCCCl 7a_100000746330_100000210328 [0,1,0,0,0,0|1,0,1]=3 4430 B15R0.70 CCCCCCCCCOCCCCCF 34a_100000210712_100000729378 [0,1,0,0,0,0|1,0,1]=3 4431 B15R0.70 CCCCCCCCCOCCCCCF 7a_100000210712_100000729378 [0,1,0,0,0,0|1,0,1]=3 4432 B15R0.70 CCCCCCCCCOCCCCCI 34a_200012148887_100011214924 [0,1,0,0,0,0|1,0,1]=3 4433 B15R0.70 CCCCCCCCCOCCCCCI 7a_200012148887_100000210328 [0,1,0,0,0,0|1,0,1]=3 4434 B15R0.70 CCCCCCCCCOCCCCCN 34a_100000762737_100011214924 [0,1,0,0,0,0|1,0,1]=3 4435 B15R0.70 CCCCCCCCCOCCCCCO 34a_100000210712_100000746330 [0,1,0,0,0,0|0,0,2]=3 4436 B15R0.70 CCCCCCCCCOCCCCCO 7a_100000210712_100000746330 [0,1,0,0,0,0|0,0,2]=3 4437 B15R0.70 CCCCCCCCCOCCCCOC 34a_100000210712_100000755781 [0,1,0,0,0,0|2,0,0]=3 4438 B15R0.70 CCCCCCCCCOCCCCOC 34a_100000740925_100011214924 [0,1,0,0,0,0|2,0,0]=3 4439 B15R0.70 CCCCCCCCCOCCCCOC 7a_100000210712_100000730899 [0,1,0,0,0,0|2,0,0]=3 4440 B15R0.70 CCCCCCCCCOCCCCSC 34a_100011217163_100011214924 [0,1,0,0,0,0|2,0,0]=3 4441 B15R0.70 CCCCCCCCCOCCCCSC 7a_100011217163_100000210328 [0,1,0,0,0,0|2,0,0]=3 4442 B15R0.70 CCCCCCCCCOCCCOCC 34a_100000210712_100012232248 [0,1,0,0,0,0|2,0,1]=4 4443 B15R0.70 CCCCCCCCCOCCCOCC 34a_100000757476_100011214924 [0,1,0,0,0,0|2,0,1]=4 4444 B15R0.70 CCCCCCCCCOCCCOCC 7a_100000210712_100012232248 [0,1,0,0,0,0|2,0,1]=4 4445 B15R0.70 CCCCCCCCCOCCCOCC 7a_100000757476_100000210328 [0,1,0,0,0,0|2,0,1]=4 4446 B15R0.70 CCCCCCCCCOCCCSCC 34a_100011216438_100011214924 [0,1,0,0,0,0|2,0,1]=4 4447 B15R0.70 CCCCCCCCCOCCCSCC 7a_100011216438_100000210328 [0,1,0,0,0,0|2,0,1]=4 4448 B15R0.70 CCCCCCCCCOCCOCC#N 7a_100000210712_200000047693 [0,1,0,0,0,0|2,0,1]=4 4449 B15R0.70 CCCCCCCCCOCCOCCBr 34a_100000692535_100011214924 [0,1,0,0,0,0|2,0,1]=4 4450 B15R0.70 CCCCCCCCCOCCOCCBr 7a_100000692535_100000210328 [0,1,0,0,0,0|2,0,1]=4 4451 B15R0.70 CCCCCCCCCOCCOCCC 34a_100000210712_100011215938 [0,1,0,0,0,0|2,0,1]=4 4452 B15R0.70 CCCCCCCCCOCCOCCC 34a_100000752267_100011214924 [0,1,0,0,0,0|2,0,1]=4 4453 B15R0.70 CCCCCCCCCOCCOCCC 7a_100000210712_100011215938 [0,1,0,0,0,0|2,0,1]=4 4454 B15R0.70 CCCCCCCCCOCCOCCC 7a_100000752267_100000210328 [0,1,0,0,0,0|2,0,1]=4 4455 B15R0.70 CCCCCCCCCOCCOCCCl 34a_100011215305_100011214924 [0,1,0,0,0,0|2,0,1]=4 4456 B15R0.70 CCCCCCCCCOCCOCCCl 7a_100011215305_100000210328 [0,1,0,0,0,0|2,0,1]=4 4457 B15R0.70 CCCCCCCCCOCCOCCF 34a_200015357709_100011214924 [0,1,0,0,0,0|2,0,1]=4 4458 B15R0.70 CCCCCCCCCOCCOCCF 7a_200015357709_100000210328 [0,1,0,0,0,0|2,0,1]=4 4459 B15R0.70 CCCCCCCCCOCCOCCI 34a_100012149058_100011214924 [0,1,0,0,0,0|2,0,1]=4 4460 B15R0.70 CCCCCCCCCOCCOCCI 7a_100012149058_100000210328 [0,1,0,0,0,0|2,0,1]=4 4461 B15R0.70 CCCCCCCCCOCCOCCN 34a_100000211614_100011214924 [0,1,0,0,0,0|2,0,1]=4 4462 B15R0.70 CCCCCCCCCOCCOCCO 34a_100000210712_100000692535 [0,1,0,0,0,0|1,0,2]=4 4463 B15R0.70 CCCCCCCCCOCCOCCO 7a_100000210712_100011215305 [0,1,0,0,0,0|1,0,2]=4 4464 B15R0.70 CCCCCCCCCOCCSCCC 34a_200000230433_100011214924 [0,1,0,0,0,0|2,0,1]=4 4465 B15R0.70 CCCCCCCCCOCCSCCC 7a_200000230433_100000210328 [0,1,0,0,0,0|2,0,1]=4 4466 B15R0.70 CCCCCCCCCOCOCCCC 34a_100000210712_100011995733 [0,1,0,0,0,0|2,0,1]=4 4467 B15R0.70 CCCCCCCCCSCCCCC#N 62a_100011219923_100000210670 [0,1,0,0,0,0|1,0,1]=3 4468 B15R0.70 CCCCCCCCCSCCCCC=O 62a_100000139335_100000210670 [0,1,0,0,0,0|0,0,0]=1 4469 B15R0.70 CCCCCCCCCSCCCCCF 62a_100000729378_100000210670 [0,1,0,0,0,0|1,0,1]=3 4470 B15R0.70 CCCCCCCCCSCCCCCO 62a_100000746330_100000210670 [0,1,0,0,0,0|0,0,2]=3 4471 B15R0.70 CCCCCCCCCSCCCCOC 62a_100000730899_100000210670 [0,1,0,0,0,0|2,0,0]=3 4472 B15R0.70 CCCCCCCCCSCCCOCC 62a_100012232248_100000210670 [0,1,0,0,0,0|2,0,1]=4 4473 B15R0.70 CCCCCCCCCSCCOCC#N 62a_200000047693_100000210670 [0,1,0,0,0,0|2,0,1]=4 4474 B15R0.70 CCCCCCCCCSCCOCCC 62a_100011215938_100000210670 [0,1,0,0,0,0|2,0,1]=4 4475 B15R0.70 CCCCCCCCCSCCOCCO 62a_100011215305_100000210670 [0,1,0,0,0,0|1,0,2]=4 4476 B15R0.70 CCCCCCCCCSCOCCCC 62a_100011995733_100000210670 [0,1,0,0,0,0|2,0,1]=4 4477 B15R0.70 CCCCCCCCCSCOCCOC 62a_100000231047_100000210670 [0,1,0,0,0,0|3,0,0]=4 4478 B15R0.70 CCCCCCCCNCCCCCC#N 2230a_100000229939_100009813376 [0,1,0,0,0,0|1,0,1]=3 4479 B15R0.70 CCCCCCCCNCCCCCC=O 2230a_100000229939_100000139337 [0,1,0,0,0,0|0,0,0]=1 4480 B15R0.70 CCCCCCCCNCCCCCCC 2230a_100000229938_100000210759 [0,1,0,0,0,0|1,0,1]=3 4481 B15R0.70 CCCCCCCCNCCCCCCC 2230a_100000229939_100000210681 [0,1,0,0,0,0|1,0,1]=3 4482 B15R0.70 CCCCCCCCNCCCCCCC 34a_100000229939_100000210614 [0,1,0,0,0,0|1,0,1]=3 4483 B15R0.70 CCCCCCCCNCCCCCCF 2230a_100000229939_100015922095 [0,1,0,0,0,0|1,0,1]=3 4484 B15R0.70 CCCCCCCCNCCCCCCF 34a_100000229939_100015922095 [0,1,0,0,0,0|1,0,1]=3 4485 B15R0.70 CCCCCCCCNCCCCCCO 2230a_100000229939_100000766143 [0,1,0,0,0,0|0,0,2]=3 4486 B15R0.70 CCCCCCCCNCCCCCCO 2230a_100000686447_100000210759 [0,1,0,0,0,0|0,0,2]=3 4487 B15R0.70 CCCCCCCCNCCCCCCO 34a_100000229939_100000766143 [0,1,0,0,0,0|0,0,2]=3 4488 B15R0.70 CCCCCCCCNCCCCCCO 34a_100000686447_100000210759 [0,1,0,0,0,0|0,0,2]=3 4489 B15R0.70 CCCCCCCCNCCCCCOC 2230a_100000747528_100000210759 [0,1,0,0,0,0|2,0,0]=3 4490 B15R0.70 CCCCCCCCNCCCCCOC 34a_100000747528_100000210759 [0,1,0,0,0,0|2,0,0]=3 4491 B15R0.70 CCCCCCCCNCCCCN=[N+]=[N-] 2230a_100000101370_100000210759 [0,1,0,0,0,0|3,0,0]=4 4492 B15R0.70 CCCCCCCCNCCCOCCC 2230a_100011217757_100000210759 [0,1,0,0,0,0|2,0,1]=4 4493 B15R0.70 CCCCCCCCNCCCOCCC 34a_100011217757_100000210759 [0,1,0,0,0,0|2,0,1]=4 4494 B15R0.70 CCCCCCCCNCCOCCCC 2230a_100000229939_100000743108 [0,1,0,0,0,0|2,0,1]=4 4495 B15R0.70 CCCCCCCCNCCOCCCC 34a_100000229939_100000743108 [0,1,0,0,0,0|2,0,1]=4 4496 B15R0.70 CCCCCCCCNCCOCCOC 2230a_100000229939_100000695917 [0,1,0,0,0,0|3,0,0]=4 4497 B15R0.70 CCCCCCCCNCCOCCOC 2230a_100000745349_100000210759 [0,1,0,0,0,0|3,0,0]=4 4498 B15R0.70 CCCCCCCCNCCOCCOC 34a_100000229939_100000695917 [0,1,0,0,0,0|3,0,0]=4 4499 B15R0.70 CCCCCCCCNCCOCCOC 34a_100000745349_100000210759 [0,1,0,0,0,0|3,0,0]=4 4500 B15R0.70 CCCCCCCCNCCSCCCC 2230a_100025743550_100000210759 [0,1,0,0,0,0|2,0,1]=4 4501 B15R0.70 CCCCCCCCOCCCCCC#N 7a_100000210232_100009813376 [0,1,0,0,0,0|1,0,1]=3 4502 B15R0.70 CCCCCCCCOCCCCCC=O 7a_100000210232_100000139337 [0,1,0,0,0,0|0,0,0]=1 4503 B15R0.70 CCCCCCCCOCCCCCCBr 34a_100011215345_100000210759 [0,1,0,0,0,0|1,0,1]=3 4504 B15R0.70 CCCCCCCCOCCCCCCBr 7a_100011215345_100000210759 [0,1,0,0,0,0|1,0,1]=3 4505 B15R0.70 CCCCCCCCOCCCCCCC 34a_100000210232_100000210614 [0,1,0,0,0,0|1,0,1]=3 4506 B15R0.70 CCCCCCCCOCCCCCCC 34a_100000210272_100000210759 [0,1,0,0,0,0|1,0,1]=3 4507 B15R0.70 CCCCCCCCOCCCCCCC 7a_100000210232_100000210614 [0,1,0,0,0,0|1,0,1]=3 4508 B15R0.70 CCCCCCCCOCCCCCCC 7a_100000210272_100000210759 [0,1,0,0,0,0|1,0,1]=3 4509 B15R0.70 CCCCCCCCOCCCCCCCl 34a_100000766143_100000210759 [0,1,0,0,0,0|1,0,1]=3 4510 B15R0.70 CCCCCCCCOCCCCCCCl 7a_100000766143_100000210759 [0,1,0,0,0,0|1,0,1]=3 4511 B15R0.70 CCCCCCCCOCCCCCCF 34a_100000210232_100015922095 [0,1,0,0,0,0|1,0,1]=3 4512 B15R0.70 CCCCCCCCOCCCCCCF 34a_100000732779_100000210759 [0,1,0,0,0,0|1,0,1]=3 4513 B15R0.70 CCCCCCCCOCCCCCCF 7a_100000210232_100015922095 [0,1,0,0,0,0|1,0,1]=3 4514 B15R0.70 CCCCCCCCOCCCCCCF 7a_100000732779_100000210759 [0,1,0,0,0,0|1,0,1]=3 4515 B15R0.70 CCCCCCCCOCCCCCCN 34a_100000686447_100000210759 [0,1,0,0,0,0|1,0,1]=3 4516 B15R0.70 CCCCCCCCOCCCCCCO 34a_100000210232_100000766143 [0,1,0,0,0,0|0,0,2]=3 4517 B15R0.70 CCCCCCCCOCCCCCCO 7a_100000210232_100000766143 [0,1,0,0,0,0|0,0,2]=3 4518 B15R0.70 CCCCCCCCOCCCCCNC 34a_100000722520_100000210759 [0,1,0,0,0,0|2,0,0]=3 4519 B15R0.70 CCCCCCCCOCCOCCCC 34a_100000210232_100000743108 [0,1,0,0,0,0|2,0,1]=4 4520 B15R0.70 CCCCCCCCOCCOCCCC 34a_100000210238_100000210759 [0,1,0,0,0,0|2,0,1]=4 4521 B15R0.70 CCCCCCCCOCCOCCCC 7a_100000210232_100000743108 [0,1,0,0,0,0|2,0,1]=4 4522 B15R0.70 CCCCCCCCOCCOCCCC 7a_100000210238_100000210759 [0,1,0,0,0,0|2,0,1]=4 4523 B15R0.70 CCCCCCCCOCCOCCNC 34a_100000228057_100000210759 [0,1,0,0,0,0|3,0,0]=4 4524 B15R0.70 CCCCCCCCOCCOCCOC 34a_100000210232_100000695917 [0,1,0,0,0,0|3,0,0]=4 4525 B15R0.70 CCCCCCCCOCCOCCOC 34a_100011215163_100000210759 [0,1,0,0,0,0|3,0,0]=4 4526 B15R0.70 CCCCCCCCOCCOCCOC 7a_100000210232_100000695917 [0,1,0,0,0,0|3,0,0]=4 4527 B15R0.70 CCCCCCCCOCCOCCOC 7a_100011215163_100000210759 [0,1,0,0,0,0|3,0,0]=4 4528 B15R0.70 CCCCCCCCOCCSCCCC 34a_200000230436_100000210759 [0,1,0,0,0,0|2,0,1]=4 4529 B15R0.70 CCCCCCCCOCCSCCCC 7a_200000230436_100000210759 [0,1,0,0,0,0|2,0,1]=4 4530 B15R0.70 CCCCCCCCSCCCCCC#N 62a_100000210759_100009813376 [0,1,0,0,0,0|1,0,1]=3 4531 B15R0.70 CCCCCCCCSCCCCCC#N 62a_100009813376_100000210317 [0,1,0,0,0,0|1,0,1]=3 4532 B15R0.70 CCCCCCCCSCCCCCC=O 62a_100000139337_100000210317 [0,1,0,0,0,0|0,0,0]=1 4533 B15R0.70 CCCCCCCCSCCCCCC=O 62a_100000210759_100000139337 [0,1,0,0,0,0|0,0,0]=1 4534 B15R0.70 CCCCCCCCSCCCCCCF 62a_100000210759_100015922095 [0,1,0,0,0,0|1,0,1]=3 4535 B15R0.70 CCCCCCCCSCCCCCCF 62a_100015922095_100000210317 [0,1,0,0,0,0|1,0,1]=3 4536 B15R0.70 CCCCCCCCSCCCCCCO 62a_100000210759_100000766143 [0,1,0,0,0,0|0,0,2]=3 4537 B15R0.70 CCCCCCCCSCCCCCCO 62a_100000766143_100000210317 [0,1,0,0,0,0|0,0,2]=3 4538 B15R0.70 CCCCCCCCSCCOCCCC 62a_100000210759_100000743108 [0,1,0,0,0,0|2,0,1]=4 4539 B15R0.70 CCCCCCCCSCCOCCCC 62a_100000743108_100000210317 [0,1,0,0,0,0|2,0,1]=4 4540 B15R0.70 CCCCCCCCSCCOCCOC 62a_100000210759_100000695917 [0,1,0,0,0,0|3,0,0]=4 4541 B15R0.70 CCCCCCCCSCCOCCOC 62a_100000695917_100000210317 [0,1,0,0,0,0|3,0,0]=4 4542 B15R0.70 CCCCCCCNCCCCCCC#N 2230a_100000229938_100009813337 [0,1,0,0,0,0|1,0,1]=3 4543 B15R0.70 CCCCCCCNCCCCCCCO 2230a_100000229938_100000760002 [0,1,0,0,0,0|0,0,2]=3 4544 B15R0.70 CCCCCCCNCCCCCCCO 2230a_100011996573_100000210681 [0,1,0,0,0,0|0,0,2]=3 4545 B15R0.70 CCCCCCCNCCCCCCCO 34a_100011996573_100000210614 [0,1,0,0,0,0|0,0,2]=3 4546 B15R0.70 CCCCCCCNCCCCCCOC 2230a_100000229938_100011998445 [0,1,0,0,0,0|2,0,0]=3 4547 B15R0.70 CCCCCCCNCCCOCCCC 2230a_200000211371_100000210681 [0,1,0,0,0,0|2,0,1]=4 4548 B15R0.70 CCCCCCCNCCCOCCCC 34a_200000211371_100000210614 [0,1,0,0,0,0|2,0,1]=4 4549 B15R0.70 CCCCCCCNCCCOCCCO 2230a_100011310245_100000210681 [0,1,0,0,0,0|1,0,2]=4 4550 B15R0.70 CCCCCCCNCCCOCCCO 34a_100011310245_100000210614 [0,1,0,0,0,0|1,0,2]=4 4551 B15R0.70 CCCCCCCNCCCOCCOC 2230a_100000206027_100000210681 [0,1,0,0,0,0|3,0,0]=4 4552 B15R0.70 CCCCCCCNCCCOCCOC 2230a_100000229938_100011216529 [0,1,0,0,0,0|3,0,0]=4 4553 B15R0.70 CCCCCCCNCCCOCCOC 34a_100000206027_100000210614 [0,1,0,0,0,0|3,0,0]=4 4554 B15R0.70 CCCCCCCOCCCCCCC#N 7a_100000210272_100009813337 [0,1,0,0,0,0|1,0,1]=3 4555 B15R0.70 CCCCCCCOCCCCCCCBr 34a_100000760002_100000210614 [0,1,0,0,0,0|1,0,1]=3 4556 B15R0.70 CCCCCCCOCCCCCCCBr 7a_100000760002_100000210614 [0,1,0,0,0,0|1,0,1]=3 4557 B15R0.70 CCCCCCCOCCCCCCCN 34a_100011996573_100000210614 [0,1,0,0,0,0|1,0,1]=3 4558 B15R0.70 CCCCCCCOCCCCCCCO 34a_100000210272_100000760002 [0,1,0,0,0,0|0,0,2]=3 4559 B15R0.70 CCCCCCCOCCCCCCCO 7a_100000210272_100000760002 [0,1,0,0,0,0|0,0,2]=3 4560 B15R0.70 CCCCCCCOCCCCCCOC 34a_100000210272_100011998445 [0,1,0,0,0,0|2,0,0]=3 4561 B15R0.70 CCCCCCCOCCCCCCOC 34a_200012092642_100000210614 [0,1,0,0,0,0|2,0,0]=3 4562 B15R0.70 CCCCCCCOCCCCCCOC 7a_100000210272_100011998445 [0,1,0,0,0,0|2,0,0]=3 4563 B15R0.70 CCCCCCCOCCCCCCOC 7a_200012092642_100000210614 [0,1,0,0,0,0|2,0,0]=3 4564 B15R0.70 CCCCCCCOCCCOCCCC 34a_200011215613_100000210614 [0,1,0,0,0,0|2,0,1]=4 4565 B15R0.70 CCCCCCCOCCCOCCCC 7a_200011215613_100000210614 [0,1,0,0,0,0|2,0,1]=4 4566 B15R0.70 CCCCCCCOCCCOCCCN 34a_100011310245_100000210614 [0,1,0,0,0,0|2,0,1]=4 4567 B15R0.70 CCCCCCCOCCCOCCOC 34a_100000210272_100011216529 [0,1,0,0,0,0|3,0,0]=4 4568 B15R0.70 CCCCCCCOCCCOCCOC 7a_100000210272_100011216529 [0,1,0,0,0,0|3,0,0]=4 4569 B15R0.70 CCCCCCCOCCNCCCCC 34a_100000224656_100000210614 [0,1,0,0,0,0|2,0,1]=4 4570 B15R0.70 CCCCCCCOCCOCCCCC 34a_100011215259_100000210614 [0,1,0,0,0,0|2,0,1]=4 4571 B15R0.70 CCCCCCCOCCOCCCCC 7a_100011215259_100000210614 [0,1,0,0,0,0|2,0,1]=4 4572 B15R0.70 CCCCCCCSCCCCCCC#N 62a_100000210614_100009813337 [0,1,0,0,0,0|1,0,1]=3 4573 B15R0.70 CCCCCCCSCCCCCCC#N 62a_100009813337_100000210316 [0,1,0,0,0,0|1,0,1]=3 4574 B15R0.70 CCCCCCCSCCCCCCCO 62a_100000210614_100000760002 [0,1,0,0,0,0|0,0,2]=3 4575 B15R0.70 CCCCCCCSCCCCCCCO 62a_100000760002_100000210316 [0,1,0,0,0,0|0,0,2]=3 4576 B15R0.70 CCCCCCCSCCCCCCOC 62a_100000210614_100011998445 [0,1,0,0,0,0|2,0,0]=3 4577 B15R0.70 CCCCCCCSCCCCCCOC 62a_100011998445_100000210316 [0,1,0,0,0,0|2,0,0]=3 4578 B15R0.70 CCCCCCCSCCCOCCOC 62a_100000210614_100011216529 [0,1,0,0,0,0|3,0,0]=4 4579 B15R0.70 CCCCCCCSCCCOCCOC 62a_100011216529_100000210316 [0,1,0,0,0,0|3,0,0]=4 4580 B15R0.70 CCCCCCNCCCCCCCCO 2230a_100000210581_100000033203 [0,1,0,0,0,0|0,0,2]=3 4581 B15R0.70 CCCCCCNCCCCCCCCO 2230a_102515433106_100000210314 [0,1,0,0,0,0|0,0,2]=3 4582 B15R0.70 CCCCCCNCCCCCCCCO 34a_102515433106_100000210314 [0,1,0,0,0,0|0,0,2]=3 4583 B15R0.70 CCCCCCNCCCCCCN=[N+]=[N-] 2230a_200000049180_100000210314 [0,1,0,0,0,0|3,0,0]=4 4584 B15R0.70 CCCCCCOCCCCCCCCBr 34a_100009813846_100000210314 [0,1,0,0,0,0|1,0,1]=3 4585 B15R0.70 CCCCCCOCCCCCCCCBr 7a_100009813846_100000210314 [0,1,0,0,0,0|1,0,1]=3 4586 B15R0.70 CCCCCCOCCCCCCCCCl 34a_100000033203_100000210314 [0,1,0,0,0,0|1,0,1]=3 4587 B15R0.70 CCCCCCOCCCCCCCCCl 7a_100000033203_100000210314 [0,1,0,0,0,0|1,0,1]=3 4588 B15R0.70 CCCCCCOCCCCCCCCN 34a_102515433106_100000210314 [0,1,0,0,0,0|1,0,1]=3 4589 B15R0.70 CCCCCCOCCCCCCCCO 34a_100000210259_100000033203 [0,1,0,0,0,0|0,0,2]=3 4590 B15R0.70 CCCCCCOCCCCCCCCO 7a_100000210259_100000033203 [0,1,0,0,0,0|0,0,2]=3 4591 B15R0.70 CCCCCCOCCCCCNCCN 34a_103619048469_100000210314 [0,1,0,0,0,0|2,0,1]=4 4592 B15R0.70 CCCCCCOCCCCNCCCC 34a_200011216965_100000210314 [0,1,0,0,0,0|2,0,1]=4 4593 B15R0.70 CCCCCCOCCCCOCCCC 34a_200000760531_100000210314 [0,1,0,0,0,0|2,0,1]=4 4594 B15R0.70 CCCCCCOCCCCOCCCC 7a_200000760531_100000210314 [0,1,0,0,0,0|2,0,1]=4 4595 B15R0.70 CCCCCCOCCCOCCCOC 34a_200011215475_100000210314 [0,1,0,0,0,0|3,0,0]=4 4596 B15R0.70 CCCCCCOCCCOCCCOC 7a_200011215475_100000210314 [0,1,0,0,0,0|3,0,0]=4 4597 B15R0.70 CCCCCCOCCOCCCCC#N 7a_100000691444_100000211819 [0,1,0,0,0,0|2,0,1]=4 4598 B15R0.70 CCCCCCOCCOCCCCC=O 7a_100000691444_100000139335 [0,1,0,0,0,0|1,0,0]=2 4599 B15R0.70 CCCCCCOCCOCCCCCC 34a_100000691444_100000210314 [0,1,0,0,0,0|2,0,1]=4 4600 B15R0.70 CCCCCCOCCOCCCCCC 7a_100000691444_100000210314 [0,1,0,0,0,0|2,0,1]=4 4601 B15R0.70 CCCCCCOCCOCCCCCF 34a_100000691444_100000729378 [0,1,0,0,0,0|2,0,1]=4 4602 B15R0.70 CCCCCCOCCOCCCCCF 7a_100000691444_100000729378 [0,1,0,0,0,0|2,0,1]=4 4603 B15R0.70 CCCCCCOCCOCCCCCO 34a_100000691444_100000746330 [0,1,0,0,0,0|1,0,2]=4 4604 B15R0.70 CCCCCCOCCOCCCCCO 7a_100000691444_100000746330 [0,1,0,0,0,0|1,0,2]=4 4605 B15R0.70 CCCCCCOCCOCCCCOC 34a_100000691444_100000755781 [0,1,0,0,0,0|3,0,0]=4 4606 B15R0.70 CCCCCCOCCOCCCCOC 7a_100000691444_100000730899 [0,1,0,0,0,0|3,0,0]=4 4607 B15R0.70 CCCCCCOCCOCCOCC=O 34a_100000032842_200009817547 [0,1,0,0,0,0|2,0,0]=3 4608 B15R0.70 CCCCCCOCCOCCOCC=O 7a_100000032842_200015260668 [0,1,0,0,0,0|2,0,0]=3 4609 B15R0.70 CCCCCCSCCCCCCCCO 62a_100000033203_100000210757 [0,1,0,0,0,0|0,0,2]=3 4610 B15R0.70 CCCCCCSCCCCCCCCO 62a_100000210314_100000033203 [0,1,0,0,0,0|0,0,2]=3 4611 B15R0.70 CCCCCNCCCCCCCCCO 2230a_100000078944_100000210326 [0,1,0,0,0,0|0,0,2]=3 4612 B15R0.70 CCCCCNCCCCCCCCCO 2230a_100000209983_100009813782 [0,1,0,0,0,0|0,0,2]=3 4613 B15R0.70 CCCCCNCCCCCCCCCO 34a_100000078944_100000718602 [0,1,0,0,0,0|0,0,2]=3 4614 B15R0.70 CCCCCNCCOCCCCCCF 34a_100000224656_100015922095 [0,1,0,0,0,0|2,0,1]=4 4615 B15R0.70 CCCCCNCCOCCCCCCO 34a_100000224656_100000766143 [0,1,0,0,0,0|1,0,2]=4 4616 B15R0.70 CCCCCOCCCCCCCCCBr 34a_100009813782_100000718602 [0,1,0,0,0,0|1,0,1]=3 4617 B15R0.70 CCCCCOCCCCCCCCCBr 7a_100009813782_100000210326 [0,1,0,0,0,0|1,0,1]=3 4618 B15R0.70 CCCCCOCCCCCCCCCCl 34a_100009868337_100000718602 [0,1,0,0,0,0|1,0,1]=3 4619 B15R0.70 CCCCCOCCCCCCCCCCl 7a_100009868337_100000210326 [0,1,0,0,0,0|1,0,1]=3 4620 B15R0.70 CCCCCOCCCCCCCCCN 34a_100000078944_100000718602 [0,1,0,0,0,0|1,0,1]=3 4621 B15R0.70 CCCCCOCCCCCCCCCO 34a_100000210253_100009813782 [0,1,0,0,0,0|0,0,2]=3 4622 B15R0.70 CCCCCOCCCCCCCCCO 7a_100000210253_100009813782 [0,1,0,0,0,0|0,0,2]=3 4623 B15R0.70 CCCCCOCCOCCCCCC#N 7a_100011215259_100009813376 [0,1,0,0,0,0|2,0,1]=4 4624 B15R0.70 CCCCCOCCOCCCCCC=O 7a_100011215259_100000139337 [0,1,0,0,0,0|1,0,0]=2 4625 B15R0.70 CCCCCOCCOCCCCCCF 34a_100011215259_100015922095 [0,1,0,0,0,0|2,0,1]=4 4626 B15R0.70 CCCCCOCCOCCCCCCF 7a_100011215259_100015922095 [0,1,0,0,0,0|2,0,1]=4 4627 B15R0.70 CCCCCOCCOCCCCCCO 34a_100011215259_100000766143 [0,1,0,0,0,0|1,0,2]=4 4628 B15R0.70 CCCCCOCCOCCCCCCO 7a_100011215259_100000766143 [0,1,0,0,0,0|1,0,2]=4 4629 B15R0.70 CCCCCSCCCCCCCCCO 62a_100000210326_100009813782 [0,1,0,0,0,0|0,0,2]=3 4630 B15R0.70 CCCCCSCCCCCCCCCO 62a_100009813782_100000210326 [0,1,0,0,0,0|0,0,2]=3 4631 B15R0.70 CCCCNCCCCCCCCCCO 2230a_100000066964_100000210211 [0,1,0,0,0,0|0,0,2]=3 4632 B15R0.70 CCCCNCCCCCCCCCCO 2230a_100000102301_100009813290 [0,1,0,0,0,0|0,0,2]=3 4633 B15R0.70 CCCCNCCCCCCCCCCO 34a_100000066964_100000210210 [0,1,0,0,0,0|0,0,2]=3 4634 B15R0.70 CCCCNCCCCCCCCCCO 7a_106832991798_100009813290 [0,1,0,0,0,0|0,0,2]=3 4635 B15R0.70 CCCCNCCCCOCCCCCF 34a_200011216965_100000729378 [0,1,0,0,0,0|2,0,1]=4 4636 B15R0.70 CCCCNCCCCOCCCCCO 34a_200011216965_100000746330 [0,1,0,0,0,0|1,0,2]=4 4637 B15R0.70 CCCCNCCCCOCCCCOC 34a_200011216965_100000755781 [0,1,0,0,0,0|3,0,0]=4 4638 B15R0.70 CCCCOCCCCCCCCCCBr 34a_100009813290_100000210210 [0,1,0,0,0,0|1,0,1]=3 4639 B15R0.70 CCCCOCCCCCCCCCCBr 7a_100009813290_100000210211 [0,1,0,0,0,0|1,0,1]=3 4640 B15R0.70 CCCCOCCCCCCCCCCCl 34a_200000033068_100000210210 [0,1,0,0,0,0|1,0,1]=3 4641 B15R0.70 CCCCOCCCCCCCCCCCl 7a_200000033068_100000210211 [0,1,0,0,0,0|1,0,1]=3 4642 B15R0.70 CCCCOCCCCCCCCCCN 34a_100000066964_100000210210 [0,1,0,0,0,0|1,0,1]=3 4643 B15R0.70 CCCCOCCCCCCCCCCO 34a_100000210227_100009813290 [0,1,0,0,0,0|0,0,2]=3 4644 B15R0.70 CCCCOCCCCCCCCCCO 7a_100000210227_100009813290 [0,1,0,0,0,0|0,0,2]=3 4645 B15R0.70 CCCCOCCCCOCCCCC#N 7a_200000760531_100000211819 [0,1,0,0,0,0|2,0,1]=4 4646 B15R0.70 CCCCOCCCCOCCCCC=O 7a_200000760531_100000139335 [0,1,0,0,0,0|1,0,0]=2 4647 B15R0.70 CCCCOCCCCOCCCCCF 34a_200000760531_100000729378 [0,1,0,0,0,0|2,0,1]=4 4648 B15R0.70 CCCCOCCCCOCCCCCF 7a_200000760531_100000729378 [0,1,0,0,0,0|2,0,1]=4 4649 B15R0.70 CCCCOCCCCOCCCCCO 34a_200000760531_100000746330 [0,1,0,0,0,0|1,0,2]=4 4650 B15R0.70 CCCCOCCCCOCCCCCO 7a_200000760531_100000746330 [0,1,0,0,0,0|1,0,2]=4 4651 B15R0.70 CCCCOCCCCOCCCCOC 34a_200000760531_100000755781 [0,1,0,0,0,0|3,0,0]=4 4652 B15R0.70 CCCCOCCCCOCCCCOC 7a_200000760531_100000730899 [0,1,0,0,0,0|3,0,0]=4 4653 B15R0.70 CCCCOCCCNCCCCCC#N 2230a_200000211371_100009813376 [0,1,0,0,0,0|2,0,1]=4 4654 B15R0.70 CCCCOCCCNCCCCCC=O 2230a_200000211371_100000139337 [0,1,0,0,0,0|1,0,0]=2 4655 B15R0.70 CCCCOCCCNCCCCCCF 2230a_200000211371_100015922095 [0,1,0,0,0,0|2,0,1]=4 4656 B15R0.70 CCCCOCCCNCCCCCCF 34a_200000211371_100015922095 [0,1,0,0,0,0|2,0,1]=4 4657 B15R0.70 CCCCOCCCNCCCCCCO 2230a_200000211371_100000766143 [0,1,0,0,0,0|1,0,2]=4 4658 B15R0.70 CCCCOCCCNCCCCCCO 34a_200000211371_100000766143 [0,1,0,0,0,0|1,0,2]=4 4659 B15R0.70 CCCCOCCCOCCCCCC#N 7a_200011215613_100009813376 [0,1,0,0,0,0|2,0,1]=4 4660 B15R0.70 CCCCOCCCOCCCCCC=O 7a_200011215613_100000139337 [0,1,0,0,0,0|1,0,0]=2 4661 B15R0.70 CCCCOCCCOCCCCCCF 34a_200011215613_100015922095 [0,1,0,0,0,0|2,0,1]=4 4662 B15R0.70 CCCCOCCCOCCCCCCF 7a_200011215613_100015922095 [0,1,0,0,0,0|2,0,1]=4 4663 B15R0.70 CCCCOCCCOCCCCCCO 34a_200011215613_100000766143 [0,1,0,0,0,0|1,0,2]=4 4664 B15R0.70 CCCCOCCCOCCCCCCO 7a_200011215613_100000766143 [0,1,0,0,0,0|1,0,2]=4 4665 B15R0.70 CCCCOCCNCCCCCCCO 2230a_100011996573_100000743108 [0,1,0,0,0,0|1,0,2]=4 4666 B15R0.70 CCCCOCCNCCCCCCCO 34a_100011996573_100000743108 [0,1,0,0,0,0|1,0,2]=4 4667 B15R0.70 CCCCOCCOCCCCCCC#N 7a_100000210238_100009813337 [0,1,0,0,0,0|2,0,1]=4 4668 B15R0.70 CCCCOCCOCCCCCCCBr 34a_100000760002_100000743108 [0,1,0,0,0,0|2,0,1]=4 4669 B15R0.70 CCCCOCCOCCCCCCCBr 7a_100000760002_100000743108 [0,1,0,0,0,0|2,0,1]=4 4670 B15R0.70 CCCCOCCOCCCCCCCN 34a_100011996573_100000743108 [0,1,0,0,0,0|2,0,1]=4 4671 B15R0.70 CCCCOCCOCCCCCCCO 34a_100000210238_100000760002 [0,1,0,0,0,0|1,0,2]=4 4672 B15R0.70 CCCCOCCOCCCCCCCO 7a_100000210238_100000760002 [0,1,0,0,0,0|1,0,2]=4 4673 B15R0.70 CCCCOCCOCCCCCCOC 34a_100000210238_100011998445 [0,1,0,0,0,0|3,0,0]=4 4674 B15R0.70 CCCCOCCOCCCCCCOC 34a_200012092642_100000743108 [0,1,0,0,0,0|3,0,0]=4 4675 B15R0.70 CCCCOCCOCCCCCCOC 7a_100000210238_100011998445 [0,1,0,0,0,0|3,0,0]=4 4676 B15R0.70 CCCCOCCOCCCCCCOC 7a_200012092642_100000743108 [0,1,0,0,0,0|3,0,0]=4 4677 B15R0.70 CCCCOCCOCCOCCCC=O 7a_100011215186_200011292268 [0,1,0,0,0,0|2,0,0]=3 4678 B15R0.70 CCCCOCCSCCCCCCC#N 62a_100000743108_100009813337 [0,1,0,0,0,0|2,0,1]=4 4679 B15R0.70 CCCCOCCSCCCCCCC#N 62a_100009813337_100000743108 [0,1,0,0,0,0|2,0,1]=4 4680 B15R0.70 CCCCOCCSCCCCCCCO 62a_100000743108_100000760002 [0,1,0,0,0,0|1,0,2]=4 4681 B15R0.70 CCCCOCCSCCCCCCCO 62a_100000760002_100000743108 [0,1,0,0,0,0|1,0,2]=4 4682 B15R0.70 CCCCOCCSCCCCCCOC 62a_100000743108_100011998445 [0,1,0,0,0,0|3,0,0]=4 4683 B15R0.70 CCCCOCCSCCCCCCOC 62a_100011998445_100000743108 [0,1,0,0,0,0|3,0,0]=4 4684 B15R0.70 CCCCOCNCCCCCCCCO 2230a_102515433106_100011995733 [0,1,0,0,0,0|1,0,2]=4 4685 B15R0.70 CCCCOCNCCCCCCCCO 34a_102515433106_100011995733 [0,1,0,0,0,0|1,0,2]=4 4686 B15R0.70 CCCCOCOCCCCCCCCBr 34a_100009813846_100011995733 [0,1,0,0,0,0|2,0,1]=4 4687 B15R0.70 CCCCOCOCCCCCCCCCl 34a_100000033203_100011995733 [0,1,0,0,0,0|2,0,1]=4 4688 B15R0.70 CCCCOCOCCCCCCCCN 34a_102515433106_100011995733 [0,1,0,0,0,0|2,0,1]=4 4689 B15R0.70 CCCCOCSCCCCCCCCO 62a_100000033203_100011995733 [0,1,0,0,0,0|1,0,2]=4 4690 B15R0.70 CCCCOCSCCCCCCCCO 62a_100011995733_100000033203 [0,1,0,0,0,0|1,0,2]=4 4691 B15R0.70 CCCCSCCCCCCCCCCO 62a_100000210211_200000033068 [0,1,0,0,0,0|0,0,2]=3 4692 B15R0.70 CCCCSCCCCCCCCCCO 62a_100009813290_100000210210 [0,1,0,0,0,0|0,0,2]=3 4693 B15R0.70 CCCCSCCNCCCCCCC#N 2230a_100025743550_100009813337 [0,1,0,0,0,0|2,0,1]=4 4694 B15R0.70 CCCCSCCNCCCCCCCO 2230a_100025743550_100000760002 [0,1,0,0,0,0|1,0,2]=4 4695 B15R0.70 CCCCSCCNCCCCCCOC 2230a_100025743550_100011998445 [0,1,0,0,0,0|3,0,0]=4 4696 B15R0.70 CCCCSCCOCCCCCCC#N 7a_200000230436_100009813337 [0,1,0,0,0,0|2,0,1]=4 4697 B15R0.70 CCCCSCCOCCCCCCCO 34a_200000230436_100000760002 [0,1,0,0,0,0|1,0,2]=4 4698 B15R0.70 CCCCSCCOCCCCCCCO 7a_200000230436_100000760002 [0,1,0,0,0,0|1,0,2]=4 4699 B15R0.70 CCCCSCCOCCCCCCOC 34a_200000230436_100011998445 [0,1,0,0,0,0|3,0,0]=4 4700 B15R0.70 CCCCSCCOCCCCCCOC 7a_200000230436_100011998445 [0,1,0,0,0,0|3,0,0]=4 4701 B15R0.70 CCCOCCCCCCCCCCCBr 34a_100009812471_100000210303 [0,1,0,0,0,0|1,0,1]=3 4702 B15R0.70 CCCOCCCCCCCCCCCBr 7a_100009812471_100000210303 [0,1,0,0,0,0|1,0,1]=3 4703 B15R0.70 CCCOCCCCCCCCCCCO 34a_100000210258_100009812471 [0,1,0,0,0,0|0,0,2]=3 4704 B15R0.70 CCCOCCCCCCCCCOCC 34a_100009875440_100000210303 [0,1,0,0,0,0|2,0,1]=4 4705 B15R0.70 CCCOCCCCCCCCCOCC 7a_100009875440_100000210303 [0,1,0,0,0,0|2,0,1]=4 4706 B15R0.70 CCCOCCCNCCCCCCC#N 2230a_100011217757_100009813337 [0,1,0,0,0,0|2,0,1]=4 4707 B15R0.70 CCCOCCCNCCCCCCCO 2230a_100011217757_100000760002 [0,1,0,0,0,0|1,0,2]=4 4708 B15R0.70 CCCOCCCNCCCCCCCO 34a_100011217757_100000760002 [0,1,0,0,0,0|1,0,2]=4 4709 B15R0.70 CCCOCCCNCCCCCCOC 2230a_100011217757_100011998445 [0,1,0,0,0,0|3,0,0]=4 4710 B15R0.70 CCCOCCCNCCCCCCOC 34a_100011217757_100011998445 [0,1,0,0,0,0|3,0,0]=4 4711 B15R0.70 CCCOCCNCCCCCCCCO 2230a_100161115042_100000033203 [0,1,0,0,0,0|1,0,2]=4 4712 B15R0.70 CCCOCCNCCCCCCCCO 2230a_102515433106_100011215938 [0,1,0,0,0,0|1,0,2]=4 4713 B15R0.70 CCCOCCNCCCCCCCCO 34a_100161115042_100000033203 [0,1,0,0,0,0|1,0,2]=4 4714 B15R0.70 CCCOCCNCCCCCCCCO 34a_102515433106_100011215938 [0,1,0,0,0,0|1,0,2]=4 4715 B15R0.70 CCCOCCOCCCCCCCCBr 34a_100009813846_100011215938 [0,1,0,0,0,0|2,0,1]=4 4716 B15R0.70 CCCOCCOCCCCCCCCBr 7a_100009813846_100011215938 [0,1,0,0,0,0|2,0,1]=4 4717 B15R0.70 CCCOCCOCCCCCCCCCl 34a_100000033203_100011215938 [0,1,0,0,0,0|2,0,1]=4 4718 B15R0.70 CCCOCCOCCCCCCCCCl 7a_100000033203_100011215938 [0,1,0,0,0,0|2,0,1]=4 4719 B15R0.70 CCCOCCOCCCCCCCCN 34a_102515433106_100011215938 [0,1,0,0,0,0|2,0,1]=4 4720 B15R0.70 CCCOCCOCCCCCCCCO 34a_100000752267_100000033203 [0,1,0,0,0,0|1,0,2]=4 4721 B15R0.70 CCCOCCOCCCCCCCCO 7a_100000752267_100000033203 [0,1,0,0,0,0|1,0,2]=4 4722 B15R0.70 CCCOCCOCCNCCCCC=O 2230a_200011904461_100000139335 [0,1,0,0,0,0|2,0,0]=3 4723 B15R0.70 CCCOCCSCCCCCCCCO 62a_100000033203_100011215938 [0,1,0,0,0,0|1,0,2]=4 4724 B15R0.70 CCCOCCSCCCCCCCCO 62a_100011215938_100000033203 [0,1,0,0,0,0|1,0,2]=4 4725 B15R0.70 CCCSCCCCCCCCCCCO 62a_100009812471_100000210303 [0,1,0,0,0,0|0,0,2]=3 4726 B15R0.70 CCCSCCNCCCCCCCCO 2230a_100020603323_100000033203 [0,1,0,0,0,0|1,0,2]=4 4727 B15R0.70 CCCSCCOCCCCCCCCO 34a_200000230433_100000033203 [0,1,0,0,0,0|1,0,2]=4 4728 B15R0.70 CCCSCCOCCCCCCCCO 7a_200000230433_100000033203 [0,1,0,0,0,0|1,0,2]=4 4729 B15R0.70 CCNCCCCCCCCCCCCO 2230a_100000066677_100000210202 [0,1,0,0,0,0|0,0,2]=3 4730 B15R0.70 CCNCCCCCCCCCCCCO 2230a_100015525214_100009813331 [0,1,0,0,0,0|0,0,2]=3 4731 B15R0.70 CCNCCCCCCCCCCCCO 34a_100000066677_100000210202 [0,1,0,0,0,0|0,0,2]=3 4732 B15R0.70 CCNCCCCCCOCCCCCO 2230a_100015525214_200132310570 [0,1,0,0,0,0|1,0,2]=4 4733 B15R0.70 CCOCCCCCCCCCCCCBr 34a_100009813331_100000210202 [0,1,0,0,0,0|1,0,1]=3 4734 B15R0.70 CCOCCCCCCCCCCCCBr 7a_100009813331_100000210202 [0,1,0,0,0,0|1,0,1]=3 4735 B15R0.70 CCOCCCCCCCCCCCCN 34a_100000066677_100000210202 [0,1,0,0,0,0|1,0,1]=3 4736 B15R0.70 CCOCCCCCCCCCCCCO 34a_100121572206_100009813331 [0,1,0,0,0,0|0,0,2]=3 4737 B15R0.70 CCOCCCCCCCCCOCC#N 7a_100009875440_100011215382 [0,1,0,0,0,0|2,0,1]=4 4738 B15R0.70 CCOCCCCCCCCCOCC=O 34a_100009875440_200009817547 [0,1,0,0,0,0|1,0,0]=2 4739 B15R0.70 CCOCCCCCCCCCOCC=O 7a_100009875440_200015260668 [0,1,0,0,0,0|1,0,0]=2 4740 B15R0.70 CCOCCCCCCCCCOCCF 34a_100009875440_100011217306 [0,1,0,0,0,0|2,0,1]=4 4741 B15R0.70 CCOCCCCCCCCCOCCF 7a_100009875440_100011217306 [0,1,0,0,0,0|2,0,1]=4 4742 B15R0.70 CCOCCCCCCCCCOCCO 34a_100009875440_100000211926 [0,1,0,0,0,0|1,0,2]=4 4743 B15R0.70 CCOCCCCCCCCCOCCO 7a_100009875440_100000211926 [0,1,0,0,0,0|1,0,2]=4 4744 B15R0.70 CCOCCCCCCCCCOCSC 34a_100009875440_100011218213 [0,1,0,0,0,0|3,0,0]=4 4745 B15R0.70 CCOCCCCCCOCCCCCO 34a_100121572206_200132310570 [0,1,0,0,0,0|1,0,2]=4 4746 B15R0.70 CCOCCCCCOCCCCCCCl 34a_200132310570_100000210202 [0,1,0,0,0,0|2,0,1]=4 4747 B15R0.70 CCOCCCCCOCCCCCCCl 7a_200132310570_100000210202 [0,1,0,0,0,0|2,0,1]=4 4748 B15R0.70 CCOCCCNCCCCCCCCO 2230a_100000210961_100000033203 [0,1,0,0,0,0|1,0,2]=4 4749 B15R0.70 CCOCCCNCCCCCCCCO 2230a_102515433106_100012232248 [0,1,0,0,0,0|1,0,2]=4 4750 B15R0.70 CCOCCCNCCCCCCCCO 34a_100000210961_100000033203 [0,1,0,0,0,0|1,0,2]=4 4751 B15R0.70 CCOCCCNCCCCCCCCO 34a_102515433106_100012232248 [0,1,0,0,0,0|1,0,2]=4 4752 B15R0.70 CCOCCCOCCCCCCCCBr 34a_100009813846_100012232248 [0,1,0,0,0,0|2,0,1]=4 4753 B15R0.70 CCOCCCOCCCCCCCCBr 7a_100009813846_100012232248 [0,1,0,0,0,0|2,0,1]=4 4754 B15R0.70 CCOCCCOCCCCCCCCCl 34a_100000033203_100012232248 [0,1,0,0,0,0|2,0,1]=4 4755 B15R0.70 CCOCCCOCCCCCCCCCl 7a_100000033203_100012232248 [0,1,0,0,0,0|2,0,1]=4 4756 B15R0.70 CCOCCCOCCCCCCCCN 34a_102515433106_100012232248 [0,1,0,0,0,0|2,0,1]=4 4757 B15R0.70 CCOCCCOCCCCCCCCO 34a_100000757476_100000033203 [0,1,0,0,0,0|1,0,2]=4 4758 B15R0.70 CCOCCCOCCCCCCCCO 7a_100000757476_100000033203 [0,1,0,0,0,0|1,0,2]=4 4759 B15R0.70 CCOCCCSCCCCCCCCO 62a_100000033203_100012232248 [0,1,0,0,0,0|1,0,2]=4 4760 B15R0.70 CCOCCCSCCCCCCCCO 62a_100012232248_100000033203 [0,1,0,0,0,0|1,0,2]=4 4761 B15R0.70 CCOCCNCCCCCCCCCO 2230a_100000078944_100011215890 [0,1,0,0,0,0|1,0,2]=4 4762 B15R0.70 CCOCCNCCCCCCCCCO 2230a_102516460346_100009813782 [0,1,0,0,0,0|1,0,2]=4 4763 B15R0.70 CCOCCNCCCCCCCCCO 34a_100000078944_100000210147 [0,1,0,0,0,0|1,0,2]=4 4764 B15R0.70 CCOCCNCCCCCCCCCO 34a_102516460346_100009813782 [0,1,0,0,0,0|1,0,2]=4 4765 B15R0.70 CCOCCOCCCCCCCCCBr 34a_100009813782_100000210147 [0,1,0,0,0,0|2,0,1]=4 4766 B15R0.70 CCOCCOCCCCCCCCCBr 7a_100009813782_100011215890 [0,1,0,0,0,0|2,0,1]=4 4767 B15R0.70 CCOCCOCCCCCCCCCCl 34a_100009868337_100000210147 [0,1,0,0,0,0|2,0,1]=4 4768 B15R0.70 CCOCCOCCCCCCCCCCl 7a_100009868337_100011215890 [0,1,0,0,0,0|2,0,1]=4 4769 B15R0.70 CCOCCOCCCCCCCCCN 34a_100000078944_100000210147 [0,1,0,0,0,0|2,0,1]=4 4770 B15R0.70 CCOCCOCCCCCCCCCO 34a_100000210136_100009813782 [0,1,0,0,0,0|1,0,2]=4 4771 B15R0.70 CCOCCOCCCCCCCCCO 7a_100000210136_100009813782 [0,1,0,0,0,0|1,0,2]=4 4772 B15R0.70 CCOCCOCCNCCCCCC=O 2230a_100102712874_100000139337 [0,1,0,0,0,0|2,0,0]=3 4773 B15R0.70 CCOCCOCCOCCCCCC=O 7a_100000210240_100000139337 [0,1,0,0,0,0|2,0,0]=3 4774 B15R0.70 CCOCCOCCSCCCCCC=O 62a_100000139337_100011211534 [0,1,0,0,0,0|2,0,0]=3 4775 B15R0.70 CCOCCOCCSCCCCCC=O 62a_100011211534_100000139337 [0,1,0,0,0,0|2,0,0]=3 4776 B15R0.70 CCOCCSCCCCCCCCCO 62a_100000210147_100009813782 [0,1,0,0,0,0|1,0,2]=4 4777 B15R0.70 CCOCCSCCCCCCCCCO 62a_100009813782_100011215890 [0,1,0,0,0,0|1,0,2]=4 4778 B15R0.70 CCOCSCCCCCCCCCCO 62a_100000739092_200000033068 [0,1,0,0,0,0|1,0,2]=4 4779 B15R0.70 CCOCSCCCCCCCCCCO 62a_100009813290_100000739092 [0,1,0,0,0,0|1,0,2]=4 4780 B15R0.70 CCSCCCCCCCCCCCCO 62a_100009813331_100000210202 [0,1,0,0,0,0|0,0,2]=3 4781 B15R0.70 CCSCCCCCCOCCCCCO 62a_100000210202_200132310570 [0,1,0,0,0,0|1,0,2]=4 4782 B15R0.70 CCSCCCCCCOCCCCCO 62a_200132310570_100000210202 [0,1,0,0,0,0|1,0,2]=4 4783 B15R0.70 CCSCCCOCCCCCCCCO 34a_100011216438_100000033203 [0,1,0,0,0,0|1,0,2]=4 4784 B15R0.70 CCSCCCOCCCCCCCCO 7a_100011216438_100000033203 [0,1,0,0,0,0|1,0,2]=4 4785 B15R0.70 CCSCCNCCCCCCCCCO 2230a_100000078944_100000757381 [0,1,0,0,0,0|1,0,2]=4 4786 B15R0.70 CCSCCNCCCCCCCCCO 2230a_100000106463_100009813782 [0,1,0,0,0,0|1,0,2]=4 4787 B15R0.70 CCSCCNCCCCCCCCCO 34a_100000078944_100000757381 [0,1,0,0,0,0|1,0,2]=4 4788 B15R0.70 CCSCCOCCCCCCCCCBr 34a_100009813782_100000757381 [0,1,0,0,0,0|2,0,1]=4 4789 B15R0.70 CCSCCOCCCCCCCCCBr 7a_100009813782_100000757381 [0,1,0,0,0,0|2,0,1]=4 4790 B15R0.70 CCSCCOCCCCCCCCCCl 34a_100009868337_100000757381 [0,1,0,0,0,0|2,0,1]=4 4791 B15R0.70 CCSCCOCCCCCCCCCCl 7a_100009868337_100000757381 [0,1,0,0,0,0|2,0,1]=4 4792 B15R0.70 CCSCCOCCCCCCCCCN 34a_100000078944_100000757381 [0,1,0,0,0,0|2,0,1]=4 4793 B15R0.70 CCSCCOCCCCCCCCCO 34a_100000212035_100009813782 [0,1,0,0,0,0|1,0,2]=4 4794 B15R0.70 CCSCCOCCCCCCCCCO 7a_100000212035_100009813782 [0,1,0,0,0,0|1,0,2]=4 4795 B15R0.70 CCSCCSCCCCCCCCCO 62a_100000757381_100009813782 [0,1,0,0,0,0|1,0,2]=4 4796 B15R0.70 CCSCCSCCCCCCCCCO 62a_100009813782_100000757381 [0,1,0,0,0,0|1,0,2]=4 4797 B15R0.70 CNCCCCCCCCCCCCCO 2230a_106832991635_100009812470 [0,1,0,0,0,0|0,0,2]=3 4798 B15R0.70 CNCCCCCCCCCCCCCO 34a_100102657272_100009812470 [0,1,0,0,0,0|0,0,2]=3 4799 B15R0.70 CNCCCCCCCCCCCCCO 7a_106832991635_100009812470 [0,1,0,0,0,0|0,0,2]=3 4800 B15R0.70 CNCCCCCOCCCCCCCO 34a_100000722520_100000760002 [0,1,0,0,0,0|1,0,2]=4 4801 B15R0.70 CNCCCCCOCCCCCCOC 34a_100000722520_100011998445 [0,1,0,0,0,0|3,0,0]=4 4802 B15R0.70 CNCCCOCCCCCCCCCO 34a_100000213112_100009813782 [0,1,0,0,0,0|1,0,2]=4 4803 B15R0.70 COCCCCCCCCCCCCCBr 34a_100009812470_200000210301 [0,1,0,0,0,0|1,0,1]=3 4804 B15R0.70 COCCCCCCCCCCCCCBr 7a_100009812470_200000210301 [0,1,0,0,0,0|1,0,1]=3 4805 B15R0.70 COCCCCCCCCCCCCCO 34a_100138415774_100009812470 [0,1,0,0,0,0|0,0,2]=3 4806 B15R0.70 COCCCCCCNCCCCCCO 2230a_100000686447_100011998445 [0,1,0,0,0,0|1,0,2]=4 4807 B15R0.70 COCCCCCCNCCCCCCO 34a_100000686447_100011998445 [0,1,0,0,0,0|1,0,2]=4 4808 B15R0.70 COCCCCCCNCCCCCOC 2230a_100000747528_100011998445 [0,1,0,0,0,0|3,0,0]=4 4809 B15R0.70 COCCCCCCNCCCCCOC 34a_100000747528_100011998445 [0,1,0,0,0,0|3,0,0]=4 4810 B15R0.70 COCCCCCCOCCCCCC#N 7a_200012092642_100009813376 [0,1,0,0,0,0|2,0,1]=4 4811 B15R0.70 COCCCCCCOCCCCCC=O 7a_200012092642_100000139337 [0,1,0,0,0,0|1,0,0]=2 4812 B15R0.70 COCCCCCCOCCCCCCBr 34a_100011215345_100011998445 [0,1,0,0,0,0|2,0,1]=4 4813 B15R0.70 COCCCCCCOCCCCCCBr 7a_100011215345_100011998445 [0,1,0,0,0,0|2,0,1]=4 4814 B15R0.70 COCCCCCCOCCCCCCCl 34a_100000766143_100011998445 [0,1,0,0,0,0|2,0,1]=4 4815 B15R0.70 COCCCCCCOCCCCCCCl 7a_100000766143_100011998445 [0,1,0,0,0,0|2,0,1]=4 4816 B15R0.70 COCCCCCCOCCCCCCF 34a_100000732779_100011998445 [0,1,0,0,0,0|2,0,1]=4 4817 B15R0.70 COCCCCCCOCCCCCCF 34a_200012092642_100015922095 [0,1,0,0,0,0|2,0,1]=4 4818 B15R0.70 COCCCCCCOCCCCCCF 7a_100000732779_100011998445 [0,1,0,0,0,0|2,0,1]=4 4819 B15R0.70 COCCCCCCOCCCCCCF 7a_200012092642_100015922095 [0,1,0,0,0,0|2,0,1]=4 4820 B15R0.70 COCCCCCCOCCCCCCN 34a_100000686447_100011998445 [0,1,0,0,0,0|2,0,1]=4 4821 B15R0.70 COCCCCCCOCCCCCCO 34a_200012092642_100000766143 [0,1,0,0,0,0|1,0,2]=4 4822 B15R0.70 COCCCCCCOCCCCCCO 7a_200012092642_100000766143 [0,1,0,0,0,0|1,0,2]=4 4823 B15R0.70 COCCCCCCSCCCCCC#N 62a_100009813376_100011998445 [0,1,0,0,0,0|2,0,1]=4 4824 B15R0.70 COCCCCCCSCCCCCC#N 62a_100011998445_100009813376 [0,1,0,0,0,0|2,0,1]=4 4825 B15R0.70 COCCCCCCSCCCCCC=O 62a_100000139337_100011998445 [0,1,0,0,0,0|1,0,0]=2 4826 B15R0.70 COCCCCCCSCCCCCC=O 62a_100011998445_100000139337 [0,1,0,0,0,0|1,0,0]=2 4827 B15R0.70 COCCCCCCSCCCCCCF 62a_100011998445_100015922095 [0,1,0,0,0,0|2,0,1]=4 4828 B15R0.70 COCCCCCCSCCCCCCF 62a_100015922095_100011998445 [0,1,0,0,0,0|2,0,1]=4 4829 B15R0.70 COCCCCCCSCCCCCCO 62a_100000766143_100011998445 [0,1,0,0,0,0|1,0,2]=4 4830 B15R0.70 COCCCCCCSCCCCCCO 62a_100011998445_100000766143 [0,1,0,0,0,0|1,0,2]=4 4831 B15R0.70 COCCCCCNCCCCCCC#N 2230a_100000747528_100009813337 [0,1,0,0,0,0|2,0,1]=4 4832 B15R0.70 COCCCCCNCCCCCCCO 2230a_100000747528_100000760002 [0,1,0,0,0,0|1,0,2]=4 4833 B15R0.70 COCCCCCNCCCCCCCO 34a_100000747528_100000760002 [0,1,0,0,0,0|1,0,2]=4 4834 B15R0.70 COCCCCNCCCCCCCCO 2230a_102515433106_100000730899 [0,1,0,0,0,0|1,0,2]=4 4835 B15R0.70 COCCCCNCCCCCCCCO 34a_102515433106_100000755781 [0,1,0,0,0,0|1,0,2]=4 4836 B15R0.70 COCCCCOCCCCCCCCBr 34a_100009813846_100000755781 [0,1,0,0,0,0|2,0,1]=4 4837 B15R0.70 COCCCCOCCCCCCCCBr 7a_100009813846_100000730899 [0,1,0,0,0,0|2,0,1]=4 4838 B15R0.70 COCCCCOCCCCCCCCCl 34a_100000033203_100000755781 [0,1,0,0,0,0|2,0,1]=4 4839 B15R0.70 COCCCCOCCCCCCCCCl 7a_100000033203_100000730899 [0,1,0,0,0,0|2,0,1]=4 4840 B15R0.70 COCCCCOCCCCCCCCN 34a_102515433106_100000755781 [0,1,0,0,0,0|2,0,1]=4 4841 B15R0.70 COCCCCOCCCCCCCCO 34a_100000740925_100000033203 [0,1,0,0,0,0|1,0,2]=4 4842 B15R0.70 COCCCCSCCCCCCCCO 62a_100000033203_100000730899 [0,1,0,0,0,0|1,0,2]=4 4843 B15R0.70 COCCCCSCCCCCCCCO 62a_100000730899_100000033203 [0,1,0,0,0,0|1,0,2]=4 4844 B15R0.70 COCCCNCCCCCCCCCO 2230a_100000078944_100000740836 [0,1,0,0,0,0|1,0,2]=4 4845 B15R0.70 COCCCNCCCCCCCCCO 34a_100000078944_100000740836 [0,1,0,0,0,0|1,0,2]=4 4846 B15R0.70 COCCCNCCCCCCCCCO 34a_100150723488_100009813782 [0,1,0,0,0,0|1,0,2]=4 4847 B15R0.70 COCCCOCCCCCCCCCBr 34a_100009813782_100000740836 [0,1,0,0,0,0|2,0,1]=4 4848 B15R0.70 COCCCOCCCCCCCCCBr 7a_100009813782_100000740836 [0,1,0,0,0,0|2,0,1]=4 4849 B15R0.70 COCCCOCCCCCCCCCCl 34a_100009868337_100000740836 [0,1,0,0,0,0|2,0,1]=4 4850 B15R0.70 COCCCOCCCCCCCCCCl 7a_100009868337_100000740836 [0,1,0,0,0,0|2,0,1]=4 4851 B15R0.70 COCCCOCCCCCCCCCN 34a_100000078944_100000740836 [0,1,0,0,0,0|2,0,1]=4 4852 B15R0.70 COCCCOCCCCCCCCCO 34a_100000740835_100009813782 [0,1,0,0,0,0|1,0,2]=4 4853 B15R0.70 COCCCOCCCOCCCCC=O 7a_200011215475_100000139335 [0,1,0,0,0,0|2,0,0]=3 4854 B15R0.70 COCCCSCCCCCCCCCO 62a_100000709357_100009813782 [0,1,0,0,0,0|1,0,2]=4 4855 B15R0.70 COCCCSCCCCCCCCCO 62a_100009813782_100000709357 [0,1,0,0,0,0|1,0,2]=4 4856 B15R0.70 COCCNCCCCCCCCCCO 2230a_100000066964_100011201679 [0,1,0,0,0,0|1,0,2]=4 4857 B15R0.70 COCCNCCCCCCCCCCO 2230a_100000209980_100009813290 [0,1,0,0,0,0|1,0,2]=4 4858 B15R0.70 COCCNCCCCCCCCCCO 34a_100000066964_100011201679 [0,1,0,0,0,0|1,0,2]=4 4859 B15R0.70 COCCOCCCCCCCCCCBr 34a_100009813290_100011201679 [0,1,0,0,0,0|2,0,1]=4 4860 B15R0.70 COCCOCCCCCCCCCCBr 7a_100009813290_100000233755 [0,1,0,0,0,0|2,0,1]=4 4861 B15R0.70 COCCOCCCCCCCCCCCl 34a_200000033068_100011201679 [0,1,0,0,0,0|2,0,1]=4 4862 B15R0.70 COCCOCCCCCCCCCCCl 7a_200000033068_100000233755 [0,1,0,0,0,0|2,0,1]=4 4863 B15R0.70 COCCOCCCCCCCCCCN 34a_100000066964_100011201679 [0,1,0,0,0,0|2,0,1]=4 4864 B15R0.70 COCCOCCCCCCCCCCO 34a_100000210237_100009813290 [0,1,0,0,0,0|1,0,2]=4 4865 B15R0.70 COCCOCCCNCCCCCC=O 2230a_100000206027_100000139337 [0,1,0,0,0,0|2,0,0]=3 4866 B15R0.70 COCCOCCCSCCCCCC=O 62a_100000139337_100011216529 [0,1,0,0,0,0|2,0,0]=3 4867 B15R0.70 COCCOCCCSCCCCCC=O 62a_100011216529_100000139337 [0,1,0,0,0,0|2,0,0]=3 4868 B15R0.70 COCCOCCOCCNCCCC=O 2230a_100012028300_200011292268 [0,1,0,0,0,0|3,0,0]=4 4869 B15R0.70 COCCOCCOCCOCCCC=O 7a_100000688194_200011292268 [0,1,0,0,0,0|3,0,0]=4 4870 B15R0.70 COCCOCCOCCSCCCC=O 62a_100013367474_200011292268 [0,1,0,0,0,0|3,0,0]=4 4871 B15R0.70 COCCOCCOCCSCCCC=O 62a_200011292268_100013367474 [0,1,0,0,0,0|3,0,0]=4 4872 B15R0.70 COCCSCCCCCCCCCCO 62a_100000233755_200000033068 [0,1,0,0,0,0|1,0,2]=4 4873 B15R0.70 COCCSCCCCCCCCCCO 62a_100009813290_100000233755 [0,1,0,0,0,0|1,0,2]=4 4874 B15R0.70 COCSCCCCCCCCCCCO 62a_100009812471_100000766300 [0,1,0,0,0,0|1,0,2]=4 4875 B15R0.70 CSCCCCCCCCCCCCCO 62a_100009812470_200000210301 [0,1,0,0,0,0|0,0,2]=3 4876 B15R0.70 CSCCCCOCCCCCCCCO 34a_100011217163_100000033203 [0,1,0,0,0,0|1,0,2]=4 4877 B15R0.70 CSCCCCOCCCCCCCCO 7a_100011217163_100000033203 [0,1,0,0,0,0|1,0,2]=4 4878 B15R0.70 CSCCCNCCCCCCCCCO 2230a_100000749238_100009813782 [0,1,0,0,0,0|1,0,2]=4 4879 B15R0.70 CSCCCOCCCCCCCCCO 34a_100000690336_100009813782 [0,1,0,0,0,0|1,0,2]=4 4880 B15R0.70 CSCCCOCCCCCCCCCO 7a_100000690336_100009813782 [0,1,0,0,0,0|1,0,2]=4 4881 B15R0.70 CSCCNCCCCCCCCCCO 2230a_100000066964_100000751147 [0,1,0,0,0,0|1,0,2]=4 4882 B15R0.70 CSCCNCCCCCCCCCCO 2230a_100020590264_100009813290 [0,1,0,0,0,0|1,0,2]=4 4883 B15R0.70 CSCCNCCCCCCCCCCO 34a_100000066964_100000212216 [0,1,0,0,0,0|1,0,2]=4 4884 B15R0.70 CSCCOCCCCCCCCCCBr 34a_100009813290_100000212216 [0,1,0,0,0,0|2,0,1]=4 4885 B15R0.70 CSCCOCCCCCCCCCCBr 7a_100009813290_100000212216 [0,1,0,0,0,0|2,0,1]=4 4886 B15R0.70 CSCCOCCCCCCCCCCCl 34a_200000033068_100000212216 [0,1,0,0,0,0|2,0,1]=4 4887 B15R0.70 CSCCOCCCCCCCCCCCl 7a_200000033068_100000212216 [0,1,0,0,0,0|2,0,1]=4 4888 B15R0.70 CSCCOCCCCCCCCCCN 34a_100000066964_100000212216 [0,1,0,0,0,0|2,0,1]=4 4889 B15R0.70 CSCCOCCCCCCCCCCO 34a_100000230434_100009813290 [0,1,0,0,0,0|1,0,2]=4 4890 B15R0.70 CSCCOCCCCCCCCCCO 7a_100000230434_100009813290 [0,1,0,0,0,0|1,0,2]=4 4891 B15R0.70 CSCCSCCCCCCCCCCO 62a_100000212216_200000033068 [0,1,0,0,0,0|1,0,2]=4 4892 B15R0.70 CSCCSCCCCCCCCCCO 62a_100009813290_100000751147 [0,1,0,0,0,0|1,0,2]=4 4893 B15R0.70 CSCOCCCCCCCCCCCBr 34a_100009812471_100011218213 [0,1,0,0,0,0|2,0,1]=4 4894 B15R0.70 CSCSCCCCCCCCCCCO 62a_100009812471_100011218213 [0,1,0,0,0,0|1,0,2]=4 4895 B15R0.70 FCCCCCCOCCCCCCCBr 34a_100000760002_100015922095 [0,1,0,0,0,0|2,0,1]=4 4896 B15R0.70 FCCCCCCOCCCCCCCBr 7a_100000760002_100015922095 [0,1,0,0,0,0|2,0,1]=4 4897 B15R0.70 FCCCCCOCCCCCCCCBr 34a_100009813846_100000729378 [0,1,0,0,0,0|2,0,1]=4 4898 B15R0.70 FCCCCCOCCCCCCCCBr 7a_100009813846_100000729378 [0,1,0,0,0,0|2,0,1]=4 4899 B15R0.70 FCCCCCOCCCCCCCCCl 34a_100000033203_100000729378 [0,1,0,0,0,0|2,0,1]=4 4900 B15R0.70 FCCCCCOCCCCCCCCCl 7a_100000033203_100000729378 [0,1,0,0,0,0|2,0,1]=4 4901 B15R0.70 FCCCCOCCCCCCCCCBr 34a_100009813782_100000729493 [0,1,0,0,0,0|2,0,1]=4 4902 B15R0.70 FCCCCOCCCCCCCCCBr 7a_100009813782_100000729493 [0,1,0,0,0,0|2,0,1]=4 4903 B15R0.70 FCCCCOCCCCCCCCCCl 34a_100009868337_100000729493 [0,1,0,0,0,0|2,0,1]=4 4904 B15R0.70 FCCCCOCCCCCCCCCCl 7a_100009868337_100000729493 [0,1,0,0,0,0|2,0,1]=4 4905 B15R0.70 FCCCOCCCCCCCCCCBr 34a_100009813290_100011934791 [0,1,0,0,0,0|2,0,1]=4 4906 B15R0.70 FCCCOCCCCCCCCCCBr 7a_100009813290_100011934791 [0,1,0,0,0,0|2,0,1]=4 4907 B15R0.70 FCCCOCCCCCCCCCCCl 34a_200000033068_100011934791 [0,1,0,0,0,0|2,0,1]=4 4908 B15R0.70 FCCCOCCCCCCCCCCCl 7a_200000033068_100011934791 [0,1,0,0,0,0|2,0,1]=4 4909 B15R0.70 FCCOCCCCCCCCCCCBr 34a_100009812471_100011217306 [0,1,0,0,0,0|2,0,1]=4 4910 B15R0.70 FCCOCCCCCCCCCCCBr 7a_100009812471_100011217306 [0,1,0,0,0,0|2,0,1]=4 4911 B15R0.70 FCOCCCCCCCCCCCCBr 34a_100009813331_100015361967 [0,1,0,0,0,0|2,0,1]=4 4912 B15R0.70 FCOCCCCCCCCCCCCBr 7a_100009813331_100015361967 [0,1,0,0,0,0|2,0,1]=4 4913 B15R0.70 N#CCCCCCCNCCCCCCO 2230a_100000686447_100009813337 [0,1,0,0,0,0|2,0,1]=4 4914 B15R0.70 N#CCCCCCCOCCCCCCBr 7a_100011215345_100009813337 [0,1,0,0,0,0|2,0,1]=4 4915 B15R0.70 N#CCCCCCCOCCCCCCCl 7a_100000766143_100009813337 [0,1,0,0,0,0|2,0,1]=4 4916 B15R0.70 N#CCCCCCCOCCCCCCF 7a_100000732779_100009813337 [0,1,0,0,0,0|2,0,1]=4 4917 B15R0.70 N#CCCCCCCSCCCCCC=O 62a_100000139337_100009813337 [0,1,0,0,0,0|1,0,1]=3 4918 B15R0.70 N#CCCCCCCSCCCCCC=O 62a_100009813337_100000139337 [0,1,0,0,0,0|1,0,1]=3 4919 B15R0.70 N#CCCCCCCSCCCCCCF 62a_100009813337_100015922095 [0,1,0,0,0,0|2,0,1]=4 4920 B15R0.70 N#CCCCCCCSCCCCCCF 62a_100015922095_100009813337 [0,1,0,0,0,0|2,0,1]=4 4921 B15R0.70 N#CCCCCCCSCCCCCCO 62a_100000766143_100009813337 [0,1,0,0,0,0|2,0,1]=4 4922 B15R0.70 N#CCCCCCCSCCCCCCO 62a_100009813337_100000766143 [0,1,0,0,0,0|2,0,1]=4 4923 B15R0.70 N#CCCCCCNCCCCCCCO 2230a_100011996573_100009813376 [0,1,0,0,0,0|2,0,1]=4 4924 B15R0.70 N#CCCCCCOCCCCCCCBr 7a_100000760002_100009813376 [0,1,0,0,0,0|2,0,1]=4 4925 B15R0.70 N#CCCCCCSCCCCCCCO 62a_100000760002_100009813376 [0,1,0,0,0,0|2,0,1]=4 4926 B15R0.70 N#CCCCCCSCCCCCCCO 62a_100009813376_100000760002 [0,1,0,0,0,0|2,0,1]=4 4927 B15R0.70 N#CCCCCNCCCCCCCCO 2230a_102515433106_100000211819 [0,1,0,0,0,0|2,0,1]=4 4928 B15R0.70 N#CCCCCOCCCCCCCCBr 7a_100009813846_100000211819 [0,1,0,0,0,0|2,0,1]=4 4929 B15R0.70 N#CCCCCOCCCCCCCCCl 7a_100000033203_100000211819 [0,1,0,0,0,0|2,0,1]=4 4930 B15R0.70 N#CCCCCSCCCCCCCCO 62a_100000033203_100000211819 [0,1,0,0,0,0|2,0,1]=4 4931 B15R0.70 N#CCCCCSCCCCCCCCO 62a_100011219923_100000033203 [0,1,0,0,0,0|2,0,1]=4 4932 B15R0.70 N#CCCCNCCCCCCCCCO 2230a_100000078944_100000687738 [0,1,0,0,0,0|2,0,1]=4 4933 B15R0.70 N#CCCCOCCCCCCCCCBr 7a_100009813782_100000687738 [0,1,0,0,0,0|2,0,1]=4 4934 B15R0.70 N#CCCCOCCCCCCCCCCl 7a_100009868337_100000687738 [0,1,0,0,0,0|2,0,1]=4 4935 B15R0.70 N#CCCCSCCCCCCCCCO 62a_100000687738_100009813782 [0,1,0,0,0,0|2,0,1]=4 4936 B15R0.70 N#CCCCSCCCCCCCCCO 62a_100009813782_100000687738 [0,1,0,0,0,0|2,0,1]=4 4937 B15R0.70 N#CCCNCCCCCCCCCCO 2230a_100000066964_100011215226 [0,1,0,0,0,0|2,0,1]=4 4938 B15R0.70 N#CCCOCCCCCCCCCCBr 7a_100009813290_100000184422 [0,1,0,0,0,0|2,0,1]=4 4939 B15R0.70 N#CCCOCCCCCCCCCCCl 7a_200000033068_100000184422 [0,1,0,0,0,0|2,0,1]=4 4940 B15R0.70 N#CCCSCCCCCCCCCCO 62a_100009813290_100011215226 [0,1,0,0,0,0|2,0,1]=4 4941 B15R0.70 N#CCCSCCCCCCCCCCO 62a_100011215226_200000033068 [0,1,0,0,0,0|2,0,1]=4 4942 B15R0.70 N#CCOCCCCCCCCCCCBr 7a_100009812471_100011215382 [0,1,0,0,0,0|2,0,1]=4 4943 B15R0.70 N#CCSCCCCCCCCCCCO 62a_100009812471_100011215382 [0,1,0,0,0,0|2,0,1]=4 4944 B15R0.70 NCCCCCCCCCCCCOCF 34a_100000066677_100015361967 [0,1,0,0,0,0|2,0,1]=4 4945 B15R0.70 NCCCCCCCCCCOCCCF 34a_100000066964_100011934791 [0,1,0,0,0,0|2,0,1]=4 4946 B15R0.70 NCCCCCCCCCCOCCCO 34a_100000066964_100000230001 [0,1,0,0,0,0|1,0,2]=4 4947 B15R0.70 NCCCCCCCCCOCCCCF 34a_100000078944_100000729493 [0,1,0,0,0,0|2,0,1]=4 4948 B15R0.70 NCCCCCCCCCOCCCCO 34a_100000078944_100011216708 [0,1,0,0,0,0|1,0,2]=4 4949 B15R0.70 NCCCCCCCCOCCCCCF 34a_102515433106_100000729378 [0,1,0,0,0,0|2,0,1]=4 4950 B15R0.70 NCCCCCCCCOCCCCCO 34a_102515433106_100000746330 [0,1,0,0,0,0|1,0,2]=4 4951 B15R0.70 NCCCCCCCOCCCCCCF 34a_100011996573_100015922095 [0,1,0,0,0,0|2,0,1]=4 4952 B15R0.70 NCCCCCCCOCCCCCCO 34a_100011996573_100000766143 [0,1,0,0,0,0|1,0,2]=4 4953 B15R0.70 NCCCCCCOCCCCCCCO 34a_100000686447_100000760002 [0,1,0,0,0,0|1,0,2]=4 4954 B15R0.70 NCCCCCOCCCCCCCCO 34a_100000762737_100000033203 [0,1,0,0,0,0|1,0,2]=4 4955 B15R0.70 NCCCCOCCCCCCCCCO 34a_100000750430_100009813782 [0,1,0,0,0,0|1,0,2]=4 4956 B15R0.70 NCCCOCCCCCCCCCCO 34a_100000182051_100009813290 [0,1,0,0,0,0|1,0,2]=4 4957 B15R0.70 NCCOCCCCCCCCCCCO 34a_100000210304_100009812471 [0,1,0,0,0,0|1,0,2]=4 4958 B15R0.70 NOCCOCCCCCCCCCCO 34a_100000700252_100009813290 [0,1,0,0,0,0|3,0,0]=4 4959 B15R0.70 O=CCCCCCNCCCCCCCO 2230a_100011996573_100000139337 [0,1,0,0,0,0|1,0,0]=2 4960 B15R0.70 O=CCCCCCNCCCOCCCO 2230a_100011310245_100000139337 [0,1,0,0,0,0|2,0,0]=3 4961 B15R0.70 O=CCCCCCOCCCCCCCBr 7a_100000760002_100000139337 [0,1,0,0,0,0|1,0,0]=2 4962 B15R0.70 O=CCCCCCSCCCCCCCO 62a_100000139337_100000760002 [0,1,0,0,0,0|1,0,0]=2 4963 B15R0.70 O=CCCCCCSCCCCCCCO 62a_100000760002_100000139337 [0,1,0,0,0,0|1,0,0]=2 4964 B15R0.70 O=CCCCCNCCCCCCCCO 2230a_102515433106_100000139335 [0,1,0,0,0,0|1,0,0]=2 4965 B15R0.70 O=CCCCCNCCOCCOCCO 2230a_100011998139_100000139335 [0,1,0,0,0,0|3,0,0]=4 4966 B15R0.70 O=CCCCCOCCCCCCCCBr 7a_100009813846_100000139335 [0,1,0,0,0,0|1,0,0]=2 4967 B15R0.70 O=CCCCCOCCCCCCCCCl 7a_100000033203_100000139335 [0,1,0,0,0,0|1,0,0]=2 4968 B15R0.70 O=CCCCCOCCOCCOCCBr 7a_100010132937_100000139335 [0,1,0,0,0,0|3,0,0]=4 4969 B15R0.70 O=CCCCCOCCOCCOCCCl 7a_100000032323_100000139335 [0,1,0,0,0,0|3,0,0]=4 4970 B15R0.70 O=CCCCCSCCCCCCCCO 62a_100000033203_100000139335 [0,1,0,0,0,0|1,0,0]=2 4971 B15R0.70 O=CCCCCSCCCCCCCCO 62a_100000139335_100000033203 [0,1,0,0,0,0|1,0,0]=2 4972 B15R0.70 O=CCCCCSCCOCCOCCO 62a_100000032323_100000139335 [0,1,0,0,0,0|3,0,0]=4 4973 B15R0.70 O=CCCCCSCCOCCOCCO 62a_100000139335_100000032323 [0,1,0,0,0,0|3,0,0]=4 4974 B15R0.70 O=CCCCNCCCCCCCCCO 2230a_100000078944_200011292268 [0,1,0,0,0,0|1,0,0]=2 4975 B15R0.70 O=CCCCNCCCOCCOCCO 2230a_100011996194_200011292268 [0,1,0,0,0,0|3,0,0]=4 4976 B15R0.70 O=CCCCOCCCCCCCCCBr 7a_100009813782_200011292268 [0,1,0,0,0,0|1,0,0]=2 4977 B15R0.70 O=CCCCOCCCCCCCCCCl 7a_100009868337_200011292268 [0,1,0,0,0,0|1,0,0]=2 4978 B15R0.70 O=CCCCSCCCCCCCCCO 62a_100009813782_200011292268 [0,1,0,0,0,0|1,0,0]=2 4979 B15R0.70 O=CCCCSCCCCCCCCCO 62a_200011292268_100009813782 [0,1,0,0,0,0|1,0,0]=2 4980 B15R0.70 O=CCOCCCCCCCCCCCBr 34a_100009812471_200009817547 [0,1,0,0,0,0|1,0,0]=2 4981 B15R0.70 O=CCOCCCCCCCCCCCBr 7a_100009812471_200015260668 [0,1,0,0,0,0|1,0,0]=2 4982 B15R0.70 O=CCSCCCCCCCCCCCO 62a_100009812471_200015260668 [0,1,0,0,0,0|1,0,0]=2 4983 B15R0.70 OCCCCCCCCCCCCNCF 34a_100000066677_100015361967 [0,1,0,0,0,0|1,0,2]=4 4984 B15R0.70 OCCCCCCCCCCCCSCF 62a_100009813331_100015361967 [0,1,0,0,0,0|1,0,2]=4 4985 B15R0.70 OCCCCCCCCCCCNCCF 34a_100000724931_100009812471 [0,1,0,0,0,0|1,0,2]=4 4986 B15R0.70 OCCCCCCCCCCCNCCO 2230a_100016997473_100009812471 [0,1,0,0,0,0|1,0,2]=4 4987 B15R0.70 OCCCCCCCCCCCNCCO 34a_100016990907_100009812471 [0,1,0,0,0,0|1,0,2]=4 4988 B15R0.70 OCCCCCCCCCCCOCCBr 34a_100000211926_100009812471 [0,1,0,0,0,0|1,0,2]=4 4989 B15R0.70 OCCCCCCCCCCCSCCF 62a_100009812471_100011217306 [0,1,0,0,0,0|1,0,2]=4 4990 B15R0.70 OCCCCCCCCCCCSCCO 62a_100009812471_100000211926 [0,1,0,0,0,0|1,0,2]=4 4991 B15R0.70 OCCCCCCCCCCNCCCF 2230a_100000066964_100011934791 [0,1,0,0,0,0|1,0,2]=4 4992 B15R0.70 OCCCCCCCCCCNCCCF 2230a_100015189416_100009813290 [0,1,0,0,0,0|1,0,2]=4 4993 B15R0.70 OCCCCCCCCCCNCCCF 34a_100000066964_100011934791 [0,1,0,0,0,0|1,0,2]=4 4994 B15R0.70 OCCCCCCCCCCNCCCF 34a_100015189416_100009813290 [0,1,0,0,0,0|1,0,2]=4 4995 B15R0.70 OCCCCCCCCCCNCCCO 2230a_100000066964_100000230001 [0,1,0,0,0,0|1,0,2]=4 4996 B15R0.70 OCCCCCCCCCCNCCCO 34a_100000066964_100000230001 [0,1,0,0,0,0|1,0,2]=4 4997 B15R0.70 OCCCCCCCCCCOCCCBr 34a_100011217188_100009813290 [0,1,0,0,0,0|1,0,2]=4 4998 B15R0.70 OCCCCCCCCCCOCCCCl 34a_100000230001_100009813290 [0,1,0,0,0,0|1,0,2]=4 4999 B15R0.70 OCCCCCCCCCCOCCCF 34a_100000759539_100009813290 [0,1,0,0,0,0|1,0,2]=4 5000 B15R0.70 OCCCCCCCCCCSCCCF 62a_100009813290_100011934791 [0,1,0,0,0,0|1,0,2]=4 5001 B15R0.70 OCCCCCCCCCCSCCCF 62a_100011934791_200000033068 [0,1,0,0,0,0|1,0,2]=4 5002 B15R0.70 OCCCCCCCCCCSCCCO 62a_100009813290_100011215043 [0,1,0,0,0,0|1,0,2]=4 5003 B15R0.70 OCCCCCCCCCCSCCCO 62a_100011215043_200000033068 [0,1,0,0,0,0|1,0,2]=4 5004 B15R0.70 OCCCCCCCCCNCCCCF 2230a_100000078944_100000729493 [0,1,0,0,0,0|1,0,2]=4 5005 B15R0.70 OCCCCCCCCCNCCCCF 34a_100000078944_100000729493 [0,1,0,0,0,0|1,0,2]=4 5006 B15R0.70 OCCCCCCCCCNCCCCO 2230a_100000078944_100000210776 [0,1,0,0,0,0|1,0,2]=4 5007 B15R0.70 OCCCCCCCCCNCCCCO 2230a_100000750430_100009813782 [0,1,0,0,0,0|1,0,2]=4 5008 B15R0.70 OCCCCCCCCCNCCCCO 34a_100000078944_100011216708 [0,1,0,0,0,0|1,0,2]=4 5009 B15R0.70 OCCCCCCCCCNCCCCO 34a_100000750430_100009813782 [0,1,0,0,0,0|1,0,2]=4 5010 B15R0.70 OCCCCCCCCCOCCCCBr 34a_100011216708_100009813782 [0,1,0,0,0,0|1,0,2]=4 5011 B15R0.70 OCCCCCCCCCOCCCCCl 34a_100000210776_100009813782 [0,1,0,0,0,0|1,0,2]=4 5012 B15R0.70 OCCCCCCCCCOCCCCCl 7a_100000210776_100009813782 [0,1,0,0,0,0|1,0,2]=4 5013 B15R0.70 OCCCCCCCCCOCCCCF 34a_100011995726_100009813782 [0,1,0,0,0,0|1,0,2]=4 5014 B15R0.70 OCCCCCCCCCOCCCCF 7a_100011995726_100009813782 [0,1,0,0,0,0|1,0,2]=4 5015 B15R0.70 OCCCCCCCCCOCCCCI 34a_200012148704_100009813782 [0,1,0,0,0,0|1,0,2]=4 5016 B15R0.70 OCCCCCCCCCSCCCCF 62a_100000729493_100009813782 [0,1,0,0,0,0|1,0,2]=4 5017 B15R0.70 OCCCCCCCCCSCCCCF 62a_100009813782_100000729493 [0,1,0,0,0,0|1,0,2]=4 5018 B15R0.70 OCCCCCCCCCSCCCCO 62a_100000210776_100009813782 [0,1,0,0,0,0|1,0,2]=4 5019 B15R0.70 OCCCCCCCCCSCCCCO 62a_100009813782_100000210776 [0,1,0,0,0,0|1,0,2]=4 5020 B15R0.70 OCCCCCCCCNCCCCCF 2230a_102515433106_100000729378 [0,1,0,0,0,0|1,0,2]=4 5021 B15R0.70 OCCCCCCCCNCCCCCF 34a_102515433106_100000729378 [0,1,0,0,0,0|1,0,2]=4 5022 B15R0.70 OCCCCCCCCNCCCCCO 2230a_100000762737_100000033203 [0,1,0,0,0,0|1,0,2]=4 5023 B15R0.70 OCCCCCCCCNCCCCCO 2230a_102515433106_100000746330 [0,1,0,0,0,0|1,0,2]=4 5024 B15R0.70 OCCCCCCCCNCCCCCO 34a_100000762737_100000033203 [0,1,0,0,0,0|1,0,2]=4 5025 B15R0.70 OCCCCCCCCNCCCCCO 34a_102515433106_100000746330 [0,1,0,0,0,0|1,0,2]=4 5026 B15R0.70 OCCCCCCCCOCCCCCBr 34a_100000746331_100000033203 [0,1,0,0,0,0|1,0,2]=4 5027 B15R0.70 OCCCCCCCCOCCCCCBr 7a_100000746331_100000033203 [0,1,0,0,0,0|1,0,2]=4 5028 B15R0.70 OCCCCCCCCOCCCCCCl 34a_100000746330_100000033203 [0,1,0,0,0,0|1,0,2]=4 5029 B15R0.70 OCCCCCCCCOCCCCCCl 7a_100000746330_100000033203 [0,1,0,0,0,0|1,0,2]=4 5030 B15R0.70 OCCCCCCCCOCCCCCI 34a_200012148887_100000033203 [0,1,0,0,0,0|1,0,2]=4 5031 B15R0.70 OCCCCCCCCOCCCCCI 7a_200012148887_100000033203 [0,1,0,0,0,0|1,0,2]=4 5032 B15R0.70 OCCCCCCCCSCCCCCF 62a_100000033203_100000729378 [0,1,0,0,0,0|1,0,2]=4 5033 B15R0.70 OCCCCCCCCSCCCCCF 62a_100000729378_100000033203 [0,1,0,0,0,0|1,0,2]=4 5034 B15R0.70 OCCCCCCCCSCCCCCO 62a_100000033203_100000746330 [0,1,0,0,0,0|1,0,2]=4 5035 B15R0.70 OCCCCCCCCSCCCCCO 62a_100000746330_100000033203 [0,1,0,0,0,0|1,0,2]=4 5036 B15R0.70 OCCCCCCCNCCCCCCF 2230a_100011996573_100015922095 [0,1,0,0,0,0|1,0,2]=4 5037 B15R0.70 OCCCCCCCNCCCCCCF 34a_100011996573_100015922095 [0,1,0,0,0,0|1,0,2]=4 5038 B15R0.70 OCCCCCCCNCCCCCCO 2230a_100000686447_100000760002 [0,1,0,0,0,0|1,0,2]=4 5039 B15R0.70 OCCCCCCCNCCCCCCO 2230a_100011996573_100000766143 [0,1,0,0,0,0|1,0,2]=4 5040 B15R0.70 OCCCCCCCNCCCCCCO 34a_100000686447_100000760002 [0,1,0,0,0,0|1,0,2]=4 5041 B15R0.70 OCCCCCCCNCCCCCCO 34a_100011996573_100000766143 [0,1,0,0,0,0|1,0,2]=4 5042 B15R0.70 OCCCCCCCOCCCCCCBr 34a_100011215345_100000760002 [0,1,0,0,0,0|1,0,2]=4 5043 B15R0.70 OCCCCCCCOCCCCCCBr 7a_100011215345_100000760002 [0,1,0,0,0,0|1,0,2]=4 5044 B15R0.70 OCCCCCCCOCCCCCCCl 34a_100000766143_100000760002 [0,1,0,0,0,0|1,0,2]=4 5045 B15R0.70 OCCCCCCCOCCCCCCCl 7a_100000766143_100000760002 [0,1,0,0,0,0|1,0,2]=4 5046 B15R0.70 OCCCCCCCOCCCCCCF 34a_100000732779_100000760002 [0,1,0,0,0,0|1,0,2]=4 5047 B15R0.70 OCCCCCCCOCCCCCCF 7a_100000732779_100000760002 [0,1,0,0,0,0|1,0,2]=4 5048 B15R0.70 OCCCCCCCSCCCCCCF 62a_100000760002_100015922095 [0,1,0,0,0,0|1,0,2]=4 5049 B15R0.70 OCCCCCCCSCCCCCCF 62a_100015922095_100000760002 [0,1,0,0,0,0|1,0,2]=4 5050 B15R0.70 OCCCCCCCSCCCCCCO 62a_100000760002_100000766143 [0,1,0,0,0,0|1,0,2]=4 5051 B15R0.70 OCCCCCCCSCCCCCCO 62a_100000766143_100000760002 [0,1,0,0,0,0|1,0,2]=4 5052 B15R0.70 OCCCCCCOCCCCCCCBr 34a_100000760002_100000766143 [0,1,0,0,0,0|1,0,2]=4 5053 B15R0.70 OCCCCCCOCCCCCCCBr 7a_100000760002_100000766143 [0,1,0,0,0,0|1,0,2]=4 5054 B15R0.70 OCCCCCOCCCCCCCCBr 34a_100009813846_100000746330 [0,1,0,0,0,0|1,0,2]=4 5055 B15R0.70 OCCCCCOCCCCCCCCBr 7a_100009813846_100000746330 [0,1,0,0,0,0|1,0,2]=4 5056 B15R0.70 OCCCCCOCCCCCCCCCl 34a_100000033203_100000746330 [0,1,0,0,0,0|1,0,2]=4 5057 B15R0.70 OCCCCCOCCCCCCCCCl 7a_100000033203_100000746330 [0,1,0,0,0,0|1,0,2]=4 5058 B15R0.70 OCCCCOCCCCCCCCCBr 34a_100009813782_100011216708 [0,1,0,0,0,0|1,0,2]=4 5059 B15R0.70 OCCCCOCCCCCCCCCBr 7a_100009813782_100000210776 [0,1,0,0,0,0|1,0,2]=4 5060 B15R0.70 OCCCCOCCCCCCCCCCl 34a_100009868337_100011216708 [0,1,0,0,0,0|1,0,2]=4 5061 B15R0.70 OCCCCOCCCCCCCCCCl 7a_100009868337_100000210776 [0,1,0,0,0,0|1,0,2]=4 5062 B15R0.70 OCCCOCCCCCCCCCCBr 34a_100009813290_100000230001 [0,1,0,0,0,0|1,0,2]=4 5063 B15R0.70 OCCCOCCCCCCCCCCBr 7a_100009813290_100011215043 [0,1,0,0,0,0|1,0,2]=4 5064 B15R0.70 OCCCOCCCCCCCCCCCl 34a_200000033068_100000230001 [0,1,0,0,0,0|1,0,2]=4 5065 B15R0.70 OCCCOCCCCCCCCCCCl 7a_200000033068_100011215043 [0,1,0,0,0,0|1,0,2]=4 5066 B15R0.70 OCCOCCCCCCCCCCCBr 34a_100009812471_100000211926 [0,1,0,0,0,0|1,0,2]=4 5067 B15R0.70 OCCOCCCCCCCCCCCBr 7a_100009812471_100000211926 [0,1,0,0,0,0|1,0,2]=4 5068 B15R0.70 [13CH3]OCCCCCCCCCCCCCBr 34a_100009812470_200025704644 [0,1,0,0,0,0|1,0,1]=3 5069 B15R0.70 [13CH3]OCCCCCCCCCCCCCBr 7a_100009812470_200025704644 [0,1,0,0,0,0|1,0,1]=3 5070 B15R0.70 [13CH3]SCCCCCCCCCCCCCO 62a_100009812470_200025704644 [0,1,0,0,0,0|0,0,2]=3 5071 B15R0.70 [N-]=[N+]=NCCCCCCNCCCCC=O 2230a_200000049180_100000139335 [0,1,0,0,0,0|3,0,0]=4 5072 B15R0.81 C#CC(=O)CCCCCCCCCCCC 1458a_100000211873_100000759014 [0,1,0,0,0,0|1,0,2]=4 5073 B15R0.81 C#CC(C)NCCCCCCCCCCC 2230a_100000707721_100011215454 [0,1,0,0,0,0|2,0,1]=4 5074 B15R0.81 C#CC(C)NCCCCCCCCCCC 34a_100000707721_100011215454 [0,1,0,0,0,0|2,0,1]=4 5075 B15R0.81 C#CC(C)NCCCCCCCCCCC 34a_200011215754_200000035995 [0,1,0,0,0,0|2,0,1]=4 5076 B15R0.81 C#CC(C)OCCCCCCCCCCC 34a_100000210809_200000035995 [0,1,0,0,0,0|2,0,1]=4 5077 B15R0.81 C#CC(C)SCCCCCCCCCCC 62a_200000035995_100011215454 [0,1,0,0,0,0|2,0,1]=4 5078 B15R0.81 C#CC(O)CCCCCNCCCCCC 2230a_100000210581_200010408556 [0,1,0,0,0,0|2,0,1]=4 5079 B15R0.81 C#CC(O)CCCCCOCCCCCC 34a_100000210259_200010408556 [0,1,0,0,0,0|2,0,1]=4 5080 B15R0.81 C#CC(O)CCCCCOCCCCCC 7a_100000210259_200010408556 [0,1,0,0,0,0|2,0,1]=4 5081 B15R0.81 C#CC(O)CCCCCSCCCCC=O 62a_100000139335_200010408556 [0,1,0,0,0,0|1,0,2]=4 5082 B15R0.81 C#CC(O)CCCCCSCCCCC=O 62a_200010408556_100000139335 [0,1,0,0,0,0|1,0,2]=4 5083 B15R0.81 C#CC(O)CCCCCSCCCCCC 62a_100000210314_200010408556 [0,1,0,0,0,0|2,0,1]=4 5084 B15R0.81 C#CC(O)CCCCCSCCCCCC 62a_200010408556_100000210757 [0,1,0,0,0,0|2,0,1]=4 5085 B15R0.81 C#CCCCCCCCCCOC(C)CC 34a_100000034437_100011215416 [0,1,0,0,0,0|2,0,1]=4 5086 B15R0.81 C#CCCCCCCCCCOC(C)CC 7a_100000034437_100000758301 [0,1,0,0,0,0|2,0,1]=4 5087 B15R0.81 C#CCCCCCCCCOCC(C)CC 34a_100000065265_100000748023 [0,1,0,0,0,0|2,0,1]=4 5088 B15R0.81 C#CCCCCCCCCOCC(C)CC 7a_100000065265_100000748023 [0,1,0,0,0,0|2,0,1]=4 5089 B15R0.81 C#CCCCCCCCCOCC(O)CC 34a_100000065265_100011218378 [0,1,0,0,0,0|2,0,1]=4 5090 B15R0.81 C#CCCCCCCCCOCC(O)CC 7a_100000065265_100011218378 [0,1,0,0,0,0|2,0,1]=4 5091 B15R0.81 C#CCCCCCCCCOC[C@@H](C)CC 34a_100000065265_100009816398 [0,1,0,0,0,0|2,0,1]=4 5092 B15R0.81 C#CCCCCCCCCOC[C@@H](C)CC 7a_100000065265_100009816398 [0,1,0,0,0,0|2,0,1]=4 5093 B15R0.81 C#CCCCCCCCNCCC(C)CC 2230a_100020591266_100153394163 [0,1,0,0,0,0|2,0,1]=4 5094 B15R0.81 C#CCCCCCCCOCCC(C)CC 7a_100011215188_100153394163 [0,1,0,0,0,0|2,0,1]=4 5095 B15R0.81 C#CCCCCCCOCCCC(C)CC 7a_100011216074_100012276617 [0,1,0,0,0,0|2,0,1]=4 5096 B15R0.81 C#CCCCCOCCCCCC(C)CC 7a_200000035636_100010269958 [0,1,0,0,0,0|2,0,1]=4 5097 B15R0.81 C#C[C@@H](C)OCCCCCCCCCCC 34a_100009815206_100011215454 [0,1,0,0,0,0|2,0,1]=4 5098 B15R0.81 C#C[C@@H](C)OCCCCCCCCCCC 7a_100009815206_100011215454 [0,1,0,0,0,0|2,0,1]=4 5099 B15R0.81 C=CC(=O)CCCCCCCCCCCC 1458a_100000185746_100000759014 [0,1,0,0,0,0|1,0,1]=3 5100 B15R0.81 C=CC(=O)CCCCCCCCCCCO 1458a_100000185746_100009812471 [0,1,0,0,0,0|2,0,1]=4 5101 B15R0.81 C=CC(=O)NCCCCCCCCCCC 1626a_200011215754_100000185746 [0,1,0,0,0,0|2,0,1]=4 5102 B15R0.81 C=CC(=O)NCCCCCCCCCCC 240690a_200011215754_200121576911 [0,1,0,0,0,0|2,0,1]=4 5103 B15R0.81 C=CC(C)COCCCCCCCCCC 34a_100011215527_100000210320 [0,1,0,0,0,0|2,0,0]=3 5104 B15R0.81 C=CC(C)COCCCCCCCCCC 7a_100011215527_100000210320 [0,1,0,0,0,0|2,0,0]=3 5105 B15R0.81 C=CC(C)COCCCCCCCCCO 34a_100011215527_100009813782 [0,1,0,0,0,0|3,0,0]=4 5106 B15R0.81 C=CC(C)COCCCCCCCCCO 7a_100011215527_100009813782 [0,1,0,0,0,0|3,0,0]=4 5107 B15R0.81 C=CC(C)OCCCCCCCCCCC 34a_100000695699_100011215454 [0,1,0,0,0,0|2,0,0]=3 5108 B15R0.81 C=CC(C)OCCCCCCCCCCO 34a_100000695699_100009813290 [0,1,0,0,0,0|3,0,0]=4 5109 B15R0.81 C=CC(C)SCCCCCCCCCCC 62a_100011215867_100011215454 [0,1,0,0,0,0|2,0,0]=3 5110 B15R0.81 C=CC(C)SCCCCCCCCCCO 62a_100011215867_200000033068 [0,1,0,0,0,0|3,0,0]=4 5111 B15R0.81 C=CC(O)CNCCCCCCCCCC 2230a_100000684558_100000730141 [0,1,0,0,0,0|2,0,0]=3 5112 B15R0.81 C=CC(O)CNCCCCCCCCCC 34a_100000684558_100000730141 [0,1,0,0,0,0|2,0,0]=3 5113 B15R0.81 C=CC(O)CNCCCCCCCCCO 2230a_100000078944_100000730141 [0,1,0,0,0,0|3,0,0]=4 5114 B15R0.81 C=CC(O)CNCCCCCCCCCO 34a_100000078944_100000730141 [0,1,0,0,0,0|3,0,0]=4 5115 B15R0.81 C=CC(O)COCCCCCCCCCBr 34a_100009813782_100000730141 [0,1,0,0,0,0|3,0,0]=4 5116 B15R0.81 C=CC(O)COCCCCCCCCCBr 7a_100009813782_100000730141 [0,1,0,0,0,0|3,0,0]=4 5117 B15R0.81 C=CC(O)COCCCCCCCCCC 34a_100000210711_100000730141 [0,1,0,0,0,0|2,0,0]=3 5118 B15R0.81 C=CC(O)COCCCCCCCCCC 7a_100000210711_100000730141 [0,1,0,0,0,0|2,0,0]=3 5119 B15R0.81 C=CC(O)COCCCCCCCCCCl 34a_100009868337_100000730141 [0,1,0,0,0,0|3,0,0]=4 5120 B15R0.81 C=CC(O)COCCCCCCCCCCl 7a_100009868337_100000730141 [0,1,0,0,0,0|3,0,0]=4 5121 B15R0.81 C=CC(O)COCCCCCCCCCN 34a_100000078944_100000730141 [0,1,0,0,0,0|3,0,0]=4 5122 B15R0.81 C=CC(O)CSCCCCCCCCCC 62a_100000730141_100000210320 [0,1,0,0,0,0|2,0,0]=3 5123 B15R0.81 C=CC(O)CSCCCCCCCCCO 62a_100000730141_100009813782 [0,1,0,0,0,0|3,0,0]=4 5124 B15R0.81 C=CC(O)CSCCCCCCCCCO 62a_100009813782_100000730141 [0,1,0,0,0,0|3,0,0]=4 5125 B15R0.81 C=CCCCCCCCCCCC(=O)CC 1458a_100000210414_100011093070 [0,1,0,0,0,0|1,0,1]=3 5126 B15R0.81 C=CCCCCCCCCCCC(=O)CO 1458a_100000210174_100011093070 [0,1,0,0,0,0|2,0,1]=4 5127 B15R0.81 C=CCCCCCCCCCCN(C)CC 2230a_100000225621_100011093070 [0,1,0,0,0,0|2,0,0]=3 5128 B15R0.81 C=CCCCCCCCCCCN(C)CC 269982a_100000225621_100011093070 [0,1,0,0,0,0|2,0,0]=3 5129 B15R0.81 C=CCCCCCCCCCNC(=O)CC 11a_100000081888_100000210414 [0,1,0,0,0,0|2,0,1]=4 5130 B15R0.81 C=CCCCCCCCCCNC(=O)CC 1626a_100000081888_100000210414 [0,1,0,0,0,0|2,0,1]=4 5131 B15R0.81 C=CCCCCCCCCCNC(=O)CC 240690a_100000081888_100000210414 [0,1,0,0,0,0|2,0,1]=4 5132 B15R0.81 C=CCCCCCCCCCNC(=O)CC 527a_100000081888_100000210414 [0,1,0,0,0,0|2,0,1]=4 5133 B15R0.81 C=CCCCCCCCCCNC(C)CC 2230a_100000081888_100000758301 [0,1,0,0,0,0|2,0,0]=3 5134 B15R0.81 C=CCCCCCCCCCNC(C)CC 2230a_100000209981_100009814027 [0,1,0,0,0,0|2,0,0]=3 5135 B15R0.81 C=CCCCCCCCCCNC(C)CC 34a_100000081888_100011215416 [0,1,0,0,0,0|2,0,0]=3 5136 B15R0.81 C=CCCCCCCCCCNC(C)CO 2230a_100000081888_100012180447 [0,1,0,0,0,0|3,0,0]=4 5137 B15R0.81 C=CCCCCCCCCCNC(C)CO 34a_100000081888_100012180447 [0,1,0,0,0,0|3,0,0]=4 5138 B15R0.81 C=CCCCCCCCCCN[C@H](C)CO 2230a_100000737577_100009814027 [0,1,0,0,0,0|3,0,0]=4 5139 B15R0.81 C=CCCCCCCCCCOC(C)CC 34a_100000038209_100011215416 [0,1,0,0,0,0|2,0,0]=3 5140 B15R0.81 C=CCCCCCCCCCOC(C)CC 7a_100000038209_100000758301 [0,1,0,0,0,0|2,0,0]=3 5141 B15R0.81 C=CCCCCCCCCCOC(C)CC 7a_100000210228_100009814027 [0,1,0,0,0,0|2,0,0]=3 5142 B15R0.81 C=CCCCCCCCCCOC(C)CF 34a_100016041109_100009814027 [0,1,0,0,0,0|3,0,0]=4 5143 B15R0.81 C=CCCCCCCCCCOC(C)CF 7a_100016041109_100009814027 [0,1,0,0,0,0|3,0,0]=4 5144 B15R0.81 C=CCCCCCCCCCOC(C)CN 34a_100000210904_100009814027 [0,1,0,0,0,0|3,0,0]=4 5145 B15R0.81 C=CCCCCCCCCCOC(C)CO 34a_100000038209_100012180447 [0,1,0,0,0,0|3,0,0]=4 5146 B15R0.81 C=CCCCCCCCCCOC(C)CO 7a_100000038209_100012180447 [0,1,0,0,0,0|3,0,0]=4 5147 B15R0.81 C=CCCCCCCCCCSC(C)CC 62a_100000758301_100009814027 [0,1,0,0,0,0|2,0,0]=3 5148 B15R0.81 C=CCCCCCCCCCSC(C)CC 62a_100009814027_100000758301 [0,1,0,0,0,0|2,0,0]=3 5149 B15R0.81 C=CCCCCCCCCCSC(C)CO 62a_100012180447_100009814027 [0,1,0,0,0,0|3,0,0]=4 5150 B15R0.81 C=CCCCCCCCCCSC(C)OC 62a_100009814027_100009879195 [0,1,0,0,0,0|3,0,0]=4 5151 B15R0.81 C=CCCCCCCCCCSC(C)OC 62a_100009879195_100009814027 [0,1,0,0,0,0|3,0,0]=4 5152 B15R0.81 C=CCCCCCCCCCS[C@H](C)CO 62a_100009814027_100016084084 [0,1,0,0,0,0|3,0,0]=4 5153 B15R0.81 C=CCCCCCCCCCS[C@H](C)CO 62a_100016084084_100009814027 [0,1,0,0,0,0|3,0,0]=4 5154 B15R0.81 C=CCCCCCCCCNCC(C)CC 2230a_100020588543_100011933949 [0,1,0,0,0,0|2,0,0]=3 5155 B15R0.81 C=CCCCCCCCCNCC(C)CO 34a_100000744482_100011933949 [0,1,0,0,0,0|3,0,0]=4 5156 B15R0.81 C=CCCCCCCCCNCC(O)CC 2230a_100011218483_100011933949 [0,1,0,0,0,0|2,0,0]=3 5157 B15R0.81 C=CCCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100011933949 [0,1,0,0,0,0|3,0,0]=4 5158 B15R0.81 C=CCCCCCCCCNC[C@@H](F)CO 34a_100015665980_100011933949 [0,1,0,0,0,0|3,0,0]=4 5159 B15R0.81 C=CCCCCCCCCNC[C@H](O)CO 2230a_100020644852_100011933949 [0,1,0,0,0,0|3,0,0]=4 5160 B15R0.81 C=CCCCCCCCCOCC(=O)CC 34a_100000725409_100011933949 [0,1,0,0,0,0|2,0,1]=4 5161 B15R0.81 C=CCCCCCCCCOCC(=O)CC 7a_100011215194_100000747405 [0,1,0,0,0,0|2,0,1]=4 5162 B15R0.81 C=CCCCCCCCCOCC(C)CC 34a_100011215194_100000748023 [0,1,0,0,0,0|2,0,0]=3 5163 B15R0.81 C=CCCCCCCCCOCC(C)CC 7a_100011215194_100000748023 [0,1,0,0,0,0|2,0,0]=3 5164 B15R0.81 C=CCCCCCCCCOCC(C)CN 34a_100000744482_100011933949 [0,1,0,0,0,0|3,0,0]=4 5165 B15R0.81 C=CCCCCCCCCOCC(C)OC 34a_100000690652_100011933949 [0,1,0,0,0,0|3,0,0]=4 5166 B15R0.81 C=CCCCCCCCCOCC(Cl)CCl 34a_100000033668_100011933949 [0,1,0,0,0,0|3,0,0]=4 5167 B15R0.81 C=CCCCCCCCCOCC(O)CC 34a_100011215194_100011218378 [0,1,0,0,0,0|2,0,0]=3 5168 B15R0.81 C=CCCCCCCCCOCC(O)CC 7a_100011215194_100011218378 [0,1,0,0,0,0|2,0,0]=3 5169 B15R0.81 C=CCCCCCCCCOCC(O)CO 34a_100011215194_100011219619 [0,1,0,0,0,0|3,0,0]=4 5170 B15R0.81 C=CCCCCCCCCOCC(O)CO 7a_100011215194_100011219619 [0,1,0,0,0,0|3,0,0]=4 5171 B15R0.81 C=CCCCCCCCCOC[C@@H](C)CC 34a_100011215194_100009816398 [0,1,0,0,0,0|2,0,0]=3 5172 B15R0.81 C=CCCCCCCCCOC[C@@H](C)CC 7a_100009816381_100011933949 [0,1,0,0,0,0|2,0,0]=3 5173 B15R0.81 C=CCCCCCCCCOC[C@@H](C)CC 7a_100011215194_100009816398 [0,1,0,0,0,0|2,0,0]=3 5174 B15R0.81 C=CCCCCCCCCOC[C@@H](C)CO 34a_100011215194_100000059175 [0,1,0,0,0,0|3,0,0]=4 5175 B15R0.81 C=CCCCCCCCCOC[C@@H](C)CO 7a_100011215194_100000059175 [0,1,0,0,0,0|3,0,0]=4 5176 B15R0.81 C=CCCCCCCCCOC[C@@H](O)CF 34a_100011215194_100015614560 [0,1,0,0,0,0|3,0,0]=4 5177 B15R0.81 C=CCCCCCCCCOC[C@@H](O)CF 7a_100011215194_100015614560 [0,1,0,0,0,0|3,0,0]=4 5178 B15R0.81 C=CCCCCCCCCOC[C@@H](O)CO 34a_100011215194_100009815848 [0,1,0,0,0,0|3,0,0]=4 5179 B15R0.81 C=CCCCCCCCCOC[C@@H](O)CO 7a_100011215194_100009815848 [0,1,0,0,0,0|3,0,0]=4 5180 B15R0.81 C=CCCCCCCCCOC[C@H](F)CN 34a_100015665980_100011933949 [0,1,0,0,0,0|3,0,0]=4 5181 B15R0.81 C=CCCCCCCCCSCC(=O)CC 62a_100000747405_100011933949 [0,1,0,0,0,0|2,0,1]=4 5182 B15R0.81 C=CCCCCCCCCSCC(=O)CC 62a_100011933949_100000747405 [0,1,0,0,0,0|2,0,1]=4 5183 B15R0.81 C=CCCCCCCCCSCC(C)CC 62a_100000748023_100011933949 [0,1,0,0,0,0|2,0,0]=3 5184 B15R0.81 C=CCCCCCCCCSCC(C)CC 62a_100011933949_100000748023 [0,1,0,0,0,0|2,0,0]=3 5185 B15R0.81 C=CCCCCCCCCSCC(O)CC 62a_100011218378_100011933949 [0,1,0,0,0,0|2,0,0]=3 5186 B15R0.81 C=CCCCCCCCCSCC(O)CC 62a_100011933949_100011218378 [0,1,0,0,0,0|2,0,0]=3 5187 B15R0.81 C=CCCCCCCCCSCC(O)CO 62a_100011219619_100011933949 [0,1,0,0,0,0|3,0,0]=4 5188 B15R0.81 C=CCCCCCCCCSCC(O)CO 62a_100011933949_100011219619 [0,1,0,0,0,0|3,0,0]=4 5189 B15R0.81 C=CCCCCCCCCSC[C@@H](C)CC 62a_100009816398_100011933949 [0,1,0,0,0,0|2,0,0]=3 5190 B15R0.81 C=CCCCCCCCCSC[C@@H](C)CC 62a_100011933949_100009816398 [0,1,0,0,0,0|2,0,0]=3 5191 B15R0.81 C=CCCCCCCCCSC[C@@H](C)CO 62a_100000059175_100011933949 [0,1,0,0,0,0|3,0,0]=4 5192 B15R0.81 C=CCCCCCCCCSC[C@@H](C)CO 62a_100011933949_100000059175 [0,1,0,0,0,0|3,0,0]=4 5193 B15R0.81 C=CCCCCCCCCSC[C@@H](O)CF 62a_100011933949_100015614560 [0,1,0,0,0,0|3,0,0]=4 5194 B15R0.81 C=CCCCCCCCCSC[C@@H](O)CF 62a_100015614560_100011933949 [0,1,0,0,0,0|3,0,0]=4 5195 B15R0.81 C=CCCCCCCCCSC[C@@H](O)CO 62a_100009815848_100011933949 [0,1,0,0,0,0|3,0,0]=4 5196 B15R0.81 C=CCCCCCCCCSC[C@@H](O)CO 62a_100011933949_100009815848 [0,1,0,0,0,0|3,0,0]=4 5197 B15R0.81 C=CCCCCCCCNCCC(C)CC 2230a_100020591266_100012355270 [0,1,0,0,0,0|2,0,0]=3 5198 B15R0.81 C=CCCCCCCCNCCC(C)CO 2230a_106354213184_100012355270 [0,1,0,0,0,0|3,0,0]=4 5199 B15R0.81 C=CCCCCCCCNCCC(C)CO 34a_106354213184_100012355270 [0,1,0,0,0,0|3,0,0]=4 5200 B15R0.81 C=CCCCCCCCOCCC(C)CC 7a_100011215188_100012355270 [0,1,0,0,0,0|2,0,0]=3 5201 B15R0.81 C=CCCCCCCCOCCC(C)OC 7a_100000764861_100012355270 [0,1,0,0,0,0|3,0,0]=4 5202 B15R0.81 C=CCCCCCCOCCCC(C)CC 7a_100011216074_100011215473 [0,1,0,0,0,0|2,0,0]=3 5203 B15R0.81 C=CCCCCCCOCCCN(C)CC 7a_200011216477_100015186262 [0,1,0,0,0,0|3,0,0]=4 5204 B15R0.81 C=CCCCCCCOCCC[C@@H](C)CN 34a_100160569302_100011215473 [0,1,0,0,0,0|3,0,0]=4 5205 B15R0.81 C=CCCCCCCSCCCN(C)CC 62a_100011215473_100015186262 [0,1,0,0,0,0|3,0,0]=4 5206 B15R0.81 C=CCCCCOCCCCCC(C)CC 7a_200000035636_100011215482 [0,1,0,0,0,0|2,0,0]=3 5207 B15R0.81 C=C[C@H](N)COCCCCCCCCCC 34a_100016989147_100000210320 [0,1,0,0,0,0|2,0,0]=3 5208 B15R0.81 C=C[C@H](N)COCCCCCCCCCO 34a_100016989147_100009813782 [0,1,0,0,0,0|3,0,0]=4 5209 B15R0.81 CCC(=O)CCCCCCCCCCCO 1458a_100000210414_100009812471 [0,1,0,0,0,0|0,0,3]=4 5210 B15R0.81 CCC(C)CCCCCOCCCCC#N 7a_200000035636_100000211819 [0,1,0,0,0,0|2,0,1]=4 5211 B15R0.81 CCC(C)CCCCCOCCCCC=O 7a_200000035636_100000139335 [0,1,0,0,0,0|1,0,0]=2 5212 B15R0.81 CCC(C)CCCCCOCCCCCF 7a_200000035636_100000729378 [0,1,0,0,0,0|2,0,1]=4 5213 B15R0.81 CCC(C)CCCCCOCCCCCO 7a_200000035636_100000746330 [0,1,0,0,0,0|1,0,2]=4 5214 B15R0.81 CCC(C)CCCCCOCCCCOC 7a_200000035636_100000730899 [0,1,0,0,0,0|3,0,0]=4 5215 B15R0.81 CCC(C)CCCOCCCCCCC#N 7a_100011216074_100009813337 [0,1,0,0,0,0|2,0,1]=4 5216 B15R0.81 CCC(C)CCCOCCCCCCCO 7a_100011216074_100000760002 [0,1,0,0,0,0|1,0,2]=4 5217 B15R0.81 CCC(C)CCCOCCCCCCOC 7a_100011216074_100011998445 [0,1,0,0,0,0|3,0,0]=4 5218 B15R0.81 CCC(C)CCNCCCCCCCCO 2230a_100020591266_100000033203 [0,1,0,0,0,0|1,0,2]=4 5219 B15R0.81 CCC(C)CCOCCCCCCCCO 7a_100011215188_100000033203 [0,1,0,0,0,0|1,0,2]=4 5220 B15R0.81 CCC(C)CNCCCCCCCCCO 2230a_100000078944_100000748023 [0,1,0,0,0,0|1,0,2]=4 5221 B15R0.81 CCC(C)CNCCCCCCCCCO 2230a_100020588543_100009813782 [0,1,0,0,0,0|1,0,2]=4 5222 B15R0.81 CCC(C)CNCCCCCCCCCO 270004a_100000078944_100000243153 [0,1,0,0,0,0|1,0,2]=4 5223 B15R0.81 CCC(C)CNCCCCCCCCCO 34a_100000078944_100000748023 [0,1,0,0,0,0|1,0,2]=4 5224 B15R0.81 CCC(C)COCCCCCCCCCBr 34a_100009813782_100000748023 [0,1,0,0,0,0|2,0,1]=4 5225 B15R0.81 CCC(C)COCCCCCCCCCBr 7a_100009813782_100000748023 [0,1,0,0,0,0|2,0,1]=4 5226 B15R0.81 CCC(C)COCCCCCCCCCCl 34a_100009868337_100000748023 [0,1,0,0,0,0|2,0,1]=4 5227 B15R0.81 CCC(C)COCCCCCCCCCCl 7a_100009868337_100000748023 [0,1,0,0,0,0|2,0,1]=4 5228 B15R0.81 CCC(C)COCCCCCCCCCN 34a_100000078944_100000748023 [0,1,0,0,0,0|2,0,1]=4 5229 B15R0.81 CCC(C)CSCCCCCCCCCO 62a_100000748023_100009813782 [0,1,0,0,0,0|1,0,2]=4 5230 B15R0.81 CCC(C)CSCCCCCCCCCO 62a_100009813782_100000748023 [0,1,0,0,0,0|1,0,2]=4 5231 B15R0.81 CCC(C)NCCCCCCCCCCO 2230a_100000066964_100000758301 [0,1,0,0,0,0|1,0,2]=4 5232 B15R0.81 CCC(C)NCCCCCCCCCCO 2230a_100000209981_100009813290 [0,1,0,0,0,0|1,0,2]=4 5233 B15R0.81 CCC(C)NCCCCCCCCCCO 34a_100000066964_100011215416 [0,1,0,0,0,0|1,0,2]=4 5234 B15R0.81 CCC(C)OCCCCCCCCCCBr 34a_100009813290_100011215416 [0,1,0,0,0,0|2,0,1]=4 5235 B15R0.81 CCC(C)OCCCCCCCCCCBr 7a_100009813290_100000758301 [0,1,0,0,0,0|2,0,1]=4 5236 B15R0.81 CCC(C)OCCCCCCCCCCCl 34a_200000033068_100011215416 [0,1,0,0,0,0|2,0,1]=4 5237 B15R0.81 CCC(C)OCCCCCCCCCCCl 7a_200000033068_100000758301 [0,1,0,0,0,0|2,0,1]=4 5238 B15R0.81 CCC(C)OCCCCCCCCCCN 34a_100000066964_100011215416 [0,1,0,0,0,0|2,0,1]=4 5239 B15R0.81 CCC(C)OCCCCCCCCCCO 7a_100000210228_100009813290 [0,1,0,0,0,0|1,0,2]=4 5240 B15R0.81 CCC(C)SCCCCCCCCCCO 62a_100000758301_200000033068 [0,1,0,0,0,0|1,0,2]=4 5241 B15R0.81 CCC(C)SCCCCCCCCCCO 62a_100009813290_100000758301 [0,1,0,0,0,0|1,0,2]=4 5242 B15R0.81 CCC(O)CNCCCCCCCCCO 2230a_100000078944_100011218378 [0,1,0,0,0,0|1,0,2]=4 5243 B15R0.81 CCC(O)CNCCCCCCCCCO 2230a_100011218483_100009813782 [0,1,0,0,0,0|1,0,2]=4 5244 B15R0.81 CCC(O)CNCCCCCCCCCO 34a_100000078944_100011218378 [0,1,0,0,0,0|1,0,2]=4 5245 B15R0.81 CCC(O)COCCCCCCCCCBr 34a_100009813782_100011218378 [0,1,0,0,0,0|2,0,1]=4 5246 B15R0.81 CCC(O)COCCCCCCCCCBr 7a_100009813782_100011218378 [0,1,0,0,0,0|2,0,1]=4 5247 B15R0.81 CCC(O)COCCCCCCCCCCl 34a_100009868337_100011218378 [0,1,0,0,0,0|2,0,1]=4 5248 B15R0.81 CCC(O)COCCCCCCCCCCl 7a_100009868337_100011218378 [0,1,0,0,0,0|2,0,1]=4 5249 B15R0.81 CCC(O)COCCCCCCCCCN 34a_100000078944_100011218378 [0,1,0,0,0,0|2,0,1]=4 5250 B15R0.81 CCC(O)CSCCCCCCCCCO 62a_100009813782_100011218378 [0,1,0,0,0,0|1,0,2]=4 5251 B15R0.81 CCC(O)CSCCCCCCCCCO 62a_100011218378_100009813782 [0,1,0,0,0,0|1,0,2]=4 5252 B15R0.81 CCCCCCCCCCCCC(=O)CC 1458a_100000210414_100000759014 [0,1,0,0,0,0|1,0,2]=4 5253 B15R0.81 CCCCCCCCCCCCC(=O)CC 1458a_100011215791_100000210202 [0,1,0,0,0,0|1,0,2]=4 5254 B15R0.81 CCCCCCCCCCCCC(=O)CF 1458a_100011215791_100015361967 [0,1,0,0,0,0|1,0,2]=4 5255 B15R0.81 CCCCCCCCCCCCC(=O)CO 1458a_100000210174_100000759014 [0,1,0,0,0,0|0,0,3]=4 5256 B15R0.81 CCCCCCCCCCCCC(=O)NC 11a_106832991635_100011215791 [0,1,0,0,0,0|2,0,1]=4 5257 B15R0.81 CCCCCCCCCCCCC(=O)NC 1626a_100102657272_100011215791 [0,1,0,0,0,0|2,0,1]=4 5258 B15R0.81 CCCCCCCCCCCCC(=O)NC 240690a_100102657272_100011215791 [0,1,0,0,0,0|2,0,1]=4 5259 B15R0.81 CCCCCCCCCCCCC(C)NC 2230a_106832991635_200011217028 [0,1,0,0,0,0|2,0,0]=3 5260 B15R0.81 CCCCCCCCCCCCC(C)NC 270004a_106832991635_100011219199 [0,1,0,0,0,0|2,0,0]=3 5261 B15R0.81 CCCCCCCCCCCCC(C)NC 34a_100102657272_200011217028 [0,1,0,0,0,0|2,0,0]=3 5262 B15R0.81 CCCCCCCCCCCCC(C)NC 7a_106832991635_200011217028 [0,1,0,0,0,0|2,0,0]=3 5263 B15R0.81 CCCCCCCCCCCCC(C)OC 34a_100138415774_200011217028 [0,1,0,0,0,0|2,0,0]=3 5264 B15R0.81 CCCCCCCCCCCCC(C)OC 34a_200011215752_200000210301 [0,1,0,0,0,0|2,0,0]=3 5265 B15R0.81 CCCCCCCCCCCCC(C)OC 7a_200011215752_200000210301 [0,1,0,0,0,0|2,0,0]=3 5266 B15R0.81 CCCCCCCCCCCCC(C)O[13CH3] 34a_200011215752_200025704644 [0,1,0,0,0,0|2,0,0]=3 5267 B15R0.81 CCCCCCCCCCCCC(C)O[13CH3] 7a_200011215752_200025704644 [0,1,0,0,0,0|2,0,0]=3 5268 B15R0.81 CCCCCCCCCCCCN(C)CC 2230a_100000225621_100011215052 [0,1,0,0,0,0|2,0,1]=4 5269 B15R0.81 CCCCCCCCCCCCN(C)CC 2230a_100000227908_100000210202 [0,1,0,0,0,0|2,0,1]=4 5270 B15R0.81 CCCCCCCCCCCCN(C)CC 269982a_100000225621_100000759014 [0,1,0,0,0,0|2,0,1]=4 5271 B15R0.81 CCCCCCCCCCCCN(C)CC 269982a_100000227908_100000204670 [0,1,0,0,0,0|2,0,1]=4 5272 B15R0.81 CCCCCCCCCCCCN(C)CF 269982a_100000227908_100015361967 [0,1,0,0,0,0|2,0,1]=4 5273 B15R0.81 CCCCCCCCCCCNC(C)C#N 2230a_100000737613_100011215454 [0,1,0,0,0,0|2,0,1]=4 5274 B15R0.81 CCCCCCCCCCCNC(C)C#N 2230a_200011215754_100000184139 [0,1,0,0,0,0|2,0,1]=4 5275 B15R0.81 CCCCCCCCCCCNC(C)CC 2230a_100000209981_100011215454 [0,1,0,0,0,0|2,0,1]=4 5276 B15R0.81 CCCCCCCCCCCNC(C)CC 2230a_200011215754_100000758301 [0,1,0,0,0,0|2,0,1]=4 5277 B15R0.81 CCCCCCCCCCCNC(C)CC 34a_200011215754_100011215416 [0,1,0,0,0,0|2,0,1]=4 5278 B15R0.81 CCCCCCCCCCCNC(C)CO 2230a_200011215754_100012180447 [0,1,0,0,0,0|1,0,2]=4 5279 B15R0.81 CCCCCCCCCCCNC(C)CO 34a_200011215754_100012180447 [0,1,0,0,0,0|1,0,2]=4 5280 B15R0.81 CCCCCCCCCCCN[C@H](C)CO 2230a_100000737577_100011215454 [0,1,0,0,0,0|1,0,2]=4 5281 B15R0.81 CCCCCCCCCCCOC(C)C#N 34a_100011218135_100011215454 [0,1,0,0,0,0|2,0,1]=4 5282 B15R0.81 CCCCCCCCCCCOC(C)C#N 7a_100000210809_100000703298 [0,1,0,0,0,0|2,0,1]=4 5283 B15R0.81 CCCCCCCCCCCOC(C)CC 34a_100000210809_100011215416 [0,1,0,0,0,0|2,0,1]=4 5284 B15R0.81 CCCCCCCCCCCOC(C)CC 7a_100000210228_100011215454 [0,1,0,0,0,0|2,0,1]=4 5285 B15R0.81 CCCCCCCCCCCOC(C)CC 7a_100000210809_100000758301 [0,1,0,0,0,0|2,0,1]=4 5286 B15R0.81 CCCCCCCCCCCOC(C)CF 34a_100016041109_100011215454 [0,1,0,0,0,0|2,0,1]=4 5287 B15R0.81 CCCCCCCCCCCOC(C)CF 7a_100016041109_100011215454 [0,1,0,0,0,0|2,0,1]=4 5288 B15R0.81 CCCCCCCCCCCOC(C)CN 34a_100000210904_100011215454 [0,1,0,0,0,0|2,0,1]=4 5289 B15R0.81 CCCCCCCCCCCOC(C)CO 34a_100000210809_100012180447 [0,1,0,0,0,0|1,0,2]=4 5290 B15R0.81 CCCCCCCCCCCOC(C)CO 7a_100000210809_100012180447 [0,1,0,0,0,0|1,0,2]=4 5291 B15R0.81 CCCCCCCCCCCSC(C)C#N 62a_100000703298_100011215454 [0,1,0,0,0,0|2,0,1]=4 5292 B15R0.81 CCCCCCCCCCCSC(C)CO 62a_100012180447_100011215454 [0,1,0,0,0,0|1,0,2]=4 5293 B15R0.81 CCCCCCCCCCCSC(C)OC 62a_100009879195_100011215454 [0,1,0,0,0,0|3,0,0]=4 5294 B15R0.81 CCCCCCCCCCCSC(F)C#N 62a_200000117898_100011215454 [0,1,0,0,0,0|2,0,1]=4 5295 B15R0.81 CCCCCCCCCCCS[C@H](C)CO 62a_100016084084_100011215454 [0,1,0,0,0,0|1,0,2]=4 5296 B15R0.81 CCCCCCCCCCNCC(C)CC 2230a_100000684558_100000748023 [0,1,0,0,0,0|2,0,1]=4 5297 B15R0.81 CCCCCCCCCCNCC(C)CC 2230a_100020588543_100000210320 [0,1,0,0,0,0|2,0,1]=4 5298 B15R0.81 CCCCCCCCCCNCC(C)CC 270004a_100000684558_100000243153 [0,1,0,0,0,0|2,0,1]=4 5299 B15R0.81 CCCCCCCCCCNCC(C)CC 34a_100000684558_100000748023 [0,1,0,0,0,0|2,0,1]=4 5300 B15R0.81 CCCCCCCCCCNCC(C)CO 34a_100000744482_100000210320 [0,1,0,0,0,0|1,0,2]=4 5301 B15R0.81 CCCCCCCCCCNCC(O)CC 2230a_100000684558_100011218378 [0,1,0,0,0,0|2,0,1]=4 5302 B15R0.81 CCCCCCCCCCNCC(O)CC 2230a_100011218483_100000210320 [0,1,0,0,0,0|2,0,1]=4 5303 B15R0.81 CCCCCCCCCCNCC(O)CC 34a_100000684558_100011218378 [0,1,0,0,0,0|2,0,1]=4 5304 B15R0.81 CCCCCCCCCCNCC(O)CO 2230a_100000684558_100011219619 [0,1,0,0,0,0|1,0,2]=4 5305 B15R0.81 CCCCCCCCCCNCC(O)CO 34a_100000684558_100011219619 [0,1,0,0,0,0|1,0,2]=4 5306 B15R0.81 CCCCCCCCCCNC[C@@H](C)CC 2230a_100000684558_100009816398 [0,1,0,0,0,0|2,0,1]=4 5307 B15R0.81 CCCCCCCCCCNC[C@@H](C)CC 34a_100000684558_100009816398 [0,1,0,0,0,0|2,0,1]=4 5308 B15R0.81 CCCCCCCCCCNC[C@@H](C)CO 2230a_100000684558_100000059175 [0,1,0,0,0,0|1,0,2]=4 5309 B15R0.81 CCCCCCCCCCNC[C@@H](C)CO 34a_100000684558_100000059175 [0,1,0,0,0,0|1,0,2]=4 5310 B15R0.81 CCCCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100000210320 [0,1,0,0,0,0|3,0,0]=4 5311 B15R0.81 CCCCCCCCCCNC[C@@H](F)CO 34a_100015665980_100000210320 [0,1,0,0,0,0|1,0,2]=4 5312 B15R0.81 CCCCCCCCCCNC[C@@H](O)CF 2230a_100000684558_100015614560 [0,1,0,0,0,0|2,0,1]=4 5313 B15R0.81 CCCCCCCCCCNC[C@@H](O)CF 34a_100000684558_100015614560 [0,1,0,0,0,0|2,0,1]=4 5314 B15R0.81 CCCCCCCCCCNC[C@@H](O)CO 2230a_100000684558_100009815848 [0,1,0,0,0,0|1,0,2]=4 5315 B15R0.81 CCCCCCCCCCNC[C@@H](O)CO 34a_100000684558_100009815848 [0,1,0,0,0,0|1,0,2]=4 5316 B15R0.81 CCCCCCCCCCNC[C@H](O)CO 2230a_100020644852_100000210320 [0,1,0,0,0,0|1,0,2]=4 5317 B15R0.81 CCCCCCCCCCOCC(C)CC 34a_100000210711_100000748023 [0,1,0,0,0,0|2,0,1]=4 5318 B15R0.81 CCCCCCCCCCOCC(C)CC 7a_100000210711_100000748023 [0,1,0,0,0,0|2,0,1]=4 5319 B15R0.81 CCCCCCCCCCOCC(C)CN 34a_100000744482_100000210320 [0,1,0,0,0,0|2,0,1]=4 5320 B15R0.81 CCCCCCCCCCOCC(C)OC 34a_100000690652_100000210320 [0,1,0,0,0,0|3,0,0]=4 5321 B15R0.81 CCCCCCCCCCOCC(Cl)CCl 34a_100000033668_100000210320 [0,1,0,0,0,0|2,0,1]=4 5322 B15R0.81 CCCCCCCCCCOCC(O)CC 34a_100000210711_100011218378 [0,1,0,0,0,0|2,0,1]=4 5323 B15R0.81 CCCCCCCCCCOCC(O)CC 7a_100000210711_100011218378 [0,1,0,0,0,0|2,0,1]=4 5324 B15R0.81 CCCCCCCCCCOCC(O)CO 34a_100000210711_100011219619 [0,1,0,0,0,0|1,0,2]=4 5325 B15R0.81 CCCCCCCCCCOCC(O)CO 7a_100000210711_100011219619 [0,1,0,0,0,0|1,0,2]=4 5326 B15R0.81 CCCCCCCCCCOC[C@@H](C)CC 34a_100000210711_100009816398 [0,1,0,0,0,0|2,0,1]=4 5327 B15R0.81 CCCCCCCCCCOC[C@@H](C)CC 7a_100000210711_100009816398 [0,1,0,0,0,0|2,0,1]=4 5328 B15R0.81 CCCCCCCCCCOC[C@@H](C)CC 7a_100009816381_100000210320 [0,1,0,0,0,0|2,0,1]=4 5329 B15R0.81 CCCCCCCCCCOC[C@@H](C)CO 34a_100000210711_100000059175 [0,1,0,0,0,0|1,0,2]=4 5330 B15R0.81 CCCCCCCCCCOC[C@@H](C)CO 7a_100000210711_100000059175 [0,1,0,0,0,0|1,0,2]=4 5331 B15R0.81 CCCCCCCCCCOC[C@@H](O)CF 34a_100000210711_100015614560 [0,1,0,0,0,0|2,0,1]=4 5332 B15R0.81 CCCCCCCCCCOC[C@@H](O)CF 7a_100000210711_100015614560 [0,1,0,0,0,0|2,0,1]=4 5333 B15R0.81 CCCCCCCCCCOC[C@@H](O)CO 34a_100000210711_100009815848 [0,1,0,0,0,0|1,0,2]=4 5334 B15R0.81 CCCCCCCCCCOC[C@@H](O)CO 7a_100000210711_100009815848 [0,1,0,0,0,0|1,0,2]=4 5335 B15R0.81 CCCCCCCCCCOC[C@H](F)CN 34a_100015665980_100000210320 [0,1,0,0,0,0|2,0,1]=4 5336 B15R0.81 CCCCCCCCCCSCC(C)CC 62a_100000748023_100000210320 [0,1,0,0,0,0|2,0,1]=4 5337 B15R0.81 CCCCCCCCCCSCC(O)CC 62a_100011218378_100000210320 [0,1,0,0,0,0|2,0,1]=4 5338 B15R0.81 CCCCCCCCCCSCC(O)CO 62a_100011219619_100000210320 [0,1,0,0,0,0|1,0,2]=4 5339 B15R0.81 CCCCCCCCCCSC[C@@H](C)CC 62a_100009816398_100000210320 [0,1,0,0,0,0|2,0,1]=4 5340 B15R0.81 CCCCCCCCCCSC[C@@H](C)CO 62a_100000059175_100000210320 [0,1,0,0,0,0|1,0,2]=4 5341 B15R0.81 CCCCCCCCCCSC[C@@H](O)CF 62a_100015614560_100000210320 [0,1,0,0,0,0|2,0,1]=4 5342 B15R0.81 CCCCCCCCCCSC[C@@H](O)CO 62a_100009815848_100000210320 [0,1,0,0,0,0|1,0,2]=4 5343 B15R0.81 CCCCCCCCCNCCC(C)CC 2230a_100020591266_100011214924 [0,1,0,0,0,0|2,0,1]=4 5344 B15R0.81 CCCCCCCCCNCCC(C)CO 2230a_106354213184_100011214924 [0,1,0,0,0,0|1,0,2]=4 5345 B15R0.81 CCCCCCCCCNCCC(C)CO 34a_106354213184_100011214924 [0,1,0,0,0,0|1,0,2]=4 5346 B15R0.81 CCCCCCCCCOCCC(C)CC 7a_100011215188_100000210328 [0,1,0,0,0,0|2,0,1]=4 5347 B15R0.81 CCCCCCCCCOCCC(C)OC 7a_100000764861_100000210328 [0,1,0,0,0,0|3,0,0]=4 5348 B15R0.81 CCCCCCCCOCCCC(C)CC 7a_100011216074_100000210759 [0,1,0,0,0,0|2,0,1]=4 5349 B15R0.81 CCCCCCCCOCCC[C@@H](C)CN 34a_100160569302_100000210759 [0,1,0,0,0,0|2,0,1]=4 5350 B15R0.81 CCCCCCOCCCCCC(C)CC 7a_200000035636_100000210314 [0,1,0,0,0,0|2,0,1]=4 5351 B15R0.81 CCN(C)CCCCCCCCCCCO 2230a_100000225621_100009812471 [0,1,0,0,0,0|1,0,2]=4 5352 B15R0.81 CCN(C)CCCCCCCCCCCO 269982a_100000225621_100009812471 [0,1,0,0,0,0|1,0,2]=4 5353 B15R0.81 CC[C@H](C)CNCCCCCCCCCO 2230a_100000078944_100009816398 [0,1,0,0,0,0|1,0,2]=4 5354 B15R0.81 CC[C@H](C)CNCCCCCCCCCO 34a_100000078944_100009816398 [0,1,0,0,0,0|1,0,2]=4 5355 B15R0.81 CC[C@H](C)COCCCCCCCCCBr 34a_100009813782_100009816398 [0,1,0,0,0,0|2,0,1]=4 5356 B15R0.81 CC[C@H](C)COCCCCCCCCCBr 7a_100009813782_100009816398 [0,1,0,0,0,0|2,0,1]=4 5357 B15R0.81 CC[C@H](C)COCCCCCCCCCCl 34a_100009868337_100009816398 [0,1,0,0,0,0|2,0,1]=4 5358 B15R0.81 CC[C@H](C)COCCCCCCCCCCl 7a_100009868337_100009816398 [0,1,0,0,0,0|2,0,1]=4 5359 B15R0.81 CC[C@H](C)COCCCCCCCCCN 34a_100000078944_100009816398 [0,1,0,0,0,0|2,0,1]=4 5360 B15R0.81 CC[C@H](C)COCCCCCCCCCO 7a_100009816381_100009813782 [0,1,0,0,0,0|1,0,2]=4 5361 B15R0.81 CC[C@H](C)CSCCCCCCCCCO 62a_100009813782_100009816398 [0,1,0,0,0,0|1,0,2]=4 5362 B15R0.81 CC[C@H](C)CSCCCCCCCCCO 62a_100009816398_100009813782 [0,1,0,0,0,0|1,0,2]=4 5363 B15R0.81 COC(=O)CCCCCCCCOCC=O 34a_100000035544_200009817547 [0,1,0,0,0,0|2,0,1]=4 5364 B15R0.81 COC(=O)CCCCCCCCOCC=O 7a_100000035544_200015260668 [0,1,0,0,0,0|2,0,1]=4 5365 B15R0.81 COC(=O)CCCCCCCCSCC=O 62a_100010282707_200015260668 [0,1,0,0,0,0|2,0,1]=4 5366 B15R0.81 COC(=O)CCCCCCCCSCC=O 62a_200015260668_100010282707 [0,1,0,0,0,0|2,0,1]=4 5367 B15R0.81 COC(=O)CCCCCCOCCCC=O 7a_100009863599_200011292268 [0,1,0,0,0,0|2,0,1]=4 5368 B15R0.81 COC(=O)CCCCCCSCCCC=O 62a_100009815986_200011292268 [0,1,0,0,0,0|2,0,1]=4 5369 B15R0.81 COC(=O)CCCCCCSCCCC=O 62a_200011292268_100009815986 [0,1,0,0,0,0|2,0,1]=4 5370 B15R0.81 COC(=O)CCCCCOCCCCC=O 7a_100000074720_100000139335 [0,1,0,0,0,0|2,0,1]=4 5371 B15R0.81 COC(=O)CCCCCSCCCCC=O 62a_100000139335_100009816466 [0,1,0,0,0,0|2,0,1]=4 5372 B15R0.81 COC(=O)CCCCCSCCCCC=O 62a_100009816466_100000139335 [0,1,0,0,0,0|2,0,1]=4 5373 B15R0.81 COC(=O)CCCCOCCCCCC=O 7a_100000059025_100000139337 [0,1,0,0,0,0|2,0,1]=4 5374 B15R0.81 COC(=O)CCCCSCCCCCC=O 62a_100000139337_100000204269 [0,1,0,0,0,0|2,0,1]=4 5375 B15R0.81 COC(=O)CCCCSCCCCCC=O 62a_100000204269_100000139337 [0,1,0,0,0,0|2,0,1]=4 5376 B15R0.133 C#CCCCCCC(=O)CCCCCCC 1458a_100000211969_100012094781 [0,1,0,0,0,0|1,0,2]=4 5377 B15R0.133 C#CCCCCCC(=O)CCCCCCC 1458a_100000694772_100000210614 [0,1,0,0,0,0|1,0,2]=4 5378 B15R0.133 C#CCCCCCN(C)CCCCCCC 2230a_100000228206_100012094781 [0,1,0,0,0,0|2,0,1]=4 5379 B15R0.133 C#CCCCCCN(C)CCCCCCC 269982a_100000228206_100012094781 [0,1,0,0,0,0|2,0,1]=4 5380 B15R0.133 C#CCCCCNC(C)CCCCCCC 2230a_100000706060_200011218727 [0,1,0,0,0,0|2,0,1]=4 5381 B15R0.133 C#CCCCCNC(C)CCCCCCC 34a_100000706060_200011218727 [0,1,0,0,0,0|2,0,1]=4 5382 B15R0.133 C#CCCCCOC(C)CCCCCCC 34a_100000766709_200011218727 [0,1,0,0,0,0|2,0,1]=4 5383 B15R0.133 C#CCCCCOC(C)CCCCCCC 34a_200011215852_100010269958 [0,1,0,0,0,0|2,0,1]=4 5384 B15R0.133 C#CCCCCOC(C)CCCCCCC 7a_100000766709_200011218727 [0,1,0,0,0,0|2,0,1]=4 5385 B15R0.133 C#CCCCCOC(C)CCCCCCC 7a_200011215852_100010269958 [0,1,0,0,0,0|2,0,1]=4 5386 B15R0.133 C#CCCCCSC(C)CCCCCCC 62a_100010269958_200011218727 [0,1,0,0,0,0|2,0,1]=4 5387 B15R0.133 C#CCCCCSC(C)CCCCCCC 62a_200011218727_100010269958 [0,1,0,0,0,0|2,0,1]=4 5388 B15R0.133 C=CCCCCCC(=O)CCCCCCC 1458a_100000211969_100000700193 [0,1,0,0,0,0|1,0,1]=3 5389 B15R0.133 C=CCCCCCC(=O)CCCCCCC 1458a_100011934241_100000210614 [0,1,0,0,0,0|1,0,1]=3 5390 B15R0.133 C=CCCCCCC(=O)CCCCCCF 1458a_100011934241_100015922095 [0,1,0,0,0,0|2,0,1]=4 5391 B15R0.133 C=CCCCCCC(=O)CCCCCCO 1458a_100011934241_100000766143 [0,1,0,0,0,0|2,0,1]=4 5392 B15R0.133 C=CCCCCCC(=O)CCCCCCO 1458a_100011996774_100000700193 [0,1,0,0,0,0|2,0,1]=4 5393 B15R0.133 C=CCCCCCC(=O)CCCCCOC 1458a_100011935119_100000700193 [0,1,0,0,0,0|2,0,1]=4 5394 B15R0.133 C=CCCCCCC(=O)CCOCCCC 1458a_100011934241_100000743108 [0,1,0,0,0,0|2,0,1]=4 5395 B15R0.133 C=CCCCCCC(=O)NCCCCCC 11a_100000210581_100011934241 [0,1,0,0,0,0|2,0,1]=4 5396 B15R0.133 C=CCCCCCC(=O)NCCCCCC 1626a_100000210581_100011934241 [0,1,0,0,0,0|2,0,1]=4 5397 B15R0.133 C=CCCCCCC(=O)NCCCCCC 240690a_100000210581_100011934241 [0,1,0,0,0,0|2,0,1]=4 5398 B15R0.133 C=CCCCCCC(=O)NCCCCCC 527a_100000210581_100011934241 [0,1,0,0,0,0|2,0,1]=4 5399 B15R0.133 C=CCCCCCN(C)CCCCCCC 2230a_100000228206_100000700193 [0,1,0,0,0,0|2,0,0]=3 5400 B15R0.133 C=CCCCCCN(C)CCCCCCC 269982a_100000228206_100000700193 [0,1,0,0,0,0|2,0,0]=3 5401 B15R0.133 C=CCCCCNC(=O)CCCCCCC 11a_100000703577_100000211969 [0,1,0,0,0,0|2,0,1]=4 5402 B15R0.133 C=CCCCCNC(=O)CCCCCCC 1626a_100000703577_100000211969 [0,1,0,0,0,0|2,0,1]=4 5403 B15R0.133 C=CCCCCNC(=O)CCCCCCC 240690a_100000703577_100000211969 [0,1,0,0,0,0|2,0,1]=4 5404 B15R0.133 C=CCCCCNC(=O)CCCCCCC 527a_100000703577_100000211969 [0,1,0,0,0,0|2,0,1]=4 5405 B15R0.133 C=CCCCCNC(C)CCCCCCC 2230a_100000703577_200011218727 [0,1,0,0,0,0|2,0,0]=3 5406 B15R0.133 C=CCCCCNC(C)CCCCCCC 270004a_100000703577_100000210596 [0,1,0,0,0,0|2,0,0]=3 5407 B15R0.133 C=CCCCCNC(C)CCCCCCC 34a_100000703577_200011218727 [0,1,0,0,0,0|2,0,0]=3 5408 B15R0.133 C=CCCCCOC(C)CCCCCCC 34a_100000766645_200011218727 [0,1,0,0,0,0|2,0,0]=3 5409 B15R0.133 C=CCCCCOC(C)CCCCCCC 34a_200011215852_100011215482 [0,1,0,0,0,0|2,0,0]=3 5410 B15R0.133 C=CCCCCOC(C)CCCCCCC 7a_100000766645_200011218727 [0,1,0,0,0,0|2,0,0]=3 5411 B15R0.133 C=CCCCCOC(C)CCCCCCC 7a_200011215852_100011215482 [0,1,0,0,0,0|2,0,0]=3 5412 B15R0.133 C=CCCCCSC(C)CCCCCCC 62a_100011215482_200011218727 [0,1,0,0,0,0|2,0,0]=3 5413 B15R0.133 C=CCCCCSC(C)CCCCCCC 62a_200011218727_100011215482 [0,1,0,0,0,0|2,0,0]=3 5414 B15R0.133 C=CCOCCOC(C)CCCCCCC 34a_100000037705_200011218727 [0,1,0,0,0,0|3,0,0]=4 5415 B15R0.133 C=CCOCCOC(C)CCCCCCC 7a_100000037705_200011218727 [0,1,0,0,0,0|3,0,0]=4 5416 B15R0.133 C=COCCCNC(C)CCCCCCC 2230a_100000210767_200011218727 [0,1,0,0,0,0|3,0,0]=4 5417 B15R0.133 C=COCCCNC(C)CCCCCCC 270004a_100000210767_100000210596 [0,1,0,0,0,0|3,0,0]=4 5418 B15R0.133 C=COCCCNC(C)CCCCCCC 34a_100000210767_200011218727 [0,1,0,0,0,0|3,0,0]=4 5419 B15R0.133 CC=CCCCOC(C)CCCCCCC 34a_100020645299_200011218727 [0,1,0,0,0,0|2,0,1]=4 5420 B15R0.133 CCCCCCCC(=O)CCCCCC#N 1458a_100000211969_100009813376 [0,1,0,0,0,0|1,0,2]=4 5421 B15R0.133 CCCCCCCC(=O)CCCCCCC 1458a_100000211969_100000210614 [0,1,0,0,0,0|1,0,2]=4 5422 B15R0.133 CCCCCCCC(=O)CCCCCCF 1458a_100000211969_100015922095 [0,1,0,0,0,0|1,0,2]=4 5423 B15R0.133 CCCCCCCC(=O)CCCCCCO 1458a_100000211969_100000766143 [0,1,0,0,0,0|0,0,3]=4 5424 B15R0.133 CCCCCCCC(=O)CCCCCCO 1458a_100011996774_100000210614 [0,1,0,0,0,0|0,0,3]=4 5425 B15R0.133 CCCCCCCC(=O)CCCCCOC 1458a_100011935119_100000210614 [0,1,0,0,0,0|2,0,1]=4 5426 B15R0.133 CCCCCCCC(C)NCCCCC#N 270004a_100000751965_100000210596 [0,1,0,0,0,0|2,0,1]=4 5427 B15R0.133 CCCCCCCC(C)NCCCCCC 2230a_100000210581_200011218727 [0,1,0,0,0,0|2,0,1]=4 5428 B15R0.133 CCCCCCCC(C)NCCCCCC 270004a_100000210581_100000210596 [0,1,0,0,0,0|2,0,1]=4 5429 B15R0.133 CCCCCCCC(C)NCCCCCO 2230a_100000762737_200011218727 [0,1,0,0,0,0|1,0,2]=4 5430 B15R0.133 CCCCCCCC(C)NCCCCCO 270004a_100000762737_100000210596 [0,1,0,0,0,0|1,0,2]=4 5431 B15R0.133 CCCCCCCC(C)NCCCCCO 34a_100000762737_200011218727 [0,1,0,0,0,0|1,0,2]=4 5432 B15R0.133 CCCCCCCC(C)OCCCCC#N 7a_200011215852_100000211819 [0,1,0,0,0,0|2,0,1]=4 5433 B15R0.133 CCCCCCCC(C)OCCCCC=O 7a_200011215852_100000139335 [0,1,0,0,0,0|1,0,0]=2 5434 B15R0.133 CCCCCCCC(C)OCCCCCBr 34a_100000746331_200011218727 [0,1,0,0,0,0|2,0,1]=4 5435 B15R0.133 CCCCCCCC(C)OCCCCCBr 7a_100000746331_200011218727 [0,1,0,0,0,0|2,0,1]=4 5436 B15R0.133 CCCCCCCC(C)OCCCCCC 34a_100000210259_200011218727 [0,1,0,0,0,0|2,0,1]=4 5437 B15R0.133 CCCCCCCC(C)OCCCCCC 34a_200011215852_100000210314 [0,1,0,0,0,0|2,0,1]=4 5438 B15R0.133 CCCCCCCC(C)OCCCCCC 7a_100000210259_200011218727 [0,1,0,0,0,0|2,0,1]=4 5439 B15R0.133 CCCCCCCC(C)OCCCCCC 7a_200011215852_100000210314 [0,1,0,0,0,0|2,0,1]=4 5440 B15R0.133 CCCCCCCC(C)OCCCCCCl 34a_100000746330_200011218727 [0,1,0,0,0,0|2,0,1]=4 5441 B15R0.133 CCCCCCCC(C)OCCCCCCl 7a_100000746330_200011218727 [0,1,0,0,0,0|2,0,1]=4 5442 B15R0.133 CCCCCCCC(C)OCCCCCF 34a_200011215852_100000729378 [0,1,0,0,0,0|2,0,1]=4 5443 B15R0.133 CCCCCCCC(C)OCCCCCF 7a_200011215852_100000729378 [0,1,0,0,0,0|2,0,1]=4 5444 B15R0.133 CCCCCCCC(C)OCCCCCI 34a_200012148887_200011218727 [0,1,0,0,0,0|2,0,1]=4 5445 B15R0.133 CCCCCCCC(C)OCCCCCI 7a_200012148887_200011218727 [0,1,0,0,0,0|2,0,1]=4 5446 B15R0.133 CCCCCCCC(C)OCCCCCN 34a_100000762737_200011218727 [0,1,0,0,0,0|2,0,1]=4 5447 B15R0.133 CCCCCCCC(C)OCCCCCO 34a_200011215852_100000746330 [0,1,0,0,0,0|1,0,2]=4 5448 B15R0.133 CCCCCCCC(C)OCCCCCO 7a_200011215852_100000746330 [0,1,0,0,0,0|1,0,2]=4 5449 B15R0.133 CCCCCCCC(C)OCCCCOC 34a_100000740925_200011218727 [0,1,0,0,0,0|3,0,0]=4 5450 B15R0.133 CCCCCCCC(C)OCCCCOC 34a_200011215852_100000755781 [0,1,0,0,0,0|3,0,0]=4 5451 B15R0.133 CCCCCCCC(C)OCCCCOC 7a_200011215852_100000730899 [0,1,0,0,0,0|3,0,0]=4 5452 B15R0.133 CCCCCCCC(C)OCCCCSC 34a_100011217163_200011218727 [0,1,0,0,0,0|3,0,0]=4 5453 B15R0.133 CCCCCCCC(C)OCCCCSC 7a_100011217163_200011218727 [0,1,0,0,0,0|3,0,0]=4 5454 B15R0.133 CCCCCCCC(C)SCCCCC#N 62a_100011219923_200011218727 [0,1,0,0,0,0|2,0,1]=4 5455 B15R0.133 CCCCCCCC(C)SCCCCC#N 62a_200011218727_100000211819 [0,1,0,0,0,0|2,0,1]=4 5456 B15R0.133 CCCCCCCC(C)SCCCCC=O 62a_100000139335_200011218727 [0,1,0,0,0,0|1,0,0]=2 5457 B15R0.133 CCCCCCCC(C)SCCCCC=O 62a_200011218727_100000139335 [0,1,0,0,0,0|1,0,0]=2 5458 B15R0.133 CCCCCCCC(C)SCCCCCF 62a_100000729378_200011218727 [0,1,0,0,0,0|2,0,1]=4 5459 B15R0.133 CCCCCCCC(C)SCCCCCF 62a_200011218727_100000729378 [0,1,0,0,0,0|2,0,1]=4 5460 B15R0.133 CCCCCCCC(C)SCCCCCO 62a_100000746330_200011218727 [0,1,0,0,0,0|1,0,2]=4 5461 B15R0.133 CCCCCCCC(C)SCCCCCO 62a_200011218727_100000746330 [0,1,0,0,0,0|1,0,2]=4 5462 B15R0.133 CCCCCCCC(C)SCCCCOC 62a_100000730899_200011218727 [0,1,0,0,0,0|3,0,0]=4 5463 B15R0.133 CCCCCCCC(C)SCCCCOC 62a_200011218727_100000730899 [0,1,0,0,0,0|3,0,0]=4 5464 B15R0.133 CCCCCCCN(C)CCCCCC#N 2230a_100000228206_100009813376 [0,1,0,0,0,0|2,0,1]=4 5465 B15R0.133 CCCCCCCN(C)CCCCCC#N 269982a_100000228206_100009813376 [0,1,0,0,0,0|2,0,1]=4 5466 B15R0.133 CCCCCCCN(C)CCCCCC=O 2230a_100000228206_100000139337 [0,1,0,0,0,0|1,0,0]=2 5467 B15R0.133 CCCCCCCN(C)CCCCCC=O 269982a_100000228206_100000139337 [0,1,0,0,0,0|1,0,0]=2 5468 B15R0.133 CCCCCCCN(C)CCCCCCC 2230a_100000228206_100000210681 [0,1,0,0,0,0|2,0,1]=4 5469 B15R0.133 CCCCCCCN(C)CCCCCCC 2230a_100000730722_200000210301 [0,1,0,0,0,0|2,0,1]=4 5470 B15R0.133 CCCCCCCN(C)CCCCCCC 269982a_100000228206_100000210681 [0,1,0,0,0,0|2,0,1]=4 5471 B15R0.133 CCCCCCCN(C)CCCCCCC 269982a_100000730722_200000210301 [0,1,0,0,0,0|2,0,1]=4 5472 B15R0.133 CCCCCCCN(C)CCCCCCF 2230a_100000228206_100015922095 [0,1,0,0,0,0|2,0,1]=4 5473 B15R0.133 CCCCCCCN(C)CCCCCCF 269982a_100000228206_100015922095 [0,1,0,0,0,0|2,0,1]=4 5474 B15R0.133 CCCCCCCN(C)CCCCCCO 2230a_100000228206_100000766143 [0,1,0,0,0,0|1,0,2]=4 5475 B15R0.133 CCCCCCCN(C)CCCCCCO 269982a_100000228206_100000766143 [0,1,0,0,0,0|1,0,2]=4 5476 B15R0.133 CCCCCCCN([13CH3])CCCCCCC 2230a_100000730722_200025704644 [0,1,0,0,0,0|2,0,1]=4 5477 B15R0.133 CCCCCCCN([13CH3])CCCCCCC 269982a_100000730722_200025704644 [0,1,0,0,0,0|2,0,1]=4 5478 B15R0.133 CCCCCCNC(=O)CSCCCC=O 62a_100000230325_200011292268 [0,1,0,0,0,0|2,0,1]=4 5479 B15R0.149 C#CCCCCC(=O)CCCCCCCC 1458a_100000210188_100010269958 [0,1,0,0,0,0|1,0,2]=4 5480 B15R0.149 C#CCCCCC(=O)CCCCCCCC 1458a_100000696528_100000210759 [0,1,0,0,0,0|1,0,2]=4 5481 B15R0.149 C#CCCCCCCC(=O)CCCCCC 1458a_100000034748_100000210757 [0,1,0,0,0,0|1,0,2]=4 5482 B15R0.149 C#CCCCCCCC(=O)CCCCCC 1458a_100102632555_100012276617 [0,1,0,0,0,0|1,0,2]=4 5483 B15R0.149 C#CCCCCCCN(C)CCCCCC 2230a_106256046315_100012276617 [0,1,0,0,0,0|2,0,1]=4 5484 B15R0.149 C#CCCCCCCN(C)CCCCCC 269982a_106256046315_100012276617 [0,1,0,0,0,0|2,0,1]=4 5485 B15R0.149 C#CCCCCCNC(C)CCCCCC 2230a_100000210919_100012094781 [0,1,0,0,0,0|2,0,1]=4 5486 B15R0.149 C#CCCCCCNC(C)CCCCCC 34a_100000210919_100012094781 [0,1,0,0,0,0|2,0,1]=4 5487 B15R0.149 C#CCCCCCOC(C)CCCCCC 34a_100000210265_100012094781 [0,1,0,0,0,0|2,0,1]=4 5488 B15R0.149 C#CCCCCCOC(C)CCCCCC 34a_100000766912_100011215978 [0,1,0,0,0,0|2,0,1]=4 5489 B15R0.149 C#CCCCCCOC(C)CCCCCC 7a_100000210265_100012094781 [0,1,0,0,0,0|2,0,1]=4 5490 B15R0.149 C#CCCCCCOC(C)CCCCCC 7a_100000766912_100011215978 [0,1,0,0,0,0|2,0,1]=4 5491 B15R0.149 C#CCCCCCSC(C)CCCCCC 62a_100011215978_100012094781 [0,1,0,0,0,0|2,0,1]=4 5492 B15R0.149 C#CCCCCCSC(C)CCCCCC 62a_100012094781_100011215978 [0,1,0,0,0,0|2,0,1]=4 5493 B15R0.149 C#CCCCCN(C)CCCCCCCC 2230a_100000207567_100010269958 [0,1,0,0,0,0|2,0,1]=4 5494 B15R0.149 C#CCCCCN(C)CCCCCCCC 269982a_100000207567_100010269958 [0,1,0,0,0,0|2,0,1]=4 5495 B15R0.149 C#CCCCNC(C)CCCCCCCC 270004a_100000718082_100011216694 [0,1,0,0,0,0|2,0,1]=4 5496 B15R0.149 C#CCCCOC(C)CCCCCCCC 34a_100000210740_100000695029 [0,1,0,0,0,0|2,0,1]=4 5497 B15R0.149 C#CCCCOC(C)CCCCCCCC 7a_100000210740_100011215417 [0,1,0,0,0,0|2,0,1]=4 5498 B15R0.149 C#CCCCOCCC(C)CCCCCC 34a_200011024964_100000695029 [0,1,0,0,0,0|2,0,1]=4 5499 B15R0.149 C#CCCCOCCC(C)CCCCCC 7a_200011024964_100011215417 [0,1,0,0,0,0|2,0,1]=4 5500 B15R0.149 C#CCCOCC(C)CCCCCCCC 34a_200012125181_100000688953 [0,1,0,0,0,0|2,0,1]=4 5501 B15R0.149 C#CCCOCC(C)CCCCCCCC 7a_200012125181_100000688953 [0,1,0,0,0,0|2,0,1]=4 5502 B15R0.149 C/C=C/COCC(C)CCCCCCCC 34a_200012125181_100102629194 [0,1,0,0,0,0|2,0,1]=4 5503 B15R0.149 C/C=C/COCC(C)CCCCCCCC 7a_200012125181_100102629194 [0,1,0,0,0,0|2,0,1]=4 5504 B15R0.149 C=CCCCCC(=O)CCCCCCCC 1458a_100000210188_100011215482 [0,1,0,0,0,0|1,0,1]=3 5505 B15R0.149 C=CCCCCC(=O)CCCCCCCC 1458a_100011215552_100000210759 [0,1,0,0,0,0|1,0,1]=3 5506 B15R0.149 C=CCCCCC(=O)CCCCCCCO 1458a_100011215552_100000760002 [0,1,0,0,0,0|2,0,1]=4 5507 B15R0.149 C=CCCCCC(=O)CCCCCCCO 1458a_100011219782_100011215482 [0,1,0,0,0,0|2,0,1]=4 5508 B15R0.149 C=CCCCCC(=O)CCCCCCOC 1458a_100011215552_100011998445 [0,1,0,0,0,0|2,0,1]=4 5509 B15R0.149 C=CCCCCC(=O)NCCCCCCC 11a_100000229938_100011215552 [0,1,0,0,0,0|2,0,1]=4 5510 B15R0.149 C=CCCCCC(=O)NCCCCCCC 1626a_100000229938_100011215552 [0,1,0,0,0,0|2,0,1]=4 5511 B15R0.149 C=CCCCCC(=O)NCCCCCCC 240690a_100000229938_100011215552 [0,1,0,0,0,0|2,0,1]=4 5512 B15R0.149 C=CCCCCC(=O)NCCCCCCC 527a_100000229938_100011215552 [0,1,0,0,0,0|2,0,1]=4 5513 B15R0.149 C=CCCCCCCC(=O)CCCCCC 1458a_100011809334_100000210757 [0,1,0,0,0,0|1,0,1]=3 5514 B15R0.149 C=CCCCCCCC(=O)CCCCCC 1458a_100102632555_100011215473 [0,1,0,0,0,0|1,0,1]=3 5515 B15R0.149 C=CCCCCCCC(=O)CCCCCF 1458a_100011809334_100000729378 [0,1,0,0,0,0|2,0,1]=4 5516 B15R0.149 C=CCCCCCCC(=O)CCCCCO 1458a_100011809334_100000746330 [0,1,0,0,0,0|2,0,1]=4 5517 B15R0.149 C=CCCCCCCC(=O)CCCCCO 1458a_100102619762_100011215473 [0,1,0,0,0,0|2,0,1]=4 5518 B15R0.149 C=CCCCCCCC(=O)CCCCOC 1458a_100011809334_100000755781 [0,1,0,0,0,0|2,0,1]=4 5519 B15R0.149 C=CCCCCCCC(=O)CCCOCC 1458a_100011809334_100012232248 [0,1,0,0,0,0|2,0,1]=4 5520 B15R0.149 C=CCCCCCCC(=O)CCOCCC 1458a_100011809334_100011215938 [0,1,0,0,0,0|2,0,1]=4 5521 B15R0.149 C=CCCCCCCC(=O)COCCCC 1458a_100000757543_100011215473 [0,1,0,0,0,0|2,0,1]=4 5522 B15R0.149 C=CCCCCCCC(=O)COCCCC 1458a_100011809334_100011995733 [0,1,0,0,0,0|2,0,1]=4 5523 B15R0.149 C=CCCCCCCC(=O)CSCCCC 1458a_100000191162_100011215473 [0,1,0,0,0,0|2,0,1]=4 5524 B15R0.149 C=CCCCCCCC(=O)NCCCCC 11a_100000209983_100011809334 [0,1,0,0,0,0|2,0,1]=4 5525 B15R0.149 C=CCCCCCCC(=O)NCCCCC 1626a_100000209983_100011809334 [0,1,0,0,0,0|2,0,1]=4 5526 B15R0.149 C=CCCCCCCC(=O)NCCCCC 240690a_100000209983_100011809334 [0,1,0,0,0,0|2,0,1]=4 5527 B15R0.149 C=CCCCCCCC(=O)NCCCCC 527a_100000209983_100011809334 [0,1,0,0,0,0|2,0,1]=4 5528 B15R0.149 C=CCCCCCCN(C)CCCCCC 2230a_106256046315_100011215473 [0,1,0,0,0,0|2,0,0]=3 5529 B15R0.149 C=CCCCCCCN(C)CCCCCC 269982a_106256046315_100011215473 [0,1,0,0,0,0|2,0,0]=3 5530 B15R0.149 C=CCCCCCCN(C)CCCCCO 2230a_100000722520_100011215473 [0,1,0,0,0,0|3,0,0]=4 5531 B15R0.149 C=CCCCCCCN(C)CCCCCO 269982a_100000722520_100011215473 [0,1,0,0,0,0|3,0,0]=4 5532 B15R0.149 C=CCCCCCNC(C)CCCCCC 2230a_100000210919_100000700193 [0,1,0,0,0,0|2,0,0]=3 5533 B15R0.149 C=CCCCCCNC(C)CCCCCC 34a_100000210919_100000700193 [0,1,0,0,0,0|2,0,0]=3 5534 B15R0.149 C=CCCCCCOC(C)CCCCCC 34a_100000210265_100000700193 [0,1,0,0,0,0|2,0,0]=3 5535 B15R0.149 C=CCCCCCOC(C)CCCCCC 34a_100011216702_100011215978 [0,1,0,0,0,0|2,0,0]=3 5536 B15R0.149 C=CCCCCCOC(C)CCCCCC 7a_100000210265_100000700193 [0,1,0,0,0,0|2,0,0]=3 5537 B15R0.149 C=CCCCCCOC(C)CCCCCC 7a_100011216702_100011215978 [0,1,0,0,0,0|2,0,0]=3 5538 B15R0.149 C=CCCCCCOC(C)COCCCC 34a_100011217071_100000700193 [0,1,0,0,0,0|3,0,0]=4 5539 B15R0.149 C=CCCCCCOC(C)COCCCC 7a_100011217071_100000700193 [0,1,0,0,0,0|3,0,0]=4 5540 B15R0.149 C=CCCCCCSC(C)CCCCCC 62a_100000700193_100011215978 [0,1,0,0,0,0|2,0,0]=3 5541 B15R0.149 C=CCCCCCSC(C)CCCCCC 62a_100011215978_100000700193 [0,1,0,0,0,0|2,0,0]=3 5542 B15R0.149 C=CCCCCN(C)CCCCCCCC 2230a_100000207567_100011215482 [0,1,0,0,0,0|2,0,0]=3 5543 B15R0.149 C=CCCCCN(C)CCCCCCCC 2230a_100012000471_100000210759 [0,1,0,0,0,0|2,0,0]=3 5544 B15R0.149 C=CCCCCN(C)CCCCCCCC 269982a_100000207567_100011215482 [0,1,0,0,0,0|2,0,0]=3 5545 B15R0.149 C=CCCCCN(C)CCCCCCCC 269982a_100012000471_100000210759 [0,1,0,0,0,0|2,0,0]=3 5546 B15R0.149 C=CCCCCN(C)CCCCCCCO 2230a_100012000471_100000760002 [0,1,0,0,0,0|3,0,0]=4 5547 B15R0.149 C=CCCCCN(C)CCCCCCCO 269982a_100012000471_100000760002 [0,1,0,0,0,0|3,0,0]=4 5548 B15R0.149 C=CCCCCN(C)CCCCCCOC 2230a_100012000471_100011998445 [0,1,0,0,0,0|3,0,0]=4 5549 B15R0.149 C=CCCCCN(C)CCCCCCOC 269982a_100012000471_100011998445 [0,1,0,0,0,0|3,0,0]=4 5550 B15R0.149 C=CCCCNC(=O)CCCCCCCC 11a_100000700776_100000210188 [0,1,0,0,0,0|2,0,1]=4 5551 B15R0.149 C=CCCCNC(=O)CCCCCCCC 1626a_100000700776_100000210188 [0,1,0,0,0,0|2,0,1]=4 5552 B15R0.149 C=CCCCNC(=O)CCCCCCCC 240690a_100000700776_100000210188 [0,1,0,0,0,0|2,0,1]=4 5553 B15R0.149 C=CCCCNC(=O)CCCCCCCC 527a_100000700776_100000210188 [0,1,0,0,0,0|2,0,1]=4 5554 B15R0.149 C=CCCCNC(C)CCCCCCCC 270004a_100000700776_100011216694 [0,1,0,0,0,0|2,0,0]=3 5555 B15R0.149 C=CCCCOC(C)CCCCCCCC 34a_100000210740_100000757094 [0,1,0,0,0,0|2,0,0]=3 5556 B15R0.149 C=CCCCOC(C)CCCCCCCC 7a_100000210740_100000757094 [0,1,0,0,0,0|2,0,0]=3 5557 B15R0.149 C=CCCCOCCC(C)CCCCCC 34a_200011024964_100000757094 [0,1,0,0,0,0|2,0,0]=3 5558 B15R0.149 C=CCCCOCCC(C)CCCCCC 7a_200011024964_100000757094 [0,1,0,0,0,0|2,0,0]=3 5559 B15R0.149 C=CCCNCC(C)CCCCCCCC 270004a_100015191253_100011995885 [0,1,0,0,0,0|2,0,0]=3 5560 B15R0.149 C=CCCOCC(C)CCCCCCCC 34a_200012125181_100000754431 [0,1,0,0,0,0|2,0,0]=3 5561 B15R0.149 C=CCCOCC(C)CCCCCCCC 7a_200012125181_100000754431 [0,1,0,0,0,0|2,0,0]=3 5562 B15R0.149 C=CCOCCC(=O)CCCCCCCC 1458a_200011217002_100000210759 [0,1,0,0,0,0|2,0,1]=4 5563 B15R0.149 C=COCCCCOC(C)CCCCCC 34a_100000031558_100011215978 [0,1,0,0,0,0|3,0,0]=4 5564 B15R0.149 C=COCCCCOC(C)CCCCCC 7a_100000031558_100011215978 [0,1,0,0,0,0|3,0,0]=4 5565 B15R0.149 C=COCCOC(C)CCCCCCCC 34a_100000210740_100000039644 [0,1,0,0,0,0|3,0,0]=4 5566 B15R0.149 C=COCCOC(C)CCCCCCCC 7a_100000210740_100000039644 [0,1,0,0,0,0|3,0,0]=4 5567 B15R0.149 C=COCCOCCC(C)CCCCCC 34a_200011024964_100000039644 [0,1,0,0,0,0|3,0,0]=4 5568 B15R0.149 C=COCCOCCC(C)CCCCCC 7a_200011024964_100000039644 [0,1,0,0,0,0|3,0,0]=4 5569 B15R0.149 CC=CCOCC(C)CCCCCCCC 34a_200012125181_100000070051 [0,1,0,0,0,0|2,0,1]=4 5570 B15R0.149 CC=CCOCC(C)CCCCCCCC 7a_200012125181_100000070051 [0,1,0,0,0,0|2,0,1]=4 5571 B15R0.149 CCCCCCC(=O)CCCCCCC#N 1458a_100102632555_100009813337 [0,1,0,0,0,0|1,0,2]=4 5572 B15R0.149 CCCCCCC(=O)CCCCCCCO 1458a_100011219782_100000210757 [0,1,0,0,0,0|0,0,3]=4 5573 B15R0.149 CCCCCCC(=O)CCCCCCCO 1458a_100102632555_100000760002 [0,1,0,0,0,0|0,0,3]=4 5574 B15R0.149 CCCCCCC(=O)CCCCCCOC 1458a_100102632555_100011998445 [0,1,0,0,0,0|2,0,1]=4 5575 B15R0.149 CCCCCCC(C)CCOCCCC#N 7a_200011024964_100000687738 [0,1,0,0,0,0|2,0,1]=4 5576 B15R0.149 CCCCCCC(C)CCOCCCC=O 7a_200011024964_200011292268 [0,1,0,0,0,0|1,0,0]=2 5577 B15R0.149 CCCCCCC(C)CCOCCCCC 34a_200011024964_100000718602 [0,1,0,0,0,0|2,0,1]=4 5578 B15R0.149 CCCCCCC(C)CCOCCCCC 7a_200011024964_100000210326 [0,1,0,0,0,0|2,0,1]=4 5579 B15R0.149 CCCCCCC(C)CCOCCCCF 34a_200011024964_100000729493 [0,1,0,0,0,0|2,0,1]=4 5580 B15R0.149 CCCCCCC(C)CCOCCCCF 7a_200011024964_100000729493 [0,1,0,0,0,0|2,0,1]=4 5581 B15R0.149 CCCCCCC(C)CCOCCCCO 34a_200011024964_100011216708 [0,1,0,0,0,0|1,0,2]=4 5582 B15R0.149 CCCCCCC(C)CCOCCCCO 7a_200011024964_100000210776 [0,1,0,0,0,0|1,0,2]=4 5583 B15R0.149 CCCCCCC(C)CCOCCCOC 34a_200011024964_100000740836 [0,1,0,0,0,0|3,0,0]=4 5584 B15R0.149 CCCCCCC(C)CCOCCCOC 7a_200011024964_100000740836 [0,1,0,0,0,0|3,0,0]=4 5585 B15R0.149 CCCCCCC(C)NCCCCCC#N 2230a_100000210919_100009813376 [0,1,0,0,0,0|2,0,1]=4 5586 B15R0.149 CCCCCCC(C)NCCCCCC#N 270004a_100000061152_100000210826 [0,1,0,0,0,0|2,0,1]=4 5587 B15R0.149 CCCCCCC(C)NCCCCCC=O 2230a_100000210919_100000139337 [0,1,0,0,0,0|1,0,0]=2 5588 B15R0.149 CCCCCCC(C)NCCCCCCF 2230a_100000210919_100015922095 [0,1,0,0,0,0|2,0,1]=4 5589 B15R0.149 CCCCCCC(C)NCCCCCCF 34a_100000210919_100015922095 [0,1,0,0,0,0|2,0,1]=4 5590 B15R0.149 CCCCCCC(C)NCCCCCCO 2230a_100000210919_100000766143 [0,1,0,0,0,0|1,0,2]=4 5591 B15R0.149 CCCCCCC(C)NCCCCCCO 2230a_100000686447_100011215978 [0,1,0,0,0,0|1,0,2]=4 5592 B15R0.149 CCCCCCC(C)NCCCCCCO 270004a_100000686447_100000210826 [0,1,0,0,0,0|1,0,2]=4 5593 B15R0.149 CCCCCCC(C)NCCCCCCO 34a_100000210919_100000766143 [0,1,0,0,0,0|1,0,2]=4 5594 B15R0.149 CCCCCCC(C)NCCCCCCO 34a_100000686447_100011215978 [0,1,0,0,0,0|1,0,2]=4 5595 B15R0.149 CCCCCCC(C)NCCCCCOC 2230a_100000747528_100011215978 [0,1,0,0,0,0|3,0,0]=4 5596 B15R0.149 CCCCCCC(C)NCCCCCOC 270004a_100000747528_100000210826 [0,1,0,0,0,0|3,0,0]=4 5597 B15R0.149 CCCCCCC(C)NCCCCCOC 34a_100000747528_100011215978 [0,1,0,0,0,0|3,0,0]=4 5598 B15R0.149 CCCCCCC(C)OCCCCCC#N 7a_100000210265_100009813376 [0,1,0,0,0,0|2,0,1]=4 5599 B15R0.149 CCCCCCC(C)OCCCCCC=O 7a_100000210265_100000139337 [0,1,0,0,0,0|1,0,0]=2 5600 B15R0.149 CCCCCCC(C)OCCCCCCBr 34a_100011215345_100011215978 [0,1,0,0,0,0|2,0,1]=4 5601 B15R0.149 CCCCCCC(C)OCCCCCCBr 7a_100011215345_100011215978 [0,1,0,0,0,0|2,0,1]=4 5602 B15R0.149 CCCCCCC(C)OCCCCCCCl 34a_100000766143_100011215978 [0,1,0,0,0,0|2,0,1]=4 5603 B15R0.149 CCCCCCC(C)OCCCCCCCl 7a_100000766143_100011215978 [0,1,0,0,0,0|2,0,1]=4 5604 B15R0.149 CCCCCCC(C)OCCCCCCF 34a_100000210265_100015922095 [0,1,0,0,0,0|2,0,1]=4 5605 B15R0.149 CCCCCCC(C)OCCCCCCF 34a_100000732779_100011215978 [0,1,0,0,0,0|2,0,1]=4 5606 B15R0.149 CCCCCCC(C)OCCCCCCF 7a_100000210265_100015922095 [0,1,0,0,0,0|2,0,1]=4 5607 B15R0.149 CCCCCCC(C)OCCCCCCF 7a_100000732779_100011215978 [0,1,0,0,0,0|2,0,1]=4 5608 B15R0.149 CCCCCCC(C)OCCCCCCN 34a_100000686447_100011215978 [0,1,0,0,0,0|2,0,1]=4 5609 B15R0.149 CCCCCCC(C)OCCCCCCO 34a_100000210265_100000766143 [0,1,0,0,0,0|1,0,2]=4 5610 B15R0.149 CCCCCCC(C)OCCCCCCO 7a_100000210265_100000766143 [0,1,0,0,0,0|1,0,2]=4 5611 B15R0.149 CCCCCCC(C)OCCCCCNC 34a_100000722520_100011215978 [0,1,0,0,0,0|3,0,0]=4 5612 B15R0.149 CCCCCCC(C)SCCCCCC#N 62a_100009813376_100011215978 [0,1,0,0,0,0|2,0,1]=4 5613 B15R0.149 CCCCCCC(C)SCCCCCC#N 62a_100011215978_100009813376 [0,1,0,0,0,0|2,0,1]=4 5614 B15R0.149 CCCCCCC(C)SCCCCCC=O 62a_100000139337_100011215978 [0,1,0,0,0,0|1,0,0]=2 5615 B15R0.149 CCCCCCC(C)SCCCCCC=O 62a_100011215978_100000139337 [0,1,0,0,0,0|1,0,0]=2 5616 B15R0.149 CCCCCCC(C)SCCCCCCF 62a_100011215978_100015922095 [0,1,0,0,0,0|2,0,1]=4 5617 B15R0.149 CCCCCCC(C)SCCCCCCF 62a_100015922095_100011215978 [0,1,0,0,0,0|2,0,1]=4 5618 B15R0.149 CCCCCCC(C)SCCCCCCO 62a_100000766143_100011215978 [0,1,0,0,0,0|1,0,2]=4 5619 B15R0.149 CCCCCCC(C)SCCCCCCO 62a_100011215978_100000766143 [0,1,0,0,0,0|1,0,2]=4 5620 B15R0.149 CCCCCCCCC(=O)CCCCC#N 1458a_100000210188_100000211819 [0,1,0,0,0,0|1,0,2]=4 5621 B15R0.149 CCCCCCCCC(=O)CCCCCC 1458a_100000210188_100000210757 [0,1,0,0,0,0|1,0,2]=4 5622 B15R0.149 CCCCCCCCC(=O)CCCCCC 1458a_100102632555_100000210759 [0,1,0,0,0,0|1,0,2]=4 5623 B15R0.149 CCCCCCCCC(=O)CCCCCF 1458a_100000210188_100000729378 [0,1,0,0,0,0|1,0,2]=4 5624 B15R0.149 CCCCCCCCC(=O)CCCCCO 1458a_100000210188_100000746330 [0,1,0,0,0,0|0,0,3]=4 5625 B15R0.149 CCCCCCCCC(=O)CCCCCO 1458a_100102619762_100000210759 [0,1,0,0,0,0|0,0,3]=4 5626 B15R0.149 CCCCCCCCC(=O)CCCCOC 1458a_100000210188_100000755781 [0,1,0,0,0,0|2,0,1]=4 5627 B15R0.149 CCCCCCCCC(C)CNCCC#N 270004a_100000720768_100011995885 [0,1,0,0,0,0|2,0,1]=4 5628 B15R0.149 CCCCCCCCC(C)CNCCCC 270004a_100000102301_100011995885 [0,1,0,0,0,0|2,0,1]=4 5629 B15R0.149 CCCCCCCCC(C)CNCCCF 270004a_100015189416_100011995885 [0,1,0,0,0,0|2,0,1]=4 5630 B15R0.149 CCCCCCCCC(C)CNCCCO 270004a_100000182051_100011995885 [0,1,0,0,0,0|1,0,2]=4 5631 B15R0.149 CCCCCCCCC(C)CNCCOC 270004a_100000209980_100011995885 [0,1,0,0,0,0|3,0,0]=4 5632 B15R0.149 CCCCCCCCC(C)CNCCSC 270004a_100020590264_100011995885 [0,1,0,0,0,0|3,0,0]=4 5633 B15R0.149 CCCCCCCCC(C)COCCC#N 7a_200012125181_100000184422 [0,1,0,0,0,0|2,0,1]=4 5634 B15R0.149 CCCCCCCCC(C)COCCCC 34a_200012125181_100000210210 [0,1,0,0,0,0|2,0,1]=4 5635 B15R0.149 CCCCCCCCC(C)COCCCC 7a_200012125181_100000210211 [0,1,0,0,0,0|2,0,1]=4 5636 B15R0.149 CCCCCCCCC(C)COCCCF 34a_200012125181_100011934791 [0,1,0,0,0,0|2,0,1]=4 5637 B15R0.149 CCCCCCCCC(C)COCCCF 7a_200012125181_100011934791 [0,1,0,0,0,0|2,0,1]=4 5638 B15R0.149 CCCCCCCCC(C)COCCCO 34a_200012125181_100000230001 [0,1,0,0,0,0|1,0,2]=4 5639 B15R0.149 CCCCCCCCC(C)COCCCO 7a_200012125181_100011215043 [0,1,0,0,0,0|1,0,2]=4 5640 B15R0.149 CCCCCCCCC(C)COCCOC 34a_200012125181_100011201679 [0,1,0,0,0,0|3,0,0]=4 5641 B15R0.149 CCCCCCCCC(C)COCCOC 7a_200012125181_100000233755 [0,1,0,0,0,0|3,0,0]=4 5642 B15R0.149 CCCCCCCCC(C)COCCSC 34a_200012125181_100000212216 [0,1,0,0,0,0|3,0,0]=4 5643 B15R0.149 CCCCCCCCC(C)COCCSC 7a_200012125181_100000212216 [0,1,0,0,0,0|3,0,0]=4 5644 B15R0.149 CCCCCCCCC(C)NCCCCC 270004a_100000209983_100011216694 [0,1,0,0,0,0|2,0,1]=4 5645 B15R0.149 CCCCCCCCC(C)NCCCCO 270004a_100000750430_100011216694 [0,1,0,0,0,0|1,0,2]=4 5646 B15R0.149 CCCCCCCCC(C)NCCCOC 270004a_100150723488_100011216694 [0,1,0,0,0,0|3,0,0]=4 5647 B15R0.149 CCCCCCCCC(C)NCCCSC 270004a_100000749238_100011216694 [0,1,0,0,0,0|3,0,0]=4 5648 B15R0.149 CCCCCCCCC(C)OCCCC#N 7a_100000210740_100000687738 [0,1,0,0,0,0|2,0,1]=4 5649 B15R0.149 CCCCCCCCC(C)OCCCC=O 7a_100000210740_200011292268 [0,1,0,0,0,0|1,0,0]=2 5650 B15R0.149 CCCCCCCCC(C)OCCCCC 34a_100000210740_100000718602 [0,1,0,0,0,0|2,0,1]=4 5651 B15R0.149 CCCCCCCCC(C)OCCCCC 7a_100000210740_100000210326 [0,1,0,0,0,0|2,0,1]=4 5652 B15R0.149 CCCCCCCCC(C)OCCCCF 34a_100000210740_100000729493 [0,1,0,0,0,0|2,0,1]=4 5653 B15R0.149 CCCCCCCCC(C)OCCCCF 7a_100000210740_100000729493 [0,1,0,0,0,0|2,0,1]=4 5654 B15R0.149 CCCCCCCCC(C)OCCCCO 34a_100000210740_100011216708 [0,1,0,0,0,0|1,0,2]=4 5655 B15R0.149 CCCCCCCCC(C)OCCCCO 7a_100000210740_100000210776 [0,1,0,0,0,0|1,0,2]=4 5656 B15R0.149 CCCCCCCCC(C)OCCCOC 34a_100000210740_100000740836 [0,1,0,0,0,0|3,0,0]=4 5657 B15R0.149 CCCCCCCCC(C)OCCCOC 7a_100000210740_100000740836 [0,1,0,0,0,0|3,0,0]=4 5658 B15R0.149 CCCCCCCCN(C)CCCCC#N 2230a_100000207567_100000211819 [0,1,0,0,0,0|2,0,1]=4 5659 B15R0.149 CCCCCCCCN(C)CCCCC#N 269982a_100000207567_100011219923 [0,1,0,0,0,0|2,0,1]=4 5660 B15R0.149 CCCCCCCCN(C)CCCCC=O 2230a_100000207567_100000139335 [0,1,0,0,0,0|1,0,0]=2 5661 B15R0.149 CCCCCCCCN(C)CCCCC=O 269982a_100000207567_100000139335 [0,1,0,0,0,0|1,0,0]=2 5662 B15R0.149 CCCCCCCCN(C)CCCCCC 2230a_100000207567_100000210314 [0,1,0,0,0,0|2,0,1]=4 5663 B15R0.149 CCCCCCCCN(C)CCCCCC 2230a_106256046315_100000210759 [0,1,0,0,0,0|2,0,1]=4 5664 B15R0.149 CCCCCCCCN(C)CCCCCC 269982a_100000207567_100000210757 [0,1,0,0,0,0|2,0,1]=4 5665 B15R0.149 CCCCCCCCN(C)CCCCCC 269982a_106256046315_100000210759 [0,1,0,0,0,0|2,0,1]=4 5666 B15R0.149 CCCCCCCCN(C)CCCCCF 2230a_100000207567_100000729378 [0,1,0,0,0,0|2,0,1]=4 5667 B15R0.149 CCCCCCCCN(C)CCCCCF 269982a_100000207567_100000729378 [0,1,0,0,0,0|2,0,1]=4 5668 B15R0.149 CCCCCCCCN(C)CCCCCO 2230a_100000207567_100000746330 [0,1,0,0,0,0|1,0,2]=4 5669 B15R0.149 CCCCCCCCN(C)CCCCCO 2230a_100000722520_100000210759 [0,1,0,0,0,0|1,0,2]=4 5670 B15R0.149 CCCCCCCCN(C)CCCCCO 269982a_100000207567_100000746330 [0,1,0,0,0,0|1,0,2]=4 5671 B15R0.149 CCCCCCCCN(C)CCCCCO 269982a_100000722520_100000210759 [0,1,0,0,0,0|1,0,2]=4 5672 B15R0.149 CCCCCCCCN(C)CCCCOC 2230a_100000207567_100000730899 [0,1,0,0,0,0|3,0,0]=4 5673 B15R0.149 CCCCCCCCN(C)CCCCOC 269982a_100000207567_100000730899 [0,1,0,0,0,0|3,0,0]=4 5674 B15R0.149 CCCCCCCNC(C)CCCCCC 2230a_100000210919_100000210681 [0,1,0,0,0,0|2,0,1]=4 5675 B15R0.149 CCCCCCCNC(C)CCCCCC 2230a_100000229938_100011215978 [0,1,0,0,0,0|2,0,1]=4 5676 B15R0.149 CCCCCCCNC(C)CCCCCC 270004a_100000229938_100000210826 [0,1,0,0,0,0|2,0,1]=4 5677 B15R0.149 CCCCCCCNC(C)CCCCCC 34a_100000210919_100000210614 [0,1,0,0,0,0|2,0,1]=4 5678 B15R0.149 CCCCCCCOC(C)CCCCCC 34a_100000210265_100000210614 [0,1,0,0,0,0|2,0,1]=4 5679 B15R0.149 CCCCCCCOC(C)CCCCCC 34a_100000210272_100011215978 [0,1,0,0,0,0|2,0,1]=4 5680 B15R0.149 CCCCCCCOC(C)CCCCCC 7a_100000210265_100000210614 [0,1,0,0,0,0|2,0,1]=4 5681 B15R0.149 CCCCCCCOC(C)CCCCCC 7a_100000210272_100011215978 [0,1,0,0,0,0|2,0,1]=4 5682 B15R0.149 CCCCCCN(C)CCCCCCC#N 2230a_106256046315_100009813337 [0,1,0,0,0,0|2,0,1]=4 5683 B15R0.149 CCCCCCN(C)CCCCCCC#N 269982a_106256046315_100009813337 [0,1,0,0,0,0|2,0,1]=4 5684 B15R0.149 CCCCCCN(C)CCCCCCCO 2230a_106256046315_100000760002 [0,1,0,0,0,0|1,0,2]=4 5685 B15R0.149 CCCCCCN(C)CCCCCCCO 269982a_106256046315_100000760002 [0,1,0,0,0,0|1,0,2]=4 5686 B15R0.149 CCCCCCN(C)CCCCCCOC 2230a_106256046315_100011998445 [0,1,0,0,0,0|3,0,0]=4 5687 B15R0.149 CCCCCCN(C)CCCCCCOC 269982a_106256046315_100011998445 [0,1,0,0,0,0|3,0,0]=4 5688 B15R0.149 CCCCCNC(=O)CSCCCCC=O 62a_100000139335_100000230301 [0,1,0,0,0,0|2,0,1]=4 5689 B15R0.149 CCCCCNC(=O)CSCCCCC=O 62a_100000230301_100000139335 [0,1,0,0,0,0|2,0,1]=4 5690 B15R0.149 CCCCOCC(C)OCCCCCC=O 7a_100011217071_100000139337 [0,1,0,0,0,0|2,0,0]=3 5691 B15R0.164 C#CCCCCCCCCCCOC(C)C 34a_100000054667_100000210206 [0,1,0,0,0,0|2,0,1]=4 5692 B15R0.164 C#CCCCCCCCCCCOC(C)C 7a_100000054667_100000210206 [0,1,0,0,0,0|2,0,1]=4 5693 B15R0.164 C#CCCCCCCCCCOCC(=O)N 34a_100000034437_100000187820 [0,1,0,0,0,0|1,0,2]=4 5694 B15R0.164 C#CCCCCCCCCCOCC(=O)N 7a_100000034437_100000187820 [0,1,0,0,0,0|1,0,2]=4 5695 B15R0.164 C#CCCCCCCCCCOCC(=O)[O-] 34a_100000034437_100020667443 [0,1,0,0,0,0|1,0,2]=4 5696 B15R0.164 C#CCCCCCCCCCOCC(C)C 34a_100000034437_100000210624 [0,1,0,0,0,0|2,0,1]=4 5697 B15R0.164 C#CCCCCCCCCCOCC(C)C 7a_100000034437_100000210760 [0,1,0,0,0,0|2,0,1]=4 5698 B15R0.164 C#CCCCCCCCCCOCC(C)O 34a_100000034437_100011218427 [0,1,0,0,0,0|2,0,1]=4 5699 B15R0.164 C#CCCCCCCCCCOCC(C)O 7a_100000034437_100011218427 [0,1,0,0,0,0|2,0,1]=4 5700 B15R0.164 C#CCCCCCCCCCOC[C@@H](C)O 34a_100000034437_100009817552 [0,1,0,0,0,0|2,0,1]=4 5701 B15R0.164 C#CCCCCCCCCCOC[C@@H](C)O 7a_100000034437_100009817552 [0,1,0,0,0,0|2,0,1]=4 5702 B15R0.164 C#CCCCCCCCCOCCC(=O)C 7a_100000065265_100000053229 [0,1,0,0,0,0|1,0,2]=4 5703 B15R0.164 C#CCCCCCCCCOCCC(=O)N 34a_100000065265_100000731001 [0,1,0,0,0,0|1,0,2]=4 5704 B15R0.164 C#CCCCCCCCCOCCC(=O)N 7a_100000065265_100000744528 [0,1,0,0,0,0|1,0,2]=4 5705 B15R0.164 C#CCCCCCCCCOCCC(C)C 34a_100000065265_100000210312 [0,1,0,0,0,0|2,0,1]=4 5706 B15R0.164 C#CCCCCCCCCOCCC(C)C 7a_100000065265_100000210626 [0,1,0,0,0,0|2,0,1]=4 5707 B15R0.164 C#CCCCCCCCCOCCC(C)O 34a_100000065265_100012276601 [0,1,0,0,0,0|2,0,1]=4 5708 B15R0.164 C#CCCCCCCCCOCCC(C)O 7a_100000065265_100012276601 [0,1,0,0,0,0|2,0,1]=4 5709 B15R0.164 C#CCCCCCCCNCCCC(=O)N 34a_100000739312_100153394163 [0,1,0,0,0,0|1,0,2]=4 5710 B15R0.164 C#CCCCCCCCNCCCC(C)C 2230a_200000737386_100153394163 [0,1,0,0,0,0|2,0,1]=4 5711 B15R0.164 C#CCCCCCCCNCCCC(C)C 34a_200000737386_100153394163 [0,1,0,0,0,0|2,0,1]=4 5712 B15R0.164 C#CCCCCCCCOCCCC(=O)C 34a_100000054614_100000685027 [0,1,0,0,0,0|1,0,2]=4 5713 B15R0.164 C#CCCCCCCCOCCCC(=O)C 34a_100000759063_100153394163 [0,1,0,0,0,0|1,0,2]=4 5714 B15R0.164 C#CCCCCCCCOCCCC(=O)C 7a_100000054614_100011215641 [0,1,0,0,0,0|1,0,2]=4 5715 B15R0.164 C#CCCCCCCCOCCCC(=O)C 7a_100000759063_100153394163 [0,1,0,0,0,0|1,0,2]=4 5716 B15R0.164 C#CCCCCCCCOCCCC(=O)N 34a_100000054614_100102525003 [0,1,0,0,0,0|1,0,2]=4 5717 B15R0.164 C#CCCCCCCCOCCCC(=O)N 7a_100000054614_100102525003 [0,1,0,0,0,0|1,0,2]=4 5718 B15R0.164 C#CCCCCCCCOCCCC(C)C 34a_100000054614_100011214892 [0,1,0,0,0,0|2,0,1]=4 5719 B15R0.164 C#CCCCCCCCOCCCC(C)C 34a_100000210774_100153394163 [0,1,0,0,0,0|2,0,1]=4 5720 B15R0.164 C#CCCCCCCCOCCCC(C)C 7a_100000054614_100011214892 [0,1,0,0,0,0|2,0,1]=4 5721 B15R0.164 C#CCCCCCCCOCCCC(C)C 7a_100000210774_100153394163 [0,1,0,0,0,0|2,0,1]=4 5722 B15R0.164 C#CCCCCCCCOCCCC(C)O 34a_100000054614_200000718107 [0,1,0,0,0,0|2,0,1]=4 5723 B15R0.164 C#CCCCCCCCOCCCC(C)O 7a_100000054614_200000718107 [0,1,0,0,0,0|2,0,1]=4 5724 B15R0.164 C#CCCCCCCCSCCCC(=O)C 62a_100011215641_100153394163 [0,1,0,0,0,0|1,0,2]=4 5725 B15R0.164 C#CCCCCCCCSCCCC(=O)C 62a_100153394163_100011215641 [0,1,0,0,0,0|1,0,2]=4 5726 B15R0.164 C#CCCCCCCCSCCCC(=O)N 62a_100102525003_100153394163 [0,1,0,0,0,0|1,0,2]=4 5727 B15R0.164 C#CCCCCCCCSCCCC(=O)N 62a_100153394163_100102525003 [0,1,0,0,0,0|1,0,2]=4 5728 B15R0.164 C#CCCCCCCCSCCCC(C)C 62a_100011214892_100153394163 [0,1,0,0,0,0|2,0,1]=4 5729 B15R0.164 C#CCCCCCCCSCCCC(C)C 62a_100153394163_100011214892 [0,1,0,0,0,0|2,0,1]=4 5730 B15R0.164 C#CCCCCCCCSCCCC(C)O 62a_100153394163_200000718107 [0,1,0,0,0,0|2,0,1]=4 5731 B15R0.164 C#CCCCCCCCSCCCC(C)O 62a_200000718107_100153394163 [0,1,0,0,0,0|2,0,1]=4 5732 B15R0.164 C#CCCCCCCNCCCCC(=O)N 34a_100000696515_100012276617 [0,1,0,0,0,0|1,0,2]=4 5733 B15R0.164 C#CCCCCCCOCCCCC(=O)C 34a_100011217361_100009817362 [0,1,0,0,0,0|1,0,2]=4 5734 B15R0.164 C#CCCCCCCOCCCCC(=O)C 7a_100011217361_100000735457 [0,1,0,0,0,0|1,0,2]=4 5735 B15R0.164 C#CCCCCCCOCCCCC(=O)N 34a_100012022536_100012276617 [0,1,0,0,0,0|1,0,2]=4 5736 B15R0.164 C#CCCCCCCOCCCCC(=O)N 7a_100012022536_100012276617 [0,1,0,0,0,0|1,0,2]=4 5737 B15R0.164 C#CCCCCCCOCCCCC(C)C 34a_100011214890_100012276617 [0,1,0,0,0,0|2,0,1]=4 5738 B15R0.164 C#CCCCCCCOCCCCC(C)C 34a_100011217361_100011216152 [0,1,0,0,0,0|2,0,1]=4 5739 B15R0.164 C#CCCCCCCOCCCCC(C)C 7a_100011214890_100012276617 [0,1,0,0,0,0|2,0,1]=4 5740 B15R0.164 C#CCCCCCCOCCCCC(C)C 7a_100011217361_100011216152 [0,1,0,0,0,0|2,0,1]=4 5741 B15R0.164 C#CCCCCCCSCCCCC(=O)C 62a_100000735457_100012276617 [0,1,0,0,0,0|1,0,2]=4 5742 B15R0.164 C#CCCCCCCSCCCCC(=O)C 62a_100012276617_100000735457 [0,1,0,0,0,0|1,0,2]=4 5743 B15R0.164 C#CCCCCCCSCCCCC(C)C 62a_100011216152_100012276617 [0,1,0,0,0,0|2,0,1]=4 5744 B15R0.164 C#CCCCCCCSCCCCC(C)C 62a_100012276617_100011216152 [0,1,0,0,0,0|2,0,1]=4 5745 B15R0.164 C#CCCCCCNCCCCCC(C)C 2230a_100011290863_100012094781 [0,1,0,0,0,0|2,0,1]=4 5746 B15R0.164 C#CCCCCCNCCCCCC(C)C 34a_100011290863_100012094781 [0,1,0,0,0,0|2,0,1]=4 5747 B15R0.164 C#CCCCCCOCCCCCC(=O)N 34a_100000123541_100012094781 [0,1,0,0,0,0|1,0,2]=4 5748 B15R0.164 C#CCCCCCOCCCCCC(=O)N 34a_100000766912_100009817443 [0,1,0,0,0,0|1,0,2]=4 5749 B15R0.164 C#CCCCCCOCCCCCC(=O)N 7a_100000123541_100012094781 [0,1,0,0,0,0|1,0,2]=4 5750 B15R0.164 C#CCCCCCOCCCCCC(=O)N 7a_100000766912_100009817443 [0,1,0,0,0,0|1,0,2]=4 5751 B15R0.164 C#CCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100012094781 [0,1,0,0,0,0|1,0,2]=4 5752 B15R0.164 C#CCCCCCOCCCCCC(C)C 34a_100000766912_100000210682 [0,1,0,0,0,0|2,0,1]=4 5753 B15R0.164 C#CCCCCCOCCCCCC(C)C 34a_100011995859_100012094781 [0,1,0,0,0,0|2,0,1]=4 5754 B15R0.164 C#CCCCCCOCCCCCC(C)C 7a_100000766912_100000210682 [0,1,0,0,0,0|2,0,1]=4 5755 B15R0.164 C#CCCCCCOCCCCCC(C)C 7a_100011995859_100012094781 [0,1,0,0,0,0|2,0,1]=4 5756 B15R0.164 C#CCCCCCSCCCCCC(=O)N 62a_100009817443_100012094781 [0,1,0,0,0,0|1,0,2]=4 5757 B15R0.164 C#CCCCCCSCCCCCC(=O)N 62a_100012094781_100009817443 [0,1,0,0,0,0|1,0,2]=4 5758 B15R0.164 C#CCCCCCSCCCCCC(C)C 62a_100000210682_100012094781 [0,1,0,0,0,0|2,0,1]=4 5759 B15R0.164 C#CCCCCCSCCCCCC(C)C 62a_100012094781_100000210682 [0,1,0,0,0,0|2,0,1]=4 5760 B15R0.164 C#CCCCCNCCCCCCC(C)C 2230a_100000211014_100010269958 [0,1,0,0,0,0|2,0,1]=4 5761 B15R0.164 C#CCCCCNCCCCCCC(C)C 34a_100000211014_100010269958 [0,1,0,0,0,0|2,0,1]=4 5762 B15R0.164 C#CCCCOCCCCCCCC(C)C 34a_200000210741_100000695029 [0,1,0,0,0,0|2,0,1]=4 5763 B15R0.164 C#CCCCOCCCCCCCC(C)C 7a_200000210741_100011215417 [0,1,0,0,0,0|2,0,1]=4 5764 B15R0.164 C=C(Br)CCOCCCCCCCCCC 34a_100009813270_100000210320 [0,1,0,0,0,0|2,0,0]=3 5765 B15R0.164 C=C(Br)CCOCCCCCCCCCO 34a_100009813270_100009813782 [0,1,0,0,0,0|3,0,0]=4 5766 B15R0.164 C=C(C)CCNCCCCCCCCCC 2230a_100000684558_100000730704 [0,1,0,0,0,0|2,0,0]=3 5767 B15R0.164 C=C(C)CCNCCCCCCCCCC 34a_100000684558_100000730704 [0,1,0,0,0,0|2,0,0]=3 5768 B15R0.164 C=C(C)CCNCCCCCCCCCO 2230a_100000078944_100000730704 [0,1,0,0,0,0|3,0,0]=4 5769 B15R0.164 C=C(C)CCNCCCCCCCCCO 34a_100000078944_100000730704 [0,1,0,0,0,0|3,0,0]=4 5770 B15R0.164 C=C(C)CCOCCCCCCCCCBr 34a_100009813782_100000730704 [0,1,0,0,0,0|3,0,0]=4 5771 B15R0.164 C=C(C)CCOCCCCCCCCCBr 7a_100009813782_100000730704 [0,1,0,0,0,0|3,0,0]=4 5772 B15R0.164 C=C(C)CCOCCCCCCCCCC 34a_100000210711_100000730704 [0,1,0,0,0,0|2,0,0]=3 5773 B15R0.164 C=C(C)CCOCCCCCCCCCC 34a_100000764851_100000210320 [0,1,0,0,0,0|2,0,0]=3 5774 B15R0.164 C=C(C)CCOCCCCCCCCCC 7a_100000210711_100000730704 [0,1,0,0,0,0|2,0,0]=3 5775 B15R0.164 C=C(C)CCOCCCCCCCCCCl 34a_100009868337_100000730704 [0,1,0,0,0,0|3,0,0]=4 5776 B15R0.164 C=C(C)CCOCCCCCCCCCCl 7a_100009868337_100000730704 [0,1,0,0,0,0|3,0,0]=4 5777 B15R0.164 C=C(C)CCOCCCCCCCCCN 34a_100000078944_100000730704 [0,1,0,0,0,0|3,0,0]=4 5778 B15R0.164 C=C(C)CCOCCCCCCCCCO 34a_100000764851_100009813782 [0,1,0,0,0,0|3,0,0]=4 5779 B15R0.164 C=C(C)CCSCCCCCCCCCC 62a_100000730704_100000210320 [0,1,0,0,0,0|2,0,0]=3 5780 B15R0.164 C=C(C)CCSCCCCCCCCCO 62a_100000730704_100009813782 [0,1,0,0,0,0|3,0,0]=4 5781 B15R0.164 C=C(C)CCSCCCCCCCCCO 62a_100009813782_100000730704 [0,1,0,0,0,0|3,0,0]=4 5782 B15R0.164 C=C(C)CNCCCCCCCCCCC 2230a_200011215754_100000748629 [0,1,0,0,0,0|2,0,0]=3 5783 B15R0.164 C=C(C)CNCCCCCCCCCCC 34a_200011215754_100000748629 [0,1,0,0,0,0|2,0,0]=3 5784 B15R0.164 C=C(C)CNCCCCCCCCCCO 2230a_100000066964_100000748629 [0,1,0,0,0,0|3,0,0]=4 5785 B15R0.164 C=C(C)CNCCCCCCCCCCO 34a_100000066964_100000748629 [0,1,0,0,0,0|3,0,0]=4 5786 B15R0.164 C=C(C)COCCCCCCCCCCBr 34a_100009813290_100000748629 [0,1,0,0,0,0|3,0,0]=4 5787 B15R0.164 C=C(C)COCCCCCCCCCCBr 7a_100009813290_100000748629 [0,1,0,0,0,0|3,0,0]=4 5788 B15R0.164 C=C(C)COCCCCCCCCCCC 34a_100000210245_100011215454 [0,1,0,0,0,0|2,0,0]=3 5789 B15R0.164 C=C(C)COCCCCCCCCCCC 34a_100000210809_100000748629 [0,1,0,0,0,0|2,0,0]=3 5790 B15R0.164 C=C(C)COCCCCCCCCCCC 7a_100000210809_100000748629 [0,1,0,0,0,0|2,0,0]=3 5791 B15R0.164 C=C(C)COCCCCCCCCCCCl 34a_200000033068_100000748629 [0,1,0,0,0,0|3,0,0]=4 5792 B15R0.164 C=C(C)COCCCCCCCCCCCl 7a_200000033068_100000748629 [0,1,0,0,0,0|3,0,0]=4 5793 B15R0.164 C=C(C)COCCCCCCCCCCN 34a_100000066964_100000748629 [0,1,0,0,0,0|3,0,0]=4 5794 B15R0.164 C=C(C)COCCCCCCCCCCO 34a_100000210245_100009813290 [0,1,0,0,0,0|3,0,0]=4 5795 B15R0.164 C=C(C)CSCCCCCCCCCCC 62a_100000748629_100011215454 [0,1,0,0,0,0|2,0,0]=3 5796 B15R0.164 C=C(C)CSCCCCCCCCCCO 62a_100000748629_200000033068 [0,1,0,0,0,0|3,0,0]=4 5797 B15R0.164 C=C(C)CSCCCCCCCCCCO 62a_100009813290_100000211660 [0,1,0,0,0,0|3,0,0]=4 5798 B15R0.164 C=C(F)CNCCCCCCCCCCC 2230a_200011215754_100009893438 [0,1,0,0,0,0|2,0,0]=3 5799 B15R0.164 C=C(F)CNCCCCCCCCCCC 34a_200011215754_100009893438 [0,1,0,0,0,0|2,0,0]=3 5800 B15R0.164 C=C(F)CNCCCCCCCCCCO 2230a_100000066964_100009893438 [0,1,0,0,0,0|3,0,0]=4 5801 B15R0.164 C=C(F)CNCCCCCCCCCCO 34a_100000066964_100009893438 [0,1,0,0,0,0|3,0,0]=4 5802 B15R0.164 C=C(F)COCCCCCCCCCCBr 34a_100009813290_100009893438 [0,1,0,0,0,0|3,0,0]=4 5803 B15R0.164 C=C(F)COCCCCCCCCCCBr 7a_100009813290_100000042424 [0,1,0,0,0,0|3,0,0]=4 5804 B15R0.164 C=C(F)COCCCCCCCCCCC 34a_100000210809_100009893438 [0,1,0,0,0,0|2,0,0]=3 5805 B15R0.164 C=C(F)COCCCCCCCCCCC 34a_200010262243_100011215454 [0,1,0,0,0,0|2,0,0]=3 5806 B15R0.164 C=C(F)COCCCCCCCCCCC 7a_100000210809_100000042424 [0,1,0,0,0,0|2,0,0]=3 5807 B15R0.164 C=C(F)COCCCCCCCCCCCl 34a_200000033068_100009893438 [0,1,0,0,0,0|3,0,0]=4 5808 B15R0.164 C=C(F)COCCCCCCCCCCCl 7a_200000033068_100000042424 [0,1,0,0,0,0|3,0,0]=4 5809 B15R0.164 C=C(F)COCCCCCCCCCCN 34a_100000066964_100009893438 [0,1,0,0,0,0|3,0,0]=4 5810 B15R0.164 C=C(F)COCCCCCCCCCCO 34a_200010262243_100009813290 [0,1,0,0,0,0|3,0,0]=4 5811 B15R0.164 C=C(F)CSCCCCCCCCCCC 62a_100000042424_100011215454 [0,1,0,0,0,0|2,0,0]=3 5812 B15R0.164 C=C(F)CSCCCCCCCCCCO 62a_100000042424_200000033068 [0,1,0,0,0,0|3,0,0]=4 5813 B15R0.164 C=C(F)CSCCCCCCCCCCO 62a_100009813290_100000042424 [0,1,0,0,0,0|3,0,0]=4 5814 B15R0.164 C=CCCCCCCCCCCCC(=O)C 1458a_100000070787_102130925996 [0,1,0,0,0,0|0,0,2]=3 5815 B15R0.164 C=CCCCCCCCCCCCN(C)C 2230a_100102631434_102130925996 [0,1,0,0,0,0|2,0,0]=3 5816 B15R0.164 C=CCCCCCCCCCCCN(C)C 269982a_100102631434_102130925996 [0,1,0,0,0,0|2,0,0]=3 5817 B15R0.164 C=CCCCCCCCCCCNC(C)C 2230a_100138425928_100011093070 [0,1,0,0,0,0|2,0,0]=3 5818 B15R0.164 C=CCCCCCCCCCCNC(C)C 34a_100138425928_100011093070 [0,1,0,0,0,0|2,0,0]=3 5819 B15R0.164 C=CCCCCCCCCCCOC(C)C 34a_100000212225_100011093070 [0,1,0,0,0,0|2,0,0]=3 5820 B15R0.164 C=CCCCCCCCCCCSC(C)C 62a_100000210206_100011093070 [0,1,0,0,0,0|2,0,0]=3 5821 B15R0.164 C=CCCCCCCCCCCSC(C)C 62a_100011093070_100000210206 [0,1,0,0,0,0|2,0,0]=3 5822 B15R0.164 C=CCCCCCCCCCNCC(=C)C 2230a_100000081888_100000748629 [0,1,0,0,0,0|2,0,1]=4 5823 B15R0.164 C=CCCCCCCCCCNCC(=C)C 34a_100000081888_100000748629 [0,1,0,0,0,0|2,0,1]=4 5824 B15R0.164 C=CCCCCCCCCCNCC(=O)N 2230a_100000081888_100000747473 [0,1,0,0,0,0|1,0,2]=4 5825 B15R0.164 C=CCCCCCCCCCNCC(=O)N 2230a_100000711301_100009814027 [0,1,0,0,0,0|1,0,2]=4 5826 B15R0.164 C=CCCCCCCCCCNCC(=O)N 34a_100000081888_100000187820 [0,1,0,0,0,0|1,0,2]=4 5827 B15R0.164 C=CCCCCCCCCCNCC(=O)O 269956a_100016091260_100009814027 [0,1,0,0,0,0|1,0,2]=4 5828 B15R0.164 C=CCCCCCCCCCNCC(=O)[O-] 34a_100000081888_100020667443 [0,1,0,0,0,0|1,0,2]=4 5829 B15R0.164 C=CCCCCCCCCCNCC(C)C 2230a_100000081888_100000210760 [0,1,0,0,0,0|2,0,0]=3 5830 B15R0.164 C=CCCCCCCCCCNCC(C)C 2230a_100000210953_100009814027 [0,1,0,0,0,0|2,0,0]=3 5831 B15R0.164 C=CCCCCCCCCCNCC(C)C 270004a_100000081888_100000210432 [0,1,0,0,0,0|2,0,0]=3 5832 B15R0.164 C=CCCCCCCCCCNCC(C)C 34a_100000081888_100000210624 [0,1,0,0,0,0|2,0,0]=3 5833 B15R0.164 C=CCCCCCCCCCNCC(C)C 34a_100000210953_100009814027 [0,1,0,0,0,0|2,0,0]=3 5834 B15R0.164 C=CCCCCCCCCCNCC(C)O 2230a_100000081888_100011218427 [0,1,0,0,0,0|2,0,0]=3 5835 B15R0.164 C=CCCCCCCCCCNCC(C)O 2230a_100000210904_100009814027 [0,1,0,0,0,0|2,0,0]=3 5836 B15R0.164 C=CCCCCCCCCCNCC(C)O 34a_100000081888_100011218427 [0,1,0,0,0,0|2,0,0]=3 5837 B15R0.164 C=CCCCCCCCCCNCC(C)O 34a_100000210904_100009814027 [0,1,0,0,0,0|2,0,0]=3 5838 B15R0.164 C=CCCCCCCCCCNCC(F)F 2230a_100000081888_100011934356 [0,1,0,0,0,0|3,0,0]=4 5839 B15R0.164 C=CCCCCCCCCCNCC(F)F 34a_100000081888_100011934356 [0,1,0,0,0,0|3,0,0]=4 5840 B15R0.164 C=CCCCCCCCCCNCC(F)F 34a_100000765723_100009814027 [0,1,0,0,0,0|3,0,0]=4 5841 B15R0.164 C=CCCCCCCCCCNC[C@@H](C)O 2230a_100000081888_100009817552 [0,1,0,0,0,0|2,0,0]=3 5842 B15R0.164 C=CCCCCCCCCCNC[C@@H](C)O 34a_100000081888_100009817552 [0,1,0,0,0,0|2,0,0]=3 5843 B15R0.164 C=CCCCCCCCCCOCC(=C)C 34a_100000038209_100000748629 [0,1,0,0,0,0|2,0,1]=4 5844 B15R0.164 C=CCCCCCCCCCOCC(=C)C 34a_100000210245_100009814027 [0,1,0,0,0,0|2,0,1]=4 5845 B15R0.164 C=CCCCCCCCCCOCC(=C)C 7a_100000038209_100000748629 [0,1,0,0,0,0|2,0,1]=4 5846 B15R0.164 C=CCCCCCCCCCOCC(=O)C 34a_100000211253_100009814027 [0,1,0,0,0,0|1,0,2]=4 5847 B15R0.164 C=CCCCCCCCCCOCC(=O)N 34a_100000038209_100000187820 [0,1,0,0,0,0|1,0,2]=4 5848 B15R0.164 C=CCCCCCCCCCOCC(=O)N 7a_100000038209_100000187820 [0,1,0,0,0,0|1,0,2]=4 5849 B15R0.164 C=CCCCCCCCCCOCC(=O)[O-] 34a_100000038209_100020667443 [0,1,0,0,0,0|1,0,2]=4 5850 B15R0.164 C=CCCCCCCCCCOCC(C)Br 34a_100012180447_100009814027 [0,1,0,0,0,0|2,0,0]=3 5851 B15R0.164 C=CCCCCCCCCCOCC(C)C 34a_100000038209_100000210624 [0,1,0,0,0,0|2,0,0]=3 5852 B15R0.164 C=CCCCCCCCCCOCC(C)C 34a_100000210257_100009814027 [0,1,0,0,0,0|2,0,0]=3 5853 B15R0.164 C=CCCCCCCCCCOCC(C)C 7a_100000038209_100000210760 [0,1,0,0,0,0|2,0,0]=3 5854 B15R0.164 C=CCCCCCCCCCOCC(C)F 34a_100015925927_100009814027 [0,1,0,0,0,0|2,0,0]=3 5855 B15R0.164 C=CCCCCCCCCCOCC(C)O 34a_100000038209_100011218427 [0,1,0,0,0,0|2,0,0]=3 5856 B15R0.164 C=CCCCCCCCCCOCC(C)O 7a_100000038209_100011218427 [0,1,0,0,0,0|2,0,0]=3 5857 B15R0.164 C=CCCCCCCCCCOCC(F)F 34a_100000038209_100011934356 [0,1,0,0,0,0|3,0,0]=4 5858 B15R0.164 C=CCCCCCCCCCOCC(F)F 34a_100000743014_100009814027 [0,1,0,0,0,0|3,0,0]=4 5859 B15R0.164 C=CCCCCCCCCCOCC(F)F 7a_100000038209_100011934356 [0,1,0,0,0,0|3,0,0]=4 5860 B15R0.164 C=CCCCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100009814027 [0,1,0,0,0,0|2,0,0]=3 5861 B15R0.164 C=CCCCCCCCCCOC[C@@H](C)N 34a_100000737577_100009814027 [0,1,0,0,0,0|2,0,0]=3 5862 B15R0.164 C=CCCCCCCCCCOC[C@@H](C)O 34a_100000038209_100009817552 [0,1,0,0,0,0|2,0,0]=3 5863 B15R0.164 C=CCCCCCCCCCOC[C@@H](C)O 7a_100000038209_100009817552 [0,1,0,0,0,0|2,0,0]=3 5864 B15R0.164 C=CCCCCCCCCCSCC(=C)C 62a_100000748629_100009814027 [0,1,0,0,0,0|2,0,1]=4 5865 B15R0.164 C=CCCCCCCCCCSCC(=C)C 62a_100009814027_100000211660 [0,1,0,0,0,0|2,0,1]=4 5866 B15R0.164 C=CCCCCCCCCCSCC(=O)N 62a_100000747473_100009814027 [0,1,0,0,0,0|1,0,2]=4 5867 B15R0.164 C=CCCCCCCCCCSCC(=O)N 62a_100009814027_100000747473 [0,1,0,0,0,0|1,0,2]=4 5868 B15R0.164 C=CCCCCCCCCCSCC(=O)[O-] 62a_100009814027_100020667443 [0,1,0,0,0,0|1,0,2]=4 5869 B15R0.164 C=CCCCCCCCCCSCC(=O)[O-] 62a_100020667443_100009814027 [0,1,0,0,0,0|1,0,2]=4 5870 B15R0.164 C=CCCCCCCCCCSCC(C)C 62a_100000210624_100009814027 [0,1,0,0,0,0|2,0,0]=3 5871 B15R0.164 C=CCCCCCCCCCSCC(C)C 62a_100009814027_100000210760 [0,1,0,0,0,0|2,0,0]=3 5872 B15R0.164 C=CCCCCCCCCCSCC(C)O 62a_100009814027_100011218427 [0,1,0,0,0,0|2,0,0]=3 5873 B15R0.164 C=CCCCCCCCCCSCC(C)O 62a_100011218427_100009814027 [0,1,0,0,0,0|2,0,0]=3 5874 B15R0.164 C=CCCCCCCCCCSCC(F)F 62a_100009814027_100011934356 [0,1,0,0,0,0|3,0,0]=4 5875 B15R0.164 C=CCCCCCCCCCSCC(F)F 62a_100011934356_100009814027 [0,1,0,0,0,0|3,0,0]=4 5876 B15R0.164 C=CCCCCCCCCCSC[C@@H](C)O 62a_100009814027_100009817552 [0,1,0,0,0,0|2,0,0]=3 5877 B15R0.164 C=CCCCCCCCCCSC[C@@H](C)O 62a_100009817552_100009814027 [0,1,0,0,0,0|2,0,0]=3 5878 B15R0.164 C=CCCCCCCCCNCCC(C)O 2230a_200000755665_100011933949 [0,1,0,0,0,0|2,0,0]=3 5879 B15R0.164 C=CCCCCCCCCOCCC(=C)C 34a_100000764851_100011933949 [0,1,0,0,0,0|2,0,1]=4 5880 B15R0.164 C=CCCCCCCCCOCCC(=C)C 34a_100011215194_100000730704 [0,1,0,0,0,0|2,0,1]=4 5881 B15R0.164 C=CCCCCCCCCOCCC(=C)C 7a_100011215194_100000730704 [0,1,0,0,0,0|2,0,1]=4 5882 B15R0.164 C=CCCCCCCCCOCCC(=O)C 34a_100000759926_100011933949 [0,1,0,0,0,0|1,0,2]=4 5883 B15R0.164 C=CCCCCCCCCOCCC(=O)C 7a_100000759926_100011933949 [0,1,0,0,0,0|1,0,2]=4 5884 B15R0.164 C=CCCCCCCCCOCCC(=O)C 7a_100011215194_100000053229 [0,1,0,0,0,0|1,0,2]=4 5885 B15R0.164 C=CCCCCCCCCOCCC(=O)N 34a_100000757172_100011933949 [0,1,0,0,0,0|1,0,2]=4 5886 B15R0.164 C=CCCCCCCCCOCCC(=O)N 34a_100011215194_100000731001 [0,1,0,0,0,0|1,0,2]=4 5887 B15R0.164 C=CCCCCCCCCOCCC(=O)N 7a_100000757172_100011933949 [0,1,0,0,0,0|1,0,2]=4 5888 B15R0.164 C=CCCCCCCCCOCCC(=O)N 7a_100011215194_100000744528 [0,1,0,0,0,0|1,0,2]=4 5889 B15R0.164 C=CCCCCCCCCOCCC(C)Br 34a_100009893172_100011933949 [0,1,0,0,0,0|2,0,0]=3 5890 B15R0.164 C=CCCCCCCCCOCCC(C)C 34a_100000210254_100011933949 [0,1,0,0,0,0|2,0,0]=3 5891 B15R0.164 C=CCCCCCCCCOCCC(C)C 34a_100011215194_100000210312 [0,1,0,0,0,0|2,0,0]=3 5892 B15R0.164 C=CCCCCCCCCOCCC(C)C 7a_100000210254_100011933949 [0,1,0,0,0,0|2,0,0]=3 5893 B15R0.164 C=CCCCCCCCCOCCC(C)C 7a_100011215194_100000210626 [0,1,0,0,0,0|2,0,0]=3 5894 B15R0.164 C=CCCCCCCCCOCCC(C)O 34a_100011215194_100012276601 [0,1,0,0,0,0|2,0,0]=3 5895 B15R0.164 C=CCCCCCCCCOCCC(C)O 7a_100011215194_100012276601 [0,1,0,0,0,0|2,0,0]=3 5896 B15R0.164 C=CCCCCCCCCOCCC(F)F 34a_100103093639_100011933949 [0,1,0,0,0,0|3,0,0]=4 5897 B15R0.164 C=CCCCCCCCCOCCN(C)C 7a_100011215194_100000755713 [0,1,0,0,0,0|3,0,0]=4 5898 B15R0.164 C=CCCCCCCCCOCC[C@@H](C)N 34a_100000706166_100011933949 [0,1,0,0,0,0|2,0,0]=3 5899 B15R0.164 C=CCCCCCCCCOCOC(C)C 34a_100011215194_100000709892 [0,1,0,0,0,0|3,0,0]=4 5900 B15R0.164 C=CCCCCCCCCSCCC(=C)C 62a_100000730704_100011933949 [0,1,0,0,0,0|2,0,1]=4 5901 B15R0.164 C=CCCCCCCCCSCCC(=C)C 62a_100011933949_100000730704 [0,1,0,0,0,0|2,0,1]=4 5902 B15R0.164 C=CCCCCCCCCSCCC(=O)C 62a_100000053229_100011933949 [0,1,0,0,0,0|1,0,2]=4 5903 B15R0.164 C=CCCCCCCCCSCCC(=O)C 62a_100011933949_100000053229 [0,1,0,0,0,0|1,0,2]=4 5904 B15R0.164 C=CCCCCCCCCSCCC(=O)N 62a_100000744528_100011933949 [0,1,0,0,0,0|1,0,2]=4 5905 B15R0.164 C=CCCCCCCCCSCCC(=O)N 62a_100011933949_100000744528 [0,1,0,0,0,0|1,0,2]=4 5906 B15R0.164 C=CCCCCCCCCSCCC(C)C 62a_100000210312_100011933949 [0,1,0,0,0,0|2,0,0]=3 5907 B15R0.164 C=CCCCCCCCCSCCC(C)C 62a_100011933949_100000210312 [0,1,0,0,0,0|2,0,0]=3 5908 B15R0.164 C=CCCCCCCCCSCCC(C)O 62a_100011933949_100012276601 [0,1,0,0,0,0|2,0,0]=3 5909 B15R0.164 C=CCCCCCCCCSCCC(C)O 62a_100012276601_100011933949 [0,1,0,0,0,0|2,0,0]=3 5910 B15R0.164 C=CCCCCCCCCSCCN(C)C 62a_100011933949_100000755713 [0,1,0,0,0,0|3,0,0]=4 5911 B15R0.164 C=CCCCCCCCCSCOC(C)C 62a_100000709892_100011933949 [0,1,0,0,0,0|3,0,0]=4 5912 B15R0.164 C=CCCCCCCCCSCOC(C)C 62a_100011933949_100000709892 [0,1,0,0,0,0|3,0,0]=4 5913 B15R0.164 C=CCCCCCCCNCCCC(=O)N 34a_100000739312_100012355270 [0,1,0,0,0,0|1,0,2]=4 5914 B15R0.164 C=CCCCCCCCNCCCC(C)C 2230a_200000737386_100012355270 [0,1,0,0,0,0|2,0,0]=3 5915 B15R0.164 C=CCCCCCCCNCCCC(C)C 34a_200000737386_100012355270 [0,1,0,0,0,0|2,0,0]=3 5916 B15R0.164 C=CCCCCCCCNCCCS(=O)C 2230a_200000753449_100012355270 [0,1,0,0,0,0|3,0,0]=4 5917 B15R0.164 C=CCCCCCCCNCCOC(C)C 2230a_100000701111_100012355270 [0,1,0,0,0,0|3,0,0]=4 5918 B15R0.164 C=CCCCCCCCNCCOC(C)C 34a_100000701111_100012355270 [0,1,0,0,0,0|3,0,0]=4 5919 B15R0.164 C=CCCCCCCCNCCSC(C)C 2230a_100000731138_100012355270 [0,1,0,0,0,0|3,0,0]=4 5920 B15R0.164 C=CCCCCCCCNCCSC(C)C 34a_100000731138_100012355270 [0,1,0,0,0,0|3,0,0]=4 5921 B15R0.164 C=CCCCCCCCOCCCC(=O)C 34a_100000730831_100000685027 [0,1,0,0,0,0|1,0,2]=4 5922 B15R0.164 C=CCCCCCCCOCCCC(=O)C 34a_100000759063_100012355270 [0,1,0,0,0,0|1,0,2]=4 5923 B15R0.164 C=CCCCCCCCOCCCC(=O)C 7a_100000730831_100011215641 [0,1,0,0,0,0|1,0,2]=4 5924 B15R0.164 C=CCCCCCCCOCCCC(=O)C 7a_100000759063_100012355270 [0,1,0,0,0,0|1,0,2]=4 5925 B15R0.164 C=CCCCCCCCOCCCC(=O)N 34a_100000730831_100102525003 [0,1,0,0,0,0|1,0,2]=4 5926 B15R0.164 C=CCCCCCCCOCCCC(=O)N 7a_100000730831_100102525003 [0,1,0,0,0,0|1,0,2]=4 5927 B15R0.164 C=CCCCCCCCOCCCC(C)C 34a_100000210774_100012355270 [0,1,0,0,0,0|2,0,0]=3 5928 B15R0.164 C=CCCCCCCCOCCCC(C)C 34a_100000730831_100011214892 [0,1,0,0,0,0|2,0,0]=3 5929 B15R0.164 C=CCCCCCCCOCCCC(C)C 7a_100000210774_100012355270 [0,1,0,0,0,0|2,0,0]=3 5930 B15R0.164 C=CCCCCCCCOCCCC(C)C 7a_100000730831_100011214892 [0,1,0,0,0,0|2,0,0]=3 5931 B15R0.164 C=CCCCCCCCOCCCC(C)O 34a_100000730831_200000718107 [0,1,0,0,0,0|2,0,0]=3 5932 B15R0.164 C=CCCCCCCCOCCCC(C)O 7a_100000730831_200000718107 [0,1,0,0,0,0|2,0,0]=3 5933 B15R0.164 C=CCCCCCCCOCCCN(C)C 7a_100000730831_100000757444 [0,1,0,0,0,0|3,0,0]=4 5934 B15R0.164 C=CCCCCCCCOCCNC(C)C 34a_100000224655_100012355270 [0,1,0,0,0,0|3,0,0]=4 5935 B15R0.164 C=CCCCCCCCOCCOC(C)C 34a_100000211219_100012355270 [0,1,0,0,0,0|3,0,0]=4 5936 B15R0.164 C=CCCCCCCCOCCOC(C)C 34a_100000730831_100000211751 [0,1,0,0,0,0|3,0,0]=4 5937 B15R0.164 C=CCCCCCCCOCCOC(C)C 7a_100000211219_100012355270 [0,1,0,0,0,0|3,0,0]=4 5938 B15R0.164 C=CCCCCCCCOCCOC(C)C 7a_100000730831_100000211751 [0,1,0,0,0,0|3,0,0]=4 5939 B15R0.164 C=CCCCCCCCOCCSC(C)C 34a_100000730831_100000730970 [0,1,0,0,0,0|3,0,0]=4 5940 B15R0.164 C=CCCCCCCCOCCSC(C)C 34a_200011212901_100012355270 [0,1,0,0,0,0|3,0,0]=4 5941 B15R0.164 C=CCCCCCCCOCCSC(C)C 7a_100000730831_100000730970 [0,1,0,0,0,0|3,0,0]=4 5942 B15R0.164 C=CCCCCCCCOCCSC(C)C 7a_200011212901_100012355270 [0,1,0,0,0,0|3,0,0]=4 5943 B15R0.164 C=CCCCCCCCSCCCC(=O)C 62a_100011215641_100012355270 [0,1,0,0,0,0|1,0,2]=4 5944 B15R0.164 C=CCCCCCCCSCCCC(=O)C 62a_100012355270_100011215641 [0,1,0,0,0,0|1,0,2]=4 5945 B15R0.164 C=CCCCCCCCSCCCC(=O)N 62a_100012355270_100102525003 [0,1,0,0,0,0|1,0,2]=4 5946 B15R0.164 C=CCCCCCCCSCCCC(=O)N 62a_100102525003_100012355270 [0,1,0,0,0,0|1,0,2]=4 5947 B15R0.164 C=CCCCCCCCSCCCC(C)C 62a_100011214892_100012355270 [0,1,0,0,0,0|2,0,0]=3 5948 B15R0.164 C=CCCCCCCCSCCCC(C)C 62a_100012355270_100011214892 [0,1,0,0,0,0|2,0,0]=3 5949 B15R0.164 C=CCCCCCCCSCCCC(C)O 62a_100012355270_200000718107 [0,1,0,0,0,0|2,0,0]=3 5950 B15R0.164 C=CCCCCCCCSCCCC(C)O 62a_200000718107_100012355270 [0,1,0,0,0,0|2,0,0]=3 5951 B15R0.164 C=CCCCCCCCSCCCN(C)C 62a_100012355270_100000757444 [0,1,0,0,0,0|3,0,0]=4 5952 B15R0.164 C=CCCCCCCCSCCOC(C)C 62a_100000211751_100012355270 [0,1,0,0,0,0|3,0,0]=4 5953 B15R0.164 C=CCCCCCCCSCCOC(C)C 62a_100012355270_100000211751 [0,1,0,0,0,0|3,0,0]=4 5954 B15R0.164 C=CCCCCCCCSCCSC(C)C 62a_100000730970_100012355270 [0,1,0,0,0,0|3,0,0]=4 5955 B15R0.164 C=CCCCCCCCSCCSC(C)C 62a_100012355270_100000730970 [0,1,0,0,0,0|3,0,0]=4 5956 B15R0.164 C=CCCCCCCNCCCCC(=O)N 34a_100000696515_100011215473 [0,1,0,0,0,0|1,0,2]=4 5957 B15R0.164 C=CCCCCCCNCCCOC(C)C 2230a_100000737246_100011215473 [0,1,0,0,0,0|3,0,0]=4 5958 B15R0.164 C=CCCCCCCNCCCOC(C)C 34a_100000737246_100011215473 [0,1,0,0,0,0|3,0,0]=4 5959 B15R0.164 C=CCCCCCCOCCCCC(=O)C 34a_200011216477_100009817362 [0,1,0,0,0,0|1,0,2]=4 5960 B15R0.164 C=CCCCCCCOCCCCC(=O)C 7a_200011216477_100000735457 [0,1,0,0,0,0|1,0,2]=4 5961 B15R0.164 C=CCCCCCCOCCCCC(=O)N 34a_100012022536_100011215473 [0,1,0,0,0,0|1,0,2]=4 5962 B15R0.164 C=CCCCCCCOCCCCC(=O)N 7a_100012022536_100011215473 [0,1,0,0,0,0|1,0,2]=4 5963 B15R0.164 C=CCCCCCCOCCCCC(C)C 34a_100011214890_100011215473 [0,1,0,0,0,0|2,0,0]=3 5964 B15R0.164 C=CCCCCCCOCCCCC(C)C 34a_200011216477_100011216152 [0,1,0,0,0,0|2,0,0]=3 5965 B15R0.164 C=CCCCCCCOCCCCC(C)C 7a_100011214890_100011215473 [0,1,0,0,0,0|2,0,0]=3 5966 B15R0.164 C=CCCCCCCOCCCCC(C)C 7a_200011216477_100011216152 [0,1,0,0,0,0|2,0,0]=3 5967 B15R0.164 C=CCCCCCCOCCCNC(C)C 34a_100000182298_100011215473 [0,1,0,0,0,0|3,0,0]=4 5968 B15R0.164 C=CCCCCCCOCCNCC(C)C 34a_100015185251_100011215473 [0,1,0,0,0,0|3,0,0]=4 5969 B15R0.164 C=CCCCCCCOCCOCC(C)C 34a_100000703358_100011215473 [0,1,0,0,0,0|3,0,0]=4 5970 B15R0.164 C=CCCCCCCOCCOCC(C)C 7a_100000703358_100011215473 [0,1,0,0,0,0|3,0,0]=4 5971 B15R0.164 C=CCCCCCCOCCSCC(C)C 34a_200000230437_100011215473 [0,1,0,0,0,0|3,0,0]=4 5972 B15R0.164 C=CCCCCCCOCCSCC(C)C 7a_200000230437_100011215473 [0,1,0,0,0,0|3,0,0]=4 5973 B15R0.164 C=CCCCCCCSCCCCC(=O)C 62a_100000735457_100011215473 [0,1,0,0,0,0|1,0,2]=4 5974 B15R0.164 C=CCCCCCCSCCCCC(=O)C 62a_100011215473_100000735457 [0,1,0,0,0,0|1,0,2]=4 5975 B15R0.164 C=CCCCCCCSCCCCC(C)C 62a_100011215473_100011216152 [0,1,0,0,0,0|2,0,0]=3 5976 B15R0.164 C=CCCCCCCSCCCCC(C)C 62a_100011216152_100011215473 [0,1,0,0,0,0|2,0,0]=3 5977 B15R0.164 C=CCCCCCCSCCCCN(C)C 62a_100011215473_100000690147 [0,1,0,0,0,0|3,0,0]=4 5978 B15R0.164 C=CCCCCCNCCCCCC(C)C 2230a_100011290863_100000700193 [0,1,0,0,0,0|2,0,0]=3 5979 B15R0.164 C=CCCCCCNCCCCCC(C)C 34a_100011290863_100000700193 [0,1,0,0,0,0|2,0,0]=3 5980 B15R0.164 C=CCCCCCNCCCOCC(C)C 2230a_100000205972_100000700193 [0,1,0,0,0,0|3,0,0]=4 5981 B15R0.164 C=CCCCCCNCCCOCC(C)C 34a_100000205972_100000700193 [0,1,0,0,0,0|3,0,0]=4 5982 B15R0.164 C=CCCCCCOCCCCCC(=O)N 34a_100000123541_100000700193 [0,1,0,0,0,0|1,0,2]=4 5983 B15R0.164 C=CCCCCCOCCCCCC(=O)N 34a_100011216702_100009817443 [0,1,0,0,0,0|1,0,2]=4 5984 B15R0.164 C=CCCCCCOCCCCCC(=O)N 7a_100000123541_100000700193 [0,1,0,0,0,0|1,0,2]=4 5985 B15R0.164 C=CCCCCCOCCCCCC(=O)N 7a_100011216702_100009817443 [0,1,0,0,0,0|1,0,2]=4 5986 B15R0.164 C=CCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000700193 [0,1,0,0,0,0|1,0,2]=4 5987 B15R0.164 C=CCCCCCOCCCCCC(C)C 34a_100011216702_100000210682 [0,1,0,0,0,0|2,0,0]=3 5988 B15R0.164 C=CCCCCCOCCCCCC(C)C 34a_100011995859_100000700193 [0,1,0,0,0,0|2,0,0]=3 5989 B15R0.164 C=CCCCCCOCCCCCC(C)C 7a_100011216702_100000210682 [0,1,0,0,0,0|2,0,0]=3 5990 B15R0.164 C=CCCCCCOCCCCCC(C)C 7a_100011995859_100000700193 [0,1,0,0,0,0|2,0,0]=3 5991 B15R0.164 C=CCCCCCOCCCCNC(C)C 34a_100011521146_100000700193 [0,1,0,0,0,0|3,0,0]=4 5992 B15R0.164 C=CCCCCCSCCCCCC(=O)N 62a_100000700193_100009817443 [0,1,0,0,0,0|1,0,2]=4 5993 B15R0.164 C=CCCCCCSCCCCCC(=O)N 62a_100009817443_100000700193 [0,1,0,0,0,0|1,0,2]=4 5994 B15R0.164 C=CCCCCCSCCCCCC(C)C 62a_100000210682_100000700193 [0,1,0,0,0,0|2,0,0]=3 5995 B15R0.164 C=CCCCCCSCCCCCC(C)C 62a_100000700193_100000210682 [0,1,0,0,0,0|2,0,0]=3 5996 B15R0.164 C=CCCCCNCCCCCCC(C)C 2230a_100000211014_100011215482 [0,1,0,0,0,0|2,0,0]=3 5997 B15R0.164 C=CCCCCNCCCCCCC(C)C 34a_100000211014_100011215482 [0,1,0,0,0,0|2,0,0]=3 5998 B15R0.164 C=CCCCCOCCCCCNC(C)C 34a_100011629493_100011215482 [0,1,0,0,0,0|3,0,0]=4 5999 B15R0.164 C=CCCCOCCCCCCCC(C)C 34a_200000210741_100000757094 [0,1,0,0,0,0|2,0,0]=3 6000 B15R0.164 C=CCCCOCCCCCCCC(C)C 7a_200000210741_100000757094 [0,1,0,0,0,0|2,0,0]=3 6001 B15R0.164 C=COCCCCOCCCCCC(C)C 34a_100000031558_100000210682 [0,1,0,0,0,0|3,0,0]=4 6002 B15R0.164 C=COCCCCOCCCCCC(C)C 7a_100000031558_100000210682 [0,1,0,0,0,0|3,0,0]=4 6003 B15R0.164 C=COCCOCCCCCCCC(C)C 34a_200000210741_100000039644 [0,1,0,0,0,0|3,0,0]=4 6004 B15R0.164 C=COCCOCCCCCCCC(C)C 7a_200000210741_100000039644 [0,1,0,0,0,0|3,0,0]=4 6005 B15R0.164 CC(=O)CCCCCCCCCCCCO 1458a_100000070787_100009813331 [0,1,0,0,0,0|1,0,0]=2 6006 B15R0.164 CC(=O)CCCCCCOCCCCCO 1458a_100000070787_200132310570 [0,1,0,0,0,0|2,0,0]=3 6007 B15R0.164 CC(=O)CCCCNCCCCCCCO 34a_100011996573_100009817362 [0,1,0,0,0,0|2,0,0]=3 6008 B15R0.164 CC(=O)CCCCNCCCOCCCO 34a_100011310245_100009817362 [0,1,0,0,0,0|3,0,0]=4 6009 B15R0.164 CC(=O)CCCCOCCCCCCCBr 34a_100000760002_100009817362 [0,1,0,0,0,0|2,0,0]=3 6010 B15R0.164 CC(=O)CCCCOCCCCCCCBr 7a_100000760002_100000735457 [0,1,0,0,0,0|2,0,0]=3 6011 B15R0.164 CC(=O)CCCCOCCCCCCCN 34a_100011996573_100009817362 [0,1,0,0,0,0|2,0,0]=3 6012 B15R0.164 CC(=O)CCCCOCCCOCCCN 34a_100011310245_100009817362 [0,1,0,0,0,0|3,0,0]=4 6013 B15R0.164 CC(=O)CCCCSCCCCCCC#N 62a_100000735457_100009813337 [0,1,0,0,0,0|2,0,1]=4 6014 B15R0.164 CC(=O)CCCCSCCCCCCC#N 62a_100009813337_100000735457 [0,1,0,0,0,0|2,0,1]=4 6015 B15R0.164 CC(=O)CCCCSCCCCCCCO 62a_100000735457_100000760002 [0,1,0,0,0,0|2,0,0]=3 6016 B15R0.164 CC(=O)CCCCSCCCCCCCO 62a_100000760002_100000735457 [0,1,0,0,0,0|2,0,0]=3 6017 B15R0.164 CC(=O)CCCNCCCCCCCCO 34a_102515433106_100000685027 [0,1,0,0,0,0|2,0,0]=3 6018 B15R0.164 CC(=O)CCCOCCCCCCCCBr 34a_100009813846_100000685027 [0,1,0,0,0,0|2,0,0]=3 6019 B15R0.164 CC(=O)CCCOCCCCCCCCBr 7a_100009813846_100011215641 [0,1,0,0,0,0|2,0,0]=3 6020 B15R0.164 CC(=O)CCCOCCCCCCCCCl 34a_100000033203_100000685027 [0,1,0,0,0,0|2,0,0]=3 6021 B15R0.164 CC(=O)CCCOCCCCCCCCCl 7a_100000033203_100011215641 [0,1,0,0,0,0|2,0,0]=3 6022 B15R0.164 CC(=O)CCCOCCCCCCCCN 34a_102515433106_100000685027 [0,1,0,0,0,0|2,0,0]=3 6023 B15R0.164 CC(=O)CCCOCCCCCCCCO 34a_100000759063_100000033203 [0,1,0,0,0,0|2,0,0]=3 6024 B15R0.164 CC(=O)CCCOCCCCCCCCO 7a_100000759063_100000033203 [0,1,0,0,0,0|2,0,0]=3 6025 B15R0.164 CC(=O)CCCOCCCCCNCCN 34a_103619048469_100000685027 [0,1,0,0,0,0|3,0,0]=4 6026 B15R0.164 CC(=O)CCCSCCCCCCCCO 62a_100000033203_100011215641 [0,1,0,0,0,0|2,0,0]=3 6027 B15R0.164 CC(=O)CCCSCCCCCCCCO 62a_100011215641_100000033203 [0,1,0,0,0,0|2,0,0]=3 6028 B15R0.164 CC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000053229 [0,1,0,0,0,0|2,0,0]=3 6029 B15R0.164 CC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000053229 [0,1,0,0,0,0|2,0,0]=3 6030 B15R0.164 CC(=O)CCOCCCCCCCCCO 34a_100000759926_100009813782 [0,1,0,0,0,0|2,0,0]=3 6031 B15R0.164 CC(=O)CCOCCCCCCCCCO 7a_100000759926_100009813782 [0,1,0,0,0,0|2,0,0]=3 6032 B15R0.164 CC(=O)CCSCCCCCCCCCO 62a_100000053229_100009813782 [0,1,0,0,0,0|2,0,0]=3 6033 B15R0.164 CC(=O)CCSCCCCCCCCCO 62a_100009813782_100000053229 [0,1,0,0,0,0|2,0,0]=3 6034 B15R0.164 CC(=O)COCCCCCCCCCCO 34a_100000211253_100009813290 [0,1,0,0,0,0|2,0,0]=3 6035 B15R0.164 CC(=O)NCCCCCCNCCCC=O 2230a_200011996284_200011292268 [0,1,0,0,0,0|2,0,1]=4 6036 B15R0.164 CC(=O)NCCCCCCNCCCCF 2230a_200011996284_100000729493 [0,1,0,0,0,0|3,0,0]=4 6037 B15R0.164 CC(=O)NCCCCCCNCCCCF 34a_200011996284_100000729493 [0,1,0,0,0,0|3,0,0]=4 6038 B15R0.164 CC(=O)NCCCCCCNCCCCO 2230a_200011996284_100000210776 [0,1,0,0,0,0|3,0,0]=4 6039 B15R0.164 CC(=O)NCCCCCCNCCCCO 34a_200011996284_100011216708 [0,1,0,0,0,0|3,0,0]=4 6040 B15R0.164 CC(=O)NCCCCCNCCCCC=O 2230a_200012022750_100000139335 [0,1,0,0,0,0|2,0,1]=4 6041 B15R0.164 CC(=O)NCCCCCNCCCCCF 2230a_200012022750_100000729378 [0,1,0,0,0,0|3,0,0]=4 6042 B15R0.164 CC(=O)NCCCCCNCCCCCF 34a_200012022750_100000729378 [0,1,0,0,0,0|3,0,0]=4 6043 B15R0.164 CC(=O)NCCCCCNCCCCCO 2230a_200012022750_100000746330 [0,1,0,0,0,0|3,0,0]=4 6044 B15R0.164 CC(=O)NCCCCCNCCCCCO 34a_200012022750_100000746330 [0,1,0,0,0,0|3,0,0]=4 6045 B15R0.164 CC(=O)NCCCCNCCCCCC=O 2230a_200011368371_100000139337 [0,1,0,0,0,0|2,0,1]=4 6046 B15R0.164 CC(=O)NCCCCNCCCCCCF 2230a_200011368371_100015922095 [0,1,0,0,0,0|3,0,0]=4 6047 B15R0.164 CC(=O)NCCCCNCCCCCCF 34a_200011368371_100015922095 [0,1,0,0,0,0|3,0,0]=4 6048 B15R0.164 CC(=O)NCCCCNCCCCCCO 2230a_200011368371_100000766143 [0,1,0,0,0,0|3,0,0]=4 6049 B15R0.164 CC(=O)NCCCCNCCCCCCO 34a_200011368371_100000766143 [0,1,0,0,0,0|3,0,0]=4 6050 B15R0.164 CC(=O)NCCCNCCCCCCCO 34a_100000736810_100000760002 [0,1,0,0,0,0|3,0,0]=4 6051 B15R0.164 CC(=O)NCCCOCCCCCCCO 34a_100000752032_100000760002 [0,1,0,0,0,0|3,0,0]=4 6052 B15R0.164 CC(=O)NCCNCCCCCCCCO 2230a_100000209853_100000033203 [0,1,0,0,0,0|3,0,0]=4 6053 B15R0.164 CC(=O)NCCNCCCCCCCCO 2230a_102515433106_100000189650 [0,1,0,0,0,0|3,0,0]=4 6054 B15R0.164 CC(=O)NCCOCCCCCCCCBr 7a_100009813846_100000189650 [0,1,0,0,0,0|3,0,0]=4 6055 B15R0.164 CC(=O)NCCOCCCCCCCCCl 7a_100000033203_100000189650 [0,1,0,0,0,0|3,0,0]=4 6056 B15R0.164 CC(=O)NCCOCCCCCCCCO 34a_100000158858_100000033203 [0,1,0,0,0,0|3,0,0]=4 6057 B15R0.164 CC(=O)NCCSCCCCCCCCO 62a_100000033203_100000189650 [0,1,0,0,0,0|3,0,0]=4 6058 B15R0.164 CC(=O)NCCSCCCCCCCCO 62a_100000189650_100000033203 [0,1,0,0,0,0|3,0,0]=4 6059 B15R0.164 CC(=O)OCCCCCNCCCCCO 2230a_100000762737_100009813381 [0,1,0,0,0,0|3,0,0]=4 6060 B15R0.164 CC(=O)OCCCCCNCCCCCO 34a_100000762737_100000033007 [0,1,0,0,0,0|3,0,0]=4 6061 B15R0.164 CC(=O)OCCCCCOCCCCCBr 34a_100000746331_100000033007 [0,1,0,0,0,0|3,0,0]=4 6062 B15R0.164 CC(=O)OCCCCCOCCCCCBr 7a_100000746331_100000033007 [0,1,0,0,0,0|3,0,0]=4 6063 B15R0.164 CC(=O)OCCCCCOCCCCCCl 34a_100000746330_100000033007 [0,1,0,0,0,0|3,0,0]=4 6064 B15R0.164 CC(=O)OCCCCCOCCCCCCl 7a_100000746330_100000033007 [0,1,0,0,0,0|3,0,0]=4 6065 B15R0.164 CC(=O)OCCCCCOCCCCCI 34a_200012148887_100000033007 [0,1,0,0,0,0|3,0,0]=4 6066 B15R0.164 CC(=O)OCCCCCOCCCCCI 7a_200012148887_100000033007 [0,1,0,0,0,0|3,0,0]=4 6067 B15R0.164 CC(=O)OCCCCCOCCCCCN 34a_100000762737_100000033007 [0,1,0,0,0,0|3,0,0]=4 6068 B15R0.164 CC(=O)OCCCCCSCCCCC=O 62a_100000033007_100000139335 [0,1,0,0,0,0|2,0,1]=4 6069 B15R0.164 CC(=O)OCCCCCSCCCCC=O 62a_100000139335_100000033007 [0,1,0,0,0,0|2,0,1]=4 6070 B15R0.164 CC(=O)OCCCCCSCCCCCF 62a_100000033007_100000729378 [0,1,0,0,0,0|3,0,0]=4 6071 B15R0.164 CC(=O)OCCCCCSCCCCCF 62a_100000729378_100000033007 [0,1,0,0,0,0|3,0,0]=4 6072 B15R0.164 CC(=O)OCCCCCSCCCCCO 62a_100000033007_100000746330 [0,1,0,0,0,0|3,0,0]=4 6073 B15R0.164 CC(=O)OCCCCCSCCCCCO 62a_100000746330_100000033007 [0,1,0,0,0,0|3,0,0]=4 6074 B15R0.164 CC(=O)OCCCCNCCCCCCO 34a_100000686447_100000033659 [0,1,0,0,0,0|3,0,0]=4 6075 B15R0.164 CC(=O)OCCCCOCCCCCC=O 7a_100000073216_100000139337 [0,1,0,0,0,0|2,0,1]=4 6076 B15R0.164 CC(=O)OCCCCOCCCCCCBr 34a_100011215345_100000033659 [0,1,0,0,0,0|3,0,0]=4 6077 B15R0.164 CC(=O)OCCCCOCCCCCCBr 7a_100011215345_100000033659 [0,1,0,0,0,0|3,0,0]=4 6078 B15R0.164 CC(=O)OCCCCOCCCCCCCl 34a_100000766143_100000033659 [0,1,0,0,0,0|3,0,0]=4 6079 B15R0.164 CC(=O)OCCCCOCCCCCCCl 7a_100000766143_100000033659 [0,1,0,0,0,0|3,0,0]=4 6080 B15R0.164 CC(=O)OCCCCOCCCCCCF 34a_100000073216_100015922095 [0,1,0,0,0,0|3,0,0]=4 6081 B15R0.164 CC(=O)OCCCCOCCCCCCF 34a_100000732779_100000033659 [0,1,0,0,0,0|3,0,0]=4 6082 B15R0.164 CC(=O)OCCCCOCCCCCCF 7a_100000073216_100015922095 [0,1,0,0,0,0|3,0,0]=4 6083 B15R0.164 CC(=O)OCCCCOCCCCCCF 7a_100000732779_100000033659 [0,1,0,0,0,0|3,0,0]=4 6084 B15R0.164 CC(=O)OCCCCOCCCCCCN 34a_100000686447_100000033659 [0,1,0,0,0,0|3,0,0]=4 6085 B15R0.164 CC(=O)OCCCCOCCCCCCO 34a_100000073216_100000766143 [0,1,0,0,0,0|3,0,0]=4 6086 B15R0.164 CC(=O)OCCCCOCCCCCCO 7a_100000073216_100000766143 [0,1,0,0,0,0|3,0,0]=4 6087 B15R0.164 CC(=O)OCCCCSCCCCCC=O 62a_100000033659_100000139337 [0,1,0,0,0,0|2,0,1]=4 6088 B15R0.164 CC(=O)OCCCCSCCCCCC=O 62a_100000139337_100000033659 [0,1,0,0,0,0|2,0,1]=4 6089 B15R0.164 CC(=O)OCCCCSCCCCCCF 62a_100000033659_100015922095 [0,1,0,0,0,0|3,0,0]=4 6090 B15R0.164 CC(=O)OCCCCSCCCCCCF 62a_100015922095_100000033659 [0,1,0,0,0,0|3,0,0]=4 6091 B15R0.164 CC(=O)OCCCCSCCCCCCO 62a_100000033659_100000766143 [0,1,0,0,0,0|3,0,0]=4 6092 B15R0.164 CC(=O)OCCCCSCCCCCCO 62a_100000766143_100000033659 [0,1,0,0,0,0|3,0,0]=4 6093 B15R0.164 CC(=O)OCCCNCCCCCCCO 34a_100011996573_100000042594 [0,1,0,0,0,0|3,0,0]=4 6094 B15R0.164 CC(=O)OCCCOCCCCCCCBr 34a_100000760002_100000042594 [0,1,0,0,0,0|3,0,0]=4 6095 B15R0.164 CC(=O)OCCCOCCCCCCCBr 7a_100000760002_100000042594 [0,1,0,0,0,0|3,0,0]=4 6096 B15R0.164 CC(=O)OCCCOCCCCCCCN 34a_100011996573_100000042594 [0,1,0,0,0,0|3,0,0]=4 6097 B15R0.164 CC(=O)OCCCSCCCCCCCO 62a_100000042594_100000760002 [0,1,0,0,0,0|3,0,0]=4 6098 B15R0.164 CC(=O)OCCCSCCCCCCCO 62a_100000760002_100000042594 [0,1,0,0,0,0|3,0,0]=4 6099 B15R0.164 CC(=O)OCCNCCCCCCCCO 34a_102515433106_100009814007 [0,1,0,0,0,0|3,0,0]=4 6100 B15R0.164 CC(=O)OCCOCCCCCCCCBr 34a_100009813846_100009814007 [0,1,0,0,0,0|3,0,0]=4 6101 B15R0.164 CC(=O)OCCOCCCCCCCCBr 7a_100009813846_100009814007 [0,1,0,0,0,0|3,0,0]=4 6102 B15R0.164 CC(=O)OCCOCCCCCCCCCl 34a_100000033203_100009814007 [0,1,0,0,0,0|3,0,0]=4 6103 B15R0.164 CC(=O)OCCOCCCCCCCCCl 7a_100000033203_100009814007 [0,1,0,0,0,0|3,0,0]=4 6104 B15R0.164 CC(=O)OCCOCCCCCCCCN 34a_102515433106_100009814007 [0,1,0,0,0,0|3,0,0]=4 6105 B15R0.164 CC(=O)OCCSCCCCCCCCO 62a_100000033203_100009814007 [0,1,0,0,0,0|3,0,0]=4 6106 B15R0.164 CC(=O)OCCSCCCCCCCCO 62a_100009814007_100000033203 [0,1,0,0,0,0|3,0,0]=4 6107 B15R0.164 CC(=O)OCNCCCCCCCCCO 34a_100000078944_100009813279 [0,1,0,0,0,0|3,0,0]=4 6108 B15R0.164 CC(=O)OCOCCCCCCCCCBr 34a_100009813782_100009813279 [0,1,0,0,0,0|3,0,0]=4 6109 B15R0.164 CC(=O)OCOCCCCCCCCCCl 34a_100009868337_100009813279 [0,1,0,0,0,0|3,0,0]=4 6110 B15R0.164 CC(=O)OCOCCCCCCCCCN 34a_100000078944_100009813279 [0,1,0,0,0,0|3,0,0]=4 6111 B15R0.164 CC(=O)OCSCCCCCCCCCO 62a_100000076356_100009813782 [0,1,0,0,0,0|3,0,0]=4 6112 B15R0.164 CC(=O)OCSCCCCCCCCCO 62a_100009813782_100000076356 [0,1,0,0,0,0|3,0,0]=4 6113 B15R0.164 CC(=O)SCCCCNCCCCCCO 2230a_100000686447_200010402107 [0,1,0,0,0,0|3,0,0]=4 6114 B15R0.164 CC(=O)SCCCCNCCCCCCO 34a_100000686447_200010402107 [0,1,0,0,0,0|3,0,0]=4 6115 B15R0.164 CC(=O)SCCCCOCCCCCCBr 34a_100011215345_200010402107 [0,1,0,0,0,0|3,0,0]=4 6116 B15R0.164 CC(=O)SCCCCOCCCCCCBr 7a_100011215345_200010402107 [0,1,0,0,0,0|3,0,0]=4 6117 B15R0.164 CC(=O)SCCCCOCCCCCCCl 34a_100000766143_200010402107 [0,1,0,0,0,0|3,0,0]=4 6118 B15R0.164 CC(=O)SCCCCOCCCCCCCl 7a_100000766143_200010402107 [0,1,0,0,0,0|3,0,0]=4 6119 B15R0.164 CC(=O)SCCCCOCCCCCCF 34a_100000732779_200010402107 [0,1,0,0,0,0|3,0,0]=4 6120 B15R0.164 CC(=O)SCCCCOCCCCCCF 7a_100000732779_200010402107 [0,1,0,0,0,0|3,0,0]=4 6121 B15R0.164 CC(=O)SCCCCOCCCCCCN 34a_100000686447_200010402107 [0,1,0,0,0,0|3,0,0]=4 6122 B15R0.164 CC(=O)SCCCCSCCCCCC=O 62a_100000139337_200010402107 [0,1,0,0,0,0|2,0,1]=4 6123 B15R0.164 CC(=O)SCCCCSCCCCCC=O 62a_200010402107_100000139337 [0,1,0,0,0,0|2,0,1]=4 6124 B15R0.164 CC(=O)SCCCCSCCCCCCF 62a_100015922095_200010402107 [0,1,0,0,0,0|3,0,0]=4 6125 B15R0.164 CC(=O)SCCCCSCCCCCCF 62a_200010402107_100015922095 [0,1,0,0,0,0|3,0,0]=4 6126 B15R0.164 CC(=O)SCCCCSCCCCCCO 62a_100000766143_200010402107 [0,1,0,0,0,0|3,0,0]=4 6127 B15R0.164 CC(=O)SCCCCSCCCCCCO 62a_200010402107_100000766143 [0,1,0,0,0,0|3,0,0]=4 6128 B15R0.164 CC(=O)SCCCNCCCCCCCO 2230a_100011996573_100000038929 [0,1,0,0,0,0|3,0,0]=4 6129 B15R0.164 CC(=O)SCCCNCCCCCCCO 34a_100011996573_100000038929 [0,1,0,0,0,0|3,0,0]=4 6130 B15R0.164 CC(=O)SCCCOCCCCCCCBr 34a_100000760002_100000038929 [0,1,0,0,0,0|3,0,0]=4 6131 B15R0.164 CC(=O)SCCCOCCCCCCCBr 7a_100000760002_100000038929 [0,1,0,0,0,0|3,0,0]=4 6132 B15R0.164 CC(=O)SCCCOCCCCCCCN 34a_100011996573_100000038929 [0,1,0,0,0,0|3,0,0]=4 6133 B15R0.164 CC(=O)SCCCSCCCCCCCO 62a_100000038929_100000760002 [0,1,0,0,0,0|3,0,0]=4 6134 B15R0.164 CC(=O)SCCCSCCCCCCCO 62a_100000760002_100000038929 [0,1,0,0,0,0|3,0,0]=4 6135 B15R0.164 CC(Br)CCOCCCCCCCCCO 34a_100009893172_100009813782 [0,1,0,0,0,0|1,0,2]=4 6136 B15R0.164 CC(Br)COCCCCCCCCCCO 34a_100012180447_100009813290 [0,1,0,0,0,0|1,0,2]=4 6137 B15R0.164 CC(C)CCCCCCCOCCCC#N 7a_200000210741_100000687738 [0,1,0,0,0,0|2,0,1]=4 6138 B15R0.164 CC(C)CCCCCCCOCCCC=O 7a_200000210741_200011292268 [0,1,0,0,0,0|1,0,0]=2 6139 B15R0.164 CC(C)CCCCCCCOCCCCF 34a_200000210741_100000729493 [0,1,0,0,0,0|2,0,1]=4 6140 B15R0.164 CC(C)CCCCCCCOCCCCF 7a_200000210741_100000729493 [0,1,0,0,0,0|2,0,1]=4 6141 B15R0.164 CC(C)CCCCCCCOCCCCO 34a_200000210741_100011216708 [0,1,0,0,0,0|1,0,2]=4 6142 B15R0.164 CC(C)CCCCCCCOCCCCO 7a_200000210741_100000210776 [0,1,0,0,0,0|1,0,2]=4 6143 B15R0.164 CC(C)CCCCCCNCCCCC#N 2230a_100000211014_100000211819 [0,1,0,0,0,0|2,0,1]=4 6144 B15R0.164 CC(C)CCCCCCNCCCCC=O 2230a_100000211014_100000139335 [0,1,0,0,0,0|1,0,0]=2 6145 B15R0.164 CC(C)CCCCCCNCCCCCF 2230a_100000211014_100000729378 [0,1,0,0,0,0|2,0,1]=4 6146 B15R0.164 CC(C)CCCCCCNCCCCCF 34a_100000211014_100000729378 [0,1,0,0,0,0|2,0,1]=4 6147 B15R0.164 CC(C)CCCCCCNCCCCCO 2230a_100000211014_100000746330 [0,1,0,0,0,0|1,0,2]=4 6148 B15R0.164 CC(C)CCCCCCNCCCCCO 34a_100000211014_100000746330 [0,1,0,0,0,0|1,0,2]=4 6149 B15R0.164 CC(C)CCCCCNCCCCCC#N 2230a_100011290863_100009813376 [0,1,0,0,0,0|2,0,1]=4 6150 B15R0.164 CC(C)CCCCCNCCCCCC=O 2230a_100011290863_100000139337 [0,1,0,0,0,0|1,0,0]=2 6151 B15R0.164 CC(C)CCCCCNCCCCCCF 2230a_100011290863_100015922095 [0,1,0,0,0,0|2,0,1]=4 6152 B15R0.164 CC(C)CCCCCNCCCCCCF 34a_100011290863_100015922095 [0,1,0,0,0,0|2,0,1]=4 6153 B15R0.164 CC(C)CCCCCNCCCCCCO 2230a_100000686447_100000210682 [0,1,0,0,0,0|1,0,2]=4 6154 B15R0.164 CC(C)CCCCCNCCCCCCO 2230a_100011290863_100000766143 [0,1,0,0,0,0|1,0,2]=4 6155 B15R0.164 CC(C)CCCCCNCCCCCCO 34a_100000686447_100000210682 [0,1,0,0,0,0|1,0,2]=4 6156 B15R0.164 CC(C)CCCCCNCCCCCCO 34a_100011290863_100000766143 [0,1,0,0,0,0|1,0,2]=4 6157 B15R0.164 CC(C)CCCCCOCCCCCC#N 7a_100011995859_100009813376 [0,1,0,0,0,0|2,0,1]=4 6158 B15R0.164 CC(C)CCCCCOCCCCCC=O 7a_100011995859_100000139337 [0,1,0,0,0,0|1,0,0]=2 6159 B15R0.164 CC(C)CCCCCOCCCCCCBr 34a_100011215345_100000210682 [0,1,0,0,0,0|2,0,1]=4 6160 B15R0.164 CC(C)CCCCCOCCCCCCBr 7a_100011215345_100000210682 [0,1,0,0,0,0|2,0,1]=4 6161 B15R0.164 CC(C)CCCCCOCCCCCCCl 34a_100000766143_100000210682 [0,1,0,0,0,0|2,0,1]=4 6162 B15R0.164 CC(C)CCCCCOCCCCCCCl 7a_100000766143_100000210682 [0,1,0,0,0,0|2,0,1]=4 6163 B15R0.164 CC(C)CCCCCOCCCCCCF 34a_100000732779_100000210682 [0,1,0,0,0,0|2,0,1]=4 6164 B15R0.164 CC(C)CCCCCOCCCCCCF 34a_100011995859_100015922095 [0,1,0,0,0,0|2,0,1]=4 6165 B15R0.164 CC(C)CCCCCOCCCCCCF 7a_100000732779_100000210682 [0,1,0,0,0,0|2,0,1]=4 6166 B15R0.164 CC(C)CCCCCOCCCCCCF 7a_100011995859_100015922095 [0,1,0,0,0,0|2,0,1]=4 6167 B15R0.164 CC(C)CCCCCOCCCCCCN 34a_100000686447_100000210682 [0,1,0,0,0,0|2,0,1]=4 6168 B15R0.164 CC(C)CCCCCOCCCCCCO 34a_100011995859_100000766143 [0,1,0,0,0,0|1,0,2]=4 6169 B15R0.164 CC(C)CCCCCOCCCCCCO 7a_100011995859_100000766143 [0,1,0,0,0,0|1,0,2]=4 6170 B15R0.164 CC(C)CCCCCSCCCCCC#N 62a_100000210682_100009813376 [0,1,0,0,0,0|2,0,1]=4 6171 B15R0.164 CC(C)CCCCCSCCCCCC#N 62a_100009813376_100000210682 [0,1,0,0,0,0|2,0,1]=4 6172 B15R0.164 CC(C)CCCCCSCCCCCC=O 62a_100000139337_100000210682 [0,1,0,0,0,0|1,0,0]=2 6173 B15R0.164 CC(C)CCCCCSCCCCCC=O 62a_100000210682_100000139337 [0,1,0,0,0,0|1,0,0]=2 6174 B15R0.164 CC(C)CCCCCSCCCCCCF 62a_100000210682_100015922095 [0,1,0,0,0,0|2,0,1]=4 6175 B15R0.164 CC(C)CCCCCSCCCCCCF 62a_100015922095_100000210682 [0,1,0,0,0,0|2,0,1]=4 6176 B15R0.164 CC(C)CCCCCSCCCCCCO 62a_100000210682_100000766143 [0,1,0,0,0,0|1,0,2]=4 6177 B15R0.164 CC(C)CCCCCSCCCCCCO 62a_100000766143_100000210682 [0,1,0,0,0,0|1,0,2]=4 6178 B15R0.164 CC(C)CCCCNCCCCCCCO 2230a_100011996573_100011216152 [0,1,0,0,0,0|1,0,2]=4 6179 B15R0.164 CC(C)CCCCNCCCCCCCO 34a_100011996573_100011216152 [0,1,0,0,0,0|1,0,2]=4 6180 B15R0.164 CC(C)CCCCOCCCCCCC#N 7a_100011214890_100009813337 [0,1,0,0,0,0|2,0,1]=4 6181 B15R0.164 CC(C)CCCCOCCCCCCCBr 34a_100000760002_100011216152 [0,1,0,0,0,0|2,0,1]=4 6182 B15R0.164 CC(C)CCCCOCCCCCCCBr 7a_100000760002_100011216152 [0,1,0,0,0,0|2,0,1]=4 6183 B15R0.164 CC(C)CCCCOCCCCCCCN 34a_100011996573_100011216152 [0,1,0,0,0,0|2,0,1]=4 6184 B15R0.164 CC(C)CCCCOCCCCCCCO 34a_100011214890_100000760002 [0,1,0,0,0,0|1,0,2]=4 6185 B15R0.164 CC(C)CCCCOCCCCCCCO 7a_100011214890_100000760002 [0,1,0,0,0,0|1,0,2]=4 6186 B15R0.164 CC(C)CCCCSCCCCCCC#N 62a_100009813337_100011216152 [0,1,0,0,0,0|2,0,1]=4 6187 B15R0.164 CC(C)CCCCSCCCCCCC#N 62a_100011216152_100009813337 [0,1,0,0,0,0|2,0,1]=4 6188 B15R0.164 CC(C)CCCCSCCCCCCCO 62a_100000760002_100011216152 [0,1,0,0,0,0|1,0,2]=4 6189 B15R0.164 CC(C)CCCCSCCCCCCCO 62a_100011216152_100000760002 [0,1,0,0,0,0|1,0,2]=4 6190 B15R0.164 CC(C)CCCNCCCCCCCCO 2230a_102515433106_100011214892 [0,1,0,0,0,0|1,0,2]=4 6191 B15R0.164 CC(C)CCCNCCCCCCCCO 2230a_200000737386_100000033203 [0,1,0,0,0,0|1,0,2]=4 6192 B15R0.164 CC(C)CCCNCCCCCCCCO 34a_102515433106_100011214892 [0,1,0,0,0,0|1,0,2]=4 6193 B15R0.164 CC(C)CCCNCCCCCCCCO 34a_200000737386_100000033203 [0,1,0,0,0,0|1,0,2]=4 6194 B15R0.164 CC(C)CCCOCCCCCCCCBr 34a_100009813846_100011214892 [0,1,0,0,0,0|2,0,1]=4 6195 B15R0.164 CC(C)CCCOCCCCCCCCBr 7a_100009813846_100011214892 [0,1,0,0,0,0|2,0,1]=4 6196 B15R0.164 CC(C)CCCOCCCCCCCCCl 34a_100000033203_100011214892 [0,1,0,0,0,0|2,0,1]=4 6197 B15R0.164 CC(C)CCCOCCCCCCCCCl 7a_100000033203_100011214892 [0,1,0,0,0,0|2,0,1]=4 6198 B15R0.164 CC(C)CCCOCCCCCCCCN 34a_102515433106_100011214892 [0,1,0,0,0,0|2,0,1]=4 6199 B15R0.164 CC(C)CCCOCCCCCCCCO 34a_100000210774_100000033203 [0,1,0,0,0,0|1,0,2]=4 6200 B15R0.164 CC(C)CCCOCCCCCCCCO 7a_100000210774_100000033203 [0,1,0,0,0,0|1,0,2]=4 6201 B15R0.164 CC(C)CCCSCCCCCCCCO 62a_100000033203_100011214892 [0,1,0,0,0,0|1,0,2]=4 6202 B15R0.164 CC(C)CCCSCCCCCCCCO 62a_100011214892_100000033203 [0,1,0,0,0,0|1,0,2]=4 6203 B15R0.164 CC(C)CCNCCCCCCCCCO 2230a_100000078944_100000210312 [0,1,0,0,0,0|1,0,2]=4 6204 B15R0.164 CC(C)CCNCCCCCCCCCO 269862a_100000078944_100000185833 [0,1,0,0,0,0|1,0,2]=4 6205 B15R0.164 CC(C)CCNCCCCCCCCCO 34a_100000078944_100000210312 [0,1,0,0,0,0|1,0,2]=4 6206 B15R0.164 CC(C)CCOCCCCCCCCCBr 34a_100009813782_100000210312 [0,1,0,0,0,0|2,0,1]=4 6207 B15R0.164 CC(C)CCOCCCCCCCCCBr 7a_100009813782_100000210626 [0,1,0,0,0,0|2,0,1]=4 6208 B15R0.164 CC(C)CCOCCCCCCCCCCl 34a_100009868337_100000210312 [0,1,0,0,0,0|2,0,1]=4 6209 B15R0.164 CC(C)CCOCCCCCCCCCCl 7a_100009868337_100000210626 [0,1,0,0,0,0|2,0,1]=4 6210 B15R0.164 CC(C)CCOCCCCCCCCCN 34a_100000078944_100000210312 [0,1,0,0,0,0|2,0,1]=4 6211 B15R0.164 CC(C)CCOCCCCCCCCCO 34a_100000210254_100009813782 [0,1,0,0,0,0|1,0,2]=4 6212 B15R0.164 CC(C)CCOCCCCCCCCCO 7a_100000210254_100009813782 [0,1,0,0,0,0|1,0,2]=4 6213 B15R0.164 CC(C)CCSCCCCCCCCCO 62a_100000210312_100009813782 [0,1,0,0,0,0|1,0,2]=4 6214 B15R0.164 CC(C)CCSCCCCCCCCCO 62a_100009813782_100000210312 [0,1,0,0,0,0|1,0,2]=4 6215 B15R0.164 CC(C)CNCCCCCCCCCCO 2230a_100000066964_100000210760 [0,1,0,0,0,0|1,0,2]=4 6216 B15R0.164 CC(C)CNCCCCCCCCCCO 2230a_100000210953_100009813290 [0,1,0,0,0,0|1,0,2]=4 6217 B15R0.164 CC(C)CNCCCCCCCCCCO 270004a_100000066964_100000210432 [0,1,0,0,0,0|1,0,2]=4 6218 B15R0.164 CC(C)CNCCCCCCCCCCO 34a_100000066964_100000210624 [0,1,0,0,0,0|1,0,2]=4 6219 B15R0.164 CC(C)CNCCCCCCCCCCO 34a_100000210953_100009813290 [0,1,0,0,0,0|1,0,2]=4 6220 B15R0.164 CC(C)COCCCCCCCCCCBr 34a_100009813290_100000210624 [0,1,0,0,0,0|2,0,1]=4 6221 B15R0.164 CC(C)COCCCCCCCCCCBr 7a_100009813290_100000210760 [0,1,0,0,0,0|2,0,1]=4 6222 B15R0.164 CC(C)COCCCCCCCCCCCl 34a_200000033068_100000210624 [0,1,0,0,0,0|2,0,1]=4 6223 B15R0.164 CC(C)COCCCCCCCCCCCl 7a_200000033068_100000210760 [0,1,0,0,0,0|2,0,1]=4 6224 B15R0.164 CC(C)COCCCCCCCCCCN 34a_100000066964_100000210624 [0,1,0,0,0,0|2,0,1]=4 6225 B15R0.164 CC(C)COCCCCCCCCCCO 34a_100000210257_100009813290 [0,1,0,0,0,0|1,0,2]=4 6226 B15R0.164 CC(C)COCCCNCCCCCC=O 2230a_100000205972_100000139337 [0,1,0,0,0,0|2,0,0]=3 6227 B15R0.164 CC(C)CSCCCCCCCCCCO 62a_100000210624_200000033068 [0,1,0,0,0,0|1,0,2]=4 6228 B15R0.164 CC(C)CSCCCCCCCCCCO 62a_100009813290_100000210760 [0,1,0,0,0,0|1,0,2]=4 6229 B15R0.164 CC(C)NCCCCCCCCCCCO 2230a_100138425928_100009812471 [0,1,0,0,0,0|1,0,2]=4 6230 B15R0.164 CC(C)NCCCCCCCCCCCO 34a_100138425928_100009812471 [0,1,0,0,0,0|1,0,2]=4 6231 B15R0.164 CC(C)OCCCCCCCCCCCBr 34a_100009812471_100000210206 [0,1,0,0,0,0|2,0,1]=4 6232 B15R0.164 CC(C)OCCCCCCCCCCCBr 7a_100009812471_100000210206 [0,1,0,0,0,0|2,0,1]=4 6233 B15R0.164 CC(C)OCCCCCCCCCCCO 34a_100000212225_100009812471 [0,1,0,0,0,0|1,0,2]=4 6234 B15R0.164 CC(C)SCCCCCCCCCCCO 62a_100009812471_100000210206 [0,1,0,0,0,0|1,0,2]=4 6235 B15R0.164 CC(F)COCCCCCCCCCCO 34a_100015925927_100009813290 [0,1,0,0,0,0|1,0,2]=4 6236 B15R0.164 CC(O)CCCNCCCCCCCCO 2230a_102515433106_200000718107 [0,1,0,0,0,0|1,0,2]=4 6237 B15R0.164 CC(O)CCCNCCCCCCCCO 34a_102515433106_200000718107 [0,1,0,0,0,0|1,0,2]=4 6238 B15R0.164 CC(O)CCCOCCCCCCCCBr 34a_100009813846_200000718107 [0,1,0,0,0,0|2,0,1]=4 6239 B15R0.164 CC(O)CCCOCCCCCCCCBr 7a_100009813846_200000718107 [0,1,0,0,0,0|2,0,1]=4 6240 B15R0.164 CC(O)CCCOCCCCCCCCCl 34a_100000033203_200000718107 [0,1,0,0,0,0|2,0,1]=4 6241 B15R0.164 CC(O)CCCOCCCCCCCCCl 7a_100000033203_200000718107 [0,1,0,0,0,0|2,0,1]=4 6242 B15R0.164 CC(O)CCCOCCCCCCCCN 34a_102515433106_200000718107 [0,1,0,0,0,0|2,0,1]=4 6243 B15R0.164 CC(O)CCCSCCCCCCCCO 62a_100000033203_200000718107 [0,1,0,0,0,0|1,0,2]=4 6244 B15R0.164 CC(O)CCCSCCCCCCCCO 62a_200000718107_100000033203 [0,1,0,0,0,0|1,0,2]=4 6245 B15R0.164 CC(O)CCNCCCCCCCCCO 2230a_100000078944_100012276601 [0,1,0,0,0,0|1,0,2]=4 6246 B15R0.164 CC(O)CCNCCCCCCCCCO 2230a_200000755665_100009813782 [0,1,0,0,0,0|1,0,2]=4 6247 B15R0.164 CC(O)CCNCCCCCCCCCO 34a_100000078944_100012276601 [0,1,0,0,0,0|1,0,2]=4 6248 B15R0.164 CC(O)CCOCCCCCCCCCBr 34a_100009813782_100012276601 [0,1,0,0,0,0|2,0,1]=4 6249 B15R0.164 CC(O)CCOCCCCCCCCCBr 7a_100009813782_100012276601 [0,1,0,0,0,0|2,0,1]=4 6250 B15R0.164 CC(O)CCOCCCCCCCCCCl 34a_100009868337_100012276601 [0,1,0,0,0,0|2,0,1]=4 6251 B15R0.164 CC(O)CCOCCCCCCCCCCl 7a_100009868337_100012276601 [0,1,0,0,0,0|2,0,1]=4 6252 B15R0.164 CC(O)CCOCCCCCCCCCN 34a_100000078944_100012276601 [0,1,0,0,0,0|2,0,1]=4 6253 B15R0.164 CC(O)CCSCCCCCCCCCO 62a_100009813782_100012276601 [0,1,0,0,0,0|1,0,2]=4 6254 B15R0.164 CC(O)CCSCCCCCCCCCO 62a_100012276601_100009813782 [0,1,0,0,0,0|1,0,2]=4 6255 B15R0.164 CC(O)CNCCCCCCCCCCO 2230a_100000066964_100011218427 [0,1,0,0,0,0|1,0,2]=4 6256 B15R0.164 CC(O)CNCCCCCCCCCCO 2230a_100000210904_100009813290 [0,1,0,0,0,0|1,0,2]=4 6257 B15R0.164 CC(O)CNCCCCCCCCCCO 34a_100000066964_100011218427 [0,1,0,0,0,0|1,0,2]=4 6258 B15R0.164 CC(O)CNCCCCCCCCCCO 34a_100000210904_100009813290 [0,1,0,0,0,0|1,0,2]=4 6259 B15R0.164 CC(O)COCCCCCCCCCCBr 34a_100009813290_100011218427 [0,1,0,0,0,0|2,0,1]=4 6260 B15R0.164 CC(O)COCCCCCCCCCCBr 7a_100009813290_100011218427 [0,1,0,0,0,0|2,0,1]=4 6261 B15R0.164 CC(O)COCCCCCCCCCCCl 34a_200000033068_100011218427 [0,1,0,0,0,0|2,0,1]=4 6262 B15R0.164 CC(O)COCCCCCCCCCCCl 7a_200000033068_100011218427 [0,1,0,0,0,0|2,0,1]=4 6263 B15R0.164 CC(O)COCCCCCCCCCCN 34a_100000066964_100011218427 [0,1,0,0,0,0|2,0,1]=4 6264 B15R0.164 CC(O)CSCCCCCCCCCCO 62a_100009813290_100011218427 [0,1,0,0,0,0|1,0,2]=4 6265 B15R0.164 CC(O)CSCCCCCCCCCCO 62a_100011218427_200000033068 [0,1,0,0,0,0|1,0,2]=4 6266 B15R0.164 CC/C=C/CCCOCCCCCC(=O)N 34a_100016287902_100009817443 [0,1,0,0,0,0|1,0,2]=4 6267 B15R0.164 CC/C=C/CCCOCCCCCC(=O)N 7a_100016287902_100009817443 [0,1,0,0,0,0|1,0,2]=4 6268 B15R0.164 CC/C=C\CCCCCNCCCC(=O)N 269862a_100000739312_100016288537 [0,1,0,0,0,0|1,0,2]=4 6269 B15R0.164 CC/C=C\CCCCCOCCCC(=O)C 34a_100016268722_100000685027 [0,1,0,0,0,0|1,0,2]=4 6270 B15R0.164 CC/C=C\CCCCCOCCCC(=O)C 7a_100016268722_100011215641 [0,1,0,0,0,0|1,0,2]=4 6271 B15R0.164 CC/C=C\CCCCCOCCCC(=O)N 34a_100016268722_100102525003 [0,1,0,0,0,0|1,0,2]=4 6272 B15R0.164 CC/C=C\CCCCCOCCCC(=O)N 7a_100016268722_100102525003 [0,1,0,0,0,0|1,0,2]=4 6273 B15R0.164 CC/C=C\CCCCOCCCCC(=O)C 34a_100016287862_100009817362 [0,1,0,0,0,0|1,0,2]=4 6274 B15R0.164 CC/C=C\CCCCOCCCCC(=O)C 7a_100016287862_100000735457 [0,1,0,0,0,0|1,0,2]=4 6275 B15R0.164 CCC#CCCCCCCOCCC(=O)C 34a_100000759926_200000036426 [0,1,0,0,0,0|1,0,2]=4 6276 B15R0.164 CCC#CCCCCCCOCCC(=O)C 7a_100000759926_200000036426 [0,1,0,0,0,0|1,0,2]=4 6277 B15R0.164 CCC#CCCCCCCOCCC(=O)N 34a_100000757172_200000036426 [0,1,0,0,0,0|1,0,2]=4 6278 B15R0.164 CCC#CCCCCCCOCCC(=O)N 7a_100000757172_200000036426 [0,1,0,0,0,0|1,0,2]=4 6279 B15R0.164 CCC#CCCCCCCSCCC(=O)C 62a_100000053229_200000036426 [0,1,0,0,0,0|1,0,2]=4 6280 B15R0.164 CCC#CCCCCCCSCCC(=O)C 62a_200000036426_100000053229 [0,1,0,0,0,0|1,0,2]=4 6281 B15R0.164 CCC#CCCCCCCSCCC(=O)N 62a_100000744528_200000036426 [0,1,0,0,0,0|1,0,2]=4 6282 B15R0.164 CCC#CCCCCCCSCCC(=O)N 62a_200000036426_100000744528 [0,1,0,0,0,0|1,0,2]=4 6283 B15R0.164 CCCC#CCCOCCCCCC(=O)N 34a_100000042726_100009817443 [0,1,0,0,0,0|1,0,2]=4 6284 B15R0.164 CCCC#CCCOCCCCCC(=O)N 7a_100000042726_100009817443 [0,1,0,0,0,0|1,0,2]=4 6285 B15R0.164 CCCC/C=C/CCCCOCCC(=O)C 7a_200020645093_100000053229 [0,1,0,0,0,0|1,0,2]=4 6286 B15R0.164 CCCC/C=C/CCCCOCCC(=O)N 34a_200020645093_100000731001 [0,1,0,0,0,0|1,0,2]=4 6287 B15R0.164 CCCC/C=C/CCCCOCCC(=O)N 7a_200020645093_100000744528 [0,1,0,0,0,0|1,0,2]=4 6288 B15R0.164 CCCC/C=C/COCCCCCC(=O)N 34a_200016272032_100009817443 [0,1,0,0,0,0|1,0,2]=4 6289 B15R0.164 CCCC/C=C/COCCCCCC(=O)N 7a_200016272032_100009817443 [0,1,0,0,0,0|1,0,2]=4 6290 B15R0.164 CCCC/C=C\CCOCCCCC(=O)C 34a_200016286491_100009817362 [0,1,0,0,0,0|1,0,2]=4 6291 B15R0.164 CCCC/C=C\CCOCCCCC(=O)C 7a_200016286491_100000735457 [0,1,0,0,0,0|1,0,2]=4 6292 B15R0.164 CCCCC#CCCCCOCCC(=O)C 7a_200000066234_100000053229 [0,1,0,0,0,0|1,0,2]=4 6293 B15R0.164 CCCCC#CCCCCOCCC(=O)N 34a_200000066234_100000731001 [0,1,0,0,0,0|1,0,2]=4 6294 B15R0.164 CCCCC#CCCCCOCCC(=O)N 7a_200000066234_100000744528 [0,1,0,0,0,0|1,0,2]=4 6295 B15R0.164 CCCCC#CCCCNCCCC(=O)N 34a_100000739312_200000047210 [0,1,0,0,0,0|1,0,2]=4 6296 B15R0.164 CCCCC#CCCCOCCCC(=O)C 34a_100000759063_200000047210 [0,1,0,0,0,0|1,0,2]=4 6297 B15R0.164 CCCCC#CCCCOCCCC(=O)C 7a_100000759063_200000047210 [0,1,0,0,0,0|1,0,2]=4 6298 B15R0.164 CCCCC#CCCCSCCCC(=O)C 62a_100011215641_200000047210 [0,1,0,0,0,0|1,0,2]=4 6299 B15R0.164 CCCCC#CCCCSCCCC(=O)C 62a_200000047210_100011215641 [0,1,0,0,0,0|1,0,2]=4 6300 B15R0.164 CCCCC#CCCCSCCCC(=O)N 62a_100102525003_200000047210 [0,1,0,0,0,0|1,0,2]=4 6301 B15R0.164 CCCCC#CCCCSCCCC(=O)N 62a_200000047210_100102525003 [0,1,0,0,0,0|1,0,2]=4 6302 B15R0.164 CCCCC#CCCOCCCCC(=O)C 34a_100000037610_100009817362 [0,1,0,0,0,0|1,0,2]=4 6303 B15R0.164 CCCCC#CCCOCCCCC(=O)C 7a_100000037610_100000735457 [0,1,0,0,0,0|1,0,2]=4 6304 B15R0.164 CCCCC#CCOCCCCCC(=O)N 34a_200000034558_100009817443 [0,1,0,0,0,0|1,0,2]=4 6305 B15R0.164 CCCCC#CCOCCCCCC(=O)N 7a_200000034558_100009817443 [0,1,0,0,0,0|1,0,2]=4 6306 B15R0.164 CCCCC/C=C/COCCCCC(=O)C 34a_100016258190_100009817362 [0,1,0,0,0,0|1,0,2]=4 6307 B15R0.164 CCCCC/C=C/COCCCCC(=O)C 7a_100016258190_100000735457 [0,1,0,0,0,0|1,0,2]=4 6308 B15R0.164 CCCCC/C=C\CCCOCCC(=O)C 7a_100020655193_100000053229 [0,1,0,0,0,0|1,0,2]=4 6309 B15R0.164 CCCCC/C=C\CCCOCCC(=O)N 34a_100020655193_100000731001 [0,1,0,0,0,0|1,0,2]=4 6310 B15R0.164 CCCCC/C=C\CCCOCCC(=O)N 7a_100020655193_100000744528 [0,1,0,0,0,0|1,0,2]=4 6311 B15R0.164 CCCCC/C=C\CCOCCCC(=O)C 34a_100016277358_100000685027 [0,1,0,0,0,0|1,0,2]=4 6312 B15R0.164 CCCCC/C=C\CCOCCCC(=O)C 7a_100016277358_100011215641 [0,1,0,0,0,0|1,0,2]=4 6313 B15R0.164 CCCCC/C=C\CCOCCCC(=O)N 34a_100016277358_100102525003 [0,1,0,0,0,0|1,0,2]=4 6314 B15R0.164 CCCCC/C=C\CCOCCCC(=O)N 7a_100016277358_100102525003 [0,1,0,0,0,0|1,0,2]=4 6315 B15R0.164 CCCCCC#CCCOCCCC(=O)C 34a_200000042877_100000685027 [0,1,0,0,0,0|1,0,2]=4 6316 B15R0.164 CCCCCC#CCCOCCCC(=O)C 7a_200000042877_100011215641 [0,1,0,0,0,0|1,0,2]=4 6317 B15R0.164 CCCCCC#CCCOCCCC(=O)N 34a_200000042877_100102525003 [0,1,0,0,0,0|1,0,2]=4 6318 B15R0.164 CCCCCC#CCCOCCCC(=O)N 7a_200000042877_100102525003 [0,1,0,0,0,0|1,0,2]=4 6319 B15R0.164 CCCCCC#CCNCCCCC(=O)N 34a_100000696515_100009816472 [0,1,0,0,0,0|1,0,2]=4 6320 B15R0.164 CCCCCC#CCOCCCCC(=O)C 34a_200000033628_100009817362 [0,1,0,0,0,0|1,0,2]=4 6321 B15R0.164 CCCCCC#CCOCCCCC(=O)C 7a_200000033628_100000735457 [0,1,0,0,0,0|1,0,2]=4 6322 B15R0.164 CCCCCC#CCOCCCCC(=O)N 34a_100012022536_100009816472 [0,1,0,0,0,0|1,0,2]=4 6323 B15R0.164 CCCCCC#CCOCCCCC(=O)N 7a_100012022536_100009816472 [0,1,0,0,0,0|1,0,2]=4 6324 B15R0.164 CCCCCC#CCSCCCCC(=O)C 62a_100000735457_100009816472 [0,1,0,0,0,0|1,0,2]=4 6325 B15R0.164 CCCCCC#CCSCCCCC(=O)C 62a_100009816472_100000735457 [0,1,0,0,0,0|1,0,2]=4 6326 B15R0.164 CCCCCC/C=C/COCCCC(=O)C 34a_200016276170_100000685027 [0,1,0,0,0,0|1,0,2]=4 6327 B15R0.164 CCCCCC/C=C/COCCCC(=O)C 7a_200016276170_100011215641 [0,1,0,0,0,0|1,0,2]=4 6328 B15R0.164 CCCCCC/C=C/COCCCC(=O)N 34a_200016276170_100102525003 [0,1,0,0,0,0|1,0,2]=4 6329 B15R0.164 CCCCCC/C=C/COCCCC(=O)N 7a_200016276170_100102525003 [0,1,0,0,0,0|1,0,2]=4 6330 B15R0.164 CCCCCCC#CCCOCCC(=O)C 7a_200000033163_100000053229 [0,1,0,0,0,0|1,0,2]=4 6331 B15R0.164 CCCCCCC#CCCOCCC(=O)N 34a_200000033163_100000731001 [0,1,0,0,0,0|1,0,2]=4 6332 B15R0.164 CCCCCCC#CCCOCCC(=O)N 7a_200000033163_100000744528 [0,1,0,0,0,0|1,0,2]=4 6333 B15R0.164 CCCCCCC#CCOCCCC(=O)C 34a_200000037284_100000685027 [0,1,0,0,0,0|1,0,2]=4 6334 B15R0.164 CCCCCCC#CCOCCCC(=O)C 7a_200000037284_100011215641 [0,1,0,0,0,0|1,0,2]=4 6335 B15R0.164 CCCCCCC#CCOCCCC(=O)N 34a_200000037284_100102525003 [0,1,0,0,0,0|1,0,2]=4 6336 B15R0.164 CCCCCCC#CCOCCCC(=O)N 7a_200000037284_100102525003 [0,1,0,0,0,0|1,0,2]=4 6337 B15R0.164 CCCCCCCC#CCOCCC(=O)C 7a_200000061759_100000053229 [0,1,0,0,0,0|1,0,2]=4 6338 B15R0.164 CCCCCCCC#CCOCCC(=O)N 34a_200000061759_100000731001 [0,1,0,0,0,0|1,0,2]=4 6339 B15R0.164 CCCCCCCC#CCOCCC(=O)N 7a_200000061759_100000744528 [0,1,0,0,0,0|1,0,2]=4 6340 B15R0.164 CCCCCCCC/C=C/COCC(=O)N 34a_200020667288_100000187820 [0,1,0,0,0,0|1,0,2]=4 6341 B15R0.164 CCCCCCCC/C=C/COCC(=O)N 7a_200020667288_100000187820 [0,1,0,0,0,0|1,0,2]=4 6342 B15R0.164 CCCCCCCC/C=C/COCC(=O)[O-] 34a_200020667288_100020667443 [0,1,0,0,0,0|1,0,2]=4 6343 B15R0.164 CCCCCCCCCCC=NNC(=O)C 4a_100000189765_100011218819 [0,1,0,0,0,0|2,0,1]=4 6344 B15R0.164 CCCCCCCCCCCCCC(=O)C 1458a_100000070787_100000210684 [0,1,0,0,0,0|0,0,0]=1 6345 B15R0.164 CCCCCCCCCCCCCC(=O)C 1458a_100000756256_200000210301 [0,1,0,0,0,0|0,0,0]=1 6346 B15R0.164 CCCCCCCCCCCCCC(=O)[13CH3] 1458a_100000756256_200025704644 [0,1,0,0,0,0|0,0,0]=1 6347 B15R0.164 CCCCCCCCCCCCCN(C)C 2230a_100102631434_100000210684 [0,1,0,0,0,0|2,0,0]=3 6348 B15R0.164 CCCCCCCCCCCCCN(C)C 269982a_100102631434_100000210684 [0,1,0,0,0,0|2,0,0]=3 6349 B15R0.164 CCCCCCCCCCCCCN(C)C 270004a_100102631434_200011215488 [0,1,0,0,0,0|2,0,0]=3 6350 B15R0.164 CCCCCCCCCCCCNC(=O)C 11a_100000210451_100015343762 [0,1,0,0,0,0|1,0,0]=2 6351 B15R0.164 CCCCCCCCCCCCNC(=O)C 1626a_100000210451_100015343762 [0,1,0,0,0,0|1,0,0]=2 6352 B15R0.164 CCCCCCCCCCCCNC(=O)C 240690a_100000210451_100015343762 [0,1,0,0,0,0|1,0,0]=2 6353 B15R0.164 CCCCCCCCCCCCNC(=O)C 527a_100000210451_100103153847 [0,1,0,0,0,0|1,0,0]=2 6354 B15R0.164 CCCCCCCCCCCCNC(C)C 2230a_100000210451_100000210206 [0,1,0,0,0,0|2,0,1]=4 6355 B15R0.164 CCCCCCCCCCCCNC(C)C 2230a_100138425928_100011215052 [0,1,0,0,0,0|2,0,1]=4 6356 B15R0.164 CCCCCCCCCCCCNC(C)C 34a_100000210451_100000210206 [0,1,0,0,0,0|2,0,1]=4 6357 B15R0.164 CCCCCCCCCCCCNC(C)C 34a_100138425928_100000759014 [0,1,0,0,0,0|2,0,1]=4 6358 B15R0.164 CCCCCCCCCCCCOC(C)C 34a_100000210810_100000210206 [0,1,0,0,0,0|2,0,1]=4 6359 B15R0.164 CCCCCCCCCCCCOC(C)C 34a_100000212225_100000759014 [0,1,0,0,0,0|2,0,1]=4 6360 B15R0.164 CCCCCCCCCCCCOC(C)C 7a_100000210810_100000210206 [0,1,0,0,0,0|2,0,1]=4 6361 B15R0.164 CCCCCCCCCCCNCC(=O)N 2230a_100000711301_100011215454 [0,1,0,0,0,0|1,0,0]=2 6362 B15R0.164 CCCCCCCCCCCNCC(=O)N 2230a_200011215754_100000747473 [0,1,0,0,0,0|1,0,0]=2 6363 B15R0.164 CCCCCCCCCCCNCC(=O)N 34a_200011215754_100000187820 [0,1,0,0,0,0|1,0,0]=2 6364 B15R0.164 CCCCCCCCCCCNCC(=O)O 269956a_100016091260_100011215454 [0,1,0,0,0,0|1,0,0]=2 6365 B15R0.164 CCCCCCCCCCCNCC(=O)[O-] 34a_200011215754_100020667443 [0,1,0,0,0,0|1,0,0]=2 6366 B15R0.164 CCCCCCCCCCCNCC(C)C 2230a_100000210953_100011215454 [0,1,0,0,0,0|2,0,1]=4 6367 B15R0.164 CCCCCCCCCCCNCC(C)C 2230a_200011215754_100000210760 [0,1,0,0,0,0|2,0,1]=4 6368 B15R0.164 CCCCCCCCCCCNCC(C)C 270004a_200011215754_100000210432 [0,1,0,0,0,0|2,0,1]=4 6369 B15R0.164 CCCCCCCCCCCNCC(C)C 34a_100000210953_100011215454 [0,1,0,0,0,0|2,0,1]=4 6370 B15R0.164 CCCCCCCCCCCNCC(C)C 34a_200011215754_100000210624 [0,1,0,0,0,0|2,0,1]=4 6371 B15R0.164 CCCCCCCCCCCNCC(C)O 2230a_100000210904_100011215454 [0,1,0,0,0,0|1,0,2]=4 6372 B15R0.164 CCCCCCCCCCCNCC(C)O 2230a_200011215754_100011218427 [0,1,0,0,0,0|1,0,2]=4 6373 B15R0.164 CCCCCCCCCCCNCC(C)O 34a_100000210904_100011215454 [0,1,0,0,0,0|1,0,2]=4 6374 B15R0.164 CCCCCCCCCCCNCC(C)O 34a_200011215754_100011218427 [0,1,0,0,0,0|1,0,2]=4 6375 B15R0.164 CCCCCCCCCCCNCC(F)F 2230a_200011215754_100011934356 [0,1,0,0,0,0|2,0,1]=4 6376 B15R0.164 CCCCCCCCCCCNCC(F)F 34a_100000765723_100011215454 [0,1,0,0,0,0|2,0,1]=4 6377 B15R0.164 CCCCCCCCCCCNCC(F)F 34a_200011215754_100011934356 [0,1,0,0,0,0|2,0,1]=4 6378 B15R0.164 CCCCCCCCCCCNC[C@@H](C)O 2230a_200011215754_100009817552 [0,1,0,0,0,0|1,0,2]=4 6379 B15R0.164 CCCCCCCCCCCNC[C@@H](C)O 34a_200011215754_100009817552 [0,1,0,0,0,0|1,0,2]=4 6380 B15R0.164 CCCCCCCCCCCNC[N+](=O)[O-] 34a_200011215754_100000761209 [0,1,0,0,0,0|2,0,0]=3 6381 B15R0.164 CCCCCCCCCCCOCC(=O)C 34a_100000211253_100011215454 [0,1,0,0,0,0|1,0,0]=2 6382 B15R0.164 CCCCCCCCCCCOCC(=O)N 34a_100000210809_100000187820 [0,1,0,0,0,0|1,0,0]=2 6383 B15R0.164 CCCCCCCCCCCOCC(=O)N 7a_100000210809_100000187820 [0,1,0,0,0,0|1,0,0]=2 6384 B15R0.164 CCCCCCCCCCCOCC(=O)[O-] 34a_100000210809_100020667443 [0,1,0,0,0,0|1,0,0]=2 6385 B15R0.164 CCCCCCCCCCCOCC(C)Br 34a_100012180447_100011215454 [0,1,0,0,0,0|2,0,1]=4 6386 B15R0.164 CCCCCCCCCCCOCC(C)C 34a_100000210257_100011215454 [0,1,0,0,0,0|2,0,1]=4 6387 B15R0.164 CCCCCCCCCCCOCC(C)C 34a_100000210809_100000210624 [0,1,0,0,0,0|2,0,1]=4 6388 B15R0.164 CCCCCCCCCCCOCC(C)C 7a_100000210809_100000210760 [0,1,0,0,0,0|2,0,1]=4 6389 B15R0.164 CCCCCCCCCCCOCC(C)F 34a_100015925927_100011215454 [0,1,0,0,0,0|2,0,1]=4 6390 B15R0.164 CCCCCCCCCCCOCC(C)O 34a_100000210809_100011218427 [0,1,0,0,0,0|1,0,2]=4 6391 B15R0.164 CCCCCCCCCCCOCC(C)O 7a_100000210809_100011218427 [0,1,0,0,0,0|1,0,2]=4 6392 B15R0.164 CCCCCCCCCCCOCC(F)F 34a_100000210809_100011934356 [0,1,0,0,0,0|2,0,1]=4 6393 B15R0.164 CCCCCCCCCCCOCC(F)F 34a_100000743014_100011215454 [0,1,0,0,0,0|2,0,1]=4 6394 B15R0.164 CCCCCCCCCCCOCC(F)F 7a_100000210809_100011934356 [0,1,0,0,0,0|2,0,1]=4 6395 B15R0.164 CCCCCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100011215454 [0,1,0,0,0,0|2,0,1]=4 6396 B15R0.164 CCCCCCCCCCCOC[C@@H](C)N 34a_100000737577_100011215454 [0,1,0,0,0,0|2,0,1]=4 6397 B15R0.164 CCCCCCCCCCCOC[C@@H](C)O 34a_100000210809_100009817552 [0,1,0,0,0,0|1,0,2]=4 6398 B15R0.164 CCCCCCCCCCCOC[C@@H](C)O 7a_100000210809_100009817552 [0,1,0,0,0,0|1,0,2]=4 6399 B15R0.164 CCCCCCCCCCCOC[N+](=O)[O-] 34a_100000210809_100000761209 [0,1,0,0,0,0|2,0,0]=3 6400 B15R0.164 CCCCCCCCCCCSCC(=O)N 62a_100000747473_100011215454 [0,1,0,0,0,0|1,0,0]=2 6401 B15R0.164 CCCCCCCCCCCSCC(=O)[O-] 62a_100020667443_100011215454 [0,1,0,0,0,0|1,0,0]=2 6402 B15R0.164 CCCCCCCCCCCSCC(C)C 62a_100000210624_100011215454 [0,1,0,0,0,0|2,0,1]=4 6403 B15R0.164 CCCCCCCCCCCSCC(C)O 62a_100011218427_100011215454 [0,1,0,0,0,0|1,0,2]=4 6404 B15R0.164 CCCCCCCCCCCSCC(F)F 62a_100011934356_100011215454 [0,1,0,0,0,0|2,0,1]=4 6405 B15R0.164 CCCCCCCCCCCSC[C@@H](C)O 62a_100009817552_100011215454 [0,1,0,0,0,0|1,0,2]=4 6406 B15R0.164 CCCCCCCCCCNCC=C(C)C 2230a_100000684558_100000761012 [0,1,0,0,0,0|2,0,1]=4 6407 B15R0.164 CCCCCCCCCCNCC=C(C)C 34a_100000684558_100000761012 [0,1,0,0,0,0|2,0,1]=4 6408 B15R0.164 CCCCCCCCCCNCC=C(C)C 34a_100000718196_100000210320 [0,1,0,0,0,0|2,0,1]=4 6409 B15R0.164 CCCCCCCCCCNCCC(=O)N 2230a_100000684558_100000744528 [0,1,0,0,0,0|1,0,0]=2 6410 B15R0.164 CCCCCCCCCCNCCC(=O)N 34a_100000684558_100000731001 [0,1,0,0,0,0|1,0,0]=2 6411 B15R0.164 CCCCCCCCCCNCCC(C)C 2230a_100000684558_100000210312 [0,1,0,0,0,0|2,0,1]=4 6412 B15R0.164 CCCCCCCCCCNCCC(C)C 269862a_100000684558_100000185833 [0,1,0,0,0,0|2,0,1]=4 6413 B15R0.164 CCCCCCCCCCNCCC(C)C 34a_100000684558_100000210312 [0,1,0,0,0,0|2,0,1]=4 6414 B15R0.164 CCCCCCCCCCNCCC(C)O 2230a_100000684558_100012276601 [0,1,0,0,0,0|1,0,2]=4 6415 B15R0.164 CCCCCCCCCCNCCC(C)O 2230a_200000755665_100000210320 [0,1,0,0,0,0|1,0,2]=4 6416 B15R0.164 CCCCCCCCCCNCCC(C)O 34a_100000684558_100012276601 [0,1,0,0,0,0|1,0,2]=4 6417 B15R0.164 CCCCCCCCCCNCOC(=O)C 34a_100000684558_100009813279 [0,1,0,0,0,0|2,0,0]=3 6418 B15R0.164 CCCCCCCCCCNOCC(=O)O 269956a_100000106656_100000210320 [0,1,0,0,0,0|2,0,0]=3 6419 B15R0.164 CCCCCCCCCCOCC=C(C)C 34a_100000210711_100000761012 [0,1,0,0,0,0|2,0,1]=4 6420 B15R0.164 CCCCCCCCCCOCC=C(C)C 34a_100000753907_100000210320 [0,1,0,0,0,0|2,0,1]=4 6421 B15R0.164 CCCCCCCCCCOCC=C(C)C 7a_100000210711_100000761012 [0,1,0,0,0,0|2,0,1]=4 6422 B15R0.164 CCCCCCCCCCOCCC(=O)C 34a_100000759926_100000210320 [0,1,0,0,0,0|1,0,0]=2 6423 B15R0.164 CCCCCCCCCCOCCC(=O)C 7a_100000210711_100000053229 [0,1,0,0,0,0|1,0,0]=2 6424 B15R0.164 CCCCCCCCCCOCCC(=O)C 7a_100000759926_100000210320 [0,1,0,0,0,0|1,0,0]=2 6425 B15R0.164 CCCCCCCCCCOCCC(=O)N 34a_100000210711_100000731001 [0,1,0,0,0,0|1,0,0]=2 6426 B15R0.164 CCCCCCCCCCOCCC(=O)N 34a_100000757172_100000210320 [0,1,0,0,0,0|1,0,0]=2 6427 B15R0.164 CCCCCCCCCCOCCC(=O)N 7a_100000210711_100000744528 [0,1,0,0,0,0|1,0,0]=2 6428 B15R0.164 CCCCCCCCCCOCCC(=O)N 7a_100000757172_100000210320 [0,1,0,0,0,0|1,0,0]=2 6429 B15R0.164 CCCCCCCCCCOCCC(C)Br 34a_100009893172_100000210320 [0,1,0,0,0,0|2,0,1]=4 6430 B15R0.164 CCCCCCCCCCOCCC(C)C 34a_100000210254_100000210320 [0,1,0,0,0,0|2,0,1]=4 6431 B15R0.164 CCCCCCCCCCOCCC(C)C 34a_100000210711_100000210312 [0,1,0,0,0,0|2,0,1]=4 6432 B15R0.164 CCCCCCCCCCOCCC(C)C 7a_100000210254_100000210320 [0,1,0,0,0,0|2,0,1]=4 6433 B15R0.164 CCCCCCCCCCOCCC(C)C 7a_100000210711_100000210626 [0,1,0,0,0,0|2,0,1]=4 6434 B15R0.164 CCCCCCCCCCOCCC(C)O 34a_100000210711_100012276601 [0,1,0,0,0,0|1,0,2]=4 6435 B15R0.164 CCCCCCCCCCOCCC(C)O 7a_100000210711_100012276601 [0,1,0,0,0,0|1,0,2]=4 6436 B15R0.164 CCCCCCCCCCOCCC(F)F 34a_100103093639_100000210320 [0,1,0,0,0,0|2,0,1]=4 6437 B15R0.164 CCCCCCCCCCOCCN(C)C 7a_100000210711_100000755713 [0,1,0,0,0,0|3,0,0]=4 6438 B15R0.164 CCCCCCCCCCOCC[C@@H](C)N 34a_100000706166_100000210320 [0,1,0,0,0,0|2,0,1]=4 6439 B15R0.164 CCCCCCCCCCOCOC(=O)C 34a_100000210711_100009813279 [0,1,0,0,0,0|2,0,0]=3 6440 B15R0.164 CCCCCCCCCCSCC=C(C)C 62a_100000761012_100000210320 [0,1,0,0,0,0|2,0,1]=4 6441 B15R0.164 CCCCCCCCCCSCCC(=O)C 62a_100000053229_100000210320 [0,1,0,0,0,0|1,0,0]=2 6442 B15R0.164 CCCCCCCCCCSCCC(=O)N 62a_100000744528_100000210320 [0,1,0,0,0,0|1,0,0]=2 6443 B15R0.164 CCCCCCCCCCSCCC(C)C 62a_100000210312_100000210320 [0,1,0,0,0,0|2,0,1]=4 6444 B15R0.164 CCCCCCCCCCSCCC(C)O 62a_100012276601_100000210320 [0,1,0,0,0,0|1,0,2]=4 6445 B15R0.164 CCCCCCCCCCSCOC(=O)C 62a_100000076356_100000210320 [0,1,0,0,0,0|2,0,0]=3 6446 B15R0.164 CCCCCCCCCNCCC=C(C)C 2230a_100000212291_100011217483 [0,1,0,0,0,0|2,0,1]=4 6447 B15R0.164 CCCCCCCCCNCCC=C(C)C 34a_100000212291_100011217483 [0,1,0,0,0,0|2,0,1]=4 6448 B15R0.164 CCCCCCCCCNCCC=C(F)F 2230a_100000212291_200009816681 [0,1,0,0,0,0|2,0,1]=4 6449 B15R0.164 CCCCCCCCCNCCC=C(F)F 34a_100000212291_200009816681 [0,1,0,0,0,0|2,0,1]=4 6450 B15R0.164 CCCCCCCCCNCCCC(=O)C 34a_100000212291_100000685027 [0,1,0,0,0,0|1,0,0]=2 6451 B15R0.164 CCCCCCCCCNCCCC(=O)N 34a_100000212291_100102525003 [0,1,0,0,0,0|1,0,0]=2 6452 B15R0.164 CCCCCCCCCNCCCC(=O)N 34a_100000739312_100011214924 [0,1,0,0,0,0|1,0,0]=2 6453 B15R0.164 CCCCCCCCCNCCCC(C)C 2230a_100000212291_100011214892 [0,1,0,0,0,0|2,0,1]=4 6454 B15R0.164 CCCCCCCCCNCCCC(C)C 2230a_200000737386_100011214924 [0,1,0,0,0,0|2,0,1]=4 6455 B15R0.164 CCCCCCCCCNCCCC(C)C 34a_100000212291_100011214892 [0,1,0,0,0,0|2,0,1]=4 6456 B15R0.164 CCCCCCCCCNCCCC(C)C 34a_200000737386_100011214924 [0,1,0,0,0,0|2,0,1]=4 6457 B15R0.164 CCCCCCCCCNCCCC(C)O 2230a_100000212291_200000718107 [0,1,0,0,0,0|1,0,2]=4 6458 B15R0.164 CCCCCCCCCNCCCC(C)O 34a_100000212291_200000718107 [0,1,0,0,0,0|1,0,2]=4 6459 B15R0.164 CCCCCCCCCNCCCS(=O)C 2230a_200000753449_100011214924 [0,1,0,0,0,0|2,0,0]=3 6460 B15R0.164 CCCCCCCCCNCCNC(=O)C 2230a_100000209853_100011214924 [0,1,0,0,0,0|2,0,0]=3 6461 B15R0.164 CCCCCCCCCNCCNC(=O)C 2230a_100000212291_100000189650 [0,1,0,0,0,0|2,0,0]=3 6462 B15R0.164 CCCCCCCCCNCCNC(=O)N 2230a_100000212291_200000034859 [0,1,0,0,0,0|2,0,0]=3 6463 B15R0.164 CCCCCCCCCNCCNC(=O)N 34a_100020590234_100011214924 [0,1,0,0,0,0|2,0,0]=3 6464 B15R0.164 CCCCCCCCCNCCOC(=O)C 34a_100000212291_100009814007 [0,1,0,0,0,0|2,0,0]=3 6465 B15R0.164 CCCCCCCCCNCCOC(=O)N 34a_100000212291_200011214921 [0,1,0,0,0,0|2,0,0]=3 6466 B15R0.164 CCCCCCCCCOCCC=C(C)C 34a_100000210712_100011217483 [0,1,0,0,0,0|2,0,1]=4 6467 B15R0.164 CCCCCCCCCOCCC=C(C)C 7a_100000210712_100011217483 [0,1,0,0,0,0|2,0,1]=4 6468 B15R0.164 CCCCCCCCCOCCC=C(F)F 34a_100000210712_200009816681 [0,1,0,0,0,0|2,0,1]=4 6469 B15R0.164 CCCCCCCCCOCCC=C(F)F 7a_100000210712_200009816681 [0,1,0,0,0,0|2,0,1]=4 6470 B15R0.164 CCCCCCCCCOCCCC(=O)C 34a_100000210712_100000685027 [0,1,0,0,0,0|1,0,0]=2 6471 B15R0.164 CCCCCCCCCOCCCC(=O)C 34a_100000759063_100011214924 [0,1,0,0,0,0|1,0,0]=2 6472 B15R0.164 CCCCCCCCCOCCCC(=O)C 7a_100000210712_100011215641 [0,1,0,0,0,0|1,0,0]=2 6473 B15R0.164 CCCCCCCCCOCCCC(=O)C 7a_100000759063_100000210328 [0,1,0,0,0,0|1,0,0]=2 6474 B15R0.164 CCCCCCCCCOCCCC(=O)N 34a_100000210712_100102525003 [0,1,0,0,0,0|1,0,0]=2 6475 B15R0.164 CCCCCCCCCOCCCC(=O)N 7a_100000210712_100102525003 [0,1,0,0,0,0|1,0,0]=2 6476 B15R0.164 CCCCCCCCCOCCCC(C)C 34a_100000210712_100011214892 [0,1,0,0,0,0|2,0,1]=4 6477 B15R0.164 CCCCCCCCCOCCCC(C)C 34a_100000210774_100011214924 [0,1,0,0,0,0|2,0,1]=4 6478 B15R0.164 CCCCCCCCCOCCCC(C)C 7a_100000210712_100011214892 [0,1,0,0,0,0|2,0,1]=4 6479 B15R0.164 CCCCCCCCCOCCCC(C)C 7a_100000210774_100000210328 [0,1,0,0,0,0|2,0,1]=4 6480 B15R0.164 CCCCCCCCCOCCCC(C)O 34a_100000210712_200000718107 [0,1,0,0,0,0|1,0,2]=4 6481 B15R0.164 CCCCCCCCCOCCCC(C)O 7a_100000210712_200000718107 [0,1,0,0,0,0|1,0,2]=4 6482 B15R0.164 CCCCCCCCCOCCCN(C)C 7a_100000210712_100000757444 [0,1,0,0,0,0|3,0,0]=4 6483 B15R0.164 CCCCCCCCCOCCC[N+](=O)[O-] 34a_200000037920_100011214924 [0,1,0,0,0,0|2,0,0]=3 6484 B15R0.164 CCCCCCCCCOCCNC(=O)C 34a_100000158858_100011214924 [0,1,0,0,0,0|2,0,0]=3 6485 B15R0.164 CCCCCCCCCOCCNC(=O)C 7a_100000210712_100000189650 [0,1,0,0,0,0|2,0,0]=3 6486 B15R0.164 CCCCCCCCCOCCNC(=O)N 34a_100000181757_100011214924 [0,1,0,0,0,0|2,0,0]=3 6487 B15R0.164 CCCCCCCCCOCCNC(=O)N 7a_100000210712_200000034859 [0,1,0,0,0,0|2,0,0]=3 6488 B15R0.164 CCCCCCCCCOCCOC(=O)C 34a_100000210712_100009814007 [0,1,0,0,0,0|2,0,0]=3 6489 B15R0.164 CCCCCCCCCOCCOC(=O)C 7a_100000210712_100009814007 [0,1,0,0,0,0|2,0,0]=3 6490 B15R0.164 CCCCCCCCCOCCOC(=O)N 34a_100000210712_200011214921 [0,1,0,0,0,0|2,0,0]=3 6491 B15R0.164 CCCCCCCCCOCCOC(=O)N 7a_100000210712_200011214921 [0,1,0,0,0,0|2,0,0]=3 6492 B15R0.164 CCCCCCCCCOCCOC(=O)N 7a_100000766696_100000210328 [0,1,0,0,0,0|2,0,0]=3 6493 B15R0.164 CCCCCCCCCSCCC=C(C)C 62a_100011217483_100000210670 [0,1,0,0,0,0|2,0,1]=4 6494 B15R0.164 CCCCCCCCCSCCC=C(F)F 62a_200009816681_100000210670 [0,1,0,0,0,0|2,0,1]=4 6495 B15R0.164 CCCCCCCCCSCCCC(=O)C 62a_100011215641_100000210670 [0,1,0,0,0,0|1,0,0]=2 6496 B15R0.164 CCCCCCCCCSCCCC(=O)N 62a_100102525003_100000210670 [0,1,0,0,0,0|1,0,0]=2 6497 B15R0.164 CCCCCCCCCSCCCC(C)C 62a_100011214892_100000210670 [0,1,0,0,0,0|2,0,1]=4 6498 B15R0.164 CCCCCCCCCSCCCC(C)O 62a_200000718107_100000210670 [0,1,0,0,0,0|1,0,2]=4 6499 B15R0.164 CCCCCCCCCSCCNC(=O)C 62a_100000189650_100000210670 [0,1,0,0,0,0|2,0,0]=3 6500 B15R0.164 CCCCCCCCCSCCNC(=O)N 62a_200000034859_100000210670 [0,1,0,0,0,0|2,0,0]=3 6501 B15R0.164 CCCCCCCCCSCCOC(=O)C 62a_100009814007_100000210670 [0,1,0,0,0,0|2,0,0]=3 6502 B15R0.164 CCCCCCCCCSCCOC(=O)N 62a_200011214921_100000210670 [0,1,0,0,0,0|2,0,0]=3 6503 B15R0.164 CCCCCCCCNCCCCB(O)O 2230a_100000229939_200009817182 [0,1,0,0,0,0|2,0,1]=4 6504 B15R0.164 CCCCCCCCNCCCCB(O)O 34a_100000229939_200009817182 [0,1,0,0,0,0|2,0,1]=4 6505 B15R0.164 CCCCCCCCNCCCCC(=O)C 34a_100000229939_100009817362 [0,1,0,0,0,0|1,0,0]=2 6506 B15R0.164 CCCCCCCCNCCCCC(=O)N 34a_100000696515_100000210759 [0,1,0,0,0,0|1,0,0]=2 6507 B15R0.164 CCCCCCCCNCCCCC(C)C 2230a_100000229939_100011216152 [0,1,0,0,0,0|2,0,1]=4 6508 B15R0.164 CCCCCCCCNCCCCC(C)C 34a_100000229939_100011216152 [0,1,0,0,0,0|2,0,1]=4 6509 B15R0.164 CCCCCCCCNCCCNC(=O)C 34a_100000736810_100000210759 [0,1,0,0,0,0|2,0,0]=3 6510 B15R0.164 CCCCCCCCNCCCOC(=O)C 34a_100000229939_100000042594 [0,1,0,0,0,0|2,0,0]=3 6511 B15R0.164 CCCCCCCCNCCCOC(=S)C 2230a_100000229939_200135323944 [0,1,0,0,0,0|2,1,0]=4 6512 B15R0.164 CCCCCCCCNCCCOC(=S)C 34a_100000229939_200135323944 [0,1,0,0,0,0|2,1,0]=4 6513 B15R0.164 CCCCCCCCNCCCSC(=O)C 2230a_100000229939_100000038929 [0,1,0,0,0,0|2,0,0]=3 6514 B15R0.164 CCCCCCCCNCCCSC(=O)C 34a_100000229939_100000038929 [0,1,0,0,0,0|2,0,0]=3 6515 B15R0.164 CCCCCCCCNCCOCC(=O)N 2230a_100000229939_100000076697 [0,1,0,0,0,0|2,0,0]=3 6516 B15R0.164 CCCCCCCCNCCOCC(=O)N 34a_100000229939_100000076697 [0,1,0,0,0,0|2,0,0]=3 6517 B15R0.164 CCCCCCCCNCCOCC(=O)O 269956a_100000700818_100000210759 [0,1,0,0,0,0|2,0,0]=3 6518 B15R0.164 CCCCCCCCOCCCCB(O)O 34a_100000210232_200009817182 [0,1,0,0,0,0|2,0,1]=4 6519 B15R0.164 CCCCCCCCOCCCCB(O)O 7a_100000210232_200009817182 [0,1,0,0,0,0|2,0,1]=4 6520 B15R0.164 CCCCCCCCOCCCCC(=O)C 34a_100000210232_100009817362 [0,1,0,0,0,0|1,0,0]=2 6521 B15R0.164 CCCCCCCCOCCCCC(=O)C 7a_100000210232_100000735457 [0,1,0,0,0,0|1,0,0]=2 6522 B15R0.164 CCCCCCCCOCCCCC(=O)N 34a_100012022536_100000210759 [0,1,0,0,0,0|1,0,0]=2 6523 B15R0.164 CCCCCCCCOCCCCC(=O)N 7a_100012022536_100000210759 [0,1,0,0,0,0|1,0,0]=2 6524 B15R0.164 CCCCCCCCOCCCCC(C)C 34a_100000210232_100011216152 [0,1,0,0,0,0|2,0,1]=4 6525 B15R0.164 CCCCCCCCOCCCCC(C)C 34a_100011214890_100000210759 [0,1,0,0,0,0|2,0,1]=4 6526 B15R0.164 CCCCCCCCOCCCCC(C)C 7a_100000210232_100011216152 [0,1,0,0,0,0|2,0,1]=4 6527 B15R0.164 CCCCCCCCOCCCCC(C)C 7a_100011214890_100000210759 [0,1,0,0,0,0|2,0,1]=4 6528 B15R0.164 CCCCCCCCOCCCC[N+](=O)[O-] 34a_200015379883_100000210759 [0,1,0,0,0,0|2,0,0]=3 6529 B15R0.164 CCCCCCCCOCCCC[N+](=O)[O-] 7a_200015379883_100000210759 [0,1,0,0,0,0|2,0,0]=3 6530 B15R0.164 CCCCCCCCOCCCNC(=O)C 34a_100000752032_100000210759 [0,1,0,0,0,0|2,0,0]=3 6531 B15R0.164 CCCCCCCCOCCCOC(=O)C 34a_100000210232_100000042594 [0,1,0,0,0,0|2,0,0]=3 6532 B15R0.164 CCCCCCCCOCCCOC(=O)C 7a_100000210232_100000042594 [0,1,0,0,0,0|2,0,0]=3 6533 B15R0.164 CCCCCCCCOCCCOC(=S)C 34a_100000210232_200135323944 [0,1,0,0,0,0|2,1,0]=4 6534 B15R0.164 CCCCCCCCOCCCOC(=S)C 7a_100000210232_200135323944 [0,1,0,0,0,0|2,1,0]=4 6535 B15R0.164 CCCCCCCCOCCCSC(=O)C 34a_100000210232_100000038929 [0,1,0,0,0,0|2,0,0]=3 6536 B15R0.164 CCCCCCCCOCCCSC(=O)C 7a_100000210232_100000038929 [0,1,0,0,0,0|2,0,0]=3 6537 B15R0.164 CCCCCCCCOCCOCC(=O)N 34a_100000210232_100000076697 [0,1,0,0,0,0|2,0,0]=3 6538 B15R0.164 CCCCCCCCOCCOCC(=O)N 7a_100000210232_100000076697 [0,1,0,0,0,0|2,0,0]=3 6539 B15R0.164 CCCCCCCCSCCCCB(O)O 62a_100000210759_200009817182 [0,1,0,0,0,0|2,0,1]=4 6540 B15R0.164 CCCCCCCCSCCCCB(O)O 62a_200009817182_100000210317 [0,1,0,0,0,0|2,0,1]=4 6541 B15R0.164 CCCCCCCCSCCCCC(=O)C 62a_100000210759_100000735457 [0,1,0,0,0,0|1,0,0]=2 6542 B15R0.164 CCCCCCCCSCCCCC(=O)C 62a_100000735457_100000210317 [0,1,0,0,0,0|1,0,0]=2 6543 B15R0.164 CCCCCCCCSCCCCC(C)C 62a_100000210759_100011216152 [0,1,0,0,0,0|2,0,1]=4 6544 B15R0.164 CCCCCCCCSCCCCC(C)C 62a_100011216152_100000210317 [0,1,0,0,0,0|2,0,1]=4 6545 B15R0.164 CCCCCCCCSCCCCN(C)C 62a_100000210759_100000690147 [0,1,0,0,0,0|3,0,0]=4 6546 B15R0.164 CCCCCCCCSCCCOC(=O)C 62a_100000042594_100000210317 [0,1,0,0,0,0|2,0,0]=3 6547 B15R0.164 CCCCCCCCSCCCOC(=O)C 62a_100000210759_100000042594 [0,1,0,0,0,0|2,0,0]=3 6548 B15R0.164 CCCCCCCCSCCCOC(=S)C 62a_100000210759_200135323944 [0,1,0,0,0,0|2,1,0]=4 6549 B15R0.164 CCCCCCCCSCCCOC(=S)C 62a_200135323944_100000210317 [0,1,0,0,0,0|2,1,0]=4 6550 B15R0.164 CCCCCCCCSCCCSC(=O)C 62a_100000038929_100000210317 [0,1,0,0,0,0|2,0,0]=3 6551 B15R0.164 CCCCCCCCSCCCSC(=O)C 62a_100000210759_100000038929 [0,1,0,0,0,0|2,0,0]=3 6552 B15R0.164 CCCCCCCCSCCOCC(=O)N 62a_100000076697_100000210317 [0,1,0,0,0,0|2,0,0]=3 6553 B15R0.164 CCCCCCCCSCCOCC(=O)N 62a_100000210759_100000076697 [0,1,0,0,0,0|2,0,0]=3 6554 B15R0.164 CCCCCCCNCCCCCB(O)O 2230a_100000229938_200009817188 [0,1,0,0,0,0|2,0,1]=4 6555 B15R0.164 CCCCCCCNCCCCCC(=O)N 2230a_100000229938_100009817443 [0,1,0,0,0,0|1,0,0]=2 6556 B15R0.164 CCCCCCCNCCCCCC(C)C 2230a_100000229938_100000210682 [0,1,0,0,0,0|2,0,1]=4 6557 B15R0.164 CCCCCCCNCCCCCC(C)C 2230a_100011290863_100000210681 [0,1,0,0,0,0|2,0,1]=4 6558 B15R0.164 CCCCCCCNCCCCCC(C)C 34a_100011290863_100000210614 [0,1,0,0,0,0|2,0,1]=4 6559 B15R0.164 CCCCCCCNCCCCNC(=O)C 2230a_200011368371_100000210681 [0,1,0,0,0,0|2,0,0]=3 6560 B15R0.164 CCCCCCCNCCCCNC(=O)C 34a_200011368371_100000210614 [0,1,0,0,0,0|2,0,0]=3 6561 B15R0.164 CCCCCCCNCCCCSC(=O)C 2230a_100000229938_200010402107 [0,1,0,0,0,0|2,0,0]=3 6562 B15R0.164 CCCCCCCOCCCCCB(O)O 34a_100000210272_200009817188 [0,1,0,0,0,0|2,0,1]=4 6563 B15R0.164 CCCCCCCOCCCCCB(O)O 7a_100000210272_200009817188 [0,1,0,0,0,0|2,0,1]=4 6564 B15R0.164 CCCCCCCOCCCCCC(=O)N 34a_100000123541_100000210614 [0,1,0,0,0,0|1,0,0]=2 6565 B15R0.164 CCCCCCCOCCCCCC(=O)N 34a_100000210272_100009817443 [0,1,0,0,0,0|1,0,0]=2 6566 B15R0.164 CCCCCCCOCCCCCC(=O)N 7a_100000123541_100000210614 [0,1,0,0,0,0|1,0,0]=2 6567 B15R0.164 CCCCCCCOCCCCCC(=O)N 7a_100000210272_100009817443 [0,1,0,0,0,0|1,0,0]=2 6568 B15R0.164 CCCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210614 [0,1,0,0,0,0|1,0,0]=2 6569 B15R0.164 CCCCCCCOCCCCCC(C)C 34a_100000210272_100000210682 [0,1,0,0,0,0|2,0,1]=4 6570 B15R0.164 CCCCCCCOCCCCCC(C)C 34a_100011995859_100000210614 [0,1,0,0,0,0|2,0,1]=4 6571 B15R0.164 CCCCCCCOCCCCCC(C)C 7a_100000210272_100000210682 [0,1,0,0,0,0|2,0,1]=4 6572 B15R0.164 CCCCCCCOCCCCCC(C)C 7a_100011995859_100000210614 [0,1,0,0,0,0|2,0,1]=4 6573 B15R0.164 CCCCCCCOCCCCOC(=O)C 34a_100000073216_100000210614 [0,1,0,0,0,0|2,0,0]=3 6574 B15R0.164 CCCCCCCOCCCCOC(=O)C 34a_100000210272_100000033659 [0,1,0,0,0,0|2,0,0]=3 6575 B15R0.164 CCCCCCCOCCCCOC(=O)C 7a_100000073216_100000210614 [0,1,0,0,0,0|2,0,0]=3 6576 B15R0.164 CCCCCCCOCCCCOC(=O)C 7a_100000210272_100000033659 [0,1,0,0,0,0|2,0,0]=3 6577 B15R0.164 CCCCCCCOCCCCO[N+](=O)[O-] 34a_100000210272_100015694321 [0,1,0,0,0,0|3,0,0]=4 6578 B15R0.164 CCCCCCCOCCCCO[N+](=O)[O-] 7a_100000210272_100015694321 [0,1,0,0,0,0|3,0,0]=4 6579 B15R0.164 CCCCCCCOCCCCSC(=O)C 34a_100000210272_200010402107 [0,1,0,0,0,0|2,0,0]=3 6580 B15R0.164 CCCCCCCOCCCCSC(=O)C 7a_100000210272_200010402107 [0,1,0,0,0,0|2,0,0]=3 6581 B15R0.164 CCCCCCCOCOCCOC(=O)C 34a_100000210272_100000076355 [0,1,0,0,0,0|3,0,0]=4 6582 B15R0.164 CCCCCCCSCCCCCB(O)O 62a_100000210614_200009817188 [0,1,0,0,0,0|2,0,1]=4 6583 B15R0.164 CCCCCCCSCCCCCB(O)O 62a_200009817188_100000210316 [0,1,0,0,0,0|2,0,1]=4 6584 B15R0.164 CCCCCCCSCCCCCC(=O)N 62a_100000210614_100009817443 [0,1,0,0,0,0|1,0,0]=2 6585 B15R0.164 CCCCCCCSCCCCCC(=O)N 62a_100009817443_100000210316 [0,1,0,0,0,0|1,0,0]=2 6586 B15R0.164 CCCCCCCSCCCCCC(C)C 62a_100000210614_100000210682 [0,1,0,0,0,0|2,0,1]=4 6587 B15R0.164 CCCCCCCSCCCCCC(C)C 62a_100000210682_100000210316 [0,1,0,0,0,0|2,0,1]=4 6588 B15R0.164 CCCCCCCSCCCCOC(=O)C 62a_100000033659_100000210316 [0,1,0,0,0,0|2,0,0]=3 6589 B15R0.164 CCCCCCCSCCCCOC(=O)C 62a_100000210614_100000033659 [0,1,0,0,0,0|2,0,0]=3 6590 B15R0.164 CCCCCCCSCCCCO[N+](=O)[O-] 62a_100000210614_100015694321 [0,1,0,0,0,0|3,0,0]=4 6591 B15R0.164 CCCCCCCSCCCCSC(=O)C 62a_100000210614_200010402107 [0,1,0,0,0,0|2,0,0]=3 6592 B15R0.164 CCCCCCCSCCCCSC(=O)C 62a_200010402107_100000210316 [0,1,0,0,0,0|2,0,0]=3 6593 B15R0.164 CCCCCCCSCOCCOC(=O)C 62a_100000076355_100000210316 [0,1,0,0,0,0|3,0,0]=4 6594 B15R0.164 CCCCCCCSCOCCOC(=O)C 62a_100000210614_100000076355 [0,1,0,0,0,0|3,0,0]=4 6595 B15R0.164 CCCCCCNCCCCCCB(O)O 2230a_100000210581_100009817187 [0,1,0,0,0,0|2,0,1]=4 6596 B15R0.164 CCCCCCNCCCCCCC(C)C 2230a_100000211014_100000210314 [0,1,0,0,0,0|2,0,1]=4 6597 B15R0.164 CCCCCCNCCCCCCC(C)C 34a_100000211014_100000210314 [0,1,0,0,0,0|2,0,1]=4 6598 B15R0.164 CCCCCCNCCCCCNC(=O)C 2230a_200012022750_100000210314 [0,1,0,0,0,0|2,0,0]=3 6599 B15R0.164 CCCCCCNCCCCCNC(=O)C 34a_200012022750_100000210314 [0,1,0,0,0,0|2,0,0]=3 6600 B15R0.164 CCCCCCNCCCCCOC(=O)C 2230a_100000210581_100009813381 [0,1,0,0,0,0|2,0,0]=3 6601 B15R0.164 CCCCCCNCCOCCOC(=O)C 2230a_100000210581_200000083610 [0,1,0,0,0,0|3,0,0]=4 6602 B15R0.164 CCCCCCOCCCCCCB(O)O 34a_100000210259_100009817187 [0,1,0,0,0,0|2,0,1]=4 6603 B15R0.164 CCCCCCOCCCCCCB(O)O 7a_100000210259_100009817187 [0,1,0,0,0,0|2,0,1]=4 6604 B15R0.164 CCCCCCOCCCCCOC(=O)C 34a_100000210259_100000033007 [0,1,0,0,0,0|2,0,0]=3 6605 B15R0.164 CCCCCCOCCCCCOC(=O)C 7a_100000210259_100000033007 [0,1,0,0,0,0|2,0,0]=3 6606 B15R0.164 CCCCCCOCCOCCCC(=O)C 34a_100000691444_100000685027 [0,1,0,0,0,0|2,0,0]=3 6607 B15R0.164 CCCCCCOCCOCCCC(=O)C 7a_100000691444_100011215641 [0,1,0,0,0,0|2,0,0]=3 6608 B15R0.164 CCCCCCOCCOCCCC(=O)N 34a_100000691444_100102525003 [0,1,0,0,0,0|2,0,0]=3 6609 B15R0.164 CCCCCCOCCOCCCC(=O)N 7a_100000691444_100102525003 [0,1,0,0,0,0|2,0,0]=3 6610 B15R0.164 CCCCCCOCCOCCNC(=O)C 7a_100000691444_100000189650 [0,1,0,0,0,0|3,0,0]=4 6611 B15R0.164 CCCCCCOCCOCCNC(=O)N 7a_100000691444_200000034859 [0,1,0,0,0,0|3,0,0]=4 6612 B15R0.164 CCCCCCOCCOCCOC(=O)C 34a_100000210259_200000083610 [0,1,0,0,0,0|3,0,0]=4 6613 B15R0.164 CCCCCCOCCOCCOC(=O)C 34a_100000691444_100009814007 [0,1,0,0,0,0|3,0,0]=4 6614 B15R0.164 CCCCCCOCCOCCOC(=O)C 7a_100000210259_200000083610 [0,1,0,0,0,0|3,0,0]=4 6615 B15R0.164 CCCCCCOCCOCCOC(=O)C 7a_100000691444_100009814007 [0,1,0,0,0,0|3,0,0]=4 6616 B15R0.164 CCCCCCOCCOCCOC(=O)N 34a_100000691444_200011214921 [0,1,0,0,0,0|3,0,0]=4 6617 B15R0.164 CCCCCCOCCOCCOC(=O)N 7a_100000691444_200011214921 [0,1,0,0,0,0|3,0,0]=4 6618 B15R0.164 CCCCCCSCCCCCCB(O)O 62a_100000210314_100009817187 [0,1,0,0,0,0|2,0,1]=4 6619 B15R0.164 CCCCCCSCCCCCCB(O)O 62a_100009817187_100000210757 [0,1,0,0,0,0|2,0,1]=4 6620 B15R0.164 CCCCCCSCCCCCOC(=O)C 62a_100000033007_100000210757 [0,1,0,0,0,0|2,0,0]=3 6621 B15R0.164 CCCCCCSCCCCCOC(=O)C 62a_100000210314_100000033007 [0,1,0,0,0,0|2,0,0]=3 6622 B15R0.164 CCCCCCSCCOCCOC(=O)C 62a_100000210314_200000083610 [0,1,0,0,0,0|3,0,0]=4 6623 B15R0.164 CCCCCCSCCOCCOC(=O)C 62a_200000083610_100000210757 [0,1,0,0,0,0|3,0,0]=4 6624 B15R0.164 CCCCCNCCCCCCNC(=O)C 2230a_200011996284_100000210326 [0,1,0,0,0,0|2,0,0]=3 6625 B15R0.164 CCCCCNCCCCCCNC(=O)C 34a_200011996284_100000718602 [0,1,0,0,0,0|2,0,0]=3 6626 B15R0.164 CCCCCNCCOCCCCC(=O)C 34a_100000224656_100009817362 [0,1,0,0,0,0|2,0,0]=3 6627 B15R0.164 CCCCCNCCOCCCOC(=O)C 34a_100000224656_100000042594 [0,1,0,0,0,0|3,0,0]=4 6628 B15R0.164 CCCCCNCCOCCCSC(=O)C 34a_100000224656_100000038929 [0,1,0,0,0,0|3,0,0]=4 6629 B15R0.164 CCCCCNCCOCCOCC(=O)N 34a_100000224656_100000076697 [0,1,0,0,0,0|3,0,0]=4 6630 B15R0.164 CCCCCNCCOCCOCC(=O)O 269956a_100009854275_100000210326 [0,1,0,0,0,0|3,0,0]=4 6631 B15R0.164 CCCCCOCCCCCCCC(C)C 34a_200000210741_100000718602 [0,1,0,0,0,0|2,0,1]=4 6632 B15R0.164 CCCCCOCCCCCCCC(C)C 7a_200000210741_100000210326 [0,1,0,0,0,0|2,0,1]=4 6633 B15R0.164 CCCCCOCCOCCCCC(=O)C 34a_100011215259_100009817362 [0,1,0,0,0,0|2,0,0]=3 6634 B15R0.164 CCCCCOCCOCCCCC(=O)C 7a_100011215259_100000735457 [0,1,0,0,0,0|2,0,0]=3 6635 B15R0.164 CCCCCOCCOCCCOC(=O)C 34a_100011215259_100000042594 [0,1,0,0,0,0|3,0,0]=4 6636 B15R0.164 CCCCCOCCOCCCOC(=O)C 7a_100011215259_100000042594 [0,1,0,0,0,0|3,0,0]=4 6637 B15R0.164 CCCCCOCCOCCCSC(=O)C 34a_100011215259_100000038929 [0,1,0,0,0,0|3,0,0]=4 6638 B15R0.164 CCCCCOCCOCCCSC(=O)C 7a_100011215259_100000038929 [0,1,0,0,0,0|3,0,0]=4 6639 B15R0.164 CCCCCOCCOCCOCC(=O)N 34a_100011215259_100000076697 [0,1,0,0,0,0|3,0,0]=4 6640 B15R0.164 CCCCCOCCOCCOCC(=O)N 7a_100011215259_100000076697 [0,1,0,0,0,0|3,0,0]=4 6641 B15R0.164 CCCCNCCCCOCCCC(=O)C 34a_200011216965_100000685027 [0,1,0,0,0,0|2,0,0]=3 6642 B15R0.164 CCCCNCCCCOCCCC(=O)N 34a_200011216965_100102525003 [0,1,0,0,0,0|2,0,0]=3 6643 B15R0.164 CCCCNCCCCOCCOC(=O)C 34a_200011216965_100009814007 [0,1,0,0,0,0|3,0,0]=4 6644 B15R0.164 CCCCNCCCCOCCOC(=O)N 34a_200011216965_200011214921 [0,1,0,0,0,0|3,0,0]=4 6645 B15R0.164 CCCCOCCCCOCCCC(=O)C 34a_200000760531_100000685027 [0,1,0,0,0,0|2,0,0]=3 6646 B15R0.164 CCCCOCCCCOCCCC(=O)C 7a_200000760531_100011215641 [0,1,0,0,0,0|2,0,0]=3 6647 B15R0.164 CCCCOCCCCOCCCC(=O)N 34a_200000760531_100102525003 [0,1,0,0,0,0|2,0,0]=3 6648 B15R0.164 CCCCOCCCCOCCCC(=O)N 7a_200000760531_100102525003 [0,1,0,0,0,0|2,0,0]=3 6649 B15R0.164 CCCCOCCCCOCCNC(=O)C 7a_200000760531_100000189650 [0,1,0,0,0,0|3,0,0]=4 6650 B15R0.164 CCCCOCCCCOCCNC(=O)N 7a_200000760531_200000034859 [0,1,0,0,0,0|3,0,0]=4 6651 B15R0.164 CCCCOCCCCOCCOC(=O)C 34a_200000760531_100009814007 [0,1,0,0,0,0|3,0,0]=4 6652 B15R0.164 CCCCOCCCCOCCOC(=O)C 7a_200000760531_100009814007 [0,1,0,0,0,0|3,0,0]=4 6653 B15R0.164 CCCCOCCCCOCCOC(=O)N 34a_200000760531_200011214921 [0,1,0,0,0,0|3,0,0]=4 6654 B15R0.164 CCCCOCCCCOCCOC(=O)N 7a_200000760531_200011214921 [0,1,0,0,0,0|3,0,0]=4 6655 B15R0.164 CCCCOCCCNCCCCC(=O)C 34a_200000211371_100009817362 [0,1,0,0,0,0|2,0,0]=3 6656 B15R0.164 CCCCOCCCNCCCOC(=O)C 34a_200000211371_100000042594 [0,1,0,0,0,0|3,0,0]=4 6657 B15R0.164 CCCCOCCCNCCCSC(=O)C 2230a_200000211371_100000038929 [0,1,0,0,0,0|3,0,0]=4 6658 B15R0.164 CCCCOCCCNCCCSC(=O)C 34a_200000211371_100000038929 [0,1,0,0,0,0|3,0,0]=4 6659 B15R0.164 CCCCOCCCNCCOCC(=O)N 2230a_200000211371_100000076697 [0,1,0,0,0,0|3,0,0]=4 6660 B15R0.164 CCCCOCCCNCCOCC(=O)N 34a_200000211371_100000076697 [0,1,0,0,0,0|3,0,0]=4 6661 B15R0.164 CCCCOCCCOCCCCC(=O)C 34a_200011215613_100009817362 [0,1,0,0,0,0|2,0,0]=3 6662 B15R0.164 CCCCOCCCOCCCCC(=O)C 7a_200011215613_100000735457 [0,1,0,0,0,0|2,0,0]=3 6663 B15R0.164 CCCCOCCCOCCCOC(=O)C 34a_200011215613_100000042594 [0,1,0,0,0,0|3,0,0]=4 6664 B15R0.164 CCCCOCCCOCCCOC(=O)C 7a_200011215613_100000042594 [0,1,0,0,0,0|3,0,0]=4 6665 B15R0.164 CCCCOCCCOCCCSC(=O)C 34a_200011215613_100000038929 [0,1,0,0,0,0|3,0,0]=4 6666 B15R0.164 CCCCOCCCOCCCSC(=O)C 7a_200011215613_100000038929 [0,1,0,0,0,0|3,0,0]=4 6667 B15R0.164 CCCCOCCCOCCOCC(=O)N 34a_200011215613_100000076697 [0,1,0,0,0,0|3,0,0]=4 6668 B15R0.164 CCCCOCCCOCCOCC(=O)N 7a_200011215613_100000076697 [0,1,0,0,0,0|3,0,0]=4 6669 B15R0.164 CCCCOCCNCCCCNC(=O)C 2230a_200011368371_100000743108 [0,1,0,0,0,0|3,0,0]=4 6670 B15R0.164 CCCCOCCNCCCCNC(=O)C 34a_200011368371_100000743108 [0,1,0,0,0,0|3,0,0]=4 6671 B15R0.164 CCCCOCCOCCCCCC(=O)N 34a_100000123541_100000743108 [0,1,0,0,0,0|2,0,0]=3 6672 B15R0.164 CCCCOCCOCCCCCC(=O)N 34a_100000210238_100009817443 [0,1,0,0,0,0|2,0,0]=3 6673 B15R0.164 CCCCOCCOCCCCCC(=O)N 7a_100000123541_100000743108 [0,1,0,0,0,0|2,0,0]=3 6674 B15R0.164 CCCCOCCOCCCCCC(=O)N 7a_100000210238_100009817443 [0,1,0,0,0,0|2,0,0]=3 6675 B15R0.164 CCCCOCCOCCCCCC(=O)[O-] 7a_100102619762_100000743108 [0,1,0,0,0,0|2,0,0]=3 6676 B15R0.164 CCCCOCCOCCCCOC(=O)C 34a_100000073216_100000743108 [0,1,0,0,0,0|3,0,0]=4 6677 B15R0.164 CCCCOCCOCCCCOC(=O)C 34a_100000210238_100000033659 [0,1,0,0,0,0|3,0,0]=4 6678 B15R0.164 CCCCOCCOCCCCOC(=O)C 7a_100000073216_100000743108 [0,1,0,0,0,0|3,0,0]=4 6679 B15R0.164 CCCCOCCOCCCCOC(=O)C 7a_100000210238_100000033659 [0,1,0,0,0,0|3,0,0]=4 6680 B15R0.164 CCCCOCCOCCCCSC(=O)C 34a_100000210238_200010402107 [0,1,0,0,0,0|3,0,0]=4 6681 B15R0.164 CCCCOCCOCCCCSC(=O)C 7a_100000210238_200010402107 [0,1,0,0,0,0|3,0,0]=4 6682 B15R0.164 CCCCOCCOCCOCCC(=O)C 7a_100011215186_100000053229 [0,1,0,0,0,0|3,0,0]=4 6683 B15R0.164 CCCCOCCOCCOCCC(=O)N 34a_100011215186_100000731001 [0,1,0,0,0,0|3,0,0]=4 6684 B15R0.164 CCCCOCCOCCOCCC(=O)N 7a_100011215186_100000744528 [0,1,0,0,0,0|3,0,0]=4 6685 B15R0.164 CCCCOCCSCCCCCC(=O)N 62a_100000743108_100009817443 [0,1,0,0,0,0|2,0,0]=3 6686 B15R0.164 CCCCOCCSCCCCCC(=O)N 62a_100009817443_100000743108 [0,1,0,0,0,0|2,0,0]=3 6687 B15R0.164 CCCCOCCSCCCCOC(=O)C 62a_100000033659_100000743108 [0,1,0,0,0,0|3,0,0]=4 6688 B15R0.164 CCCCOCCSCCCCOC(=O)C 62a_100000743108_100000033659 [0,1,0,0,0,0|3,0,0]=4 6689 B15R0.164 CCCCOCCSCCCCSC(=O)C 62a_100000743108_200010402107 [0,1,0,0,0,0|3,0,0]=4 6690 B15R0.164 CCCCOCCSCCCCSC(=O)C 62a_200010402107_100000743108 [0,1,0,0,0,0|3,0,0]=4 6691 B15R0.164 CCCCOCNCCCCCNC(=O)C 2230a_200012022750_100011995733 [0,1,0,0,0,0|3,0,0]=4 6692 B15R0.164 CCCCOCNCCCCCNC(=O)C 34a_200012022750_100011995733 [0,1,0,0,0,0|3,0,0]=4 6693 B15R0.164 CCCCOCSCCCCCOC(=O)C 62a_100000033007_100011995733 [0,1,0,0,0,0|3,0,0]=4 6694 B15R0.164 CCCCOCSCCCCCOC(=O)C 62a_100011995733_100000033007 [0,1,0,0,0,0|3,0,0]=4 6695 B15R0.164 CCCCSCCNCCCCCC(=O)N 2230a_100025743550_100009817443 [0,1,0,0,0,0|2,0,0]=3 6696 B15R0.164 CCCCSCCNCCCCSC(=O)C 2230a_100025743550_200010402107 [0,1,0,0,0,0|3,0,0]=4 6697 B15R0.164 CCCCSCCOCCCCCC(=O)N 34a_200000230436_100009817443 [0,1,0,0,0,0|2,0,0]=3 6698 B15R0.164 CCCCSCCOCCCCCC(=O)N 7a_200000230436_100009817443 [0,1,0,0,0,0|2,0,0]=3 6699 B15R0.164 CCCCSCCOCCCCOC(=O)C 34a_200000230436_100000033659 [0,1,0,0,0,0|3,0,0]=4 6700 B15R0.164 CCCCSCCOCCCCOC(=O)C 7a_200000230436_100000033659 [0,1,0,0,0,0|3,0,0]=4 6701 B15R0.164 CCCCSCCOCCCCSC(=O)C 34a_200000230436_200010402107 [0,1,0,0,0,0|3,0,0]=4 6702 B15R0.164 CCCCSCCOCCCCSC(=O)C 7a_200000230436_200010402107 [0,1,0,0,0,0|3,0,0]=4 6703 B15R0.164 CCCOCCCNCCCCCC(=O)N 2230a_100011217757_100009817443 [0,1,0,0,0,0|2,0,0]=3 6704 B15R0.164 CCCOCCCNCCCCCC(=O)N 34a_100011217757_100009817443 [0,1,0,0,0,0|2,0,0]=3 6705 B15R0.164 CCCOCCCNCCCCOC(=O)C 34a_100011217757_100000033659 [0,1,0,0,0,0|3,0,0]=4 6706 B15R0.164 CCCOCCCNCCCCSC(=O)C 2230a_100011217757_200010402107 [0,1,0,0,0,0|3,0,0]=4 6707 B15R0.164 CCCOCCCNCCCCSC(=O)C 34a_100011217757_200010402107 [0,1,0,0,0,0|3,0,0]=4 6708 B15R0.164 CCCOCCNCCCCCNC(=O)C 2230a_200012022750_100011215938 [0,1,0,0,0,0|3,0,0]=4 6709 B15R0.164 CCCOCCNCCCCCNC(=O)C 34a_200012022750_100011215938 [0,1,0,0,0,0|3,0,0]=4 6710 B15R0.164 CCCOCCNCCCCCOC(=O)C 2230a_100161115042_100009813381 [0,1,0,0,0,0|3,0,0]=4 6711 B15R0.164 CCCOCCNCCCCCOC(=O)C 34a_100161115042_100000033007 [0,1,0,0,0,0|3,0,0]=4 6712 B15R0.164 CCCOCCOCCCCCOC(=O)C 34a_100000752267_100000033007 [0,1,0,0,0,0|3,0,0]=4 6713 B15R0.164 CCCOCCOCCCCCOC(=O)C 7a_100000752267_100000033007 [0,1,0,0,0,0|3,0,0]=4 6714 B15R0.164 CCCOCCOCCNCCCC(=O)C 34a_200011904461_100000685027 [0,1,0,0,0,0|3,0,0]=4 6715 B15R0.164 CCCOCCOCCNCCCC(=O)N 34a_200011904461_100102525003 [0,1,0,0,0,0|3,0,0]=4 6716 B15R0.164 CCCOCCSCCCCCOC(=O)C 62a_100000033007_100011215938 [0,1,0,0,0,0|3,0,0]=4 6717 B15R0.164 CCCOCCSCCCCCOC(=O)C 62a_100011215938_100000033007 [0,1,0,0,0,0|3,0,0]=4 6718 B15R0.164 CCCSCCNCCCCCOC(=O)C 2230a_100020603323_100009813381 [0,1,0,0,0,0|3,0,0]=4 6719 B15R0.164 CCCSCCOCCCCCOC(=O)C 34a_200000230433_100000033007 [0,1,0,0,0,0|3,0,0]=4 6720 B15R0.164 CCCSCCOCCCCCOC(=O)C 7a_200000230433_100000033007 [0,1,0,0,0,0|3,0,0]=4 6721 B15R0.164 CCNCCCCCCCCCCC(=O)N 2230a_100015525214_200010167045 [0,1,0,0,0,0|1,0,0]=2 6722 B15R0.164 CCOCCCCCCCCCCC(=O)N 34a_100121572206_200010167045 [0,1,0,0,0,0|1,0,0]=2 6723 B15R0.164 CCOCCCNCCCCCNC(=O)C 2230a_200012022750_100012232248 [0,1,0,0,0,0|3,0,0]=4 6724 B15R0.164 CCOCCCNCCCCCNC(=O)C 34a_200012022750_100012232248 [0,1,0,0,0,0|3,0,0]=4 6725 B15R0.164 CCOCCCNCCCCCOC(=O)C 2230a_100000210961_100009813381 [0,1,0,0,0,0|3,0,0]=4 6726 B15R0.164 CCOCCCNCCCCCOC(=O)C 34a_100000210961_100000033007 [0,1,0,0,0,0|3,0,0]=4 6727 B15R0.164 CCOCCCOCCCCCOC(=O)C 34a_100000757476_100000033007 [0,1,0,0,0,0|3,0,0]=4 6728 B15R0.164 CCOCCCOCCCCCOC(=O)C 7a_100000757476_100000033007 [0,1,0,0,0,0|3,0,0]=4 6729 B15R0.164 CCOCCCSCCCCCOC(=O)C 62a_100000033007_100012232248 [0,1,0,0,0,0|3,0,0]=4 6730 B15R0.164 CCOCCCSCCCCCOC(=O)C 62a_100012232248_100000033007 [0,1,0,0,0,0|3,0,0]=4 6731 B15R0.164 CCOCCNCCCCCCNC(=O)C 2230a_200011996284_100011215890 [0,1,0,0,0,0|3,0,0]=4 6732 B15R0.164 CCOCCNCCCCCCNC(=O)C 34a_200011996284_100000210147 [0,1,0,0,0,0|3,0,0]=4 6733 B15R0.164 CCOCCOCCNCCCCC(=O)C 34a_100102712874_100009817362 [0,1,0,0,0,0|3,0,0]=4 6734 B15R0.164 CCOCCOCCNCCCCC(=O)N 34a_100000696515_100011211534 [0,1,0,0,0,0|3,0,0]=4 6735 B15R0.164 CCOCCOCCOCCCCC(=O)C 34a_100000210240_100009817362 [0,1,0,0,0,0|3,0,0]=4 6736 B15R0.164 CCOCCOCCOCCCCC(=O)C 7a_100000210240_100000735457 [0,1,0,0,0,0|3,0,0]=4 6737 B15R0.164 CCOCCOCCOCCCCC(=O)N 34a_100012022536_100011211534 [0,1,0,0,0,0|3,0,0]=4 6738 B15R0.164 CCOCCOCCOCCCCC(=O)N 7a_100012022536_100011211534 [0,1,0,0,0,0|3,0,0]=4 6739 B15R0.164 CCOCCOCCSCCCCC(=O)C 62a_100000735457_100011211534 [0,1,0,0,0,0|3,0,0]=4 6740 B15R0.164 CCOCCOCCSCCCCC(=O)C 62a_100011211534_100000735457 [0,1,0,0,0,0|3,0,0]=4 6741 B15R0.164 CCSCCCCCCCCCCC(=O)N 62a_100000210202_200010167045 [0,1,0,0,0,0|1,0,0]=2 6742 B15R0.164 CCSCCCCCCCCCCC(=O)N 62a_200010167045_100000210202 [0,1,0,0,0,0|1,0,0]=2 6743 B15R0.164 CCSCCCOCCCCCOC(=O)C 34a_100011216438_100000033007 [0,1,0,0,0,0|3,0,0]=4 6744 B15R0.164 CCSCCCOCCCCCOC(=O)C 7a_100011216438_100000033007 [0,1,0,0,0,0|3,0,0]=4 6745 B15R0.164 CCSCCNCCCCCCNC(=O)C 2230a_200011996284_100000757381 [0,1,0,0,0,0|3,0,0]=4 6746 B15R0.164 CCSCCNCCCCCCNC(=O)C 34a_200011996284_100000757381 [0,1,0,0,0,0|3,0,0]=4 6747 B15R0.164 CN(C)CCCCCCCCCCCCO 2230a_100102631434_100009813331 [0,1,0,0,0,0|1,0,2]=4 6748 B15R0.164 CN(C)CCCCCCCCCCCCO 269982a_100102631434_100009813331 [0,1,0,0,0,0|1,0,2]=4 6749 B15R0.164 CNCCCCCOCCCCCC(=O)N 34a_100000722520_100009817443 [0,1,0,0,0,0|2,0,0]=3 6750 B15R0.164 CNCCCCCOCCCCCC(C)C 34a_100000722520_100000210682 [0,1,0,0,0,0|3,0,0]=4 6751 B15R0.164 CNCCCCCOCCCCOC(=O)C 34a_100000722520_100000033659 [0,1,0,0,0,0|3,0,0]=4 6752 B15R0.164 CNCCCCCOCCCCSC(=O)C 34a_100000722520_200010402107 [0,1,0,0,0,0|3,0,0]=4 6753 B15R0.164 CNCCOCCOCCCCCC(=O)N 34a_100000228057_100009817443 [0,1,0,0,0,0|3,0,0]=4 6754 B15R0.164 COCCCCCCNCCCCC(=O)N 34a_100000696515_100011998445 [0,1,0,0,0,0|2,0,0]=3 6755 B15R0.164 COCCCCCCNCCCNC(=O)C 34a_100000736810_100011998445 [0,1,0,0,0,0|3,0,0]=4 6756 B15R0.164 COCCCCCCNCCOCC(=O)O 269956a_100000700818_100011998445 [0,1,0,0,0,0|3,0,0]=4 6757 B15R0.164 COCCCCCCOCCCCC(=O)C 34a_200012092642_100009817362 [0,1,0,0,0,0|2,0,0]=3 6758 B15R0.164 COCCCCCCOCCCCC(=O)C 7a_200012092642_100000735457 [0,1,0,0,0,0|2,0,0]=3 6759 B15R0.164 COCCCCCCOCCCCC(=O)N 34a_100012022536_100011998445 [0,1,0,0,0,0|2,0,0]=3 6760 B15R0.164 COCCCCCCOCCCCC(=O)N 7a_100012022536_100011998445 [0,1,0,0,0,0|2,0,0]=3 6761 B15R0.164 COCCCCCCOCCCCC(C)C 34a_100011214890_100011998445 [0,1,0,0,0,0|3,0,0]=4 6762 B15R0.164 COCCCCCCOCCCCC(C)C 34a_200012092642_100011216152 [0,1,0,0,0,0|3,0,0]=4 6763 B15R0.164 COCCCCCCOCCCCC(C)C 7a_100011214890_100011998445 [0,1,0,0,0,0|3,0,0]=4 6764 B15R0.164 COCCCCCCOCCCCC(C)C 7a_200012092642_100011216152 [0,1,0,0,0,0|3,0,0]=4 6765 B15R0.164 COCCCCCCOCCCC[N+](=O)[O-] 34a_200015379883_100011998445 [0,1,0,0,0,0|3,0,0]=4 6766 B15R0.164 COCCCCCCOCCCC[N+](=O)[O-] 7a_200015379883_100011998445 [0,1,0,0,0,0|3,0,0]=4 6767 B15R0.164 COCCCCCCOCCCNC(=O)C 34a_100000752032_100011998445 [0,1,0,0,0,0|3,0,0]=4 6768 B15R0.164 COCCCCCCOCCCOC(=O)C 34a_200012092642_100000042594 [0,1,0,0,0,0|3,0,0]=4 6769 B15R0.164 COCCCCCCOCCCOC(=O)C 7a_200012092642_100000042594 [0,1,0,0,0,0|3,0,0]=4 6770 B15R0.164 COCCCCCCOCCCSC(=O)C 34a_200012092642_100000038929 [0,1,0,0,0,0|3,0,0]=4 6771 B15R0.164 COCCCCCCOCCCSC(=O)C 7a_200012092642_100000038929 [0,1,0,0,0,0|3,0,0]=4 6772 B15R0.164 COCCCCCCOCCOCC(=O)N 34a_200012092642_100000076697 [0,1,0,0,0,0|3,0,0]=4 6773 B15R0.164 COCCCCCCOCCOCC(=O)N 7a_200012092642_100000076697 [0,1,0,0,0,0|3,0,0]=4 6774 B15R0.164 COCCCCCCSCCCCC(=O)C 62a_100000735457_100011998445 [0,1,0,0,0,0|2,0,0]=3 6775 B15R0.164 COCCCCCCSCCCCC(=O)C 62a_100011998445_100000735457 [0,1,0,0,0,0|2,0,0]=3 6776 B15R0.164 COCCCCCCSCCCCC(C)C 62a_100011216152_100011998445 [0,1,0,0,0,0|3,0,0]=4 6777 B15R0.164 COCCCCCCSCCCCC(C)C 62a_100011998445_100011216152 [0,1,0,0,0,0|3,0,0]=4 6778 B15R0.164 COCCCCCCSCCCOC(=O)C 62a_100000042594_100011998445 [0,1,0,0,0,0|3,0,0]=4 6779 B15R0.164 COCCCCCCSCCCOC(=O)C 62a_100011998445_100000042594 [0,1,0,0,0,0|3,0,0]=4 6780 B15R0.164 COCCCCCCSCCCSC(=O)C 62a_100000038929_100011998445 [0,1,0,0,0,0|3,0,0]=4 6781 B15R0.164 COCCCCCCSCCCSC(=O)C 62a_100011998445_100000038929 [0,1,0,0,0,0|3,0,0]=4 6782 B15R0.164 COCCCCCCSCCOCC(=O)N 62a_100000076697_100011998445 [0,1,0,0,0,0|3,0,0]=4 6783 B15R0.164 COCCCCCCSCCOCC(=O)N 62a_100011998445_100000076697 [0,1,0,0,0,0|3,0,0]=4 6784 B15R0.164 COCCCCCNCCCCCC(=O)N 2230a_100000747528_100009817443 [0,1,0,0,0,0|2,0,0]=3 6785 B15R0.164 COCCCCCNCCCCCC(=O)N 34a_100000747528_100009817443 [0,1,0,0,0,0|2,0,0]=3 6786 B15R0.164 COCCCCCNCCCCCC(C)C 2230a_100000747528_100000210682 [0,1,0,0,0,0|3,0,0]=4 6787 B15R0.164 COCCCCCNCCCCCC(C)C 34a_100000747528_100000210682 [0,1,0,0,0,0|3,0,0]=4 6788 B15R0.164 COCCCCCNCCCCOC(=O)C 34a_100000747528_100000033659 [0,1,0,0,0,0|3,0,0]=4 6789 B15R0.164 COCCCCCNCCCCSC(=O)C 2230a_100000747528_200010402107 [0,1,0,0,0,0|3,0,0]=4 6790 B15R0.164 COCCCCCNCCCCSC(=O)C 34a_100000747528_200010402107 [0,1,0,0,0,0|3,0,0]=4 6791 B15R0.164 COCCCCNCCCCCCC(C)C 2230a_100000211014_100000730899 [0,1,0,0,0,0|3,0,0]=4 6792 B15R0.164 COCCCCNCCCCCCC(C)C 34a_100000211014_100000755781 [0,1,0,0,0,0|3,0,0]=4 6793 B15R0.164 COCCCCNCCCCCNC(=O)C 2230a_200012022750_100000730899 [0,1,0,0,0,0|3,0,0]=4 6794 B15R0.164 COCCCCNCCCCCNC(=O)C 34a_200012022750_100000755781 [0,1,0,0,0,0|3,0,0]=4 6795 B15R0.164 COCCCCOCCCCCOC(=O)C 34a_100000740925_100000033007 [0,1,0,0,0,0|3,0,0]=4 6796 B15R0.164 COCCCCSCCCCCOC(=O)C 62a_100000033007_100000730899 [0,1,0,0,0,0|3,0,0]=4 6797 B15R0.164 COCCCCSCCCCCOC(=O)C 62a_100000730899_100000033007 [0,1,0,0,0,0|3,0,0]=4 6798 B15R0.164 COCCCNCCCCCCNC(=O)C 2230a_200011996284_100000740836 [0,1,0,0,0,0|3,0,0]=4 6799 B15R0.164 COCCCNCCCCCCNC(=O)C 34a_200011996284_100000740836 [0,1,0,0,0,0|3,0,0]=4 6800 B15R0.164 COCCCOCCCCCCCC(C)C 34a_200000210741_100000740836 [0,1,0,0,0,0|3,0,0]=4 6801 B15R0.164 COCCCOCCCCCCCC(C)C 7a_200000210741_100000740836 [0,1,0,0,0,0|3,0,0]=4 6802 B15R0.164 COCCCOCCCOCCCC(=O)C 34a_200011215475_100000685027 [0,1,0,0,0,0|3,0,0]=4 6803 B15R0.164 COCCCOCCCOCCCC(=O)C 7a_200011215475_100011215641 [0,1,0,0,0,0|3,0,0]=4 6804 B15R0.164 COCCCOCCCOCCCC(=O)N 34a_200011215475_100102525003 [0,1,0,0,0,0|3,0,0]=4 6805 B15R0.164 COCCCOCCCOCCCC(=O)N 7a_200011215475_100102525003 [0,1,0,0,0,0|3,0,0]=4 6806 B15R0.164 COCCOCCCNCCCCC(=O)C 34a_100000206027_100009817362 [0,1,0,0,0,0|3,0,0]=4 6807 B15R0.164 COCCOCCCNCCCCC(=O)N 34a_100000696515_100011216529 [0,1,0,0,0,0|3,0,0]=4 6808 B15R0.164 COCCOCCCOCCCCC(=O)N 34a_100012022536_100011216529 [0,1,0,0,0,0|3,0,0]=4 6809 B15R0.164 COCCOCCCOCCCCC(=O)N 7a_100012022536_100011216529 [0,1,0,0,0,0|3,0,0]=4 6810 B15R0.164 COCCOCCCSCCCCC(=O)C 62a_100000735457_100011216529 [0,1,0,0,0,0|3,0,0]=4 6811 B15R0.164 COCCOCCCSCCCCC(=O)C 62a_100011216529_100000735457 [0,1,0,0,0,0|3,0,0]=4 6812 B15R0.164 COCCOCCNCCCCCC(=O)N 2230a_100000745349_100009817443 [0,1,0,0,0,0|3,0,0]=4 6813 B15R0.164 COCCOCCNCCCCCC(=O)N 34a_100000745349_100009817443 [0,1,0,0,0,0|3,0,0]=4 6814 B15R0.164 COCCOCCOCCCCCC(=O)N 34a_100000123541_100000695917 [0,1,0,0,0,0|3,0,0]=4 6815 B15R0.164 COCCOCCOCCCCCC(=O)N 34a_100011215163_100009817443 [0,1,0,0,0,0|3,0,0]=4 6816 B15R0.164 COCCOCCOCCCCCC(=O)N 7a_100000123541_100000695917 [0,1,0,0,0,0|3,0,0]=4 6817 B15R0.164 COCCOCCOCCCCCC(=O)N 7a_100011215163_100009817443 [0,1,0,0,0,0|3,0,0]=4 6818 B15R0.164 COCCOCCOCCCCCC(=O)[O-] 7a_100102619762_100000695917 [0,1,0,0,0,0|3,0,0]=4 6819 B15R0.164 COCCOCCSCCCCCC(=O)N 62a_100000695917_100009817443 [0,1,0,0,0,0|3,0,0]=4 6820 B15R0.164 COCCOCCSCCCCCC(=O)N 62a_100009817443_100000695917 [0,1,0,0,0,0|3,0,0]=4 6821 B15R0.164 CS(=O)CCCNCCCCCCCCO 2230a_200000753449_100000033203 [0,1,0,0,0,0|3,0,0]=4 6822 B15R0.164 CSCCCCOCCCCCOC(=O)C 34a_100011217163_100000033007 [0,1,0,0,0,0|3,0,0]=4 6823 B15R0.164 CSCCCCOCCCCCOC(=O)C 7a_100011217163_100000033007 [0,1,0,0,0,0|3,0,0]=4 6824 B15R0.164 C[C@@H](Cl)COCCCCCCCCCCO 34a_100016084084_100009813290 [0,1,0,0,0,0|1,0,2]=4 6825 B15R0.164 C[C@@H](N)CCOCCCCCCCCCO 34a_100000706166_100009813782 [0,1,0,0,0,0|1,0,2]=4 6826 B15R0.164 C[C@@H](N)COCCCCCCCCCCO 34a_100000737577_100009813290 [0,1,0,0,0,0|1,0,2]=4 6827 B15R0.164 C[C@@H](O)CNCCCCCCCCCCO 2230a_100000066964_100009817552 [0,1,0,0,0,0|1,0,2]=4 6828 B15R0.164 C[C@@H](O)CNCCCCCCCCCCO 34a_100000066964_100009817552 [0,1,0,0,0,0|1,0,2]=4 6829 B15R0.164 C[C@@H](O)COCCCCCCCCCCBr 34a_100009813290_100009817552 [0,1,0,0,0,0|2,0,1]=4 6830 B15R0.164 C[C@@H](O)COCCCCCCCCCCBr 7a_100009813290_100009817552 [0,1,0,0,0,0|2,0,1]=4 6831 B15R0.164 C[C@@H](O)COCCCCCCCCCCCl 34a_200000033068_100009817552 [0,1,0,0,0,0|2,0,1]=4 6832 B15R0.164 C[C@@H](O)COCCCCCCCCCCCl 7a_200000033068_100009817552 [0,1,0,0,0,0|2,0,1]=4 6833 B15R0.164 C[C@@H](O)COCCCCCCCCCCN 34a_100000066964_100009817552 [0,1,0,0,0,0|2,0,1]=4 6834 B15R0.164 C[C@@H](O)CSCCCCCCCCCCO 62a_100009813290_100009817552 [0,1,0,0,0,0|1,0,2]=4 6835 B15R0.164 C[C@@H](O)CSCCCCCCCCCCO 62a_100009817552_200000033068 [0,1,0,0,0,0|1,0,2]=4 6836 B15R0.164 N#CCCCCCCOCCCCC(=O)N 7a_100012022536_100009813337 [0,1,0,0,0,0|2,0,1]=4 6837 B15R0.164 N#CCCCCCOCCCCCC(=O)N 7a_100000123541_100009813376 [0,1,0,0,0,0|2,0,1]=4 6838 B15R0.164 N#CCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100009813376 [0,1,0,0,0,0|2,0,1]=4 6839 B15R0.164 N#CCCCCCSCCCCCC(=O)N 62a_100009813376_100009817443 [0,1,0,0,0,0|2,0,1]=4 6840 B15R0.164 N#CCCCCCSCCCCCC(=O)N 62a_100009817443_100009813376 [0,1,0,0,0,0|2,0,1]=4 6841 B15R0.164 NC(=O)CCCCCCCCCCSCF 62a_100015361967_200010167045 [0,1,0,0,0,0|2,0,0]=3 6842 B15R0.164 NC(=O)CCCCCCCCCCSCF 62a_200010167045_100015361967 [0,1,0,0,0,0|2,0,0]=3 6843 B15R0.164 NC(=O)CCCCCNCCCCCCO 2230a_100000686447_100009817443 [0,1,0,0,0,0|2,0,0]=3 6844 B15R0.164 NC(=O)CCCCCNCCCCCCO 34a_100000686447_100009817443 [0,1,0,0,0,0|2,0,0]=3 6845 B15R0.164 NC(=O)CCCCCOCCCCCC=O 7a_100000123541_100000139337 [0,1,0,0,0,0|2,0,1]=4 6846 B15R0.164 NC(=O)CCCCCOCCCCCCBr 34a_100011215345_100009817443 [0,1,0,0,0,0|2,0,0]=3 6847 B15R0.164 NC(=O)CCCCCOCCCCCCBr 7a_100011215345_100009817443 [0,1,0,0,0,0|2,0,0]=3 6848 B15R0.164 NC(=O)CCCCCOCCCCCCCl 34a_100000766143_100009817443 [0,1,0,0,0,0|2,0,0]=3 6849 B15R0.164 NC(=O)CCCCCOCCCCCCCl 7a_100000766143_100009817443 [0,1,0,0,0,0|2,0,0]=3 6850 B15R0.164 NC(=O)CCCCCOCCCCCCF 34a_100000123541_100015922095 [0,1,0,0,0,0|2,0,0]=3 6851 B15R0.164 NC(=O)CCCCCOCCCCCCF 34a_100000732779_100009817443 [0,1,0,0,0,0|2,0,0]=3 6852 B15R0.164 NC(=O)CCCCCOCCCCCCF 7a_100000123541_100015922095 [0,1,0,0,0,0|2,0,0]=3 6853 B15R0.164 NC(=O)CCCCCOCCCCCCF 7a_100000732779_100009817443 [0,1,0,0,0,0|2,0,0]=3 6854 B15R0.164 NC(=O)CCCCCOCCCCCCO 34a_100000123541_100000766143 [0,1,0,0,0,0|2,0,0]=3 6855 B15R0.164 NC(=O)CCCCCOCCCCCCO 7a_100000123541_100000766143 [0,1,0,0,0,0|2,0,0]=3 6856 B15R0.164 NC(=O)CCCCCSCCCCCC=O 62a_100000139337_100009817443 [0,1,0,0,0,0|2,0,1]=4 6857 B15R0.164 NC(=O)CCCCCSCCCCCC=O 62a_100009817443_100000139337 [0,1,0,0,0,0|2,0,1]=4 6858 B15R0.164 NC(=O)CCCCCSCCCCCCF 62a_100009817443_100015922095 [0,1,0,0,0,0|2,0,0]=3 6859 B15R0.164 NC(=O)CCCCCSCCCCCCF 62a_100015922095_100009817443 [0,1,0,0,0,0|2,0,0]=3 6860 B15R0.164 NC(=O)CCCCCSCCCCCCO 62a_100000766143_100009817443 [0,1,0,0,0,0|2,0,0]=3 6861 B15R0.164 NC(=O)CCCCCSCCCCCCO 62a_100009817443_100000766143 [0,1,0,0,0,0|2,0,0]=3 6862 B15R0.164 NC(=O)CCCCNCCCCCCCO 34a_100000696515_100000760002 [0,1,0,0,0,0|2,0,0]=3 6863 B15R0.164 NC(=O)CCCCOCCCCCCCO 34a_100012022536_100000760002 [0,1,0,0,0,0|2,0,0]=3 6864 B15R0.164 NC(=O)CCCCOCCCCCCCO 7a_100012022536_100000760002 [0,1,0,0,0,0|2,0,0]=3 6865 B15R0.164 NC(=O)CCCNCCCCCCCCO 34a_100000739312_100000033203 [0,1,0,0,0,0|2,0,0]=3 6866 B15R0.164 NC(=O)CCCNCCCCCCCCO 34a_102515433106_100102525003 [0,1,0,0,0,0|2,0,0]=3 6867 B15R0.164 NC(=O)CCCOCCCCCCCCBr 34a_100009813846_100102525003 [0,1,0,0,0,0|2,0,0]=3 6868 B15R0.164 NC(=O)CCCOCCCCCCCCBr 7a_100009813846_100102525003 [0,1,0,0,0,0|2,0,0]=3 6869 B15R0.164 NC(=O)CCCOCCCCCCCCCl 34a_100000033203_100102525003 [0,1,0,0,0,0|2,0,0]=3 6870 B15R0.164 NC(=O)CCCOCCCCCCCCCl 7a_100000033203_100102525003 [0,1,0,0,0,0|2,0,0]=3 6871 B15R0.164 NC(=O)CCCSCCCCCCCCO 62a_100000033203_100102525003 [0,1,0,0,0,0|2,0,0]=3 6872 B15R0.164 NC(=O)CCCSCCCCCCCCO 62a_100102525003_100000033203 [0,1,0,0,0,0|2,0,0]=3 6873 B15R0.164 NC(=O)CCNCCCCCCCCCO 2230a_100000078944_100000744528 [0,1,0,0,0,0|2,0,0]=3 6874 B15R0.164 NC(=O)CCNCCCCCCCCCO 34a_100000078944_100000731001 [0,1,0,0,0,0|2,0,0]=3 6875 B15R0.164 NC(=O)CCOCCCCCCCCCBr 34a_100009813782_100000731001 [0,1,0,0,0,0|2,0,0]=3 6876 B15R0.164 NC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000744528 [0,1,0,0,0,0|2,0,0]=3 6877 B15R0.164 NC(=O)CCOCCCCCCCCCCl 34a_100009868337_100000731001 [0,1,0,0,0,0|2,0,0]=3 6878 B15R0.164 NC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000744528 [0,1,0,0,0,0|2,0,0]=3 6879 B15R0.164 NC(=O)CCOCCCCCCCCCO 34a_100000757172_100009813782 [0,1,0,0,0,0|2,0,0]=3 6880 B15R0.164 NC(=O)CCOCCCCCCCCCO 7a_100000757172_100009813782 [0,1,0,0,0,0|2,0,0]=3 6881 B15R0.164 NC(=O)CCSCCCCCCCCCO 62a_100000744528_100009813782 [0,1,0,0,0,0|2,0,0]=3 6882 B15R0.164 NC(=O)CCSCCCCCCCCCO 62a_100009813782_100000744528 [0,1,0,0,0,0|2,0,0]=3 6883 B15R0.164 NC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000747473 [0,1,0,0,0,0|2,0,0]=3 6884 B15R0.164 NC(=O)CNCCCCCCCCCCO 2230a_100000711301_100009813290 [0,1,0,0,0,0|2,0,0]=3 6885 B15R0.164 NC(=O)CNCCCCCCCCCCO 34a_100000066964_100000187820 [0,1,0,0,0,0|2,0,0]=3 6886 B15R0.164 NC(=O)COCCCCCCCCCCBr 34a_100009813290_100000187820 [0,1,0,0,0,0|2,0,0]=3 6887 B15R0.164 NC(=O)COCCCCCCCCCCBr 7a_100009813290_100000187820 [0,1,0,0,0,0|2,0,0]=3 6888 B15R0.164 NC(=O)COCCCCCCCCCCCl 34a_200000033068_100000187820 [0,1,0,0,0,0|2,0,0]=3 6889 B15R0.164 NC(=O)COCCCCCCCCCCCl 7a_200000033068_100000187820 [0,1,0,0,0,0|2,0,0]=3 6890 B15R0.164 NC(=O)COCCNCCCCCCCO 2230a_100011996573_100000076697 [0,1,0,0,0,0|3,0,0]=4 6891 B15R0.164 NC(=O)COCCNCCCCCCCO 34a_100011996573_100000076697 [0,1,0,0,0,0|3,0,0]=4 6892 B15R0.164 NC(=O)COCCOCCCCCCCBr 34a_100000760002_100000076697 [0,1,0,0,0,0|3,0,0]=4 6893 B15R0.164 NC(=O)COCCOCCCCCCCBr 7a_100000760002_100000076697 [0,1,0,0,0,0|3,0,0]=4 6894 B15R0.164 NC(=O)COCCSCCCCCCCO 62a_100000076697_100000760002 [0,1,0,0,0,0|3,0,0]=4 6895 B15R0.164 NC(=O)COCCSCCCCCCCO 62a_100000760002_100000076697 [0,1,0,0,0,0|3,0,0]=4 6896 B15R0.164 NC(=O)CSCCCCCCCCCCO 62a_100000747473_200000033068 [0,1,0,0,0,0|2,0,0]=3 6897 B15R0.164 NC(=O)CSCCCCCCCCCCO 62a_100009813290_100000747473 [0,1,0,0,0,0|2,0,0]=3 6898 B15R0.164 NC(=O)NCCNCCCCCCCCO 2230a_102515433106_200000034859 [0,1,0,0,0,0|3,0,0]=4 6899 B15R0.164 NC(=O)NCCNCCCCCCCCO 34a_100020590234_100000033203 [0,1,0,0,0,0|3,0,0]=4 6900 B15R0.164 NC(=O)NCCOCCCCCCCCBr 7a_100009813846_200000034859 [0,1,0,0,0,0|3,0,0]=4 6901 B15R0.164 NC(=O)NCCOCCCCCCCCCl 7a_100000033203_200000034859 [0,1,0,0,0,0|3,0,0]=4 6902 B15R0.164 NC(=O)NCCOCCCCCCCCO 34a_100000181757_100000033203 [0,1,0,0,0,0|3,0,0]=4 6903 B15R0.164 NC(=O)NCCSCCCCCCCCO 62a_100000033203_200000034859 [0,1,0,0,0,0|3,0,0]=4 6904 B15R0.164 NC(=O)NCCSCCCCCCCCO 62a_200000034859_100000033203 [0,1,0,0,0,0|3,0,0]=4 6905 B15R0.164 NC(=O)OCCNCCCCCCCCO 34a_102515433106_200011214921 [0,1,0,0,0,0|3,0,0]=4 6906 B15R0.164 NC(=O)OCCOCCCCCCCCBr 34a_100009813846_200011214921 [0,1,0,0,0,0|3,0,0]=4 6907 B15R0.164 NC(=O)OCCOCCCCCCCCBr 7a_100009813846_200011214921 [0,1,0,0,0,0|3,0,0]=4 6908 B15R0.164 NC(=O)OCCOCCCCCCCCCl 34a_100000033203_200011214921 [0,1,0,0,0,0|3,0,0]=4 6909 B15R0.164 NC(=O)OCCOCCCCCCCCCl 7a_100000033203_200011214921 [0,1,0,0,0,0|3,0,0]=4 6910 B15R0.164 NC(=O)OCCOCCCCCCCCO 7a_100000766696_100000033203 [0,1,0,0,0,0|3,0,0]=4 6911 B15R0.164 NC(=O)OCCSCCCCCCCCO 62a_100000033203_200011214921 [0,1,0,0,0,0|3,0,0]=4 6912 B15R0.164 NC(=O)OCCSCCCCCCCCO 62a_200011214921_100000033203 [0,1,0,0,0,0|3,0,0]=4 6913 B15R0.164 NCCCCCCCCCCOCC(=O)N 34a_100000066964_100000187820 [0,1,0,0,0,0|2,0,0]=3 6914 B15R0.164 NCCCCCCCCCCOCC(=O)[O-] 34a_100000066964_100020667443 [0,1,0,0,0,0|2,0,0]=3 6915 B15R0.164 NCCCCCCCCCCOC[N+](=O)[O-] 34a_100000066964_100000761209 [0,1,0,0,0,0|3,0,0]=4 6916 B15R0.164 NCCCCCCCCCOCCC(=O)N 34a_100000078944_100000731001 [0,1,0,0,0,0|2,0,0]=3 6917 B15R0.164 NCCCCCCCCOCCCC(=O)N 34a_102515433106_100102525003 [0,1,0,0,0,0|2,0,0]=3 6918 B15R0.164 NCCCCCCCCOCCOC(=O)N 34a_102515433106_200011214921 [0,1,0,0,0,0|3,0,0]=4 6919 B15R0.164 NCCCCCCCOCCOCC(=O)N 34a_100011996573_100000076697 [0,1,0,0,0,0|3,0,0]=4 6920 B15R0.164 NCCCCCCOCCCCCC(=O)N 34a_100000686447_100009817443 [0,1,0,0,0,0|2,0,0]=3 6921 B15R0.164 NCCNCCCCCOCCCC(=O)N 34a_103619048469_100102525003 [0,1,0,0,0,0|3,0,0]=4 6922 B15R0.164 O=C(O)CNCCCCCCCCCCO 269956a_100016091260_100009813290 [0,1,0,0,0,0|2,0,0]=3 6923 B15R0.164 O=C(O)COCCNCCCCCCCO 269956a_100000700818_100000760002 [0,1,0,0,0,0|3,0,0]=4 6924 B15R0.164 O=C(O)CONCCCCCCCCCO 269956a_100000106656_100009813782 [0,1,0,0,0,0|3,0,0]=4 6925 B15R0.164 O=C([O-])CCCCCOCCCCCCF 7a_100102619762_100015922095 [0,1,0,0,0,0|2,0,0]=3 6926 B15R0.164 O=C([O-])CCCCCOCCCCCCO 7a_100102619762_100000766143 [0,1,0,0,0,0|2,0,0]=3 6927 B15R0.164 O=C([O-])CNCCCCCCCCCCO 34a_100000066964_100020667443 [0,1,0,0,0,0|2,0,0]=3 6928 B15R0.164 O=C([O-])COCCCCCCCCCCBr 34a_100009813290_100020667443 [0,1,0,0,0,0|2,0,0]=3 6929 B15R0.164 O=C([O-])COCCCCCCCCCCCl 34a_200000033068_100020667443 [0,1,0,0,0,0|2,0,0]=3 6930 B15R0.164 O=C([O-])CSCCCCCCCCCCO 62a_100009813290_100020667443 [0,1,0,0,0,0|2,0,0]=3 6931 B15R0.164 O=C([O-])CSCCCCCCCCCCO 62a_100020667443_200000033068 [0,1,0,0,0,0|2,0,0]=3 6932 B15R0.164 O=CCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000139337 [0,1,0,0,0,0|2,0,1]=4 6933 B15R0.164 O=CCCCCCSCCCCCB(O)O 62a_100000139337_200009817188 [0,1,0,0,0,0|3,0,0]=4 6934 B15R0.164 O=CCCCCCSCCCCCB(O)O 62a_200009817188_100000139337 [0,1,0,0,0,0|3,0,0]=4 6935 B15R0.164 O=CCCCCSCCCCCCB(O)O 62a_100000139335_100009817187 [0,1,0,0,0,0|3,0,0]=4 6936 B15R0.164 O=CCCCCSCCCCCCB(O)O 62a_100009817187_100000139335 [0,1,0,0,0,0|3,0,0]=4 6937 B15R0.164 O=[N+]([O-])CCCCOCCCCCCCO 34a_200015379883_100000760002 [0,1,0,0,0,0|3,0,0]=4 6938 B15R0.164 O=[N+]([O-])CCCCOCCCCCCCO 7a_200015379883_100000760002 [0,1,0,0,0,0|3,0,0]=4 6939 B15R0.164 O=[N+]([O-])CCCOCCCCCCCCO 34a_200000037920_100000033203 [0,1,0,0,0,0|3,0,0]=4 6940 B15R0.164 O=[N+]([O-])CNCCCCCCCCCCO 34a_100000066964_100000761209 [0,1,0,0,0,0|3,0,0]=4 6941 B15R0.164 O=[N+]([O-])COCCCCCCCCCCBr 34a_100009813290_100000761209 [0,1,0,0,0,0|3,0,0]=4 6942 B15R0.164 O=[N+]([O-])COCCCCCCCCCCCl 34a_200000033068_100000761209 [0,1,0,0,0,0|3,0,0]=4 6943 B15R0.164 O=[N+]([O-])CSCCCCCCCCCCO 62a_100009813290_100000761209 [0,1,0,0,0,0|3,0,0]=4 6944 B15R0.322 C#CCCCC(=O)CCCCCCCCC 1458a_100000210558_100000731252 [0,1,0,0,0,0|1,0,2]=4 6945 B15R0.322 C#CCCCC(=O)CCCCCCCCC 1458a_100000690238_100000210670 [0,1,0,0,0,0|1,0,2]=4 6946 B15R0.322 C#CCCCCCCCC(=O)CCCCC 1458a_100000087357_100000210326 [0,1,0,0,0,0|1,0,2]=4 6947 B15R0.322 C#CCCCCCCCC(=O)CCCCC 1458a_100000212188_100153394163 [0,1,0,0,0,0|1,0,2]=4 6948 B15R0.322 C#CCCCCCCCN(C)CCCCC 2230a_100000223495_100153394163 [0,1,0,0,0,0|2,0,1]=4 6949 B15R0.322 C#CCCCCCCCN(C)CCCCC 269982a_100000223495_100153394163 [0,1,0,0,0,0|2,0,1]=4 6950 B15R0.322 C#CCCCCCCNC(C)CCCCC 2230a_100000211957_100012276617 [0,1,0,0,0,0|2,0,1]=4 6951 B15R0.322 C#CCCCCCCOC(C)CCCCC 34a_100011215632_100012276617 [0,1,0,0,0,0|2,0,1]=4 6952 B15R0.322 C#CCCCCCCOC(C)CCCCC 34a_100011217361_200011218191 [0,1,0,0,0,0|2,0,1]=4 6953 B15R0.322 C#CCCCCCCOC(C)CCCCC 7a_100011215632_100012276617 [0,1,0,0,0,0|2,0,1]=4 6954 B15R0.322 C#CCCCCCCOC(C)CCCCC 7a_100011217361_200011218191 [0,1,0,0,0,0|2,0,1]=4 6955 B15R0.322 C#CCCCCCCSC(C)CCCCC 62a_100012276617_200011218191 [0,1,0,0,0,0|2,0,1]=4 6956 B15R0.322 C#CCCCCCCSC(C)CCCCC 62a_200011218191_100012276617 [0,1,0,0,0,0|2,0,1]=4 6957 B15R0.322 C#CCCCN(C)CCCCCCCCC 2230a_100000232482_100000731252 [0,1,0,0,0,0|2,0,1]=4 6958 B15R0.322 C#CCCCN(C)CCCCCCCCC 269982a_100000232482_100011215417 [0,1,0,0,0,0|2,0,1]=4 6959 B15R0.322 C#CCCOC(C)CCCCCCCCC 34a_100011218016_100000688953 [0,1,0,0,0,0|2,0,1]=4 6960 B15R0.322 C#CCCOC(C)CCCCCCCCC 7a_100011218016_100000688953 [0,1,0,0,0,0|2,0,1]=4 6961 B15R0.322 C/C=C/COC(C)CCCCCCCCC 34a_100011218016_100102629194 [0,1,0,0,0,0|2,0,1]=4 6962 B15R0.322 C/C=C/COC(C)CCCCCCCCC 7a_100011218016_100102629194 [0,1,0,0,0,0|2,0,1]=4 6963 B15R0.322 C=CCCCC(=O)CCCCCCCCC 1458a_100000210558_100000757094 [0,1,0,0,0,0|1,0,1]=3 6964 B15R0.322 C=CCCCC(=O)CCCCCCCCC 1458a_100000766728_100000210670 [0,1,0,0,0,0|1,0,1]=3 6965 B15R0.322 C=CCCCC(=O)CCCCCCCCO 1458a_100000766728_100000033203 [0,1,0,0,0,0|2,0,1]=4 6966 B15R0.322 C=CCCCC(=O)NCCCCCCCC 11a_100000229939_100000766728 [0,1,0,0,0,0|2,0,1]=4 6967 B15R0.322 C=CCCCC(=O)NCCCCCCCC 1626a_100000229939_100000766728 [0,1,0,0,0,0|2,0,1]=4 6968 B15R0.322 C=CCCCC(=O)NCCCCCCCC 240690a_100000229939_100000766728 [0,1,0,0,0,0|2,0,1]=4 6969 B15R0.322 C=CCCCC(=O)NCCCCCCCC 527a_100000229939_100000766728 [0,1,0,0,0,0|2,0,1]=4 6970 B15R0.322 C=CCCCCCCCC(=O)CCCCC 1458a_100000212188_100012355270 [0,1,0,0,0,0|1,0,1]=3 6971 B15R0.322 C=CCCCCCCCC(=O)CCCCC 1458a_100011216160_100000210326 [0,1,0,0,0,0|1,0,1]=3 6972 B15R0.322 C=CCCCCCCCC(=O)CCCCF 1458a_100011216160_100000729493 [0,1,0,0,0,0|2,0,1]=4 6973 B15R0.322 C=CCCCCCCCC(=O)CCCCO 1458a_100000695505_100012355270 [0,1,0,0,0,0|2,0,1]=4 6974 B15R0.322 C=CCCCCCCCC(=O)CCCCO 1458a_100011216160_100000210776 [0,1,0,0,0,0|2,0,1]=4 6975 B15R0.322 C=CCCCCCCCC(=O)CCCOC 1458a_100000741012_100012355270 [0,1,0,0,0,0|2,0,1]=4 6976 B15R0.322 C=CCCCCCCCC(=O)CCCOC 1458a_100011216160_100000740836 [0,1,0,0,0,0|2,0,1]=4 6977 B15R0.322 C=CCCCCCCCC(=O)CCCSC 1458a_100000173376_100012355270 [0,1,0,0,0,0|2,0,1]=4 6978 B15R0.322 C=CCCCCCCCC(=O)CCOCC 1458a_100000749530_100012355270 [0,1,0,0,0,0|2,0,1]=4 6979 B15R0.322 C=CCCCCCCCC(=O)CCOCC 1458a_100011216160_100011215890 [0,1,0,0,0,0|2,0,1]=4 6980 B15R0.322 C=CCCCCCCCC(=O)CCSCC 1458a_100000230768_100012355270 [0,1,0,0,0,0|2,0,1]=4 6981 B15R0.322 C=CCCCCCCCC(=O)CCSCC 1458a_100011216160_100000757381 [0,1,0,0,0,0|2,0,1]=4 6982 B15R0.322 C=CCCCCCCCC(=O)COCCC 1458a_100000745993_100012355270 [0,1,0,0,0,0|2,0,1]=4 6983 B15R0.322 C=CCCCCCCCC(=O)CSCCC 1458a_100000217233_100012355270 [0,1,0,0,0,0|2,0,1]=4 6984 B15R0.322 C=CCCCCCCCC(=O)NCCCC 11a_100000102301_100011216160 [0,1,0,0,0,0|2,0,1]=4 6985 B15R0.322 C=CCCCCCCCC(=O)NCCCC 1626a_100000102301_100011216160 [0,1,0,0,0,0|2,0,1]=4 6986 B15R0.322 C=CCCCCCCCC(=O)NCCCC 240690a_100000102301_100011216160 [0,1,0,0,0,0|2,0,1]=4 6987 B15R0.322 C=CCCCCCCCC(=O)NCCCC 527a_100000102301_100011216160 [0,1,0,0,0,0|2,0,1]=4 6988 B15R0.322 C=CCCCCCCCN(C)CCCCC 2230a_100000223495_100012355270 [0,1,0,0,0,0|2,0,0]=3 6989 B15R0.322 C=CCCCCCCCN(C)CCCCC 269982a_100000223495_100012355270 [0,1,0,0,0,0|2,0,0]=3 6990 B15R0.322 C=CCCCCCCCN(C)CCCCO 2230a_100000717598_100012355270 [0,1,0,0,0,0|3,0,0]=4 6991 B15R0.322 C=CCCCCCCCN(C)CCCCO 269982a_100000717598_100012355270 [0,1,0,0,0,0|3,0,0]=4 6992 B15R0.322 C=CCCCCCCCN(C)CCCOC 2230a_100000224831_100012355270 [0,1,0,0,0,0|3,0,0]=4 6993 B15R0.322 C=CCCCCCCCN(C)CCCOC 269982a_100000224831_100012355270 [0,1,0,0,0,0|3,0,0]=4 6994 B15R0.322 C=CCCCCCCNC(C)CCCCC 2230a_100000211957_100011215473 [0,1,0,0,0,0|2,0,0]=3 6995 B15R0.322 C=CCCCCCCOC(C)CCCCC 34a_100011215632_100011215473 [0,1,0,0,0,0|2,0,0]=3 6996 B15R0.322 C=CCCCCCCOC(C)CCCCC 34a_200011216477_200011218191 [0,1,0,0,0,0|2,0,0]=3 6997 B15R0.322 C=CCCCCCCOC(C)CCCCC 7a_100011215632_100011215473 [0,1,0,0,0,0|2,0,0]=3 6998 B15R0.322 C=CCCCCCCOC(C)CCCCC 7a_200011216477_200011218191 [0,1,0,0,0,0|2,0,0]=3 6999 B15R0.322 C=CCCCCCCOC(C)CCCOC 34a_200011539412_100011215473 [0,1,0,0,0,0|3,0,0]=4 7000 B15R0.322 C=CCCCCCCOC(C)CCCOC 7a_200011539412_100011215473 [0,1,0,0,0,0|3,0,0]=4 7001 B15R0.322 C=CCCCCCCSC(C)CCCCC 62a_100011215473_200011218191 [0,1,0,0,0,0|2,0,0]=3 7002 B15R0.322 C=CCCCCCCSC(C)CCCCC 62a_200011218191_100011215473 [0,1,0,0,0,0|2,0,0]=3 7003 B15R0.322 C=CCCCCCOCC(=O)CCCCC 34a_100011216702_200012276598 [0,1,0,0,0,0|2,0,1]=4 7004 B15R0.322 C=CCCCCCOCC(=O)CCCCC 7a_100011216702_200012276598 [0,1,0,0,0,0|2,0,1]=4 7005 B15R0.322 C=CCCCCCOC[C@@H](N)CCCCN 34a_100016993712_100000700193 [0,1,0,0,0,0|3,0,0]=4 7006 B15R0.322 C=CCCCCCSCC(=O)CCCCC 62a_100000700193_200012276598 [0,1,0,0,0,0|2,0,1]=4 7007 B15R0.322 C=CCCCCCSCC(=O)CCCCC 62a_200012276598_100000700193 [0,1,0,0,0,0|2,0,1]=4 7008 B15R0.322 C=CCCCN(C)CCCCCCCCC 2230a_100000232482_100011713584 [0,1,0,0,0,0|2,0,0]=3 7009 B15R0.322 C=CCCCN(C)CCCCCCCCC 269982a_100000232482_100000757094 [0,1,0,0,0,0|2,0,0]=3 7010 B15R0.322 C=CCCNC(=O)CCCCCCCCC 11a_100015191253_100000210558 [0,1,0,0,0,0|2,0,1]=4 7011 B15R0.322 C=CCCNC(=O)CCCCCCCCC 1626a_100015191253_100000210558 [0,1,0,0,0,0|2,0,1]=4 7012 B15R0.322 C=CCCNC(=O)CCCCCCCCC 240690a_100015191253_100000210558 [0,1,0,0,0,0|2,0,1]=4 7013 B15R0.322 C=CCCNC(=O)CCCCCCCCC 527a_100015191253_100000210558 [0,1,0,0,0,0|2,0,1]=4 7014 B15R0.322 C=CCCNC(C)CCCCCCCCC 270004a_100015191253_100011215753 [0,1,0,0,0,0|2,0,0]=3 7015 B15R0.322 C=CCCOC(C)CCCCCCCCC 34a_100011218016_100000754431 [0,1,0,0,0,0|2,0,0]=3 7016 B15R0.322 C=CCCOC(C)CCCCCCCCC 7a_100011218016_100000754431 [0,1,0,0,0,0|2,0,0]=3 7017 B15R0.322 C=CCNCC(C)CCCCCCCCC 270004a_100020586998_200011218516 [0,1,0,0,0,0|2,0,0]=3 7018 B15R0.322 C=CCSCC(=O)CCCCCCCCC 1458a_100000230395_100000210670 [0,1,0,0,0,0|2,0,1]=4 7019 B15R0.322 C=COCCC(=O)CCCCCCCCC 1458a_100000210558_100000039644 [0,1,0,0,0,0|2,0,1]=4 7020 B15R0.322 C=COCCN(C)CCCCCCCCC 2230a_100000232482_100000039644 [0,1,0,0,0,0|3,0,0]=4 7021 B15R0.322 C=COCCN(C)CCCCCCCCC 269982a_100000232482_100000039644 [0,1,0,0,0,0|3,0,0]=4 7022 B15R0.322 CC=CCOC(C)CCCCCCCCC 34a_100011218016_100000070051 [0,1,0,0,0,0|2,0,1]=4 7023 B15R0.322 CC=CCOC(C)CCCCCCCCC 7a_100011218016_100000070051 [0,1,0,0,0,0|2,0,1]=4 7024 B15R0.322 CCCCCC(=O)CCCCCCCCO 1458a_100000212188_100000033203 [0,1,0,0,0,0|0,0,3]=4 7025 B15R0.322 CCCCCC(=O)CSCCCCCC=O 62a_100000139337_200012276598 [0,1,0,0,0,0|1,0,1]=3 7026 B15R0.322 CCCCCC(=O)CSCCCCCC=O 62a_200012276598_100000139337 [0,1,0,0,0,0|1,0,1]=3 7027 B15R0.322 CCCCCC(C)NCCCCCCC#N 2230a_100000211957_100009813337 [0,1,0,0,0,0|2,0,1]=4 7028 B15R0.322 CCCCCC(C)NCCCCCCCO 2230a_100000211957_100000760002 [0,1,0,0,0,0|1,0,2]=4 7029 B15R0.322 CCCCCC(C)NCCCCCCCO 2230a_100011996573_200011218191 [0,1,0,0,0,0|1,0,2]=4 7030 B15R0.322 CCCCCC(C)NCCCCCCCO 270004a_100011996573_100000211708 [0,1,0,0,0,0|1,0,2]=4 7031 B15R0.322 CCCCCC(C)NCCCCCCCO 34a_100011996573_200011218191 [0,1,0,0,0,0|1,0,2]=4 7032 B15R0.322 CCCCCC(C)NCCCCCCOC 2230a_100000211957_100011998445 [0,1,0,0,0,0|3,0,0]=4 7033 B15R0.322 CCCCCC(C)OCCCCCCC#N 7a_100011215632_100009813337 [0,1,0,0,0,0|2,0,1]=4 7034 B15R0.322 CCCCCC(C)OCCCCCCCBr 34a_100000760002_200011218191 [0,1,0,0,0,0|2,0,1]=4 7035 B15R0.322 CCCCCC(C)OCCCCCCCBr 7a_100000760002_200011218191 [0,1,0,0,0,0|2,0,1]=4 7036 B15R0.322 CCCCCC(C)OCCCCCCCN 34a_100011996573_200011218191 [0,1,0,0,0,0|2,0,1]=4 7037 B15R0.322 CCCCCC(C)OCCCCCCCO 34a_100011215632_100000760002 [0,1,0,0,0,0|1,0,2]=4 7038 B15R0.322 CCCCCC(C)OCCCCCCCO 7a_100011215632_100000760002 [0,1,0,0,0,0|1,0,2]=4 7039 B15R0.322 CCCCCC(C)OCCCCCCOC 34a_100011215632_100011998445 [0,1,0,0,0,0|3,0,0]=4 7040 B15R0.322 CCCCCC(C)OCCCCCCOC 34a_200012092642_200011218191 [0,1,0,0,0,0|3,0,0]=4 7041 B15R0.322 CCCCCC(C)OCCCCCCOC 7a_100011215632_100011998445 [0,1,0,0,0,0|3,0,0]=4 7042 B15R0.322 CCCCCC(C)OCCCCCCOC 7a_200012092642_200011218191 [0,1,0,0,0,0|3,0,0]=4 7043 B15R0.322 CCCCCC(C)SCCCCCCC#N 62a_100009813337_200011218191 [0,1,0,0,0,0|2,0,1]=4 7044 B15R0.322 CCCCCC(C)SCCCCCCC#N 62a_200011218191_100009813337 [0,1,0,0,0,0|2,0,1]=4 7045 B15R0.322 CCCCCC(C)SCCCCCCCO 62a_100000760002_200011218191 [0,1,0,0,0,0|1,0,2]=4 7046 B15R0.322 CCCCCC(C)SCCCCCCCO 62a_200011218191_100000760002 [0,1,0,0,0,0|1,0,2]=4 7047 B15R0.322 CCCCCC(C)SCCCCCCOC 62a_100011998445_200011218191 [0,1,0,0,0,0|3,0,0]=4 7048 B15R0.322 CCCCCC(C)SCCCCCCOC 62a_200011218191_100011998445 [0,1,0,0,0,0|3,0,0]=4 7049 B15R0.322 CCCCCCCCCC(=O)CCCC#N 1458a_100000075515_100000210670 [0,1,0,0,0,0|1,0,2]=4 7050 B15R0.322 CCCCCCCCCC(=O)CCCC#N 1458a_100000210558_100000211468 [0,1,0,0,0,0|1,0,2]=4 7051 B15R0.322 CCCCCCCCCC(=O)CCCCC 1458a_100000210558_100000210326 [0,1,0,0,0,0|1,0,2]=4 7052 B15R0.322 CCCCCCCCCC(=O)CCCCC 1458a_100000212188_100000210670 [0,1,0,0,0,0|1,0,2]=4 7053 B15R0.322 CCCCCCCCCC(=O)CCCCF 1458a_100000210558_100000729493 [0,1,0,0,0,0|1,0,2]=4 7054 B15R0.322 CCCCCCCCCC(=O)CCCCO 1458a_100000210558_100000210776 [0,1,0,0,0,0|0,0,3]=4 7055 B15R0.322 CCCCCCCCCC(=O)CCCCO 1458a_100000695505_100000210670 [0,1,0,0,0,0|0,0,3]=4 7056 B15R0.322 CCCCCCCCCC(=O)CCCOC 1458a_100000210558_100000740836 [0,1,0,0,0,0|2,0,1]=4 7057 B15R0.322 CCCCCCCCCC(=O)CCCOC 1458a_100000741012_100000210670 [0,1,0,0,0,0|2,0,1]=4 7058 B15R0.322 CCCCCCCCCC(=O)CCCSC 1458a_100000173376_100000210670 [0,1,0,0,0,0|2,0,1]=4 7059 B15R0.322 CCCCCCCCCC(C)CNCCC 270004a_100020643023_200011218516 [0,1,0,0,0,0|2,0,1]=4 7060 B15R0.322 CCCCCCCCCC(C)CNCCO 270004a_100000210304_200011218516 [0,1,0,0,0,0|1,0,2]=4 7061 B15R0.322 CCCCCCCCCC(C)NCCC#N 270004a_100000720768_100011215753 [0,1,0,0,0,0|2,0,1]=4 7062 B15R0.322 CCCCCCCCCC(C)NCCCC 270004a_100000102301_100011215753 [0,1,0,0,0,0|2,0,1]=4 7063 B15R0.322 CCCCCCCCCC(C)NCCCF 270004a_100015189416_100011215753 [0,1,0,0,0,0|2,0,1]=4 7064 B15R0.322 CCCCCCCCCC(C)NCCCO 270004a_100000182051_100011215753 [0,1,0,0,0,0|1,0,2]=4 7065 B15R0.322 CCCCCCCCCC(C)NCCOC 270004a_100000209980_100011215753 [0,1,0,0,0,0|3,0,0]=4 7066 B15R0.322 CCCCCCCCCC(C)NCCSC 270004a_100020590264_100011215753 [0,1,0,0,0,0|3,0,0]=4 7067 B15R0.322 CCCCCCCCCC(C)OCCC#N 7a_100011218016_100000184422 [0,1,0,0,0,0|2,0,1]=4 7068 B15R0.322 CCCCCCCCCC(C)OCCCC 34a_100011218016_100000210210 [0,1,0,0,0,0|2,0,1]=4 7069 B15R0.322 CCCCCCCCCC(C)OCCCC 7a_100011218016_100000210211 [0,1,0,0,0,0|2,0,1]=4 7070 B15R0.322 CCCCCCCCCC(C)OCCCF 34a_100011218016_100011934791 [0,1,0,0,0,0|2,0,1]=4 7071 B15R0.322 CCCCCCCCCC(C)OCCCF 7a_100011218016_100011934791 [0,1,0,0,0,0|2,0,1]=4 7072 B15R0.322 CCCCCCCCCC(C)OCCCO 34a_100011218016_100000230001 [0,1,0,0,0,0|1,0,2]=4 7073 B15R0.322 CCCCCCCCCC(C)OCCCO 7a_100011218016_100011215043 [0,1,0,0,0,0|1,0,2]=4 7074 B15R0.322 CCCCCCCCCC(C)OCCOC 34a_100011218016_100011201679 [0,1,0,0,0,0|3,0,0]=4 7075 B15R0.322 CCCCCCCCCC(C)OCCOC 7a_100011218016_100000233755 [0,1,0,0,0,0|3,0,0]=4 7076 B15R0.322 CCCCCCCCCC(C)OCCSC 34a_100011218016_100000212216 [0,1,0,0,0,0|3,0,0]=4 7077 B15R0.322 CCCCCCCCCC(C)OCCSC 7a_100011218016_100000212216 [0,1,0,0,0,0|3,0,0]=4 7078 B15R0.322 CCCCCCCCCN(C)CCCC#N 2230a_100000232482_100000687738 [0,1,0,0,0,0|2,0,1]=4 7079 B15R0.322 CCCCCCCCCN(C)CCCC#N 269982a_100000232482_100000687738 [0,1,0,0,0,0|2,0,1]=4 7080 B15R0.322 CCCCCCCCCN(C)CCCC=O 2230a_100000232482_200011292268 [0,1,0,0,0,0|1,0,0]=2 7081 B15R0.322 CCCCCCCCCN(C)CCCC=O 269982a_100000232482_200011292268 [0,1,0,0,0,0|1,0,0]=2 7082 B15R0.322 CCCCCCCCCN(C)CCCCC 2230a_100000223495_100011214924 [0,1,0,0,0,0|2,0,1]=4 7083 B15R0.322 CCCCCCCCCN(C)CCCCC 2230a_100000232482_100000210326 [0,1,0,0,0,0|2,0,1]=4 7084 B15R0.322 CCCCCCCCCN(C)CCCCC 269982a_100000223495_100000210670 [0,1,0,0,0,0|2,0,1]=4 7085 B15R0.322 CCCCCCCCCN(C)CCCCC 269982a_100000232482_100000210215 [0,1,0,0,0,0|2,0,1]=4 7086 B15R0.322 CCCCCCCCCN(C)CCCCF 2230a_100000232482_100000729493 [0,1,0,0,0,0|2,0,1]=4 7087 B15R0.322 CCCCCCCCCN(C)CCCCF 269982a_100000232482_100000729493 [0,1,0,0,0,0|2,0,1]=4 7088 B15R0.322 CCCCCCCCCN(C)CCCCO 2230a_100000232482_100000210776 [0,1,0,0,0,0|1,0,2]=4 7089 B15R0.322 CCCCCCCCCN(C)CCCCO 2230a_100000717598_100011214924 [0,1,0,0,0,0|1,0,2]=4 7090 B15R0.322 CCCCCCCCCN(C)CCCCO 269982a_100000232482_100000210776 [0,1,0,0,0,0|1,0,2]=4 7091 B15R0.322 CCCCCCCCCN(C)CCCCO 269982a_100000717598_100000210670 [0,1,0,0,0,0|1,0,2]=4 7092 B15R0.322 CCCCCCCCCN(C)CCCOC 2230a_100000224831_100011214924 [0,1,0,0,0,0|3,0,0]=4 7093 B15R0.322 CCCCCCCCCN(C)CCCOC 2230a_100000232482_100000740836 [0,1,0,0,0,0|3,0,0]=4 7094 B15R0.322 CCCCCCCCCN(C)CCCOC 269982a_100000224831_100000210670 [0,1,0,0,0,0|3,0,0]=4 7095 B15R0.322 CCCCCCCCCN(C)CCCOC 269982a_100000232482_100000740836 [0,1,0,0,0,0|3,0,0]=4 7096 B15R0.322 CCCCCCCCNC(C)CCCC#N 270004a_100000229939_200000032708 [0,1,0,0,0,0|2,0,1]=4 7097 B15R0.322 CCCCCCCCNC(C)CCCCC 2230a_100000211957_100000210759 [0,1,0,0,0,0|2,0,1]=4 7098 B15R0.322 CCCCCCCCNC(C)CCCCC 2230a_100000229939_200011218191 [0,1,0,0,0,0|2,0,1]=4 7099 B15R0.322 CCCCCCCCNC(C)CCCCC 270004a_100000229939_100000211708 [0,1,0,0,0,0|2,0,1]=4 7100 B15R0.322 CCCCCCCCNC(C)CCCCC 34a_100000229939_200011218191 [0,1,0,0,0,0|2,0,1]=4 7101 B15R0.322 CCCCCCCCNC(C)CCCSC 270004a_100000229939_100011399439 [0,1,0,0,0,0|3,0,0]=4 7102 B15R0.322 CCCCCCCCOC(C)CCCCC 34a_100000210232_200011218191 [0,1,0,0,0,0|2,0,1]=4 7103 B15R0.322 CCCCCCCCOC(C)CCCCC 34a_100011215632_100000210759 [0,1,0,0,0,0|2,0,1]=4 7104 B15R0.322 CCCCCCCCOC(C)CCCCC 7a_100000210232_200011218191 [0,1,0,0,0,0|2,0,1]=4 7105 B15R0.322 CCCCCCCCOC(C)CCCCC 7a_100011215632_100000210759 [0,1,0,0,0,0|2,0,1]=4 7106 B15R0.322 CCCCCCCCOC(C)CCCOC 34a_200011539412_100000210759 [0,1,0,0,0,0|3,0,0]=4 7107 B15R0.322 CCCCCCCCOC(C)CCCOC 7a_200011539412_100000210759 [0,1,0,0,0,0|3,0,0]=4 7108 B15R0.322 CCCCCCCOC[C@@H](N)CCCCN 34a_100016993712_100000210614 [0,1,0,0,0,0|2,0,1]=4 7109 B15R0.322 CCCCCN(C)CCCCCCCCO 2230a_100000223495_100000033203 [0,1,0,0,0,0|1,0,2]=4 7110 B15R0.322 CCCCCN(C)CCCCCCCCO 269982a_100000223495_100000033203 [0,1,0,0,0,0|1,0,2]=4 7111 B15R0.322 CCCCNC(=O)CSCCCCCC=O 62a_100000139337_100000182744 [0,1,0,0,0,0|2,0,1]=4 7112 B15R0.322 CCCCNC(=O)CSCCCCCC=O 62a_100000182744_100000139337 [0,1,0,0,0,0|2,0,1]=4 7113 B15R0.322 CCCCOC(=O)CSCCCCCC=O 62a_100000139337_100000211628 [0,1,0,0,0,0|2,0,1]=4 7114 B15R0.322 CCCCOC(=O)CSCCCCCC=O 62a_100000211628_100000139337 [0,1,0,0,0,0|2,0,1]=4 7115 B15R0.366 C#CCC(=O)CCCCCCCCCCC 1458a_100000210736_100000184674 [0,1,0,0,0,0|1,0,2]=4 7116 B15R0.366 C#CCC(=O)CCCCCCCCCCC 1458a_100011220946_100011215454 [0,1,0,0,0,0|1,0,2]=4 7117 B15R0.366 C#CCC(C)OCCCCCCCCCC 34a_100000685586_100000210320 [0,1,0,0,0,0|2,0,1]=4 7118 B15R0.366 C#CCC(C)OCCCCCCCCCC 7a_100000685586_100000210320 [0,1,0,0,0,0|2,0,1]=4 7119 B15R0.366 C#CCCCCCCCCOC(C)CCC 34a_100000065265_100000766640 [0,1,0,0,0,0|2,0,1]=4 7120 B15R0.366 C#CCCCCCCCCOC(C)CCC 7a_100000065265_100000766640 [0,1,0,0,0,0|2,0,1]=4 7121 B15R0.366 C#CCCCCCCCOCC(C)CCC 34a_100000054614_100011216630 [0,1,0,0,0,0|2,0,1]=4 7122 B15R0.366 C#CCCCCCCCOCC(C)CCC 34a_100000688023_100153394163 [0,1,0,0,0,0|2,0,1]=4 7123 B15R0.366 C#CCCCCCCCOCC(C)CCC 7a_100000054614_100011216630 [0,1,0,0,0,0|2,0,1]=4 7124 B15R0.366 C#CCCCCCCCOCC(C)CCC 7a_100000688023_100153394163 [0,1,0,0,0,0|2,0,1]=4 7125 B15R0.366 C#CCCCCCCCOC[C@@H](N)CCC 34a_100000732646_100153394163 [0,1,0,0,0,0|2,0,1]=4 7126 B15R0.366 C#CCCCCCCCSCC(C)CCC 62a_100011216630_100153394163 [0,1,0,0,0,0|2,0,1]=4 7127 B15R0.366 C#CCCCCCCCSCC(C)CCC 62a_100153394163_100011216630 [0,1,0,0,0,0|2,0,1]=4 7128 B15R0.366 C#CCCCCCCOCCC(C)CCC 34a_100011217855_100012276617 [0,1,0,0,0,0|2,0,1]=4 7129 B15R0.366 C#CCCCCCCOCCC(C)CCC 7a_100011217855_100012276617 [0,1,0,0,0,0|2,0,1]=4 7130 B15R0.366 C#CCCCCCCOCC[C@@H](N)CCC 34a_100015193777_100012276617 [0,1,0,0,0,0|2,0,1]=4 7131 B15R0.366 C#CCCCCCOCCCC(C)CCC 34a_100011713154_100012094781 [0,1,0,0,0,0|2,0,1]=4 7132 B15R0.366 C#CCCCCCOCCCC(C)CCC 7a_100011713154_100012094781 [0,1,0,0,0,0|2,0,1]=4 7133 B15R0.366 C#CCN(C)CCCCCCCCCCC 2230a_100000225692_100011215454 [0,1,0,0,0,0|2,0,1]=4 7134 B15R0.366 C#CCN(C)CCCCCCCCCCC 34a_100000225692_100011215454 [0,1,0,0,0,0|2,0,1]=4 7135 B15R0.366 C/C=C/C(C)OCCCCCCCCCC 34a_200102604097_100000210320 [0,1,0,0,0,0|2,0,1]=4 7136 B15R0.366 C=CCC(=O)CCCCCCCCCCC 1458a_100000210193_100011215454 [0,1,0,0,0,0|1,0,1]=3 7137 B15R0.366 C=CCC(=O)CCCCCCCCCCC 1458a_100000210736_100000210623 [0,1,0,0,0,0|1,0,1]=3 7138 B15R0.366 C=CCC(=O)CCCCCCCCCCO 1458a_100000210193_100009813290 [0,1,0,0,0,0|2,0,1]=4 7139 B15R0.366 C=CCC(=O)NCCCCCCCCCC 11a_100000684558_100000210193 [0,1,0,0,0,0|2,0,1]=4 7140 B15R0.366 C=CCC(=O)NCCCCCCCCCC 1626a_100000684558_100000210193 [0,1,0,0,0,0|2,0,1]=4 7141 B15R0.366 C=CCC(=O)NCCCCCCCCCC 240690a_100000684558_100000210193 [0,1,0,0,0,0|2,0,1]=4 7142 B15R0.366 C=CCC(=O)NCCCCCCCCCC 527a_100000684558_100000210193 [0,1,0,0,0,0|2,0,1]=4 7143 B15R0.366 C=CCC(C)COCCCCCCCCC 34a_100009832082_100011214924 [0,1,0,0,0,0|2,0,0]=3 7144 B15R0.366 C=CCC(C)COCCCCCCCCC 7a_100009832082_100000210328 [0,1,0,0,0,0|2,0,0]=3 7145 B15R0.366 C=CCC(C)COCCCCCCCCO 34a_100009832082_100000033203 [0,1,0,0,0,0|3,0,0]=4 7146 B15R0.366 C=CCC(C)COCCCCCCCCO 7a_100009832082_100000033203 [0,1,0,0,0,0|3,0,0]=4 7147 B15R0.366 C=CCCCCCCCCCC(=O)CCC 1458a_100000211992_100009814027 [0,1,0,0,0,0|1,0,1]=3 7148 B15R0.366 C=CCCCCCCCCCC(=O)CCO 1458a_100011216618_100009814027 [0,1,0,0,0,0|2,0,1]=4 7149 B15R0.366 C=CCCCCCCCCCC(=O)COC 1458a_100000210968_100009814027 [0,1,0,0,0,0|2,0,1]=4 7150 B15R0.366 C=CCCCCCCCCCC(=O)CSC 1458a_100000184570_100009814027 [0,1,0,0,0,0|2,0,1]=4 7151 B15R0.366 C=CCCCCCCCCCN(C)CCC 2230a_100000747261_100009814027 [0,1,0,0,0,0|2,0,0]=3 7152 B15R0.366 C=CCCCCCCCCCN(C)CCC 269982a_100000747261_100009814027 [0,1,0,0,0,0|2,0,0]=3 7153 B15R0.366 C=CCCCCCCCCCN(C)CCO 2230a_100000210263_100009814027 [0,1,0,0,0,0|3,0,0]=4 7154 B15R0.366 C=CCCCCCCCCCN(C)CCO 269982a_100000210263_100009814027 [0,1,0,0,0,0|3,0,0]=4 7155 B15R0.366 C=CCCCCCCCCNC(C)CCC 2230a_100000741246_100011933949 [0,1,0,0,0,0|2,0,0]=3 7156 B15R0.366 C=CCCCCCCCCN[C@H](C)CCO 2230a_100000706166_100011933949 [0,1,0,0,0,0|3,0,0]=4 7157 B15R0.366 C=CCCCCCCCCN[C@H](C)CCO 34a_100000706166_100011933949 [0,1,0,0,0,0|3,0,0]=4 7158 B15R0.366 C=CCCCCCCCCN[C@H](C)COC 2230a_100000764878_100011933949 [0,1,0,0,0,0|3,0,0]=4 7159 B15R0.366 C=CCCCCCCCCOC(C)CCBr 34a_100012276601_100011933949 [0,1,0,0,0,0|3,0,0]=4 7160 B15R0.366 C=CCCCCCCCCOC(C)CCC 34a_100000764384_100011933949 [0,1,0,0,0,0|2,0,0]=3 7161 B15R0.366 C=CCCCCCCCCOC(C)CCC 34a_100011215194_100000766640 [0,1,0,0,0,0|2,0,0]=3 7162 B15R0.366 C=CCCCCCCCCOC(C)CCC 7a_100000764384_100011933949 [0,1,0,0,0,0|2,0,0]=3 7163 B15R0.366 C=CCCCCCCCCOC(C)CCC 7a_100011215194_100000766640 [0,1,0,0,0,0|2,0,0]=3 7164 B15R0.366 C=CCCCCCCCCOC(C)CCO 34a_100011215194_100009893172 [0,1,0,0,0,0|3,0,0]=4 7165 B15R0.366 C=CCCCCCCCCOC(C)CCO 7a_100011215194_100009893172 [0,1,0,0,0,0|3,0,0]=4 7166 B15R0.366 C=CCCCCCCCCOC(C)COC 34a_100011215194_100000765312 [0,1,0,0,0,0|3,0,0]=4 7167 B15R0.366 C=CCCCCCCCCOC(C)COC 7a_100011215194_100000765312 [0,1,0,0,0,0|3,0,0]=4 7168 B15R0.366 C=CCCCCCCCCO[C@H](C)COC 34a_100011934205_100011933949 [0,1,0,0,0,0|3,0,0]=4 7169 B15R0.366 C=CCCCCCCCCSC(C)CCC 62a_100000766640_100011933949 [0,1,0,0,0,0|2,0,0]=3 7170 B15R0.366 C=CCCCCCCCCSC(C)CCC 62a_100011933949_100000766640 [0,1,0,0,0,0|2,0,0]=3 7171 B15R0.366 C=CCCCCCCCCSC(C)CCO 62a_100009893172_100011933949 [0,1,0,0,0,0|3,0,0]=4 7172 B15R0.366 C=CCCCCCCCCSC(C)CCO 62a_100011933949_100009893172 [0,1,0,0,0,0|3,0,0]=4 7173 B15R0.366 C=CCCCCCCCCSC(C)COC 62a_100000765312_100011933949 [0,1,0,0,0,0|3,0,0]=4 7174 B15R0.366 C=CCCCCCCCCSC(C)COC 62a_100011933949_100000765312 [0,1,0,0,0,0|3,0,0]=4 7175 B15R0.366 C=CCCCCCCCNCC(O)COC 2230a_100000756049_100012355270 [0,1,0,0,0,0|3,0,0]=4 7176 B15R0.366 C=CCCCCCCCNCC(O)COC 34a_100000756049_100012355270 [0,1,0,0,0,0|3,0,0]=4 7177 B15R0.366 C=CCCCCCCCOCC(=O)CCC 7a_100000730831_100000747444 [0,1,0,0,0,0|2,0,1]=4 7178 B15R0.366 C=CCCCCCCCOCC(C)CCC 34a_100000688023_100012355270 [0,1,0,0,0,0|2,0,0]=3 7179 B15R0.366 C=CCCCCCCCOCC(C)CCC 34a_100000730831_100011216630 [0,1,0,0,0,0|2,0,0]=3 7180 B15R0.366 C=CCCCCCCCOCC(C)CCC 7a_100000688023_100012355270 [0,1,0,0,0,0|2,0,0]=3 7181 B15R0.366 C=CCCCCCCCOCC(C)CCC 7a_100000730831_100011216630 [0,1,0,0,0,0|2,0,0]=3 7182 B15R0.366 C=CCCCCCCCOCC(C)CCN 34a_106354213184_100012355270 [0,1,0,0,0,0|3,0,0]=4 7183 B15R0.366 C=CCCCCCCCOCC(N)COC 34a_100000724102_100012355270 [0,1,0,0,0,0|3,0,0]=4 7184 B15R0.366 C=CCCCCCCCOCC(O)COC 34a_100000730831_100011215053 [0,1,0,0,0,0|3,0,0]=4 7185 B15R0.366 C=CCCCCCCCOCC(O)COC 7a_100000730831_100011215053 [0,1,0,0,0,0|3,0,0]=4 7186 B15R0.366 C=CCCCCCCCOC[C@@H](N)CCC 34a_100000732646_100012355270 [0,1,0,0,0,0|2,0,0]=3 7187 B15R0.366 C=CCCCCCCCSCC(=O)CCC 62a_100000747444_100012355270 [0,1,0,0,0,0|2,0,1]=4 7188 B15R0.366 C=CCCCCCCCSCC(=O)CCC 62a_100012355270_100000747444 [0,1,0,0,0,0|2,0,1]=4 7189 B15R0.366 C=CCCCCCCCSCC(C)CCC 62a_100011216630_100012355270 [0,1,0,0,0,0|2,0,0]=3 7190 B15R0.366 C=CCCCCCCCSCC(C)CCC 62a_100012355270_100011216630 [0,1,0,0,0,0|2,0,0]=3 7191 B15R0.366 C=CCCCCCCCSCC(O)COC 62a_100011215053_100012355270 [0,1,0,0,0,0|3,0,0]=4 7192 B15R0.366 C=CCCCCCCCSCC(O)COC 62a_100012355270_100011215053 [0,1,0,0,0,0|3,0,0]=4 7193 B15R0.366 C=CCCCCCCOCCC(C)CCC 34a_100011217855_100011215473 [0,1,0,0,0,0|2,0,0]=3 7194 B15R0.366 C=CCCCCCCOCCC(C)CCC 7a_100011217855_100011215473 [0,1,0,0,0,0|2,0,0]=3 7195 B15R0.366 C=CCCCCCCOCC[C@@H](N)CCC 34a_100015193777_100011215473 [0,1,0,0,0,0|2,0,0]=3 7196 B15R0.366 C=CCCCCCOCCCC(C)CCC 34a_100011713154_100000700193 [0,1,0,0,0,0|2,0,0]=3 7197 B15R0.366 C=CCCCCCOCCCC(C)CCC 7a_100011713154_100000700193 [0,1,0,0,0,0|2,0,0]=3 7198 B15R0.366 C=CCN(C)CCCCCCCCCCC 2230a_100000225617_100011215454 [0,1,0,0,0,0|2,0,0]=3 7199 B15R0.366 C=CCN(C)CCCCCCCCCCC 269982a_100000225617_100011215454 [0,1,0,0,0,0|2,0,0]=3 7200 B15R0.366 C=CCN(C)CCCCCCCCCCO 2230a_100000225617_100009813290 [0,1,0,0,0,0|3,0,0]=4 7201 B15R0.366 C=CCN(C)CCCCCCCCCCO 269982a_100000225617_100009813290 [0,1,0,0,0,0|3,0,0]=4 7202 B15R0.366 C=CC[C@@H](C)OCCCCCCCCCC 34a_100000731007_100000210320 [0,1,0,0,0,0|2,0,0]=3 7203 B15R0.366 C=CC[C@@H](C)OCCCCCCCCCC 7a_100000731007_100000210320 [0,1,0,0,0,0|2,0,0]=3 7204 B15R0.366 C=CC[C@@H](C)OCCCCCCCCCO 34a_100000731007_100009813782 [0,1,0,0,0,0|3,0,0]=4 7205 B15R0.366 C=CC[C@@H](C)OCCCCCCCCCO 7a_100000731007_100009813782 [0,1,0,0,0,0|3,0,0]=4 7206 B15R0.366 C=CC[C@@H](N)COCCCCCCCCC 34a_100020615467_100011214924 [0,1,0,0,0,0|2,0,0]=3 7207 B15R0.366 C=CC[C@@H](N)COCCCCCCCCO 34a_100020615467_100000033203 [0,1,0,0,0,0|3,0,0]=4 7208 B15R0.366 CC=CC(=O)CCCCCCCCCCC 1458a_100000210699_100011215454 [0,1,0,0,0,0|1,0,2]=4 7209 B15R0.366 CCCC(=O)CCCCCCCCCCO 1458a_100000211992_100009813290 [0,1,0,0,0,0|0,0,3]=4 7210 B15R0.366 CCCC(C)CCCOCCCCCC#N 7a_100011713154_100009813376 [0,1,0,0,0,0|2,0,1]=4 7211 B15R0.366 CCCC(C)CCCOCCCCCC=O 7a_100011713154_100000139337 [0,1,0,0,0,0|1,0,0]=2 7212 B15R0.366 CCCC(C)CCCOCCCCCCF 34a_100011713154_100015922095 [0,1,0,0,0,0|2,0,1]=4 7213 B15R0.366 CCCC(C)CCCOCCCCCCF 7a_100011713154_100015922095 [0,1,0,0,0,0|2,0,1]=4 7214 B15R0.366 CCCC(C)CCCOCCCCCCO 34a_100011713154_100000766143 [0,1,0,0,0,0|1,0,2]=4 7215 B15R0.366 CCCC(C)CCCOCCCCCCO 7a_100011713154_100000766143 [0,1,0,0,0,0|1,0,2]=4 7216 B15R0.366 CCCC(C)CCOCCCCCCC#N 7a_100011217855_100009813337 [0,1,0,0,0,0|2,0,1]=4 7217 B15R0.366 CCCC(C)CCOCCCCCCCO 34a_100011217855_100000760002 [0,1,0,0,0,0|1,0,2]=4 7218 B15R0.366 CCCC(C)CCOCCCCCCCO 7a_100011217855_100000760002 [0,1,0,0,0,0|1,0,2]=4 7219 B15R0.366 CCCC(C)CCOCCCCCCOC 34a_100011217855_100011998445 [0,1,0,0,0,0|3,0,0]=4 7220 B15R0.366 CCCC(C)CCOCCCCCCOC 7a_100011217855_100011998445 [0,1,0,0,0,0|3,0,0]=4 7221 B15R0.366 CCCC(C)CNCCCCCCCCO 2230a_102515433106_100011216630 [0,1,0,0,0,0|1,0,2]=4 7222 B15R0.366 CCCC(C)CNCCCCCCCCO 270004a_102515433106_100000243154 [0,1,0,0,0,0|1,0,2]=4 7223 B15R0.366 CCCC(C)CNCCCCCCCCO 34a_102515433106_100011216630 [0,1,0,0,0,0|1,0,2]=4 7224 B15R0.366 CCCC(C)COCCCCCCCCBr 34a_100009813846_100011216630 [0,1,0,0,0,0|2,0,1]=4 7225 B15R0.366 CCCC(C)COCCCCCCCCBr 7a_100009813846_100011216630 [0,1,0,0,0,0|2,0,1]=4 7226 B15R0.366 CCCC(C)COCCCCCCCCCl 34a_100000033203_100011216630 [0,1,0,0,0,0|2,0,1]=4 7227 B15R0.366 CCCC(C)COCCCCCCCCCl 7a_100000033203_100011216630 [0,1,0,0,0,0|2,0,1]=4 7228 B15R0.366 CCCC(C)COCCCCCCCCN 34a_102515433106_100011216630 [0,1,0,0,0,0|2,0,1]=4 7229 B15R0.366 CCCC(C)COCCCCCCCCO 34a_100000688023_100000033203 [0,1,0,0,0,0|1,0,2]=4 7230 B15R0.366 CCCC(C)COCCCCCCCCO 7a_100000688023_100000033203 [0,1,0,0,0,0|1,0,2]=4 7231 B15R0.366 CCCC(C)CSCCCCCCCCO 62a_100000033203_100011216630 [0,1,0,0,0,0|1,0,2]=4 7232 B15R0.366 CCCC(C)CSCCCCCCCCO 62a_100011216630_100000033203 [0,1,0,0,0,0|1,0,2]=4 7233 B15R0.366 CCCC(C)NCCCCCCCCCO 2230a_100000078944_100000766640 [0,1,0,0,0,0|1,0,2]=4 7234 B15R0.366 CCCC(C)NCCCCCCCCCO 2230a_100000741246_100009813782 [0,1,0,0,0,0|1,0,2]=4 7235 B15R0.366 CCCC(C)NCCCCCCCCCO 270004a_100000078944_100000211909 [0,1,0,0,0,0|1,0,2]=4 7236 B15R0.366 CCCC(C)NCCCCCCCCCO 34a_100000078944_100000766640 [0,1,0,0,0,0|1,0,2]=4 7237 B15R0.366 CCCC(C)OCCCCCCCCCBr 34a_100009813782_100000766640 [0,1,0,0,0,0|2,0,1]=4 7238 B15R0.366 CCCC(C)OCCCCCCCCCBr 7a_100009813782_100000766640 [0,1,0,0,0,0|2,0,1]=4 7239 B15R0.366 CCCC(C)OCCCCCCCCCCl 34a_100009868337_100000766640 [0,1,0,0,0,0|2,0,1]=4 7240 B15R0.366 CCCC(C)OCCCCCCCCCCl 7a_100009868337_100000766640 [0,1,0,0,0,0|2,0,1]=4 7241 B15R0.366 CCCC(C)OCCCCCCCCCN 34a_100000078944_100000766640 [0,1,0,0,0,0|2,0,1]=4 7242 B15R0.366 CCCC(C)OCCCCCCCCCO 34a_100000764384_100009813782 [0,1,0,0,0,0|1,0,2]=4 7243 B15R0.366 CCCC(C)OCCCCCCCCCO 7a_100000764384_100009813782 [0,1,0,0,0,0|1,0,2]=4 7244 B15R0.366 CCCC(C)SCCCCCCCCCO 62a_100000766640_100009813782 [0,1,0,0,0,0|1,0,2]=4 7245 B15R0.366 CCCC(C)SCCCCCCCCCO 62a_100009813782_100000766640 [0,1,0,0,0,0|1,0,2]=4 7246 B15R0.366 CCCCCCCCCCCC(=O)C=CBr 1458a_100016273825_100011215454 [0,1,0,0,0,0|1,0,2]=4 7247 B15R0.366 CCCCCCCCCCCC(=O)C=CCl 1458a_200016279998_100011215454 [0,1,0,0,0,0|1,0,2]=4 7248 B15R0.366 CCCCCCCCCCCC(=O)C=CI 1458a_100016256311_100011215454 [0,1,0,0,0,0|1,0,2]=4 7249 B15R0.366 CCCCCCCCCCCC(=O)CC#N 1458a_100000210736_100011214920 [0,1,0,0,0,0|1,0,2]=4 7250 B15R0.366 CCCCCCCCCCCC(=O)CC#N 1458a_100051588842_100011215454 [0,1,0,0,0,0|1,0,2]=4 7251 B15R0.366 CCCCCCCCCCCC(=O)CCC 1458a_100000210736_100000210303 [0,1,0,0,0,0|1,0,2]=4 7252 B15R0.366 CCCCCCCCCCCC(=O)CCC 1458a_100000211992_100011215454 [0,1,0,0,0,0|1,0,2]=4 7253 B15R0.366 CCCCCCCCCCCC(=O)CCF 1458a_100000210736_100011217306 [0,1,0,0,0,0|1,0,2]=4 7254 B15R0.366 CCCCCCCCCCCC(=O)CCO 1458a_100000210736_100000211926 [0,1,0,0,0,0|0,0,3]=4 7255 B15R0.366 CCCCCCCCCCCC(=O)CCO 1458a_100011216618_100011215454 [0,1,0,0,0,0|0,0,3]=4 7256 B15R0.366 CCCCCCCCCCCC(=O)COC 1458a_100000210968_100011215454 [0,1,0,0,0,0|2,0,1]=4 7257 B15R0.366 CCCCCCCCCCCC(=O)CSC 1458a_100000184570_100011215454 [0,1,0,0,0,0|2,0,1]=4 7258 B15R0.366 CCCCCCCCCCCC(C)NCC 270004a_100015525214_100011216755 [0,1,0,0,0,0|2,0,1]=4 7259 B15R0.366 CCCCCCCCCCCC(C)OCC 34a_100011217895_100000210202 [0,1,0,0,0,0|2,0,1]=4 7260 B15R0.366 CCCCCCCCCCCC(C)OCC 7a_100011217895_100000210202 [0,1,0,0,0,0|2,0,1]=4 7261 B15R0.366 CCCCCCCCCCCC(C)OCF 34a_100011217895_100015361967 [0,1,0,0,0,0|2,0,1]=4 7262 B15R0.366 CCCCCCCCCCCC(C)OCF 7a_100011217895_100015361967 [0,1,0,0,0,0|2,0,1]=4 7263 B15R0.366 CCCCCCCCCCCN(C)CC#N 2230a_100000748184_100011215454 [0,1,0,0,0,0|2,0,1]=4 7264 B15R0.366 CCCCCCCCCCCN(C)CCC 2230a_100000747261_100011215454 [0,1,0,0,0,0|2,0,1]=4 7265 B15R0.366 CCCCCCCCCCCN(C)CCC 269982a_100000747261_100011215454 [0,1,0,0,0,0|2,0,1]=4 7266 B15R0.366 CCCCCCCCCCCN(C)CCO 2230a_100000210263_100011215454 [0,1,0,0,0,0|1,0,2]=4 7267 B15R0.366 CCCCCCCCCCCN(C)CCO 269982a_100000210263_100011215454 [0,1,0,0,0,0|1,0,2]=4 7268 B15R0.366 CCCCCCCCCCNC(C)CC#N 2230a_100000684558_100009813641 [0,1,0,0,0,0|2,0,1]=4 7269 B15R0.366 CCCCCCCCCCNC(C)CCC 2230a_100000684558_100000766640 [0,1,0,0,0,0|2,0,1]=4 7270 B15R0.366 CCCCCCCCCCNC(C)CCC 2230a_100000741246_100000210320 [0,1,0,0,0,0|2,0,1]=4 7271 B15R0.366 CCCCCCCCCCNC(C)CCC 270004a_100000684558_100000211909 [0,1,0,0,0,0|2,0,1]=4 7272 B15R0.366 CCCCCCCCCCNC(C)CCC 34a_100000684558_100000766640 [0,1,0,0,0,0|2,0,1]=4 7273 B15R0.366 CCCCCCCCCCNC(C)CCO 2230a_100000684558_100009893172 [0,1,0,0,0,0|1,0,2]=4 7274 B15R0.366 CCCCCCCCCCNC(C)CCO 34a_100000684558_100009893172 [0,1,0,0,0,0|1,0,2]=4 7275 B15R0.366 CCCCCCCCCCNC(C)COC 2230a_100000684558_100000765312 [0,1,0,0,0,0|3,0,0]=4 7276 B15R0.366 CCCCCCCCCCNC(C)COC 270004a_100000684558_100000749346 [0,1,0,0,0,0|3,0,0]=4 7277 B15R0.366 CCCCCCCCCCNC(C)COC 34a_100000684558_100000765312 [0,1,0,0,0,0|3,0,0]=4 7278 B15R0.366 CCCCCCCCCCNC(C)CSC 270004a_100000684558_100011216314 [0,1,0,0,0,0|3,0,0]=4 7279 B15R0.366 CCCCCCCCCCN[C@@H](C)CC#N 2230a_100016994482_100000210320 [0,1,0,0,0,0|2,0,1]=4 7280 B15R0.366 CCCCCCCCCCN[C@H](C)CCO 2230a_100000706166_100000210320 [0,1,0,0,0,0|1,0,2]=4 7281 B15R0.366 CCCCCCCCCCN[C@H](C)CCO 34a_100000706166_100000210320 [0,1,0,0,0,0|1,0,2]=4 7282 B15R0.366 CCCCCCCCCCN[C@H](C)COC 2230a_100000764878_100000210320 [0,1,0,0,0,0|3,0,0]=4 7283 B15R0.366 CCCCCCCCCCOC(C)CC#N 7a_100000210711_100009813641 [0,1,0,0,0,0|2,0,1]=4 7284 B15R0.366 CCCCCCCCCCOC(C)CCBr 34a_100012276601_100000210320 [0,1,0,0,0,0|2,0,1]=4 7285 B15R0.366 CCCCCCCCCCOC(C)CCC 34a_100000210711_100000766640 [0,1,0,0,0,0|2,0,1]=4 7286 B15R0.366 CCCCCCCCCCOC(C)CCC 34a_100000764384_100000210320 [0,1,0,0,0,0|2,0,1]=4 7287 B15R0.366 CCCCCCCCCCOC(C)CCC 7a_100000210711_100000766640 [0,1,0,0,0,0|2,0,1]=4 7288 B15R0.366 CCCCCCCCCCOC(C)CCC 7a_100000764384_100000210320 [0,1,0,0,0,0|2,0,1]=4 7289 B15R0.366 CCCCCCCCCCOC(C)CCO 34a_100000210711_100009893172 [0,1,0,0,0,0|1,0,2]=4 7290 B15R0.366 CCCCCCCCCCOC(C)CCO 7a_100000210711_100009893172 [0,1,0,0,0,0|1,0,2]=4 7291 B15R0.366 CCCCCCCCCCOC(C)COC 34a_100000210711_100000765312 [0,1,0,0,0,0|3,0,0]=4 7292 B15R0.366 CCCCCCCCCCOC(C)COC 7a_100000210711_100000765312 [0,1,0,0,0,0|3,0,0]=4 7293 B15R0.366 CCCCCCCCCCO[C@H](C)COC 34a_100011934205_100000210320 [0,1,0,0,0,0|3,0,0]=4 7294 B15R0.366 CCCCCCCCCCSC(C)CC#N 62a_100009813641_100000210320 [0,1,0,0,0,0|2,0,1]=4 7295 B15R0.366 CCCCCCCCCCSC(C)CCO 62a_100009893172_100000210320 [0,1,0,0,0,0|1,0,2]=4 7296 B15R0.366 CCCCCCCCCCSC(C)COC 62a_100000765312_100000210320 [0,1,0,0,0,0|3,0,0]=4 7297 B15R0.366 CCCCCCCCCNCC(C)CCC 2230a_100000212291_100011216630 [0,1,0,0,0,0|2,0,1]=4 7298 B15R0.366 CCCCCCCCCNCC(C)CCC 270004a_100000212291_100000243154 [0,1,0,0,0,0|2,0,1]=4 7299 B15R0.366 CCCCCCCCCNCC(C)CCC 34a_100000212291_100011216630 [0,1,0,0,0,0|2,0,1]=4 7300 B15R0.366 CCCCCCCCCNCC(O)COC 2230a_100000756049_100011214924 [0,1,0,0,0,0|3,0,0]=4 7301 B15R0.366 CCCCCCCCCNCC(O)COC 34a_100000212291_100011215053 [0,1,0,0,0,0|3,0,0]=4 7302 B15R0.366 CCCCCCCCCNCC(O)COC 34a_100000756049_100011214924 [0,1,0,0,0,0|3,0,0]=4 7303 B15R0.366 CCCCCCCCCNC[C@@H](O)CC#N 2230a_100000212291_100000001066 [0,1,0,0,0,0|2,0,1]=4 7304 B15R0.366 CCCCCCCCCOCC(C)CCC 34a_100000210712_100011216630 [0,1,0,0,0,0|2,0,1]=4 7305 B15R0.366 CCCCCCCCCOCC(C)CCC 34a_100000688023_100011214924 [0,1,0,0,0,0|2,0,1]=4 7306 B15R0.366 CCCCCCCCCOCC(C)CCC 7a_100000210712_100011216630 [0,1,0,0,0,0|2,0,1]=4 7307 B15R0.366 CCCCCCCCCOCC(C)CCC 7a_100000688023_100000210328 [0,1,0,0,0,0|2,0,1]=4 7308 B15R0.366 CCCCCCCCCOCC(C)CCN 34a_106354213184_100011214924 [0,1,0,0,0,0|2,0,1]=4 7309 B15R0.366 CCCCCCCCCOCC(N)COC 34a_100000724102_100011214924 [0,1,0,0,0,0|3,0,0]=4 7310 B15R0.366 CCCCCCCCCOCC(O)COC 34a_100000210712_100011215053 [0,1,0,0,0,0|3,0,0]=4 7311 B15R0.366 CCCCCCCCCOCC(O)COC 7a_100000210712_100011215053 [0,1,0,0,0,0|3,0,0]=4 7312 B15R0.366 CCCCCCCCCOC[C@@H](N)CCC 34a_100000732646_100011214924 [0,1,0,0,0,0|2,0,1]=4 7313 B15R0.366 CCCCCCCCCOC[C@@H](O)CC#N 7a_100000210712_100000001066 [0,1,0,0,0,0|2,0,1]=4 7314 B15R0.366 CCCCCCCCCSCC(C)CCC 62a_100011216630_100000210670 [0,1,0,0,0,0|2,0,1]=4 7315 B15R0.366 CCCCCCCCCSCC(O)COC 62a_100011215053_100000210670 [0,1,0,0,0,0|3,0,0]=4 7316 B15R0.366 CCCCCCCCCSC[C@@H](O)CC#N 62a_100000001066_100000210670 [0,1,0,0,0,0|2,0,1]=4 7317 B15R0.366 CCCCCCCCOCCC(C)CCC 34a_100011217855_100000210759 [0,1,0,0,0,0|2,0,1]=4 7318 B15R0.366 CCCCCCCCOCCC(C)CCC 7a_100011217855_100000210759 [0,1,0,0,0,0|2,0,1]=4 7319 B15R0.366 CCCCCCCCOCC[C@@H](N)CCC 34a_100015193777_100000210759 [0,1,0,0,0,0|2,0,1]=4 7320 B15R0.366 CCCCCCCOCCCC(C)CCC 34a_100011713154_100000210614 [0,1,0,0,0,0|2,0,1]=4 7321 B15R0.366 CCCCCCCOCCCC(C)CCC 7a_100011713154_100000210614 [0,1,0,0,0,0|2,0,1]=4 7322 B15R0.366 CCCN(C)CCCCCCCCCCO 2230a_100000747261_100009813290 [0,1,0,0,0,0|1,0,2]=4 7323 B15R0.366 CCCN(C)CCCCCCCCCCO 269982a_100000747261_100009813290 [0,1,0,0,0,0|1,0,2]=4 7324 B15R0.366 CCC[C@H](N)CCOCCCCCCCO 34a_100015193777_100000760002 [0,1,0,0,0,0|1,0,2]=4 7325 B15R0.366 CCC[C@H](N)CCOCCCCCCOC 34a_100015193777_100011998445 [0,1,0,0,0,0|3,0,0]=4 7326 B15R0.366 CCC[C@H](N)COCCCCCCCCO 34a_100000732646_100000033203 [0,1,0,0,0,0|1,0,2]=4 7327 B15R0.366 CCOC(=O)CCCCCCCSCC=O 62a_200015260668_100009991516 [0,1,0,0,0,0|2,0,1]=4 7328 B15R0.366 CCOC(=O)CCCCCOCCCC=O 7a_100011214988_200011292268 [0,1,0,0,0,0|2,0,1]=4 7329 B15R0.366 CCOC(=O)CCCCCSCCCC=O 62a_100000755133_200011292268 [0,1,0,0,0,0|2,0,1]=4 7330 B15R0.366 CCOC(=O)CCCCCSCCCC=O 62a_200011292268_100000755133 [0,1,0,0,0,0|2,0,1]=4 7331 B15R0.366 CCOC(=O)CCCCSCCCCC=O 62a_100000139335_100000750268 [0,1,0,0,0,0|2,0,1]=4 7332 B15R0.366 CCOC(=O)CCCCSCCCCC=O 62a_100000750268_100000139335 [0,1,0,0,0,0|2,0,1]=4 7333 B15R0.366 CCOC(=O)CCCOCCCCCC=O 7a_100012001163_100000139337 [0,1,0,0,0,0|2,0,1]=4 7334 B15R0.366 CCOC(=O)CCCSCCCCCC=O 62a_100000139337_100009991533 [0,1,0,0,0,0|2,0,1]=4 7335 B15R0.366 CCOC(=O)CCCSCCCCCC=O 62a_100009991533_100000139337 [0,1,0,0,0,0|2,0,1]=4 7336 B15R0.2002 C#CCCC(=O)CCCCCCCCCC 1458a_100000210375_100000753159 [0,1,0,0,0,0|1,0,2]=4 7337 B15R0.2002 C#CCCC(=O)CCCCCCCCCC 1458a_100000692101_100000210319 [0,1,0,0,0,0|1,0,2]=4 7338 B15R0.2002 C#CCCCCCCCCC(=O)CCCC 1458a_100000029693_100000210211 [0,1,0,0,0,0|1,0,2]=4 7339 B15R0.2002 C#CCCCCCCCNC(C)CCCC 2230a_100000126638_100153394163 [0,1,0,0,0,0|2,0,1]=4 7340 B15R0.2002 C#CCCCCCCCOC(C)CCCC 34a_100000054614_200011215066 [0,1,0,0,0,0|2,0,1]=4 7341 B15R0.2002 C#CCCCCCCCOC(C)CCCC 34a_100000687866_100153394163 [0,1,0,0,0,0|2,0,1]=4 7342 B15R0.2002 C#CCCCCCCCOC(C)CCCC 7a_100000054614_200011215066 [0,1,0,0,0,0|2,0,1]=4 7343 B15R0.2002 C#CCCCCCCCOC(C)CCCC 7a_100000687866_100153394163 [0,1,0,0,0,0|2,0,1]=4 7344 B15R0.2002 C#CCCCCCCCSC(C)CCCC 62a_100153394163_200011215066 [0,1,0,0,0,0|2,0,1]=4 7345 B15R0.2002 C#CCCCCCCCSC(C)CCCC 62a_200011215066_100153394163 [0,1,0,0,0,0|2,0,1]=4 7346 B15R0.2002 C#CCCCCCCOCC(C)CCCC 34a_100011995851_100012276617 [0,1,0,0,0,0|2,0,1]=4 7347 B15R0.2002 C#CCCCCCCOCC(C)CCCC 7a_100011995851_100012276617 [0,1,0,0,0,0|2,0,1]=4 7348 B15R0.2002 C#CCCCCCCOC[C@@H](N)CCCC 34a_100011934283_100012276617 [0,1,0,0,0,0|2,0,1]=4 7349 B15R0.2002 C#CCCCOCCCCC(C)CCCC 34a_200011021034_100000695029 [0,1,0,0,0,0|2,0,1]=4 7350 B15R0.2002 C#CCCCOCCCCC(C)CCCC 7a_200011021034_100011215417 [0,1,0,0,0,0|2,0,1]=4 7351 B15R0.2002 C#CCCN(C)CCCCCCCCCC 2230a_100000207566_100000688953 [0,1,0,0,0,0|2,0,1]=4 7352 B15R0.2002 C#CCCN(C)CCCCCCCCCC 269982a_100000207566_100000730999 [0,1,0,0,0,0|2,0,1]=4 7353 B15R0.2002 C#CCOC(C)CCCCCCCCCC 34a_100011215000_100000184674 [0,1,0,0,0,0|2,0,1]=4 7354 B15R0.2002 C#CCOC(C)CCCCCCCCCC 7a_100011215000_100000038162 [0,1,0,0,0,0|2,0,1]=4 7355 B15R0.2002 C/C=C/CC(=O)CCCCCCCCCC 1458a_100000210375_100102629194 [0,1,0,0,0,0|1,0,2]=4 7356 B15R0.2002 C/C=C/CN(C)CCCCCCCCCC 269982a_100000207566_100102629194 [0,1,0,0,0,0|2,0,1]=4 7357 B15R0.2002 C=CCCC(=O)CCCCCCCCCC 1458a_100000210375_100000754431 [0,1,0,0,0,0|1,0,1]=3 7358 B15R0.2002 C=CCCC(=O)CCCCCCCCCC 1458a_100000749702_100000210319 [0,1,0,0,0,0|1,0,1]=3 7359 B15R0.2002 C=CCCC(=O)CCCCCCCCCF 1458a_200009909015_100000754431 [0,1,0,0,0,0|2,0,1]=4 7360 B15R0.2002 C=CCCC(=O)CCCCCCCCCO 1458a_100000749702_100009813782 [0,1,0,0,0,0|2,0,1]=4 7361 B15R0.2002 C=CCCC(=O)COCCCCCCCC 1458a_100000759886_100000754431 [0,1,0,0,0,0|2,0,1]=4 7362 B15R0.2002 C=CCCC(=O)NCCCCCCCCC 11a_100000212291_100000749702 [0,1,0,0,0,0|2,0,1]=4 7363 B15R0.2002 C=CCCC(=O)NCCCCCCCCC 1626a_100000212291_100000749702 [0,1,0,0,0,0|2,0,1]=4 7364 B15R0.2002 C=CCCC(=O)NCCCCCCCCC 240690a_100000212291_100000749702 [0,1,0,0,0,0|2,0,1]=4 7365 B15R0.2002 C=CCCC(=O)NCCCCCCCCC 527a_100000212291_100000749702 [0,1,0,0,0,0|2,0,1]=4 7366 B15R0.2002 C=CCCC(C)NCCCCCCCCC 270004a_100000212291_100000762624 [0,1,0,0,0,0|2,0,0]=3 7367 B15R0.2002 C=CCCC(C)NCCCCCCCCO 270004a_102515433106_100000762624 [0,1,0,0,0,0|3,0,0]=4 7368 B15R0.2002 C=CCCC(C)OCCCCCCCCC 34a_100000765329_100011214924 [0,1,0,0,0,0|2,0,0]=3 7369 B15R0.2002 C=CCCC(C)OCCCCCCCCC 7a_100000765329_100000210328 [0,1,0,0,0,0|2,0,0]=3 7370 B15R0.2002 C=CCCC(C)OCCCCCCCCO 34a_100000765329_100000033203 [0,1,0,0,0,0|3,0,0]=4 7371 B15R0.2002 C=CCCC(C)OCCCCCCCCO 7a_100000765329_100000033203 [0,1,0,0,0,0|3,0,0]=4 7372 B15R0.2002 C=CCCCCCCCCC(=O)CCCC 1458a_100000210183_100011933949 [0,1,0,0,0,0|1,0,1]=3 7373 B15R0.2002 C=CCCCCCCCCC(=O)CCCC 1458a_100000211349_100000210211 [0,1,0,0,0,0|1,0,1]=3 7374 B15R0.2002 C=CCCCCCCCCC(=O)CCCF 1458a_100000211349_100011934791 [0,1,0,0,0,0|2,0,1]=4 7375 B15R0.2002 C=CCCCCCCCCC(=O)CCCO 1458a_100000211349_100011215043 [0,1,0,0,0,0|2,0,1]=4 7376 B15R0.2002 C=CCCCCCCCCC(=O)CCOC 1458a_100000211349_100000233755 [0,1,0,0,0,0|2,0,1]=4 7377 B15R0.2002 C=CCCCCCCCCC(=O)CCOC 1458a_100000749529_100011933949 [0,1,0,0,0,0|2,0,1]=4 7378 B15R0.2002 C=CCCCCCCCCC(=O)CCSC 1458a_100000174002_100011933949 [0,1,0,0,0,0|2,0,1]=4 7379 B15R0.2002 C=CCCCCCCCCC(=O)CCSC 1458a_100000211349_100000751147 [0,1,0,0,0,0|2,0,1]=4 7380 B15R0.2002 C=CCCCCCCCCC(=O)COCC 1458a_100000211967_100011933949 [0,1,0,0,0,0|2,0,1]=4 7381 B15R0.2002 C=CCCCCCCCCC(=O)CSCC 1458a_100000230394_100011933949 [0,1,0,0,0,0|2,0,1]=4 7382 B15R0.2002 C=CCCCCCCCCC(=O)NCCC 11a_100020643023_100000211349 [0,1,0,0,0,0|2,0,1]=4 7383 B15R0.2002 C=CCCCCCCCCC(=O)NCCC 1626a_100020643023_100000211349 [0,1,0,0,0,0|2,0,1]=4 7384 B15R0.2002 C=CCCCCCCCCC(=O)NCCC 240690a_100020643023_100000211349 [0,1,0,0,0,0|2,0,1]=4 7385 B15R0.2002 C=CCCCCCCCCC(=O)NCCC 527a_100020643023_100000211349 [0,1,0,0,0,0|2,0,1]=4 7386 B15R0.2002 C=CCCCCCCCCN(C)CCCC 2230a_100000207549_100011933949 [0,1,0,0,0,0|2,0,0]=3 7387 B15R0.2002 C=CCCCCCCCCN(C)CCCC 269982a_100000207549_100011933949 [0,1,0,0,0,0|2,0,0]=3 7388 B15R0.2002 C=CCCCCCCCCN(C)CCCO 2230a_100000213112_100011933949 [0,1,0,0,0,0|3,0,0]=4 7389 B15R0.2002 C=CCCCCCCCCN(C)CCCO 269982a_100000213112_100011933949 [0,1,0,0,0,0|3,0,0]=4 7390 B15R0.2002 C=CCCCCCCCCN(C)CCOC 2230a_100000743101_100011933949 [0,1,0,0,0,0|3,0,0]=4 7391 B15R0.2002 C=CCCCCCCCCN(C)CCOC 269982a_100000743101_100011933949 [0,1,0,0,0,0|3,0,0]=4 7392 B15R0.2002 C=CCCCCCCCCN(C)CCSC 2230a_100000686725_100011933949 [0,1,0,0,0,0|3,0,0]=4 7393 B15R0.2002 C=CCCCCCCCCN(C)CCSC 269982a_100000686725_100011933949 [0,1,0,0,0,0|3,0,0]=4 7394 B15R0.2002 C=CCCCCCCCNC(C)CCCC 2230a_100000126638_100012355270 [0,1,0,0,0,0|2,0,0]=3 7395 B15R0.2002 C=CCCCCCCCOC(C)CCCC 34a_100000687866_100012355270 [0,1,0,0,0,0|2,0,0]=3 7396 B15R0.2002 C=CCCCCCCCOC(C)CCCC 34a_100000730831_200011215066 [0,1,0,0,0,0|2,0,0]=3 7397 B15R0.2002 C=CCCCCCCCOC(C)CCCC 7a_100000687866_100012355270 [0,1,0,0,0,0|2,0,0]=3 7398 B15R0.2002 C=CCCCCCCCOC(C)CCCC 7a_100000730831_200011215066 [0,1,0,0,0,0|2,0,0]=3 7399 B15R0.2002 C=CCCCCCCCOC(C)CCCCl 34a_200000718107_100012355270 [0,1,0,0,0,0|3,0,0]=4 7400 B15R0.2002 C=CCCCCCCCOC(C)CCCCl 7a_200000718107_100012355270 [0,1,0,0,0,0|3,0,0]=4 7401 B15R0.2002 C=CCCCCCCCOC(C)COCC 34a_100000718985_100012355270 [0,1,0,0,0,0|3,0,0]=4 7402 B15R0.2002 C=CCCCCCCCOC(C)COCC 7a_100000718985_100012355270 [0,1,0,0,0,0|3,0,0]=4 7403 B15R0.2002 C=CCCCCCCCSC(C)CCCC 62a_100012355270_200011215066 [0,1,0,0,0,0|2,0,0]=3 7404 B15R0.2002 C=CCCCCCCCSC(C)CCCC 62a_200011215066_100012355270 [0,1,0,0,0,0|2,0,0]=3 7405 B15R0.2002 C=CCCCCCCNCC(C)OCCC 2230a_100015185124_100011215473 [0,1,0,0,0,0|3,0,0]=4 7406 B15R0.2002 C=CCCCCCCNCC(C)OCCC 34a_100015185124_100011215473 [0,1,0,0,0,0|3,0,0]=4 7407 B15R0.2002 C=CCCCCCCNCC(O)COCC 2230a_102515437182_100011215473 [0,1,0,0,0,0|3,0,0]=4 7408 B15R0.2002 C=CCCCCCCNCC(O)COCC 34a_102515437182_100011215473 [0,1,0,0,0,0|3,0,0]=4 7409 B15R0.2002 C=CCCCCCCNC[C@H](C)CCCO 2230a_100160569302_100011215473 [0,1,0,0,0,0|3,0,0]=4 7410 B15R0.2002 C=CCCCCCCNC[C@H](C)CCCO 34a_100160569302_100011215473 [0,1,0,0,0,0|3,0,0]=4 7411 B15R0.2002 C=CCCCCCCOCC(C)CCCC 34a_100011995851_100011215473 [0,1,0,0,0,0|2,0,0]=3 7412 B15R0.2002 C=CCCCCCCOCC(C)CCCC 7a_100011995851_100011215473 [0,1,0,0,0,0|2,0,0]=3 7413 B15R0.2002 C=CCCCCCCOC[C@@H](N)CCCC 34a_100011934283_100011215473 [0,1,0,0,0,0|2,0,0]=3 7414 B15R0.2002 C=CCCCCCCOC[C@@H](N)CCSC 34a_100011827619_100011215473 [0,1,0,0,0,0|3,0,0]=4 7415 B15R0.2002 C=CCCCOCCCCC(C)CCCC 34a_200011021034_100000757094 [0,1,0,0,0,0|2,0,0]=3 7416 B15R0.2002 C=CCCCOCCCCC(C)CCCC 7a_200011021034_100000757094 [0,1,0,0,0,0|2,0,0]=3 7417 B15R0.2002 C=CCCN(C)CCCCCCCCCC 2230a_100000207566_100000754431 [0,1,0,0,0,0|2,0,0]=3 7418 B15R0.2002 C=CCCN(C)CCCCCCCCCC 2230a_100020639649_100000210320 [0,1,0,0,0,0|2,0,0]=3 7419 B15R0.2002 C=CCCN(C)CCCCCCCCCC 269982a_100000207566_100000754431 [0,1,0,0,0,0|2,0,0]=3 7420 B15R0.2002 C=CCCN(C)CCCCCCCCCC 269982a_100020639649_100000210320 [0,1,0,0,0,0|2,0,0]=3 7421 B15R0.2002 C=CCCN(C)CCCCCCCCCO 2230a_100020639649_100009813782 [0,1,0,0,0,0|3,0,0]=4 7422 B15R0.2002 C=CCCN(C)CCCCCCCCCO 269982a_100020639649_100009813782 [0,1,0,0,0,0|3,0,0]=4 7423 B15R0.2002 C=CCNC(=O)CCCCCCCCCC 1626a_100020586998_100000210375 [0,1,0,0,0,0|2,0,1]=4 7424 B15R0.2002 C=CCNC(=O)CCCCCCCCCC 240690a_100020586998_100000210375 [0,1,0,0,0,0|2,0,1]=4 7425 B15R0.2002 C=CCNC(C)CCCCCCCCCC 270004a_100020586998_200011219864 [0,1,0,0,0,0|2,0,0]=3 7426 B15R0.2002 C=CCOC(C)CCCCCCCCCC 34a_100011215000_100015514636 [0,1,0,0,0,0|2,0,0]=3 7427 B15R0.2002 C=CCOC(C)CCCCCCCCCC 7a_100011215000_100015514636 [0,1,0,0,0,0|2,0,0]=3 7428 B15R0.2002 C=COCCOCCCCC(C)CCCC 34a_200011021034_100000039644 [0,1,0,0,0,0|3,0,0]=4 7429 B15R0.2002 C=COCCOCCCCC(C)CCCC 7a_200011021034_100000039644 [0,1,0,0,0,0|3,0,0]=4 7430 B15R0.2002 CC=CCC(=O)CCCCCCCCCC 1458a_100000210375_100000070051 [0,1,0,0,0,0|1,0,2]=4 7431 B15R0.2002 CC=CCC(=O)CCCCCCCCCC 1458a_100121576822_100000210319 [0,1,0,0,0,0|1,0,2]=4 7432 B15R0.2002 CC=CCN(C)CCCCCCCCCC 2230a_100000207566_100000070051 [0,1,0,0,0,0|2,0,1]=4 7433 B15R0.2002 CCCCC(=O)CCCCCCCCCF 1458a_200009909015_100000210211 [0,1,0,0,0,0|1,0,2]=4 7434 B15R0.2002 CCCCC(=O)CCCCCCCCCO 1458a_100000210183_100009813782 [0,1,0,0,0,0|0,0,3]=4 7435 B15R0.2002 CCCCC(C)CCCCOCCCC#N 7a_200011021034_100000687738 [0,1,0,0,0,0|2,0,1]=4 7436 B15R0.2002 CCCCC(C)CCCCOCCCC=O 7a_200011021034_200011292268 [0,1,0,0,0,0|1,0,0]=2 7437 B15R0.2002 CCCCC(C)CCCCOCCCCF 34a_200011021034_100000729493 [0,1,0,0,0,0|2,0,1]=4 7438 B15R0.2002 CCCCC(C)CCCCOCCCCF 7a_200011021034_100000729493 [0,1,0,0,0,0|2,0,1]=4 7439 B15R0.2002 CCCCC(C)CCCCOCCCCO 34a_200011021034_100011216708 [0,1,0,0,0,0|1,0,2]=4 7440 B15R0.2002 CCCCC(C)CCCCOCCCCO 7a_200011021034_100000210776 [0,1,0,0,0,0|1,0,2]=4 7441 B15R0.2002 CCCCC(C)CCCCOCCCOC 34a_200011021034_100000740836 [0,1,0,0,0,0|3,0,0]=4 7442 B15R0.2002 CCCCC(C)CCCCOCCCOC 7a_200011021034_100000740836 [0,1,0,0,0,0|3,0,0]=4 7443 B15R0.2002 CCCCC(C)COCCCCCCC#N 7a_100011995851_100009813337 [0,1,0,0,0,0|2,0,1]=4 7444 B15R0.2002 CCCCC(C)COCCCCCCCO 34a_100011995851_100000760002 [0,1,0,0,0,0|1,0,2]=4 7445 B15R0.2002 CCCCC(C)COCCCCCCCO 7a_100011995851_100000760002 [0,1,0,0,0,0|1,0,2]=4 7446 B15R0.2002 CCCCC(C)COCCCCCCOC 34a_100011995851_100011998445 [0,1,0,0,0,0|3,0,0]=4 7447 B15R0.2002 CCCCC(C)COCCCCCCOC 7a_100011995851_100011998445 [0,1,0,0,0,0|3,0,0]=4 7448 B15R0.2002 CCCCC(C)NCCCCCCCCO 2230a_100000126638_100000033203 [0,1,0,0,0,0|1,0,2]=4 7449 B15R0.2002 CCCCC(C)NCCCCCCCCO 2230a_102515433106_200011215066 [0,1,0,0,0,0|1,0,2]=4 7450 B15R0.2002 CCCCC(C)NCCCCCCCCO 270004a_102515433106_100000210087 [0,1,0,0,0,0|1,0,2]=4 7451 B15R0.2002 CCCCC(C)NCCCCCCCCO 34a_102515433106_200011215066 [0,1,0,0,0,0|1,0,2]=4 7452 B15R0.2002 CCCCC(C)OCCCCCCCCBr 34a_100009813846_200011215066 [0,1,0,0,0,0|2,0,1]=4 7453 B15R0.2002 CCCCC(C)OCCCCCCCCBr 7a_100009813846_200011215066 [0,1,0,0,0,0|2,0,1]=4 7454 B15R0.2002 CCCCC(C)OCCCCCCCCCl 34a_100000033203_200011215066 [0,1,0,0,0,0|2,0,1]=4 7455 B15R0.2002 CCCCC(C)OCCCCCCCCCl 7a_100000033203_200011215066 [0,1,0,0,0,0|2,0,1]=4 7456 B15R0.2002 CCCCC(C)OCCCCCCCCN 34a_102515433106_200011215066 [0,1,0,0,0,0|2,0,1]=4 7457 B15R0.2002 CCCCC(C)OCCCCCCCCO 34a_100000687866_100000033203 [0,1,0,0,0,0|1,0,2]=4 7458 B15R0.2002 CCCCC(C)OCCCCCCCCO 7a_100000687866_100000033203 [0,1,0,0,0,0|1,0,2]=4 7459 B15R0.2002 CCCCC(C)SCCCCCCCCO 62a_100000033203_200011215066 [0,1,0,0,0,0|1,0,2]=4 7460 B15R0.2002 CCCCC(C)SCCCCCCCCO 62a_200011215066_100000033203 [0,1,0,0,0,0|1,0,2]=4 7461 B15R0.2002 CCCCCCCCCCC(=O)CCC#N 1458a_100000210375_100011215226 [0,1,0,0,0,0|1,0,2]=4 7462 B15R0.2002 CCCCCCCCCCC(=O)CCC#N 1458a_100011934036_100000210319 [0,1,0,0,0,0|1,0,2]=4 7463 B15R0.2002 CCCCCCCCCCC(=O)CCCC 1458a_100000210183_100000210319 [0,1,0,0,0,0|1,0,2]=4 7464 B15R0.2002 CCCCCCCCCCC(=O)CCCC 1458a_100000210375_100000210211 [0,1,0,0,0,0|1,0,2]=4 7465 B15R0.2002 CCCCCCCCCCC(=O)CCCF 1458a_100000210375_100011934791 [0,1,0,0,0,0|1,0,2]=4 7466 B15R0.2002 CCCCCCCCCCC(=O)CCCO 1458a_100000210375_100011215043 [0,1,0,0,0,0|0,0,3]=4 7467 B15R0.2002 CCCCCCCCCCC(=O)CCOC 1458a_100000210375_100000233755 [0,1,0,0,0,0|2,0,1]=4 7468 B15R0.2002 CCCCCCCCCCC(=O)CCOC 1458a_100000749529_100000210319 [0,1,0,0,0,0|2,0,1]=4 7469 B15R0.2002 CCCCCCCCCCC(=O)CCSC 1458a_100000174002_100000210319 [0,1,0,0,0,0|2,0,1]=4 7470 B15R0.2002 CCCCCCCCCCC(=O)CCSC 1458a_100000210375_100000751147 [0,1,0,0,0,0|2,0,1]=4 7471 B15R0.2002 CCCCCCCCCCC(C)NCCC 270004a_100020643023_200011219864 [0,1,0,0,0,0|2,0,1]=4 7472 B15R0.2002 CCCCCCCCCCC(C)NCCO 270004a_100000210304_200011219864 [0,1,0,0,0,0|1,0,2]=4 7473 B15R0.2002 CCCCCCCCCCC(C)OCC#N 7a_100011215000_100011215382 [0,1,0,0,0,0|2,0,1]=4 7474 B15R0.2002 CCCCCCCCCCC(C)OCC=O 34a_100011215000_200009817547 [0,1,0,0,0,0|1,0,0]=2 7475 B15R0.2002 CCCCCCCCCCC(C)OCC=O 7a_100011215000_200015260668 [0,1,0,0,0,0|1,0,0]=2 7476 B15R0.2002 CCCCCCCCCCC(C)OCCC 34a_100011215000_100000210303 [0,1,0,0,0,0|2,0,1]=4 7477 B15R0.2002 CCCCCCCCCCC(C)OCCC 7a_100011215000_100000210303 [0,1,0,0,0,0|2,0,1]=4 7478 B15R0.2002 CCCCCCCCCCC(C)OCCF 34a_100011215000_100011217306 [0,1,0,0,0,0|2,0,1]=4 7479 B15R0.2002 CCCCCCCCCCC(C)OCCF 7a_100011215000_100011217306 [0,1,0,0,0,0|2,0,1]=4 7480 B15R0.2002 CCCCCCCCCCC(C)OCCO 34a_100011215000_100000211926 [0,1,0,0,0,0|1,0,2]=4 7481 B15R0.2002 CCCCCCCCCCC(C)OCCO 7a_100011215000_100000211926 [0,1,0,0,0,0|1,0,2]=4 7482 B15R0.2002 CCCCCCCCCCC(C)OCSC 34a_100011215000_100011218213 [0,1,0,0,0,0|3,0,0]=4 7483 B15R0.2002 CCCCCCCCCCN(C)CCC#N 2230a_100000184479_100000210320 [0,1,0,0,0,0|2,0,1]=4 7484 B15R0.2002 CCCCCCCCCCN(C)CCC#N 2230a_100000207566_100011215226 [0,1,0,0,0,0|2,0,1]=4 7485 B15R0.2002 CCCCCCCCCCN(C)CCC#N 269982a_100000207566_100011215226 [0,1,0,0,0,0|2,0,1]=4 7486 B15R0.2002 CCCCCCCCCCN(C)CCCC 2230a_100000207549_100000210320 [0,1,0,0,0,0|2,0,1]=4 7487 B15R0.2002 CCCCCCCCCCN(C)CCCC 2230a_100000207566_100000210211 [0,1,0,0,0,0|2,0,1]=4 7488 B15R0.2002 CCCCCCCCCCN(C)CCCC 269982a_100000207549_100000210320 [0,1,0,0,0,0|2,0,1]=4 7489 B15R0.2002 CCCCCCCCCCN(C)CCCC 269982a_100000207566_100000210211 [0,1,0,0,0,0|2,0,1]=4 7490 B15R0.2002 CCCCCCCCCCN(C)CCCF 2230a_100000207566_100011934791 [0,1,0,0,0,0|2,0,1]=4 7491 B15R0.2002 CCCCCCCCCCN(C)CCCF 269982a_100000207566_100011934791 [0,1,0,0,0,0|2,0,1]=4 7492 B15R0.2002 CCCCCCCCCCN(C)CCCO 2230a_100000207566_100000230001 [0,1,0,0,0,0|1,0,2]=4 7493 B15R0.2002 CCCCCCCCCCN(C)CCCO 2230a_100000213112_100000210320 [0,1,0,0,0,0|1,0,2]=4 7494 B15R0.2002 CCCCCCCCCCN(C)CCCO 269982a_100000207566_100011215043 [0,1,0,0,0,0|1,0,2]=4 7495 B15R0.2002 CCCCCCCCCCN(C)CCCO 269982a_100000213112_100000210320 [0,1,0,0,0,0|1,0,2]=4 7496 B15R0.2002 CCCCCCCCCCN(C)CCOC 2230a_100000207566_100011201679 [0,1,0,0,0,0|3,0,0]=4 7497 B15R0.2002 CCCCCCCCCCN(C)CCOC 2230a_100000743101_100000210320 [0,1,0,0,0,0|3,0,0]=4 7498 B15R0.2002 CCCCCCCCCCN(C)CCOC 269982a_100000207566_100000233755 [0,1,0,0,0,0|3,0,0]=4 7499 B15R0.2002 CCCCCCCCCCN(C)CCOC 269982a_100000743101_100000210320 [0,1,0,0,0,0|3,0,0]=4 7500 B15R0.2002 CCCCCCCCCCN(C)CCSC 2230a_100000207566_100000751147 [0,1,0,0,0,0|3,0,0]=4 7501 B15R0.2002 CCCCCCCCCCN(C)CCSC 2230a_100000686725_100000210320 [0,1,0,0,0,0|3,0,0]=4 7502 B15R0.2002 CCCCCCCCCCN(C)CCSC 269982a_100000207566_100000212216 [0,1,0,0,0,0|3,0,0]=4 7503 B15R0.2002 CCCCCCCCCCN(C)CCSC 269982a_100000686725_100000210320 [0,1,0,0,0,0|3,0,0]=4 7504 B15R0.2002 CCCCCCCCCNC(C)CCCC 2230a_100000126638_100011214924 [0,1,0,0,0,0|2,0,1]=4 7505 B15R0.2002 CCCCCCCCCNC(C)CCCC 2230a_100000212291_200011215066 [0,1,0,0,0,0|2,0,1]=4 7506 B15R0.2002 CCCCCCCCCNC(C)CCCC 270004a_100000212291_100000210087 [0,1,0,0,0,0|2,0,1]=4 7507 B15R0.2002 CCCCCCCCCNC(C)CCCC 34a_100000212291_200011215066 [0,1,0,0,0,0|2,0,1]=4 7508 B15R0.2002 CCCCCCCCCNC(C)CCOC 270004a_100000212291_100000742357 [0,1,0,0,0,0|3,0,0]=4 7509 B15R0.2002 CCCCCCCCCNC(C)CCSC 270004a_100000212291_100011217047 [0,1,0,0,0,0|3,0,0]=4 7510 B15R0.2002 CCCCCCCCCOC(C)CCCC 34a_100000210712_200011215066 [0,1,0,0,0,0|2,0,1]=4 7511 B15R0.2002 CCCCCCCCCOC(C)CCCC 34a_100000687866_100011214924 [0,1,0,0,0,0|2,0,1]=4 7512 B15R0.2002 CCCCCCCCCOC(C)CCCC 7a_100000210712_200011215066 [0,1,0,0,0,0|2,0,1]=4 7513 B15R0.2002 CCCCCCCCCOC(C)CCCC 7a_100000687866_100000210328 [0,1,0,0,0,0|2,0,1]=4 7514 B15R0.2002 CCCCCCCCCOC(C)CCCCl 34a_200000718107_100011214924 [0,1,0,0,0,0|2,0,1]=4 7515 B15R0.2002 CCCCCCCCCOC(C)CCCCl 7a_200000718107_100000210328 [0,1,0,0,0,0|2,0,1]=4 7516 B15R0.2002 CCCCCCCCNC[C@H](C)CCCO 2230a_100160569302_100000210759 [0,1,0,0,0,0|1,0,2]=4 7517 B15R0.2002 CCCCCCCCNC[C@H](C)CCCO 34a_100160569302_100000210759 [0,1,0,0,0,0|1,0,2]=4 7518 B15R0.2002 CCCCCCCCOCC(C)CCCC 34a_100011995851_100000210759 [0,1,0,0,0,0|2,0,1]=4 7519 B15R0.2002 CCCCCCCCOCC(C)CCCC 7a_100011995851_100000210759 [0,1,0,0,0,0|2,0,1]=4 7520 B15R0.2002 CCCCCCCCOC[C@@H](N)CCCC 34a_100011934283_100000210759 [0,1,0,0,0,0|2,0,1]=4 7521 B15R0.2002 CCCCCCCCOC[C@@H](N)CCSC 34a_100011827619_100000210759 [0,1,0,0,0,0|3,0,0]=4 7522 B15R0.2002 CCCCCOCCCCC(C)CCCC 34a_200011021034_100000718602 [0,1,0,0,0,0|2,0,1]=4 7523 B15R0.2002 CCCCCOCCCCC(C)CCCC 7a_200011021034_100000210326 [0,1,0,0,0,0|2,0,1]=4 7524 B15R0.2002 CCCCN(C)CCCCCCCCCO 2230a_100000207549_100009813782 [0,1,0,0,0,0|1,0,2]=4 7525 B15R0.2002 CCCCN(C)CCCCCCCCCO 269982a_100000207549_100009813782 [0,1,0,0,0,0|1,0,2]=4 7526 B15R0.2002 CCCC[C@H](N)COCCCCCCCO 34a_100011934283_100000760002 [0,1,0,0,0,0|1,0,2]=4 7527 B15R0.2002 CCCC[C@H](N)COCCCCCCOC 34a_100011934283_100011998445 [0,1,0,0,0,0|3,0,0]=4 7528 B15R0.2002 CCCNC(=O)CCCSCCCCC=O 62a_100000139335_100011194427 [0,1,0,0,0,0|2,0,1]=4 7529 B15R0.2002 CCCNC(=O)CCCSCCCCC=O 62a_100011194427_100000139335 [0,1,0,0,0,0|2,0,1]=4 7530 B15R1.35 BrCCCCCCCOC1C=CCCC1 7a_100000760002_100000751183 [0,0,0,1,0,0|3,0,0]=4 7531 B15R1.35 BrCCCCCCCOC1CCCCC1 34a_100000760002_100000210327 [0,0,0,1,0,0|2,0,1]=4 7532 B15R1.35 BrCCCCCCCOC1CCCCC1 7a_100000760002_100000210327 [0,0,0,1,0,0|2,0,1]=4 7533 B15R1.35 BrCCCCCCOCC1CCCCC1 34a_100011215345_100000211423 [0,0,0,1,0,0|2,0,1]=4 7534 B15R1.35 BrCCCCCCOCC1CCCCC1 7a_100011215345_100000211423 [0,0,0,1,0,0|2,0,1]=4 7535 B15R1.35 BrCCCCCOCCC1CCCCC1 34a_100000746331_100011209188 [0,0,0,1,0,0|2,0,1]=4 7536 B15R1.35 BrCCCCCOCCC1CCCCC1 7a_100000746331_100011273959 [0,0,0,1,0,0|2,0,1]=4 7537 B15R1.35 BrCCCCOCCCC1CCCCC1 34a_100011216708_100011713725 [0,0,0,1,0,0|2,0,1]=4 7538 B15R1.35 C#CCCCCCCNC1CCCCC1 2230a_100000182618_100012276617 [0,0,0,1,0,0|2,0,1]=4 7539 B15R1.35 C#CCCCCCCNC1CCCCC1 34a_100000182618_100012276617 [0,0,0,1,0,0|2,0,1]=4 7540 B15R1.35 C#CCCCCCCOC1CCCCC1 34a_100000210231_100012276617 [0,0,0,1,0,0|2,0,1]=4 7541 B15R1.35 C#CCCCCCCOC1CCCCC1 34a_100011217361_100000210327 [0,0,0,1,0,0|2,0,1]=4 7542 B15R1.35 C#CCCCCCCOC1CCCCC1 7a_100000210231_100012276617 [0,0,0,1,0,0|2,0,1]=4 7543 B15R1.35 C#CCCCCCCOC1CCCCC1 7a_100011217361_100000210327 [0,0,0,1,0,0|2,0,1]=4 7544 B15R1.35 C#CCCCCCCSC1CCCCC1 62a_100000210327_100012276617 [0,0,0,1,0,0|2,0,1]=4 7545 B15R1.35 C#CCCCCCCSC1CCCCC1 62a_100012276617_100000210327 [0,0,0,1,0,0|2,0,1]=4 7546 B15R1.35 C#CCCCCCNCC1CCCCC1 2230a_100000210473_100012094781 [0,0,0,1,0,0|2,0,1]=4 7547 B15R1.35 C#CCCCCCNCC1CCCCC1 34a_100000210473_100012094781 [0,0,0,1,0,0|2,0,1]=4 7548 B15R1.35 C#CCCCCCOCC1CCCCC1 34a_100000212181_100012094781 [0,0,0,1,0,0|2,0,1]=4 7549 B15R1.35 C#CCCCCCOCC1CCCCC1 34a_100000766912_100000211423 [0,0,0,1,0,0|2,0,1]=4 7550 B15R1.35 C#CCCCCCOCC1CCCCC1 7a_100000212181_100012094781 [0,0,0,1,0,0|2,0,1]=4 7551 B15R1.35 C#CCCCCCOCC1CCCCC1 7a_100000766912_100000211423 [0,0,0,1,0,0|2,0,1]=4 7552 B15R1.35 C#CCCCCCSCC1CCCCC1 62a_100000211423_100012094781 [0,0,0,1,0,0|2,0,1]=4 7553 B15R1.35 C#CCCCCCSCC1CCCCC1 62a_100012094781_100000211423 [0,0,0,1,0,0|2,0,1]=4 7554 B15R1.35 C#CCCCCNCCC1CCCCC1 2230a_100000706060_100012355289 [0,0,0,1,0,0|2,0,1]=4 7555 B15R1.35 C#CCCCCNCCC1CCCCC1 2230a_100000738074_100010269958 [0,0,0,1,0,0|2,0,1]=4 7556 B15R1.35 C#CCCCCNCCC1CCCCC1 34a_100000706060_100011209188 [0,0,0,1,0,0|2,0,1]=4 7557 B15R1.35 C#CCCCCNCCC1CCCCC1 34a_100000738074_100010269958 [0,0,0,1,0,0|2,0,1]=4 7558 B15R1.35 C#CCCCCOCCC1CCCCC1 34a_100000766709_100011209188 [0,0,0,1,0,0|2,0,1]=4 7559 B15R1.35 C#CCCCCOCCC1CCCCC1 34a_100011217863_100010269958 [0,0,0,1,0,0|2,0,1]=4 7560 B15R1.35 C#CCCCCOCCC1CCCCC1 7a_100000766709_100011273959 [0,0,0,1,0,0|2,0,1]=4 7561 B15R1.35 C#CCCCCOCCC1CCCCC1 7a_100011217863_100010269958 [0,0,0,1,0,0|2,0,1]=4 7562 B15R1.35 C#CCCCCSCCC1CCCCC1 62a_100010269958_100012355289 [0,0,0,1,0,0|2,0,1]=4 7563 B15R1.35 C#CCCCCSCCC1CCCCC1 62a_100012355289_100010269958 [0,0,0,1,0,0|2,0,1]=4 7564 B15R1.35 C#CCCCNCCCC1CCCCC1 2230a_100011211642_100000731252 [0,0,0,1,0,0|2,0,1]=4 7565 B15R1.35 C#CCCCNCCCC1CCCCC1 34a_100000718082_100011713725 [0,0,0,1,0,0|2,0,1]=4 7566 B15R1.35 C#CCCCNCCCC1CCCCC1 34a_100011211642_100000695029 [0,0,0,1,0,0|2,0,1]=4 7567 B15R1.35 C#CCCCOCCCC1CCCCC1 34a_100000198086_100000695029 [0,0,0,1,0,0|2,0,1]=4 7568 B15R1.35 C#CCCCOCCCC1CCCCC1 34a_100000215630_100011713725 [0,0,0,1,0,0|2,0,1]=4 7569 B15R1.35 C#CCCCOCCCC1CCCCC1 7a_100000198086_100011215417 [0,0,0,1,0,0|2,0,1]=4 7570 B15R1.35 C#CCCCOCCCC1CCCCC1 7a_100000215630_100011713725 [0,0,0,1,0,0|2,0,1]=4 7571 B15R1.35 C#CCCCSCCCC1CCCCC1 62a_100011215417_100011713725 [0,0,0,1,0,0|2,0,1]=4 7572 B15R1.35 C#CCCCSCCCC1CCCCC1 62a_100011713725_100011215417 [0,0,0,1,0,0|2,0,1]=4 7573 B15R1.35 C#CCCOCCCCC1CCCCC1 34a_100011215267_100000688953 [0,0,0,1,0,0|2,0,1]=4 7574 B15R1.35 C#CCCOCCCCC1CCCCC1 7a_100011215267_100000688953 [0,0,0,1,0,0|2,0,1]=4 7575 B15R1.35 C/C=C/CCOCCCC1CCCCC1 34a_100016278192_100011713725 [0,0,0,1,0,0|2,0,1]=4 7576 B15R1.35 C/C=C/COCCCCC1CCCCC1 34a_100011215267_100102629194 [0,0,0,1,0,0|2,0,1]=4 7577 B15R1.35 C/C=C/COCCCCC1CCCCC1 7a_100011215267_100102629194 [0,0,0,1,0,0|2,0,1]=4 7578 B15R1.35 C=CCCCCCCCN1CCCOC1 2230a_100000131196_100012355270 [0,0,0,1,0,0|3,0,0]=4 7579 B15R1.35 C=CCCCCCCCN1CCCOC1 269982a_100000131196_100012355270 [0,0,0,1,0,0|3,0,0]=4 7580 B15R1.35 C=CCCCCCCCN1CCCOC1 34a_100000131196_100012355270 [0,0,0,1,0,0|3,0,0]=4 7581 B15R1.35 C=CCCCCCCCN1CCOCC1 2230a_100015191051_100012355270 [0,0,0,1,0,0|3,0,0]=4 7582 B15R1.35 C=CCCCCCCCN1CCOCC1 269982a_100015191051_100012355270 [0,0,0,1,0,0|3,0,0]=4 7583 B15R1.35 C=CCCCCCCCN1CCOCC1 34a_100015191051_100012355270 [0,0,0,1,0,0|3,0,0]=4 7584 B15R1.35 C=CCCCCCCCN1CCSCC1 2230a_100000737611_100012355270 [0,0,0,1,0,0|3,0,0]=4 7585 B15R1.35 C=CCCCCCCCN1CCSCC1 269982a_100000737611_100012355270 [0,0,0,1,0,0|3,0,0]=4 7586 B15R1.35 C=CCCCCCCNC1CCCCC1 2230a_100000182618_100011215473 [0,0,0,1,0,0|2,0,0]=3 7587 B15R1.35 C=CCCCCCCNC1CCCCC1 34a_100000182618_100011215473 [0,0,0,1,0,0|2,0,0]=3 7588 B15R1.35 C=CCCCCCCNC1CCCOC1 2230a_100000719290_100011215473 [0,0,0,1,0,0|3,0,0]=4 7589 B15R1.35 C=CCCCCCCNC1CCCOC1 34a_100000719290_100011215473 [0,0,0,1,0,0|3,0,0]=4 7590 B15R1.35 C=CCCCCCCNC1CCOCC1 2230a_100000741149_100011215473 [0,0,0,1,0,0|3,0,0]=4 7591 B15R1.35 C=CCCCCCCNC1CCOCC1 34a_100000741149_100011215473 [0,0,0,1,0,0|3,0,0]=4 7592 B15R1.35 C=CCCCCCCNC1CCSCC1 2230a_100000748639_100011215473 [0,0,0,1,0,0|3,0,0]=4 7593 B15R1.35 C=CCCCCCCNC1CCSCC1 34a_100000748639_100011215473 [0,0,0,1,0,0|3,0,0]=4 7594 B15R1.35 C=CCCCCCCOC1CCCCC1 34a_100000210231_100011215473 [0,0,0,1,0,0|2,0,0]=3 7595 B15R1.35 C=CCCCCCCOC1CCCCC1 34a_200011216477_100000210327 [0,0,0,1,0,0|2,0,0]=3 7596 B15R1.35 C=CCCCCCCOC1CCCCC1 7a_100000210231_100011215473 [0,0,0,1,0,0|2,0,0]=3 7597 B15R1.35 C=CCCCCCCOC1CCCCC1 7a_200011216477_100000210327 [0,0,0,1,0,0|2,0,0]=3 7598 B15R1.35 C=CCCCCCCOC1CCCCO1 34a_100000033831_100011215473 [0,0,0,1,0,0|3,0,0]=4 7599 B15R1.35 C=CCCCCCCOC1CCCOC1 34a_100000754041_100011215473 [0,0,0,1,0,0|3,0,0]=4 7600 B15R1.35 C=CCCCCCCOC1CCCOC1 34a_200011216477_100000693364 [0,0,0,1,0,0|3,0,0]=4 7601 B15R1.35 C=CCCCCCCOC1CCCOC1 7a_200011216477_100000693364 [0,0,0,1,0,0|3,0,0]=4 7602 B15R1.35 C=CCCCCCCOC1CCCSC1 7a_100015962668_100011215473 [0,0,0,1,0,0|3,0,0]=4 7603 B15R1.35 C=CCCCCCCOC1CCOCC1 34a_100000744328_100011215473 [0,0,0,1,0,0|3,0,0]=4 7604 B15R1.35 C=CCCCCCCOC1CCOCC1 7a_200011216477_100000686592 [0,0,0,1,0,0|3,0,0]=4 7605 B15R1.35 C=CCCCCCCOC1CCSCC1 34a_100000731022_100011215473 [0,0,0,1,0,0|3,0,0]=4 7606 B15R1.35 C=CCCCCCCOC1CCSCC1 34a_200011216477_100000069128 [0,0,0,1,0,0|3,0,0]=4 7607 B15R1.35 C=CCCCCCCOC1CCSCC1 7a_100000731022_100011215473 [0,0,0,1,0,0|3,0,0]=4 7608 B15R1.35 C=CCCCCCCOC1CCSCC1 7a_200011216477_100011500858 [0,0,0,1,0,0|3,0,0]=4 7609 B15R1.35 C=CCCCCCCSC1CCCCC1 62a_100000210327_100011215473 [0,0,0,1,0,0|2,0,0]=3 7610 B15R1.35 C=CCCCCCCSC1CCCCC1 62a_100011215473_100000210327 [0,0,0,1,0,0|2,0,0]=3 7611 B15R1.35 C=CCCCCCCSC1CCCOC1 62a_100011215473_100000693364 [0,0,0,1,0,0|3,0,0]=4 7612 B15R1.35 C=CCCCCCCSC1CCOCC1 62a_100011215473_100011324220 [0,0,0,1,0,0|3,0,0]=4 7613 B15R1.35 C=CCCCCCCSC1CCSCC1 62a_100011215473_100000069128 [0,0,0,1,0,0|3,0,0]=4 7614 B15R1.35 C=CCCCCCNCC1CCCCC1 2230a_100000210473_100000700193 [0,0,0,1,0,0|2,0,0]=3 7615 B15R1.35 C=CCCCCCNCC1CCCCC1 34a_100000210473_100000700193 [0,0,0,1,0,0|2,0,0]=3 7616 B15R1.35 C=CCCCCCNCC1CCCCO1 2230a_100000174945_100000700193 [0,0,0,1,0,0|3,0,0]=4 7617 B15R1.35 C=CCCCCCNCC1CCCCO1 34a_100000174945_100000700193 [0,0,0,1,0,0|3,0,0]=4 7618 B15R1.35 C=CCCCCCNCC1CCCOC1 2230a_100000720124_100000700193 [0,0,0,1,0,0|3,0,0]=4 7619 B15R1.35 C=CCCCCCNCC1CCCOC1 34a_100000720124_100000700193 [0,0,0,1,0,0|3,0,0]=4 7620 B15R1.35 C=CCCCCCNCC1CCOCC1 2230a_100000746373_100000700193 [0,0,0,1,0,0|3,0,0]=4 7621 B15R1.35 C=CCCCCCNCC1CCOCC1 34a_100000746373_100000700193 [0,0,0,1,0,0|3,0,0]=4 7622 B15R1.35 C=CCCCCCNCC1CCSCC1 2230a_100015188806_100000700193 [0,0,0,1,0,0|3,0,0]=4 7623 B15R1.35 C=CCCCCCNCC1CCSCC1 34a_100015188806_100000700193 [0,0,0,1,0,0|3,0,0]=4 7624 B15R1.35 C=CCCCCCOCC1CCCCC1 34a_100000212181_100000700193 [0,0,0,1,0,0|2,0,0]=3 7625 B15R1.35 C=CCCCCCOCC1CCCCC1 34a_100011216702_100000211423 [0,0,0,1,0,0|2,0,0]=3 7626 B15R1.35 C=CCCCCCOCC1CCCCC1 7a_100000212181_100000700193 [0,0,0,1,0,0|2,0,0]=3 7627 B15R1.35 C=CCCCCCOCC1CCCCC1 7a_100011216702_100000211423 [0,0,0,1,0,0|2,0,0]=3 7628 B15R1.35 C=CCCCCCOCC1CCCCN1 34a_100000210821_100000700193 [0,0,0,1,0,0|3,0,0]=4 7629 B15R1.35 C=CCCCCCOCC1CCCCO1 34a_100000211370_100000700193 [0,0,0,1,0,0|3,0,0]=4 7630 B15R1.35 C=CCCCCCOCC1CCCCO1 34a_100011216702_100000211543 [0,0,0,1,0,0|3,0,0]=4 7631 B15R1.35 C=CCCCCCOCC1CCCCO1 7a_100000211370_100000700193 [0,0,0,1,0,0|3,0,0]=4 7632 B15R1.35 C=CCCCCCOCC1CCCCO1 7a_100011216702_100000211543 [0,0,0,1,0,0|3,0,0]=4 7633 B15R1.35 C=CCCCCCOCC1CCCNC1 34a_100000211344_100000700193 [0,0,0,1,0,0|3,0,0]=4 7634 B15R1.35 C=CCCCCCOCC1CCCOC1 34a_100000741520_100000700193 [0,0,0,1,0,0|3,0,0]=4 7635 B15R1.35 C=CCCCCCOCC1CCCOC1 34a_100011216702_100000741521 [0,0,0,1,0,0|3,0,0]=4 7636 B15R1.35 C=CCCCCCOCC1CCCOC1 7a_100011216702_100000741521 [0,0,0,1,0,0|3,0,0]=4 7637 B15R1.35 C=CCCCCCOCC1CCNCC1 34a_100000738675_100000700193 [0,0,0,1,0,0|3,0,0]=4 7638 B15R1.35 C=CCCCCCOCC1CCOCC1 34a_100000749013_100000700193 [0,0,0,1,0,0|3,0,0]=4 7639 B15R1.35 C=CCCCCCOCC1CCOCC1 34a_100011216702_100000754603 [0,0,0,1,0,0|3,0,0]=4 7640 B15R1.35 C=CCCCCCOCC1CCOCC1 7a_100011216702_100000754603 [0,0,0,1,0,0|3,0,0]=4 7641 B15R1.35 C=CCCCCCOCC1CCSCC1 34a_100000070558_100000700193 [0,0,0,1,0,0|3,0,0]=4 7642 B15R1.35 C=CCCCCCOCC1CCSCC1 7a_100000070558_100000700193 [0,0,0,1,0,0|3,0,0]=4 7643 B15R1.35 C=CCCCCCSCC1CCCCC1 62a_100000211423_100000700193 [0,0,0,1,0,0|2,0,0]=3 7644 B15R1.35 C=CCCCCCSCC1CCCCC1 62a_100000700193_100000211423 [0,0,0,1,0,0|2,0,0]=3 7645 B15R1.35 C=CCCCCCSCC1CCCCO1 62a_100000211543_100000700193 [0,0,0,1,0,0|3,0,0]=4 7646 B15R1.35 C=CCCCCCSCC1CCCCO1 62a_100000700193_100000211543 [0,0,0,1,0,0|3,0,0]=4 7647 B15R1.35 C=CCCCCCSCC1CCCOC1 62a_100000700193_100000741521 [0,0,0,1,0,0|3,0,0]=4 7648 B15R1.35 C=CCCCCCSCC1CCCOC1 62a_100000741521_100000700193 [0,0,0,1,0,0|3,0,0]=4 7649 B15R1.35 C=CCCCCCSCC1CCOCC1 62a_100000700193_100000749018 [0,0,0,1,0,0|3,0,0]=4 7650 B15R1.35 C=CCCCCCSCC1CCOCC1 62a_100000754603_100000700193 [0,0,0,1,0,0|3,0,0]=4 7651 B15R1.35 C=CCCCCNCCC1CCCCC1 2230a_100000703577_100012355289 [0,0,0,1,0,0|2,0,0]=3 7652 B15R1.35 C=CCCCCNCCC1CCCCC1 2230a_100000738074_100011215482 [0,0,0,1,0,0|2,0,0]=3 7653 B15R1.35 C=CCCCCNCCC1CCCCC1 270004a_100000703577_100011713444 [0,0,0,1,0,0|2,0,0]=3 7654 B15R1.35 C=CCCCCNCCC1CCCCC1 34a_100000703577_100011209188 [0,0,0,1,0,0|2,0,0]=3 7655 B15R1.35 C=CCCCCNCCC1CCCCC1 34a_100000738074_100011215482 [0,0,0,1,0,0|2,0,0]=3 7656 B15R1.35 C=CCCCCNCCC1CCCCO1 2230a_100015183643_100011215482 [0,0,0,1,0,0|3,0,0]=4 7657 B15R1.35 C=CCCCCNCCC1CCCCO1 34a_100015183643_100011215482 [0,0,0,1,0,0|3,0,0]=4 7658 B15R1.35 C=CCCCCNCCC1CCOCC1 2230a_100000703577_100011934994 [0,0,0,1,0,0|3,0,0]=4 7659 B15R1.35 C=CCCCCNCCC1CCOCC1 2230a_100000755988_100011215482 [0,0,0,1,0,0|3,0,0]=4 7660 B15R1.35 C=CCCCCNCCC1CCOCC1 34a_100000703577_100011934994 [0,0,0,1,0,0|3,0,0]=4 7661 B15R1.35 C=CCCCCNCCC1CCOCC1 34a_100000755988_100011215482 [0,0,0,1,0,0|3,0,0]=4 7662 B15R1.35 C=CCCCCNCCN1CCCCC1 2230a_100000703577_100000739454 [0,0,0,1,0,0|3,0,0]=4 7663 B15R1.35 C=CCCCCNCCN1CCCCC1 34a_100000703577_100000739454 [0,0,0,1,0,0|3,0,0]=4 7664 B15R1.35 C=CCCCCNCOC1CCCCC1 2230a_100000703577_100011935260 [0,0,0,1,0,0|3,0,0]=4 7665 B15R1.35 C=CCCCCNCOC1CCCCC1 34a_100000703577_100011935260 [0,0,0,1,0,0|3,0,0]=4 7666 B15R1.35 C=CCCCCOCCC1CCCCC1 34a_100000766645_100011209188 [0,0,0,1,0,0|2,0,0]=3 7667 B15R1.35 C=CCCCCOCCC1CCCCC1 34a_100011217863_100011215482 [0,0,0,1,0,0|2,0,0]=3 7668 B15R1.35 C=CCCCCOCCC1CCCCC1 7a_100000766645_100011273959 [0,0,0,1,0,0|2,0,0]=3 7669 B15R1.35 C=CCCCCOCCC1CCCCC1 7a_100011217863_100011215482 [0,0,0,1,0,0|2,0,0]=3 7670 B15R1.35 C=CCCCCOCCC1CCCCN1 34a_100000211664_100011215482 [0,0,0,1,0,0|3,0,0]=4 7671 B15R1.35 C=CCCCCOCCC1CCCNC1 34a_100000752241_100011215482 [0,0,0,1,0,0|3,0,0]=4 7672 B15R1.35 C=CCCCCOCCC1CCNCC1 34a_100015190746_100011215482 [0,0,0,1,0,0|3,0,0]=4 7673 B15R1.35 C=CCCCCOCCC1CCOCC1 34a_100000766645_100011934994 [0,0,0,1,0,0|3,0,0]=4 7674 B15R1.35 C=CCCCCOCCC1CCOCC1 34a_100011933979_100011215482 [0,0,0,1,0,0|3,0,0]=4 7675 B15R1.35 C=CCCCCOCCC1CCOCC1 7a_100000766645_100011934994 [0,0,0,1,0,0|3,0,0]=4 7676 B15R1.35 C=CCCCCOCCC1CCOCC1 7a_100011933979_100011215482 [0,0,0,1,0,0|3,0,0]=4 7677 B15R1.35 C=CCCCCOCCN1CCCCC1 34a_100000766645_100000739454 [0,0,0,1,0,0|3,0,0]=4 7678 B15R1.35 C=CCCCCOCCN1CCCCC1 7a_100000766645_100000739454 [0,0,0,1,0,0|3,0,0]=4 7679 B15R1.35 C=CCCCCOCOC1CCCCC1 34a_100000766645_100011935260 [0,0,0,1,0,0|3,0,0]=4 7680 B15R1.35 C=CCCCCOCOC1CCCCC1 7a_100000766645_100011935260 [0,0,0,1,0,0|3,0,0]=4 7681 B15R1.35 C=CCCCCSCCC1CCCCC1 62a_100011215482_100012355289 [0,0,0,1,0,0|2,0,0]=3 7682 B15R1.35 C=CCCCCSCCC1CCCCC1 62a_100012355289_100011215482 [0,0,0,1,0,0|2,0,0]=3 7683 B15R1.35 C=CCCCCSCCC1CCOCC1 62a_100011215482_100011934994 [0,0,0,1,0,0|3,0,0]=4 7684 B15R1.35 C=CCCCCSCCC1CCOCC1 62a_100011934994_100011215482 [0,0,0,1,0,0|3,0,0]=4 7685 B15R1.35 C=CCCCCSCCN1CCCCC1 62a_100000739454_100011215482 [0,0,0,1,0,0|3,0,0]=4 7686 B15R1.35 C=CCCCCSCCN1CCCCC1 62a_100011215482_100000739454 [0,0,0,1,0,0|3,0,0]=4 7687 B15R1.35 C=CCCCCSCOC1CCCCC1 62a_100011215482_100011935260 [0,0,0,1,0,0|3,0,0]=4 7688 B15R1.35 C=CCCCCSCOC1CCCCC1 62a_100011935260_100011215482 [0,0,0,1,0,0|3,0,0]=4 7689 B15R1.35 C=CCCCNCCCC1CCCCC1 2230a_100000700776_100011713725 [0,0,0,1,0,0|2,0,0]=3 7690 B15R1.35 C=CCCCNCCCC1CCCCC1 2230a_100011211642_100011713584 [0,0,0,1,0,0|2,0,0]=3 7691 B15R1.35 C=CCCCNCCCC1CCCCC1 34a_100000700776_100011713725 [0,0,0,1,0,0|2,0,0]=3 7692 B15R1.35 C=CCCCNCCCC1CCCCC1 34a_100011211642_100000757094 [0,0,0,1,0,0|2,0,0]=3 7693 B15R1.35 C=CCCCNCCCN1CCCCC1 2230a_100000700776_100000690320 [0,0,0,1,0,0|3,0,0]=4 7694 B15R1.35 C=CCCCNCCCN1CCCCC1 34a_100000700776_100000690320 [0,0,0,1,0,0|3,0,0]=4 7695 B15R1.35 C=CCCCNCCOC1CCCCC1 2230a_100000700776_100011211530 [0,0,0,1,0,0|3,0,0]=4 7696 B15R1.35 C=CCCCNCCOC1CCCCC1 34a_100000700776_100011211530 [0,0,0,1,0,0|3,0,0]=4 7697 B15R1.35 C=CCCCNCCOC1CCCCC1 34a_100015206981_100000757094 [0,0,0,1,0,0|3,0,0]=4 7698 B15R1.35 C=CCCCOCCCC1CCCCC1 34a_100000198086_100000757094 [0,0,0,1,0,0|2,0,0]=3 7699 B15R1.35 C=CCCCOCCCC1CCCCC1 34a_100000758997_100011713725 [0,0,0,1,0,0|2,0,0]=3 7700 B15R1.35 C=CCCCOCCCC1CCCCC1 7a_100000198086_100000757094 [0,0,0,1,0,0|2,0,0]=3 7701 B15R1.35 C=CCCCOCCCC1CCCCC1 7a_100000758997_100011713725 [0,0,0,1,0,0|2,0,0]=3 7702 B15R1.35 C=CCCCOCCCC1CCCCN1 34a_100011934581_100000757094 [0,0,0,1,0,0|3,0,0]=4 7703 B15R1.35 C=CCCCOCCCC1CCCNC1 34a_100150707839_100000757094 [0,0,0,1,0,0|3,0,0]=4 7704 B15R1.35 C=CCCCOCCCC1CCNCC1 34a_100016988962_100000757094 [0,0,0,1,0,0|3,0,0]=4 7705 B15R1.35 C=CCCCOCCCN1CCCCC1 34a_100000212458_100000757094 [0,0,0,1,0,0|3,0,0]=4 7706 B15R1.35 C=CCCCOCCCN1CCCCC1 34a_100000758997_100000690320 [0,0,0,1,0,0|3,0,0]=4 7707 B15R1.35 C=CCCCOCCCN1CCCCC1 7a_100000758997_100000007876 [0,0,0,1,0,0|3,0,0]=4 7708 B15R1.35 C=CCCCOCCNC1CCCCC1 34a_100000200466_100000757094 [0,0,0,1,0,0|3,0,0]=4 7709 B15R1.35 C=CCCCOCCOC1CCCCC1 34a_100000758997_100011211530 [0,0,0,1,0,0|3,0,0]=4 7710 B15R1.35 C=CCCCOCCOC1CCCCC1 34a_100011249652_100000757094 [0,0,0,1,0,0|3,0,0]=4 7711 B15R1.35 C=CCCCOCCOC1CCCCC1 7a_100000758997_100011211530 [0,0,0,1,0,0|3,0,0]=4 7712 B15R1.35 C=CCCCOCCOC1CCCCC1 7a_100011249652_100000757094 [0,0,0,1,0,0|3,0,0]=4 7713 B15R1.35 C=CCCCSCCCC1CCCCC1 62a_100011713584_100011713725 [0,0,0,1,0,0|2,0,0]=3 7714 B15R1.35 C=CCCCSCCCC1CCCCC1 62a_100011713725_100000757094 [0,0,0,1,0,0|2,0,0]=3 7715 B15R1.35 C=CCCCSCCCN1CCCCC1 62a_100011713584_100000007876 [0,0,0,1,0,0|3,0,0]=4 7716 B15R1.35 C=CCCCSCCCN1CCCCC1 62a_100132302099_100000757094 [0,0,0,1,0,0|3,0,0]=4 7717 B15R1.35 C=CCCCSCCOC1CCCCC1 62a_100011211530_100000757094 [0,0,0,1,0,0|3,0,0]=4 7718 B15R1.35 C=CCCCSCCOC1CCCCC1 62a_100011713584_100011211530 [0,0,0,1,0,0|3,0,0]=4 7719 B15R1.35 C=CCCNCCCOC1CCCCC1 34a_100000205933_100000754431 [0,0,0,1,0,0|3,0,0]=4 7720 B15R1.35 C=CCCOCCCCC1CCCCC1 34a_100011215267_100000754431 [0,0,0,1,0,0|2,0,0]=3 7721 B15R1.35 C=CCCOCCCCC1CCCCC1 7a_100011215267_100000754431 [0,0,0,1,0,0|2,0,0]=3 7722 B15R1.35 C=CCCOCCCCC1CCNCC1 34a_100016989291_100000754431 [0,0,0,1,0,0|3,0,0]=4 7723 B15R1.35 C=CCOCCCCCN1CCCCC1 34a_100011216611_100015514636 [0,0,0,1,0,0|3,0,0]=4 7724 B15R1.35 C=CCOCCCCCN1CCCCC1 7a_100011216611_100015514636 [0,0,0,1,0,0|3,0,0]=4 7725 B15R1.35 C=CCOCCOCCC1CCCCC1 34a_100000037705_100011209188 [0,0,0,1,0,0|3,0,0]=4 7726 B15R1.35 C=CCOCCOCCC1CCCCC1 7a_100000037705_100011273959 [0,0,0,1,0,0|3,0,0]=4 7727 B15R1.35 C=COCCCCOCC1CCCCC1 34a_100000031558_100000211423 [0,0,0,1,0,0|3,0,0]=4 7728 B15R1.35 C=COCCCCOCC1CCCCC1 7a_100000031558_100000211423 [0,0,0,1,0,0|3,0,0]=4 7729 B15R1.35 C=COCCCNCCC1CCCCC1 2230a_100000210767_100012355289 [0,0,0,1,0,0|3,0,0]=4 7730 B15R1.35 C=COCCCNCCC1CCCCC1 270004a_100000210767_100011713444 [0,0,0,1,0,0|3,0,0]=4 7731 B15R1.35 C=COCCCNCCC1CCCCC1 34a_100000210767_100011209188 [0,0,0,1,0,0|3,0,0]=4 7732 B15R1.35 C=COCCNCCCC1CCCCC1 2230a_100011211642_100000039644 [0,0,0,1,0,0|3,0,0]=4 7733 B15R1.35 C=COCCNCCCC1CCCCC1 34a_100011211642_100000039644 [0,0,0,1,0,0|3,0,0]=4 7734 B15R1.35 C=COCCOCCCC1CCCCC1 34a_100000033082_100011713725 [0,0,0,1,0,0|3,0,0]=4 7735 B15R1.35 C=COCCOCCCC1CCCCC1 34a_100000198086_100000039644 [0,0,0,1,0,0|3,0,0]=4 7736 B15R1.35 C=COCCOCCCC1CCCCC1 7a_100000198086_100000039644 [0,0,0,1,0,0|3,0,0]=4 7737 B15R1.35 C=COCCSCCCC1CCCCC1 62a_100000039644_100011713725 [0,0,0,1,0,0|3,0,0]=4 7738 B15R1.35 C=COCCSCCCC1CCCCC1 62a_100011713725_100000039644 [0,0,0,1,0,0|3,0,0]=4 7739 B15R1.35 CC=CCCCOCCC1CCCCC1 34a_100020645299_100011209188 [0,0,0,1,0,0|2,0,1]=4 7740 B15R1.35 CC=CCOCCCCC1CCCCC1 34a_100011215267_100000070051 [0,0,0,1,0,0|2,0,1]=4 7741 B15R1.35 CC=CCOCCCCC1CCCCC1 7a_100011215267_100000070051 [0,0,0,1,0,0|2,0,1]=4 7742 B15R1.35 CCCCCCCCCN1CC=CCC1 2230a_100000698166_100011214924 [0,0,0,1,0,0|2,0,1]=4 7743 B15R1.35 CCCCCCCCCN1CC=CCC1 269982a_100000698166_100000210670 [0,0,0,1,0,0|2,0,1]=4 7744 B15R1.35 CCCCCCCCCN1CC=CCC1 34a_100000698166_100011214924 [0,0,0,1,0,0|2,0,1]=4 7745 B15R1.35 CCCCCCCCCN1CCCOC1 2230a_100000131196_100011214924 [0,0,0,1,0,0|3,0,0]=4 7746 B15R1.35 CCCCCCCCCN1CCCOC1 269982a_100000131196_100000210670 [0,0,0,1,0,0|3,0,0]=4 7747 B15R1.35 CCCCCCCCCN1CCCOC1 34a_100000131196_100011214924 [0,0,0,1,0,0|3,0,0]=4 7748 B15R1.35 CCCCCCCCNC1C=CCCC1 2230a_100000229939_100000751183 [0,0,0,1,0,0|2,0,0]=3 7749 B15R1.35 CCCCCCCCNC1CCCCC1 2230a_100000182618_100000210759 [0,0,0,1,0,0|2,0,1]=4 7750 B15R1.35 CCCCCCCCNC1CCCCC1 270004a_100000229939_100000210434 [0,0,0,1,0,0|2,0,1]=4 7751 B15R1.35 CCCCCCCCNC1CCCCC1 34a_100000182618_100000210759 [0,0,0,1,0,0|2,0,1]=4 7752 B15R1.35 CCCCCCCCNC1CCCCC1 34a_100000229939_100000210327 [0,0,0,1,0,0|2,0,1]=4 7753 B15R1.35 CCCCCCCCNC1CCCOC1 2230a_100000719290_100000210759 [0,0,0,1,0,0|3,0,0]=4 7754 B15R1.35 CCCCCCCCNC1CCCOC1 270004a_100000229939_100000753404 [0,0,0,1,0,0|3,0,0]=4 7755 B15R1.35 CCCCCCCCNC1CCCOC1 34a_100000229939_100000693364 [0,0,0,1,0,0|3,0,0]=4 7756 B15R1.35 CCCCCCCCNC1CCCOC1 34a_100000719290_100000210759 [0,0,0,1,0,0|3,0,0]=4 7757 B15R1.35 CCCCCCCCNC1CCCSC1 270004a_100000229939_100000057913 [0,0,0,1,0,0|3,0,0]=4 7758 B15R1.35 CCCCCCCCOC1C=CCCC1 34a_100011215024_100000210759 [0,0,0,1,0,0|2,0,0]=3 7759 B15R1.35 CCCCCCCCOC1C=CCCC1 7a_100000210232_100000751183 [0,0,0,1,0,0|2,0,0]=3 7760 B15R1.35 CCCCCCCCOC1CC=CCC1 34a_100000073881_100000210759 [0,0,0,1,0,0|2,0,1]=4 7761 B15R1.35 CCCCCCCCOC1CCCCC1 34a_100000210231_100000210759 [0,0,0,1,0,0|2,0,1]=4 7762 B15R1.35 CCCCCCCCOC1CCCCC1 34a_100000210232_100000210327 [0,0,0,1,0,0|2,0,1]=4 7763 B15R1.35 CCCCCCCCOC1CCCCC1 7a_100000210231_100000210759 [0,0,0,1,0,0|2,0,1]=4 7764 B15R1.35 CCCCCCCCOC1CCCCC1 7a_100000210232_100000210327 [0,0,0,1,0,0|2,0,1]=4 7765 B15R1.35 CCCCCCCCOC1CCCCO1 34a_100000033831_100000210759 [0,0,0,1,0,0|1,0,2]=4 7766 B15R1.35 CCCCCCCCOC1CCCOC1 34a_100000210232_100000693364 [0,0,0,1,0,0|3,0,0]=4 7767 B15R1.35 CCCCCCCCOC1CCCOC1 34a_100000754041_100000210759 [0,0,0,1,0,0|3,0,0]=4 7768 B15R1.35 CCCCCCCCOC1CCCOC1 7a_100000210232_100000693364 [0,0,0,1,0,0|3,0,0]=4 7769 B15R1.35 CCCCCCCCOC1CCCSC1 7a_100015962668_100000210759 [0,0,0,1,0,0|3,0,0]=4 7770 B15R1.35 CCCCCCCCSC1C=CCCC1 62a_100000210759_100000751183 [0,0,0,1,0,0|2,0,0]=3 7771 B15R1.35 CCCCCCCCSC1C=CCCC1 62a_100000751183_100000210317 [0,0,0,1,0,0|2,0,0]=3 7772 B15R1.35 CCCCCCCCSC1CCCCC1 62a_100000210327_100000210317 [0,0,0,1,0,0|2,0,1]=4 7773 B15R1.35 CCCCCCCCSC1CCCCC1 62a_100000210759_100000210327 [0,0,0,1,0,0|2,0,1]=4 7774 B15R1.35 CCCCCCCCSC1CCCOC1 62a_100000210759_100000693364 [0,0,0,1,0,0|3,0,0]=4 7775 B15R1.35 CCCCCCCNCC1CC=CCC1 270004a_100000229938_100000189434 [0,0,0,1,0,0|2,0,1]=4 7776 B15R1.35 CCCCCCCNCC1CCCCC1 2230a_100000210473_100000210681 [0,0,0,1,0,0|2,0,1]=4 7777 B15R1.35 CCCCCCCNCC1CCCCC1 2230a_100000229938_100000211423 [0,0,0,1,0,0|2,0,1]=4 7778 B15R1.35 CCCCCCCNCC1CCCCC1 269862a_100000229938_100000211278 [0,0,0,1,0,0|2,0,1]=4 7779 B15R1.35 CCCCCCCNCC1CCCCC1 34a_100000210473_100000210614 [0,0,0,1,0,0|2,0,1]=4 7780 B15R1.35 CCCCCCCNCC1CCCCO1 2230a_100000174945_100000210681 [0,0,0,1,0,0|1,0,2]=4 7781 B15R1.35 CCCCCCCNCC1CCCCO1 2230a_100000229938_100000211543 [0,0,0,1,0,0|1,0,2]=4 7782 B15R1.35 CCCCCCCNCC1CCCCO1 34a_100000174945_100000210614 [0,0,0,1,0,0|1,0,2]=4 7783 B15R1.35 CCCCCCCNCC1CCCOC1 2230a_100000229938_100000741521 [0,0,0,1,0,0|3,0,0]=4 7784 B15R1.35 CCCCCCCNCC1CCCOC1 2230a_100000720124_100000210681 [0,0,0,1,0,0|3,0,0]=4 7785 B15R1.35 CCCCCCCNCC1CCCOC1 34a_100000720124_100000210614 [0,0,0,1,0,0|3,0,0]=4 7786 B15R1.35 CCCCCCCOCC1CC=CCC1 34a_100000210713_100000210614 [0,0,0,1,0,0|2,0,1]=4 7787 B15R1.35 CCCCCCCOCC1CCC=CO1 34a_100011217868_100000210614 [0,0,0,1,0,0|1,0,2]=4 7788 B15R1.35 CCCCCCCOCC1CCCCC1 34a_100000210272_100000211423 [0,0,0,1,0,0|2,0,1]=4 7789 B15R1.35 CCCCCCCOCC1CCCCC1 34a_100000212181_100000210614 [0,0,0,1,0,0|2,0,1]=4 7790 B15R1.35 CCCCCCCOCC1CCCCC1 7a_100000210272_100000211423 [0,0,0,1,0,0|2,0,1]=4 7791 B15R1.35 CCCCCCCOCC1CCCCC1 7a_100000212181_100000210614 [0,0,0,1,0,0|2,0,1]=4 7792 B15R1.35 CCCCCCCOCC1CCCCN1 34a_100000210821_100000210614 [0,0,0,1,0,0|2,0,1]=4 7793 B15R1.35 CCCCCCCOCC1CCCCO1 34a_100000210272_100000211543 [0,0,0,1,0,0|1,0,2]=4 7794 B15R1.35 CCCCCCCOCC1CCCCO1 34a_100000211370_100000210614 [0,0,0,1,0,0|1,0,2]=4 7795 B15R1.35 CCCCCCCOCC1CCCCO1 7a_100000210272_100000211543 [0,0,0,1,0,0|1,0,2]=4 7796 B15R1.35 CCCCCCCOCC1CCCCO1 7a_100000211370_100000210614 [0,0,0,1,0,0|1,0,2]=4 7797 B15R1.35 CCCCCCCOCC1CCCNC1 34a_100000211344_100000210614 [0,0,0,1,0,0|3,0,0]=4 7798 B15R1.35 CCCCCCCOCC1CCCOC1 34a_100000210272_100000741521 [0,0,0,1,0,0|3,0,0]=4 7799 B15R1.35 CCCCCCCOCC1CCCOC1 34a_100000741520_100000210614 [0,0,0,1,0,0|3,0,0]=4 7800 B15R1.35 CCCCCCCOCC1CCCOC1 7a_100000210272_100000741521 [0,0,0,1,0,0|3,0,0]=4 7801 B15R1.35 CCCCCCCSCC1CCCCC1 62a_100000210614_100000211423 [0,0,0,1,0,0|2,0,1]=4 7802 B15R1.35 CCCCCCCSCC1CCCCC1 62a_100000211423_100000210316 [0,0,0,1,0,0|2,0,1]=4 7803 B15R1.35 CCCCCCCSCC1CCCCO1 62a_100000210614_100000211543 [0,0,0,1,0,0|1,0,2]=4 7804 B15R1.35 CCCCCCCSCC1CCCCO1 62a_100000211543_100000210316 [0,0,0,1,0,0|1,0,2]=4 7805 B15R1.35 CCCCCCCSCC1CCCOC1 62a_100000210614_100000741521 [0,0,0,1,0,0|3,0,0]=4 7806 B15R1.35 CCCCCCCSCC1CCCOC1 62a_100000741521_100000210316 [0,0,0,1,0,0|3,0,0]=4 7807 B15R1.35 CCCCCCNCCC1CCCCC1 2230a_100000210581_100012355289 [0,0,0,1,0,0|2,0,1]=4 7808 B15R1.35 CCCCCCNCCC1CCCCC1 2230a_100000738074_100000210314 [0,0,0,1,0,0|2,0,1]=4 7809 B15R1.35 CCCCCCNCCC1CCCCC1 270004a_100000210581_100011713444 [0,0,0,1,0,0|2,0,1]=4 7810 B15R1.35 CCCCCCNCCC1CCCCC1 34a_100000738074_100000210314 [0,0,0,1,0,0|2,0,1]=4 7811 B15R1.35 CCCCCCNCCC1CCCCO1 2230a_100015183643_100000210314 [0,0,0,1,0,0|1,0,2]=4 7812 B15R1.35 CCCCCCNCCC1CCCCO1 34a_100015183643_100000210314 [0,0,0,1,0,0|1,0,2]=4 7813 B15R1.35 CCCCCCOCCC1CCCCC1 34a_100000210259_100011209188 [0,0,0,1,0,0|2,0,1]=4 7814 B15R1.35 CCCCCCOCCC1CCCCC1 34a_100011217863_100000210314 [0,0,0,1,0,0|2,0,1]=4 7815 B15R1.35 CCCCCCOCCC1CCCCC1 7a_100000210259_100011273959 [0,0,0,1,0,0|2,0,1]=4 7816 B15R1.35 CCCCCCOCCC1CCCCC1 7a_100011217863_100000210314 [0,0,0,1,0,0|2,0,1]=4 7817 B15R1.35 CCCCCCOCCC1CCCCN1 34a_100000211664_100000210314 [0,0,0,1,0,0|2,0,1]=4 7818 B15R1.35 CCCCCCOCCC1CCCNC1 34a_100000752241_100000210314 [0,0,0,1,0,0|3,0,0]=4 7819 B15R1.35 CCCCCCSCCC1CCCCC1 62a_100000210314_100012355289 [0,0,0,1,0,0|2,0,1]=4 7820 B15R1.35 CCCCCCSCCC1CCCCC1 62a_100012355289_100000210757 [0,0,0,1,0,0|2,0,1]=4 7821 B15R1.35 CCCCCNCCCC1CCCCC1 2230a_100000209983_100011713725 [0,0,0,1,0,0|2,0,1]=4 7822 B15R1.35 CCCCCNCCCC1CCCCC1 2230a_100011211642_100000210326 [0,0,0,1,0,0|2,0,1]=4 7823 B15R1.35 CCCCCNCCCC1CCCCC1 34a_100011211642_100000718602 [0,0,0,1,0,0|2,0,1]=4 7824 B15R1.35 CCCCCOCCCC1CCCCC1 34a_100000198086_100000718602 [0,0,0,1,0,0|2,0,1]=4 7825 B15R1.35 CCCCCOCCCC1CCCCC1 34a_100000210253_100011713725 [0,0,0,1,0,0|2,0,1]=4 7826 B15R1.35 CCCCCOCCCC1CCCCC1 7a_100000198086_100000210326 [0,0,0,1,0,0|2,0,1]=4 7827 B15R1.35 CCCCCOCCCC1CCCCC1 7a_100000210253_100011713725 [0,0,0,1,0,0|2,0,1]=4 7828 B15R1.35 CCCCCOCCCC1CCCCN1 34a_100011934581_100000718602 [0,0,0,1,0,0|2,0,1]=4 7829 B15R1.35 CCCCCOCCCC1CCCNC1 34a_100150707839_100000718602 [0,0,0,1,0,0|3,0,0]=4 7830 B15R1.35 CCCCCOCCOC1C=CCCC1 7a_100011215259_100000751183 [0,0,0,1,0,0|3,0,0]=4 7831 B15R1.35 CCCCCSCCCC1CCCCC1 62a_100000210326_100011713725 [0,0,0,1,0,0|2,0,1]=4 7832 B15R1.35 CCCCCSCCCC1CCCCC1 62a_100011713725_100000210326 [0,0,0,1,0,0|2,0,1]=4 7833 B15R1.35 CCCCOCCCCC1CCCCC1 34a_100011215267_100000210210 [0,0,0,1,0,0|2,0,1]=4 7834 B15R1.35 CCCCOCCCCC1CCCCC1 7a_100011215267_100000210211 [0,0,0,1,0,0|2,0,1]=4 7835 B15R1.35 CCCCOCCCNC1C=CCCC1 2230a_200000211371_100000751183 [0,0,0,1,0,0|3,0,0]=4 7836 B15R1.35 CCCCOCCCOC1C=CCCC1 7a_200011215613_100000751183 [0,0,0,1,0,0|3,0,0]=4 7837 B15R1.35 CNCCCCCOCC1CCCCC1 34a_100000722520_100000211423 [0,0,0,1,0,0|3,0,0]=4 7838 B15R1.35 CNCCCOCCCC1CCCCC1 34a_100000213112_100011713725 [0,0,0,1,0,0|3,0,0]=4 7839 B15R1.35 COCCCCCCNC1CCCCC1 2230a_100000182618_100011998445 [0,0,0,1,0,0|3,0,0]=4 7840 B15R1.35 COCCCCCCNC1CCCCC1 34a_100000182618_100011998445 [0,0,0,1,0,0|3,0,0]=4 7841 B15R1.35 COCCCCCCOC1C=CCCC1 34a_100011215024_100011998445 [0,0,0,1,0,0|3,0,0]=4 7842 B15R1.35 COCCCCCCOC1C=CCCC1 7a_200012092642_100000751183 [0,0,0,1,0,0|3,0,0]=4 7843 B15R1.35 COCCCCCCOC1CCCCC1 34a_100000210231_100011998445 [0,0,0,1,0,0|3,0,0]=4 7844 B15R1.35 COCCCCCCOC1CCCCC1 34a_200012092642_100000210327 [0,0,0,1,0,0|3,0,0]=4 7845 B15R1.35 COCCCCCCOC1CCCCC1 7a_100000210231_100011998445 [0,0,0,1,0,0|3,0,0]=4 7846 B15R1.35 COCCCCCCOC1CCCCC1 7a_200012092642_100000210327 [0,0,0,1,0,0|3,0,0]=4 7847 B15R1.35 COCCCCCCSC1C=CCCC1 62a_100000751183_100011998445 [0,0,0,1,0,0|3,0,0]=4 7848 B15R1.35 COCCCCCCSC1C=CCCC1 62a_100011998445_100000751183 [0,0,0,1,0,0|3,0,0]=4 7849 B15R1.35 COCCCCCCSC1CCCCC1 62a_100000210327_100011998445 [0,0,0,1,0,0|3,0,0]=4 7850 B15R1.35 COCCCCCCSC1CCCCC1 62a_100011998445_100000210327 [0,0,0,1,0,0|3,0,0]=4 7851 B15R1.35 COCCCCCNCC1CCCCC1 2230a_100000747528_100000211423 [0,0,0,1,0,0|3,0,0]=4 7852 B15R1.35 COCCCCCNCC1CCCCC1 269862a_100000747528_100000211278 [0,0,0,1,0,0|3,0,0]=4 7853 B15R1.35 COCCCCCNCC1CCCCC1 34a_100000747528_100000211423 [0,0,0,1,0,0|3,0,0]=4 7854 B15R1.35 COCCCCNCCC1CCCCC1 2230a_100000738074_100000730899 [0,0,0,1,0,0|3,0,0]=4 7855 B15R1.35 COCCCCNCCC1CCCCC1 34a_100000738074_100000755781 [0,0,0,1,0,0|3,0,0]=4 7856 B15R1.35 COCCCCOCCC1CCCCC1 34a_100000740925_100011209188 [0,0,0,1,0,0|3,0,0]=4 7857 B15R1.35 COCCCCOCCC1CCCCC1 34a_100011217863_100000755781 [0,0,0,1,0,0|3,0,0]=4 7858 B15R1.35 COCCCCOCCC1CCCCC1 7a_100011217863_100000730899 [0,0,0,1,0,0|3,0,0]=4 7859 B15R1.35 COCCCCSCCC1CCCCC1 62a_100000730899_100012355289 [0,0,0,1,0,0|3,0,0]=4 7860 B15R1.35 COCCCCSCCC1CCCCC1 62a_100012355289_100000730899 [0,0,0,1,0,0|3,0,0]=4 7861 B15R1.35 COCCCNCCCC1CCCCC1 2230a_100011211642_100000740836 [0,0,0,1,0,0|3,0,0]=4 7862 B15R1.35 COCCCNCCCC1CCCCC1 34a_100011211642_100000740836 [0,0,0,1,0,0|3,0,0]=4 7863 B15R1.35 COCCCNCCCC1CCCCC1 34a_100150723488_100011713725 [0,0,0,1,0,0|3,0,0]=4 7864 B15R1.35 COCCCOCCCC1CCCCC1 34a_100000198086_100000740836 [0,0,0,1,0,0|3,0,0]=4 7865 B15R1.35 COCCCOCCCC1CCCCC1 34a_100000740835_100011713725 [0,0,0,1,0,0|3,0,0]=4 7866 B15R1.35 COCCCOCCCC1CCCCC1 7a_100000198086_100000740836 [0,0,0,1,0,0|3,0,0]=4 7867 B15R1.35 COCCCSCCCC1CCCCC1 62a_100000709357_100011713725 [0,0,0,1,0,0|3,0,0]=4 7868 B15R1.35 COCCCSCCCC1CCCCC1 62a_100011713725_100000709357 [0,0,0,1,0,0|3,0,0]=4 7869 B15R1.35 COCCOCCCCC1CCCCC1 34a_100011215267_100011201679 [0,0,0,1,0,0|3,0,0]=4 7870 B15R1.35 COCCOCCCCC1CCCCC1 7a_100011215267_100000233755 [0,0,0,1,0,0|3,0,0]=4 7871 B15R1.35 CSCCCCOCCC1CCCCC1 34a_100011217163_100011209188 [0,0,0,1,0,0|3,0,0]=4 7872 B15R1.35 CSCCCCOCCC1CCCCC1 7a_100011217163_100011273959 [0,0,0,1,0,0|3,0,0]=4 7873 B15R1.35 CSCCCNCCCC1CCCCC1 2230a_100000749238_100011713725 [0,0,0,1,0,0|3,0,0]=4 7874 B15R1.35 CSCCCOCCCC1CCCCC1 34a_100000690336_100011713725 [0,0,0,1,0,0|3,0,0]=4 7875 B15R1.35 CSCCCOCCCC1CCCCC1 7a_100000690336_100011713725 [0,0,0,1,0,0|3,0,0]=4 7876 B15R1.35 CSCCOCCCCC1CCCCC1 34a_100011215267_100000212216 [0,0,0,1,0,0|3,0,0]=4 7877 B15R1.35 CSCCOCCCCC1CCCCC1 7a_100011215267_100000212216 [0,0,0,1,0,0|3,0,0]=4 7878 B15R1.35 ClCCCCCCOCC1CCCCC1 34a_100000766143_100000211423 [0,0,0,1,0,0|2,0,1]=4 7879 B15R1.35 ClCCCCCCOCC1CCCCC1 7a_100000766143_100000211423 [0,0,0,1,0,0|2,0,1]=4 7880 B15R1.35 ClCCCCCOCCC1CCCCC1 34a_100000746330_100011209188 [0,0,0,1,0,0|2,0,1]=4 7881 B15R1.35 ClCCCCCOCCC1CCCCC1 7a_100000746330_100011273959 [0,0,0,1,0,0|2,0,1]=4 7882 B15R1.35 ClCCCCOCCCC1CCCCC1 34a_100000210776_100011713725 [0,0,0,1,0,0|2,0,1]=4 7883 B15R1.35 ClCCCCOCCCC1CCCCC1 7a_100000210776_100011713725 [0,0,0,1,0,0|2,0,1]=4 7884 B15R1.35 FCCCCCCNCC1CCCCC1 2230a_100000210473_100015922095 [0,0,0,1,0,0|2,0,1]=4 7885 B15R1.35 FCCCCCCNCC1CCCCC1 34a_100000210473_100015922095 [0,0,0,1,0,0|2,0,1]=4 7886 B15R1.35 FCCCCCCOCC1CCCCC1 34a_100000212181_100015922095 [0,0,0,1,0,0|2,0,1]=4 7887 B15R1.35 FCCCCCCOCC1CCCCC1 34a_100000732779_100000211423 [0,0,0,1,0,0|2,0,1]=4 7888 B15R1.35 FCCCCCCOCC1CCCCC1 7a_100000212181_100015922095 [0,0,0,1,0,0|2,0,1]=4 7889 B15R1.35 FCCCCCCOCC1CCCCC1 7a_100000732779_100000211423 [0,0,0,1,0,0|2,0,1]=4 7890 B15R1.35 FCCCCCCSCC1CCCCC1 62a_100000211423_100015922095 [0,0,0,1,0,0|2,0,1]=4 7891 B15R1.35 FCCCCCCSCC1CCCCC1 62a_100015922095_100000211423 [0,0,0,1,0,0|2,0,1]=4 7892 B15R1.35 FCCCCCNCCC1CCCCC1 2230a_100000738074_100000729378 [0,0,0,1,0,0|2,0,1]=4 7893 B15R1.35 FCCCCCNCCC1CCCCC1 34a_100000738074_100000729378 [0,0,0,1,0,0|2,0,1]=4 7894 B15R1.35 FCCCCCOCCC1CCCCC1 34a_100011217863_100000729378 [0,0,0,1,0,0|2,0,1]=4 7895 B15R1.35 FCCCCCOCCC1CCCCC1 7a_100011217863_100000729378 [0,0,0,1,0,0|2,0,1]=4 7896 B15R1.35 FCCCCCSCCC1CCCCC1 62a_100000729378_100012355289 [0,0,0,1,0,0|2,0,1]=4 7897 B15R1.35 FCCCCCSCCC1CCCCC1 62a_100012355289_100000729378 [0,0,0,1,0,0|2,0,1]=4 7898 B15R1.35 FCCCCNCCCC1CCCCC1 2230a_100011211642_100000729493 [0,0,0,1,0,0|2,0,1]=4 7899 B15R1.35 FCCCCNCCCC1CCCCC1 34a_100011211642_100000729493 [0,0,0,1,0,0|2,0,1]=4 7900 B15R1.35 FCCCCOCCCC1CCCCC1 34a_100000198086_100000729493 [0,0,0,1,0,0|2,0,1]=4 7901 B15R1.35 FCCCCOCCCC1CCCCC1 34a_100011995726_100011713725 [0,0,0,1,0,0|2,0,1]=4 7902 B15R1.35 FCCCCOCCCC1CCCCC1 7a_100000198086_100000729493 [0,0,0,1,0,0|2,0,1]=4 7903 B15R1.35 FCCCCOCCCC1CCCCC1 7a_100011995726_100011713725 [0,0,0,1,0,0|2,0,1]=4 7904 B15R1.35 FCCCCSCCCC1CCCCC1 62a_100000729493_100011713725 [0,0,0,1,0,0|2,0,1]=4 7905 B15R1.35 FCCCCSCCCC1CCCCC1 62a_100011713725_100000729493 [0,0,0,1,0,0|2,0,1]=4 7906 B15R1.35 FCCCOCCCCC1CCCCC1 34a_100011215267_100011934791 [0,0,0,1,0,0|2,0,1]=4 7907 B15R1.35 FCCCOCCCCC1CCCCC1 7a_100011215267_100011934791 [0,0,0,1,0,0|2,0,1]=4 7908 B15R1.35 ICCCCCOCCC1CCCCC1 34a_200012148887_100011209188 [0,0,0,1,0,0|2,0,1]=4 7909 B15R1.35 ICCCCCOCCC1CCCCC1 7a_200012148887_100011273959 [0,0,0,1,0,0|2,0,1]=4 7910 B15R1.35 ICCCCOCCCC1CCCCC1 34a_200012148704_100011713725 [0,0,0,1,0,0|2,0,1]=4 7911 B15R1.35 N#CCCCCCCNC1CCCCC1 2230a_100000182618_100009813337 [0,0,0,1,0,0|2,0,1]=4 7912 B15R1.35 N#CCCCCCCOC1CCCCC1 7a_100000210231_100009813337 [0,0,0,1,0,0|2,0,1]=4 7913 B15R1.35 N#CCCCCCCSC1CCCCC1 62a_100000210327_100009813337 [0,0,0,1,0,0|2,0,1]=4 7914 B15R1.35 N#CCCCCCCSC1CCCCC1 62a_100009813337_100000210327 [0,0,0,1,0,0|2,0,1]=4 7915 B15R1.35 N#CCCCCCNCC1CCCCC1 2230a_100000210473_100009813376 [0,0,0,1,0,0|2,0,1]=4 7916 B15R1.35 N#CCCCCCOCC1CCCCC1 7a_100000212181_100009813376 [0,0,0,1,0,0|2,0,1]=4 7917 B15R1.35 N#CCCCCCSCC1CCCCC1 62a_100000211423_100009813376 [0,0,0,1,0,0|2,0,1]=4 7918 B15R1.35 N#CCCCCCSCC1CCCCC1 62a_100009813376_100000211423 [0,0,0,1,0,0|2,0,1]=4 7919 B15R1.35 N#CCCCCNCCC1CCCCC1 2230a_100000738074_100000211819 [0,0,0,1,0,0|2,0,1]=4 7920 B15R1.35 N#CCCCCNCCC1CCCCC1 270004a_100000751965_100011713444 [0,0,0,1,0,0|2,0,1]=4 7921 B15R1.35 N#CCCCCOCCC1CCCCC1 7a_100011217863_100000211819 [0,0,0,1,0,0|2,0,1]=4 7922 B15R1.35 N#CCCCCSCCC1CCCCC1 62a_100011219923_100012355289 [0,0,0,1,0,0|2,0,1]=4 7923 B15R1.35 N#CCCCCSCCC1CCCCC1 62a_100012355289_100000211819 [0,0,0,1,0,0|2,0,1]=4 7924 B15R1.35 N#CCCCNCCCC1CCCCC1 2230a_100011211642_100000687738 [0,0,0,1,0,0|2,0,1]=4 7925 B15R1.35 N#CCCCOCCCC1CCCCC1 7a_100000198086_100000687738 [0,0,0,1,0,0|2,0,1]=4 7926 B15R1.35 N#CCCCSCCCC1CCCCC1 62a_100000687738_100011713725 [0,0,0,1,0,0|2,0,1]=4 7927 B15R1.35 N#CCCCSCCCC1CCCCC1 62a_100011713725_100000687738 [0,0,0,1,0,0|2,0,1]=4 7928 B15R1.35 N#CCCOCCCCC1CCCCC1 7a_100011215267_100000184422 [0,0,0,1,0,0|2,0,1]=4 7929 B15R1.35 NCCCCCCCOC1CCCCC1 34a_100011996573_100000210327 [0,0,0,1,0,0|2,0,1]=4 7930 B15R1.35 NCCCCCCOCC1CCCCC1 34a_100000686447_100000211423 [0,0,0,1,0,0|2,0,1]=4 7931 B15R1.35 NCCCCCOCCC1CCCCC1 34a_100000762737_100011209188 [0,0,0,1,0,0|2,0,1]=4 7932 B15R1.35 NCCCCOCCCC1CCCCC1 34a_100000750430_100011713725 [0,0,0,1,0,0|2,0,1]=4 7933 B15R1.35 O=CCCCCCNCC1CCCCC1 2230a_100000210473_100000139337 [0,0,0,1,0,0|1,0,0]=2 7934 B15R1.35 O=CCCCCCNCC1CCCCO1 2230a_100000174945_100000139337 [0,0,0,1,0,0|2,0,0]=3 7935 B15R1.35 O=CCCCCCNCC1CCCOC1 2230a_100000720124_100000139337 [0,0,0,1,0,0|2,0,0]=3 7936 B15R1.35 O=CCCCCCNCC1CCOCC1 2230a_100000746373_100000139337 [0,0,0,1,0,0|2,0,0]=3 7937 B15R1.35 O=CCCCCCNCC1CCSCC1 2230a_100015188806_100000139337 [0,0,0,1,0,0|2,0,0]=3 7938 B15R1.35 O=CCCCCCNC[C@H]1COCCO1 2230a_100010981119_100000139337 [0,0,0,1,0,0|3,0,0]=4 7939 B15R1.35 O=CCCCCCOCC1CCCCC1 7a_100000212181_100000139337 [0,0,0,1,0,0|1,0,0]=2 7940 B15R1.35 O=CCCCCCOCC1CCCCO1 7a_100000211370_100000139337 [0,0,0,1,0,0|2,0,0]=3 7941 B15R1.35 O=CCCCCCOCC1CCSCC1 7a_100000070558_100000139337 [0,0,0,1,0,0|2,0,0]=3 7942 B15R1.35 O=CCCCCCSCC1CCCCC1 62a_100000139337_100000211423 [0,0,0,1,0,0|1,0,0]=2 7943 B15R1.35 O=CCCCCCSCC1CCCCC1 62a_100000211423_100000139337 [0,0,0,1,0,0|1,0,0]=2 7944 B15R1.35 O=CCCCCCSCC1CCCCO1 62a_100000139337_100000211543 [0,0,0,1,0,0|2,0,0]=3 7945 B15R1.35 O=CCCCCCSCC1CCCCO1 62a_100000211543_100000139337 [0,0,0,1,0,0|2,0,0]=3 7946 B15R1.35 O=CCCCCCSCC1CCCOC1 62a_100000139337_100000741521 [0,0,0,1,0,0|2,0,0]=3 7947 B15R1.35 O=CCCCCCSCC1CCCOC1 62a_100000741521_100000139337 [0,0,0,1,0,0|2,0,0]=3 7948 B15R1.35 O=CCCCCCSCC1CCOCC1 62a_100000139337_100000749018 [0,0,0,1,0,0|2,0,0]=3 7949 B15R1.35 O=CCCCCCSCC1CCOCC1 62a_100000754603_100000139337 [0,0,0,1,0,0|2,0,0]=3 7950 B15R1.35 O=CCCCCNCCC1=CCCCC1 2230a_100000212019_100000139335 [0,0,0,1,0,0|1,0,2]=4 7951 B15R1.35 O=CCCCCNCCC1CCCCC1 2230a_100000738074_100000139335 [0,0,0,1,0,0|1,0,0]=2 7952 B15R1.35 O=CCCCCNCCC1CCCCO1 2230a_100015183643_100000139335 [0,0,0,1,0,0|2,0,0]=3 7953 B15R1.35 O=CCCCCNCCC1CCOCC1 2230a_100000755988_100000139335 [0,0,0,1,0,0|2,0,0]=3 7954 B15R1.35 O=CCCCCNCCN1CCSCC1 2230a_100000755026_100000139335 [0,0,0,1,0,0|3,0,0]=4 7955 B15R1.35 O=CCCCCOCCC1CCCCC1 7a_100011217863_100000139335 [0,0,0,1,0,0|1,0,0]=2 7956 B15R1.35 O=CCCCCOCCC1CCOCC1 7a_100011933979_100000139335 [0,0,0,1,0,0|2,0,0]=3 7957 B15R1.35 O=CCCCCOCCC1SCCCS1 7a_200011025297_100000139335 [0,0,0,1,0,0|3,0,0]=4 7958 B15R1.35 O=CCCCCOCCN1CCSCC1 7a_100000686052_100000139335 [0,0,0,1,0,0|3,0,0]=4 7959 B15R1.35 O=CCCCCSCCC1CCCCC1 62a_100000139335_100012355289 [0,0,0,1,0,0|1,0,0]=2 7960 B15R1.35 O=CCCCCSCCC1CCCCC1 62a_100012355289_100000139335 [0,0,0,1,0,0|1,0,0]=2 7961 B15R1.35 O=CCCCCSCCC1CCOCC1 62a_100000139335_100011934994 [0,0,0,1,0,0|2,0,0]=3 7962 B15R1.35 O=CCCCCSCCC1CCOCC1 62a_100011934994_100000139335 [0,0,0,1,0,0|2,0,0]=3 7963 B15R1.35 O=CCCCCSCCC1OCCCO1 62a_100000139335_100000764188 [0,0,0,1,0,0|3,0,0]=4 7964 B15R1.35 O=CCCCCSCCC1OCCCO1 62a_100000764188_100000139335 [0,0,0,1,0,0|3,0,0]=4 7965 B15R1.35 O=CCCCCSCCN1CCCCC1 62a_100000139335_100000739454 [0,0,0,1,0,0|2,0,0]=3 7966 B15R1.35 O=CCCCCSCCN1CCCCC1 62a_100000739454_100000139335 [0,0,0,1,0,0|2,0,0]=3 7967 B15R1.35 O=CCCCCSCCN1CCOCC1 62a_100000139335_100000211760 [0,0,0,1,0,0|3,0,0]=4 7968 B15R1.35 O=CCCCCSCOC1CCCCC1 62a_100000139335_100011935260 [0,0,0,1,0,0|2,0,0]=3 7969 B15R1.35 O=CCCCCSCOC1CCCCC1 62a_100011935260_100000139335 [0,0,0,1,0,0|2,0,0]=3 7970 B15R1.35 O=CCCCNCCCC1CCCCC1 2230a_100011211642_200011292268 [0,0,0,1,0,0|1,0,0]=2 7971 B15R1.35 O=CCCCOCCCC1CCCCC1 7a_100000198086_200011292268 [0,0,0,1,0,0|1,0,0]=2 7972 B15R1.35 O=CCCCOCCOC1CCCCC1 7a_100011249652_200011292268 [0,0,0,1,0,0|2,0,0]=3 7973 B15R1.35 O=CCCCOCCOC1CCCCO1 7a_100000034223_200011292268 [0,0,0,1,0,0|3,0,0]=4 7974 B15R1.35 O=CCCCSCCCC1CCCCC1 62a_100011713725_200011292268 [0,0,0,1,0,0|1,0,0]=2 7975 B15R1.35 O=CCCCSCCCC1CCCCC1 62a_200011292268_100011713725 [0,0,0,1,0,0|1,0,0]=2 7976 B15R1.35 O=CCCCSCCCN1CCCCC1 62a_100132302099_200011292268 [0,0,0,1,0,0|2,0,0]=3 7977 B15R1.35 O=CCCCSCCCN1CCCCC1 62a_200011292268_100000007876 [0,0,0,1,0,0|2,0,0]=3 7978 B15R1.35 O=CCCCSCCCN1CCOCC1 62a_200011292268_100000748698 [0,0,0,1,0,0|3,0,0]=4 7979 B15R1.35 O=CCCCSCCOC1CCCCC1 62a_100011211530_200011292268 [0,0,0,1,0,0|2,0,0]=3 7980 B15R1.35 O=CCCCSCCOC1CCCCC1 62a_200011292268_100011211530 [0,0,0,1,0,0|2,0,0]=3 7981 B15R1.35 O=CCCCSCCOC1CCCCO1 62a_100000744793_200011292268 [0,0,0,1,0,0|3,0,0]=4 7982 B15R1.35 O=CCCCSCCOC1CCCCO1 62a_200011292268_100000744793 [0,0,0,1,0,0|3,0,0]=4 7983 B15R1.35 O=CCNCCCCCN1CCOCC1 2230a_100015187005_200015260668 [0,0,0,1,0,0|3,0,0]=4 7984 B15R1.35 O=CCOCCCCCN1CCCCC1 34a_100011216611_200009817547 [0,0,0,1,0,0|2,0,0]=3 7985 B15R1.35 O=CCOCCCCCN1CCCCC1 7a_100011216611_200015260668 [0,0,0,1,0,0|2,0,0]=3 7986 B15R1.35 O=CCOCCOCCN1CCCCC1 34a_200011409831_200009817547 [0,0,0,1,0,0|3,0,0]=4 7987 B15R1.35 O=CCOCCOCCN1CCCCC1 7a_200011409831_200015260668 [0,0,0,1,0,0|3,0,0]=4 7988 B15R1.35 O=CCSCCCCOC1CCCCO1 62a_100000031530_200015260668 [0,0,0,1,0,0|3,0,0]=4 7989 B15R1.35 O=CCSCCCCOC1CCCCO1 62a_200015260668_100000031530 [0,0,0,1,0,0|3,0,0]=4 7990 B15R1.35 OCCCCCCCNC1C=CCCC1 2230a_100011996573_100000751183 [0,0,0,1,0,0|3,0,0]=4 7991 B15R1.35 OCCCCCCCNC1CCCCC1 2230a_100000182618_100000760002 [0,0,0,1,0,0|1,0,2]=4 7992 B15R1.35 OCCCCCCCNC1CCCCC1 270004a_100011996573_100000210434 [0,0,0,1,0,0|1,0,2]=4 7993 B15R1.35 OCCCCCCCNC1CCCCC1 34a_100000182618_100000760002 [0,0,0,1,0,0|1,0,2]=4 7994 B15R1.35 OCCCCCCCNC1CCCCC1 34a_100011996573_100000210327 [0,0,0,1,0,0|1,0,2]=4 7995 B15R1.35 OCCCCCCCOC1C=CCCC1 34a_100011215024_100000760002 [0,0,0,1,0,0|3,0,0]=4 7996 B15R1.35 OCCCCCCCOC1CCCCC1 34a_100000210231_100000760002 [0,0,0,1,0,0|1,0,2]=4 7997 B15R1.35 OCCCCCCCOC1CCCCC1 7a_100000210231_100000760002 [0,0,0,1,0,0|1,0,2]=4 7998 B15R1.35 OCCCCCCCSC1C=CCCC1 62a_100000751183_100000760002 [0,0,0,1,0,0|3,0,0]=4 7999 B15R1.35 OCCCCCCCSC1C=CCCC1 62a_100000760002_100000751183 [0,0,0,1,0,0|3,0,0]=4 8000 B15R1.35 OCCCCCCCSC1CCCCC1 62a_100000210327_100000760002 [0,0,0,1,0,0|1,0,2]=4 8001 B15R1.35 OCCCCCCCSC1CCCCC1 62a_100000760002_100000210327 [0,0,0,1,0,0|1,0,2]=4 8002 B15R1.35 OCCCCCCNCC1CCCCC1 2230a_100000210473_100000766143 [0,0,0,1,0,0|1,0,2]=4 8003 B15R1.35 OCCCCCCNCC1CCCCC1 2230a_100000686447_100000211423 [0,0,0,1,0,0|1,0,2]=4 8004 B15R1.35 OCCCCCCNCC1CCCCC1 269862a_100000686447_100000211278 [0,0,0,1,0,0|1,0,2]=4 8005 B15R1.35 OCCCCCCNCC1CCCCC1 34a_100000210473_100000766143 [0,0,0,1,0,0|1,0,2]=4 8006 B15R1.35 OCCCCCCNCC1CCCCC1 34a_100000686447_100000211423 [0,0,0,1,0,0|1,0,2]=4 8007 B15R1.35 OCCCCCCOCC1CCCCC1 34a_100000212181_100000766143 [0,0,0,1,0,0|1,0,2]=4 8008 B15R1.35 OCCCCCCOCC1CCCCC1 7a_100000212181_100000766143 [0,0,0,1,0,0|1,0,2]=4 8009 B15R1.35 OCCCCCCSCC1CCCCC1 62a_100000211423_100000766143 [0,0,0,1,0,0|1,0,2]=4 8010 B15R1.35 OCCCCCCSCC1CCCCC1 62a_100000766143_100000211423 [0,0,0,1,0,0|1,0,2]=4 8011 B15R1.35 OCCCCCNCCC1CCCCC1 2230a_100000738074_100000746330 [0,0,0,1,0,0|1,0,2]=4 8012 B15R1.35 OCCCCCNCCC1CCCCC1 2230a_100000762737_100012355289 [0,0,0,1,0,0|1,0,2]=4 8013 B15R1.35 OCCCCCNCCC1CCCCC1 270004a_100000762737_100011713444 [0,0,0,1,0,0|1,0,2]=4 8014 B15R1.35 OCCCCCNCCC1CCCCC1 34a_100000738074_100000746330 [0,0,0,1,0,0|1,0,2]=4 8015 B15R1.35 OCCCCCNCCC1CCCCC1 34a_100000762737_100011209188 [0,0,0,1,0,0|1,0,2]=4 8016 B15R1.35 OCCCCCOCCC1CCCCC1 34a_100011217863_100000746330 [0,0,0,1,0,0|1,0,2]=4 8017 B15R1.35 OCCCCCOCCC1CCCCC1 7a_100011217863_100000746330 [0,0,0,1,0,0|1,0,2]=4 8018 B15R1.35 OCCCCCSCCC1CCCCC1 62a_100000746330_100012355289 [0,0,0,1,0,0|1,0,2]=4 8019 B15R1.35 OCCCCCSCCC1CCCCC1 62a_100012355289_100000746330 [0,0,0,1,0,0|1,0,2]=4 8020 B15R1.35 OCCCCNCCCC1CCCCC1 2230a_100000750430_100011713725 [0,0,0,1,0,0|1,0,2]=4 8021 B15R1.35 OCCCCNCCCC1CCCCC1 2230a_100011211642_100000210776 [0,0,0,1,0,0|1,0,2]=4 8022 B15R1.35 OCCCCNCCCC1CCCCC1 34a_100000750430_100011713725 [0,0,0,1,0,0|1,0,2]=4 8023 B15R1.35 OCCCCNCCCC1CCCCC1 34a_100011211642_100011216708 [0,0,0,1,0,0|1,0,2]=4 8024 B15R1.35 OCCCCOCCCC1CCCCC1 34a_100000198086_100011216708 [0,0,0,1,0,0|1,0,2]=4 8025 B15R1.35 OCCCCOCCCC1CCCCC1 7a_100000198086_100000210776 [0,0,0,1,0,0|1,0,2]=4 8026 B15R1.35 OCCCCSCCCC1CCCCC1 62a_100000210776_100011713725 [0,0,0,1,0,0|1,0,2]=4 8027 B15R1.35 OCCCCSCCCC1CCCCC1 62a_100011713725_100000210776 [0,0,0,1,0,0|1,0,2]=4 8028 B15R1.35 OCCCOCCCCC1CCCCC1 34a_100011215267_100000230001 [0,0,0,1,0,0|1,0,2]=4 8029 B15R1.35 OCCCOCCCCC1CCCCC1 7a_100011215267_100011215043 [0,0,0,1,0,0|1,0,2]=4 8030 B15R1.52 C#CCCCCOC1CCCCCC1=O 7a_100000766709_100000243696 [0,0,0,1,0,0|1,0,2]=4 8031 B15R1.52 C#CCCCCSC1CCCCCC1=O 62a_100000243696_100010269958 [0,0,0,1,0,0|1,0,2]=4 8032 B15R1.52 C#CCCCCSC1CCCCCC1=O 62a_100010269958_100000243696 [0,0,0,1,0,0|1,0,2]=4 8033 B15R1.52 C=CCCCCOC1CCCCCC1=O 7a_100000766645_100000243696 [0,0,0,1,0,0|1,0,2]=4 8034 B15R1.52 C=CCCCCSC1CCCCCC1=O 62a_100000243696_100011215482 [0,0,0,1,0,0|1,0,2]=4 8035 B15R1.52 C=CCCCCSC1CCCCCC1=O 62a_100011215482_100000243696 [0,0,0,1,0,0|1,0,2]=4 8036 B15R1.52 CC/C=C\CCOC1CCCCCC1=O 7a_100016288707_100000243696 [0,0,0,1,0,0|1,0,2]=4 8037 B15R1.52 CC/C=C\CCSC1CCCCCC1=O 62a_100000243696_100015370543 [0,0,0,1,0,0|1,0,2]=4 8038 B15R1.52 CC/C=C\CCSC1CCCCCC1=O 62a_100015370543_100000243696 [0,0,0,1,0,0|1,0,2]=4 8039 B15R1.52 CCC#CCCOC1CCCCCC1=O 7a_100000036655_100000243696 [0,0,0,1,0,0|1,0,2]=4 8040 B15R1.52 CCC/C=C/COC1CCCCCC1=O 7a_100016278788_100000243696 [0,0,0,1,0,0|1,0,2]=4 8041 B15R1.52 CCCC#CCOC1CCCCCC1=O 7a_100000034806_100000243696 [0,0,0,1,0,0|1,0,2]=4 8042 B15R1.52 CCCCCCNC1CCCCNC1=O 2230a_100000210581_100000735217 [0,0,0,1,0,0|2,0,0]=3 8043 B15R1.52 CCCCCCNC1CCCCNC1=O 2230a_100000698827_100000210314 [0,0,0,1,0,0|2,0,0]=3 8044 B15R1.52 CCCCCCNC1CCCCNC1=O 34a_100000698827_100000210314 [0,0,0,1,0,0|2,0,0]=3 8045 B15R1.52 CCCCCCOC1CCCCCC1=O 7a_100000210259_100000243696 [0,0,0,1,0,0|1,0,0]=2 8046 B15R1.52 CCCCCCOC1CCCCNC1=O 7a_100000210259_100000735217 [0,0,0,1,0,0|2,0,0]=3 8047 B15R1.52 CCCCCCSC1CCCCCC1=O 62a_100000210314_100000243696 [0,0,0,1,0,0|1,0,0]=2 8048 B15R1.52 CCCCCCSC1CCCCCC1=O 62a_100000243696_100000210757 [0,0,0,1,0,0|1,0,0]=2 8049 B15R1.52 CCCCCCSC1CCCCNC1=O 62a_100000210314_100000735217 [0,0,0,1,0,0|2,0,0]=3 8050 B15R1.52 CCCCCCSC1CCCCNC1=O 62a_100000735217_100000210757 [0,0,0,1,0,0|2,0,0]=3 8051 B15R1.52 CCCCOCNC1CCCCNC1=O 2230a_100000698827_100011995733 [0,0,0,1,0,0|3,0,0]=4 8052 B15R1.52 CCCCOCNC1CCCCNC1=O 34a_100000698827_100011995733 [0,0,0,1,0,0|3,0,0]=4 8053 B15R1.52 CCCCOCSC1CCCCCC1=O 62a_100000243696_100011995733 [0,0,0,1,0,0|2,0,0]=3 8054 B15R1.52 CCCCOCSC1CCCCCC1=O 62a_100011995733_100000243696 [0,0,0,1,0,0|2,0,0]=3 8055 B15R1.52 CCCCOCSC1CCCCNC1=O 62a_100000735217_100011995733 [0,0,0,1,0,0|3,0,0]=4 8056 B15R1.52 CCCCOCSC1CCCCNC1=O 62a_100011995733_100000735217 [0,0,0,1,0,0|3,0,0]=4 8057 B15R1.52 CCCNCCCN1CCCCCC1=O 2230a_100000195386_100000210303 [0,0,0,1,0,0|2,0,0]=3 8058 B15R1.52 CCCNCCCN1CCCCCC1=O 34a_100000195386_100000210303 [0,0,0,1,0,0|2,0,0]=3 8059 B15R1.52 CCCOCCNC1CCCCNC1=O 2230a_100000698827_100011215938 [0,0,0,1,0,0|3,0,0]=4 8060 B15R1.52 CCCOCCNC1CCCCNC1=O 2230a_100161115042_100000735217 [0,0,0,1,0,0|3,0,0]=4 8061 B15R1.52 CCCOCCNC1CCCCNC1=O 34a_100000698827_100011215938 [0,0,0,1,0,0|3,0,0]=4 8062 B15R1.52 CCCOCCOC1CCCCCC1=O 7a_100000752267_100000243696 [0,0,0,1,0,0|2,0,0]=3 8063 B15R1.52 CCCOCCOC1CCCCNC1=O 7a_100000752267_100000735217 [0,0,0,1,0,0|3,0,0]=4 8064 B15R1.52 CCCOCCSC1CCCCCC1=O 62a_100000243696_100011215938 [0,0,0,1,0,0|2,0,0]=3 8065 B15R1.52 CCCOCCSC1CCCCCC1=O 62a_100011215938_100000243696 [0,0,0,1,0,0|2,0,0]=3 8066 B15R1.52 CCCOCCSC1CCCCNC1=O 62a_100000735217_100011215938 [0,0,0,1,0,0|3,0,0]=4 8067 B15R1.52 CCCOCCSC1CCCCNC1=O 62a_100011215938_100000735217 [0,0,0,1,0,0|3,0,0]=4 8068 B15R1.52 CCCSCCNC1CCCCNC1=O 2230a_100020603323_100000735217 [0,0,0,1,0,0|3,0,0]=4 8069 B15R1.52 CCCSCCOC1CCCCCC1=O 7a_200000230433_100000243696 [0,0,0,1,0,0|2,0,0]=3 8070 B15R1.52 CCCSCCOC1CCCCNC1=O 7a_200000230433_100000735217 [0,0,0,1,0,0|3,0,0]=4 8071 B15R1.52 CCOCCCNC1CCCCNC1=O 2230a_100000210961_100000735217 [0,0,0,1,0,0|3,0,0]=4 8072 B15R1.52 CCOCCCNC1CCCCNC1=O 2230a_100000698827_100012232248 [0,0,0,1,0,0|3,0,0]=4 8073 B15R1.52 CCOCCCNC1CCCCNC1=O 34a_100000698827_100012232248 [0,0,0,1,0,0|3,0,0]=4 8074 B15R1.52 CCOCCCOC1CCCCCC1=O 7a_100000757476_100000243696 [0,0,0,1,0,0|2,0,0]=3 8075 B15R1.52 CCOCCCOC1CCCCNC1=O 7a_100000757476_100000735217 [0,0,0,1,0,0|3,0,0]=4 8076 B15R1.52 CCOCCCSC1CCCCCC1=O 62a_100000243696_100012232248 [0,0,0,1,0,0|2,0,0]=3 8077 B15R1.52 CCOCCCSC1CCCCCC1=O 62a_100012232248_100000243696 [0,0,0,1,0,0|2,0,0]=3 8078 B15R1.52 CCOCCCSC1CCCCNC1=O 62a_100000735217_100012232248 [0,0,0,1,0,0|3,0,0]=4 8079 B15R1.52 CCOCCCSC1CCCCNC1=O 62a_100012232248_100000735217 [0,0,0,1,0,0|3,0,0]=4 8080 B15R1.52 CCSCCCOC1CCCCCC1=O 7a_100011216438_100000243696 [0,0,0,1,0,0|2,0,0]=3 8081 B15R1.52 CCSCCCOC1CCCCNC1=O 7a_100011216438_100000735217 [0,0,0,1,0,0|3,0,0]=4 8082 B15R1.52 COCCCCNC1CCCCNC1=O 2230a_100000698827_100000730899 [0,0,0,1,0,0|3,0,0]=4 8083 B15R1.52 COCCCCNC1CCCCNC1=O 34a_100000698827_100000755781 [0,0,0,1,0,0|3,0,0]=4 8084 B15R1.52 COCCCCSC1CCCCCC1=O 62a_100000243696_100000730899 [0,0,0,1,0,0|2,0,0]=3 8085 B15R1.52 COCCCCSC1CCCCCC1=O 62a_100000730899_100000243696 [0,0,0,1,0,0|2,0,0]=3 8086 B15R1.52 COCCCCSC1CCCCNC1=O 62a_100000730899_100000735217 [0,0,0,1,0,0|3,0,0]=4 8087 B15R1.52 COCCCCSC1CCCCNC1=O 62a_100000735217_100000730899 [0,0,0,1,0,0|3,0,0]=4 8088 B15R1.52 COCCOCSC1CCCCCC1=O 62a_100000231047_100000243696 [0,0,0,1,0,0|3,0,0]=4 8089 B15R1.52 COCCOCSC1CCCCCC1=O 62a_100000243696_100000231047 [0,0,0,1,0,0|3,0,0]=4 8090 B15R1.52 COCNCCCN1CCCCCC1=O 2230a_100000195386_100000766300 [0,0,0,1,0,0|3,0,0]=4 8091 B15R1.52 CSCCCCOC1CCCCCC1=O 7a_100011217163_100000243696 [0,0,0,1,0,0|2,0,0]=3 8092 B15R1.52 CSCCCCOC1CCCCNC1=O 7a_100011217163_100000735217 [0,0,0,1,0,0|3,0,0]=4 8093 B15R1.52 CSCNCCCN1CCCCCC1=O 2230a_100000195386_100011218213 [0,0,0,1,0,0|3,0,0]=4 8094 B15R1.52 CSCNCCCN1CCCCCC1=O 34a_100000195386_100011218213 [0,0,0,1,0,0|3,0,0]=4 8095 B15R1.52 N#CCCCCSC1CCCCCC1=O 62a_100000243696_100000211819 [0,0,0,1,0,0|2,0,1]=4 8096 B15R1.52 N#CCCCCSC1CCCCCC1=O 62a_100011219923_100000243696 [0,0,0,1,0,0|2,0,1]=4 8097 B15R1.52 O=C1CCCCCC1OCCCCCBr 7a_100000746331_100000243696 [0,0,0,1,0,0|2,0,0]=3 8098 B15R1.52 O=C1CCCCCC1OCCCCCCl 7a_100000746330_100000243696 [0,0,0,1,0,0|2,0,0]=3 8099 B15R1.52 O=C1CCCCCC1OCCCCCI 7a_200012148887_100000243696 [0,0,0,1,0,0|2,0,0]=3 8100 B15R1.52 O=C1CCCCCC1OCCOCCBr 7a_100000692535_100000243696 [0,0,0,1,0,0|3,0,0]=4 8101 B15R1.52 O=C1CCCCCC1OCCOCCCl 7a_100011215305_100000243696 [0,0,0,1,0,0|3,0,0]=4 8102 B15R1.52 O=C1CCCCCC1OCCOCCF 7a_200015357709_100000243696 [0,0,0,1,0,0|3,0,0]=4 8103 B15R1.52 O=C1CCCCCC1OCCOCCI 7a_100012149058_100000243696 [0,0,0,1,0,0|3,0,0]=4 8104 B15R1.52 O=C1CCCCCC1SCCCCCF 62a_100000243696_100000729378 [0,0,0,1,0,0|2,0,0]=3 8105 B15R1.52 O=C1CCCCCC1SCCCCCF 62a_100000729378_100000243696 [0,0,0,1,0,0|2,0,0]=3 8106 B15R1.52 O=C1CCCCCC1SCCCCCO 62a_100000243696_100000746330 [0,0,0,1,0,0|2,0,0]=3 8107 B15R1.52 O=C1CCCCCC1SCCCCCO 62a_100000746330_100000243696 [0,0,0,1,0,0|2,0,0]=3 8108 B15R1.52 O=C1CCCCCC1SCCOCCO 62a_100000243696_100011215305 [0,0,0,1,0,0|3,0,0]=4 8109 B15R1.52 O=C1CCCCCC1SCCOCCO 62a_100011215305_100000243696 [0,0,0,1,0,0|3,0,0]=4 8110 B15R1.52 O=C1CCCCCN1CCCNCCF 2230a_100000195386_100011217306 [0,0,0,1,0,0|3,0,0]=4 8111 B15R1.52 O=C1CCCCCN1CCCNCCF 34a_100000195386_100011217306 [0,0,0,1,0,0|3,0,0]=4 8112 B15R1.52 O=C1CCCCCN1CCCNCCO 2230a_100000195386_100000211926 [0,0,0,1,0,0|3,0,0]=4 8113 B15R1.52 O=C1CCCCCN1CCCNCCO 34a_100000195386_100000211926 [0,0,0,1,0,0|3,0,0]=4 8114 B15R1.52 O=C1NCCCCC1NCCCCCF 2230a_100000698827_100000729378 [0,0,0,1,0,0|3,0,0]=4 8115 B15R1.52 O=C1NCCCCC1NCCCCCF 34a_100000698827_100000729378 [0,0,0,1,0,0|3,0,0]=4 8116 B15R1.52 O=C1NCCCCC1NCCCCCO 2230a_100000698827_100000746330 [0,0,0,1,0,0|3,0,0]=4 8117 B15R1.52 O=C1NCCCCC1NCCCCCO 2230a_100000762737_100000735217 [0,0,0,1,0,0|3,0,0]=4 8118 B15R1.52 O=C1NCCCCC1NCCCCCO 34a_100000698827_100000746330 [0,0,0,1,0,0|3,0,0]=4 8119 B15R1.52 O=C1NCCCCC1OCCCCCBr 7a_100000746331_100000735217 [0,0,0,1,0,0|3,0,0]=4 8120 B15R1.52 O=C1NCCCCC1OCCCCCCl 7a_100000746330_100000735217 [0,0,0,1,0,0|3,0,0]=4 8121 B15R1.52 O=C1NCCCCC1OCCCCCI 7a_200012148887_100000735217 [0,0,0,1,0,0|3,0,0]=4 8122 B15R1.52 O=C1NCCCCC1SCCCCCF 62a_100000729378_100000735217 [0,0,0,1,0,0|3,0,0]=4 8123 B15R1.52 O=C1NCCCCC1SCCCCCF 62a_100000735217_100000729378 [0,0,0,1,0,0|3,0,0]=4 8124 B15R1.52 O=C1NCCCCC1SCCCCCO 62a_100000735217_100000746330 [0,0,0,1,0,0|3,0,0]=4 8125 B15R1.52 O=C1NCCCCC1SCCCCCO 62a_100000746330_100000735217 [0,0,0,1,0,0|3,0,0]=4 8126 B15R1.52 O=CCCCCSC1CCCCCC1=O 62a_100000139335_100000243696 [0,0,0,1,0,0|2,0,1]=4 8127 B15R1.52 O=CCCCCSC1CCCCCC1=O 62a_100000243696_100000139335 [0,0,0,1,0,0|2,0,1]=4 8128 B15R1.220 C#CCCCCCCN1CCCCC1C 2230a_100000211376_100012276617 [0,0,0,1,0,0|2,0,1]=4 8129 B15R1.220 C#CCCCCCCN1CCCCC1C 269982a_100000211376_100012276617 [0,0,0,1,0,0|2,0,1]=4 8130 B15R1.220 C#CCCCCCCN1CCCCC1C 34a_100000211376_100012276617 [0,0,0,1,0,0|2,0,1]=4 8131 B15R1.220 C#CCCCCCNC1CCCCC1C 2230a_100000211402_100012094781 [0,0,0,1,0,0|2,0,1]=4 8132 B15R1.220 C#CCCCCCNC1CCCCC1C 34a_100000211402_100012094781 [0,0,0,1,0,0|2,0,1]=4 8133 B15R1.220 C#CCCCCCOC1CCCCC1=O 34a_100000766912_100000754470 [0,0,0,1,0,0|1,0,2]=4 8134 B15R1.220 C#CCCCCCOC1CCCCC1=O 34a_100011214950_100012094781 [0,0,0,1,0,0|1,0,2]=4 8135 B15R1.220 C#CCCCCCOC1CCCCC1=O 7a_100000766912_100000204591 [0,0,0,1,0,0|1,0,2]=4 8136 B15R1.220 C#CCCCCCOC1CCCCC1C 34a_100000211207_100012094781 [0,0,0,1,0,0|2,0,1]=4 8137 B15R1.220 C#CCCCCCOC1CCCCC1C 7a_100000211207_100012094781 [0,0,0,1,0,0|2,0,1]=4 8138 B15R1.220 C#CCCCCCSC1CCCCC1=O 62a_100000204591_100012094781 [0,0,0,1,0,0|1,0,2]=4 8139 B15R1.220 C#CCCCCCSC1CCCCC1=O 62a_100012094781_100000204591 [0,0,0,1,0,0|1,0,2]=4 8140 B15R1.220 C#CCCCCOCC1CCCCC1=O 34a_100009861125_100010269958 [0,0,0,1,0,0|1,0,2]=4 8141 B15R1.220 C#CCCCCOCC1CCCCC1=O 7a_100009861125_100010269958 [0,0,0,1,0,0|1,0,2]=4 8142 B15R1.220 C=CCCCCCCN1CCCCC1C 2230a_100000211376_100011215473 [0,0,0,1,0,0|2,0,0]=3 8143 B15R1.220 C=CCCCCCCN1CCCCC1C 269982a_100000211376_100011215473 [0,0,0,1,0,0|2,0,0]=3 8144 B15R1.220 C=CCCCCCCN1CCCCC1C 34a_100000211376_100011215473 [0,0,0,1,0,0|2,0,0]=3 8145 B15R1.220 C=CCCCCCCN1CCOC[C@@H]1C 2230a_100009815349_100011215473 [0,0,0,1,0,0|3,0,0]=4 8146 B15R1.220 C=CCCCCCCN1CCOC[C@@H]1C 269982a_100009815349_100011215473 [0,0,0,1,0,0|3,0,0]=4 8147 B15R1.220 C=CCCCCCCN1CCOC[C@@H]1C 34a_100009815349_100011215473 [0,0,0,1,0,0|3,0,0]=4 8148 B15R1.220 C=CCCCCCNC1CCCCC1C 2230a_100000211402_100000700193 [0,0,0,1,0,0|2,0,0]=3 8149 B15R1.220 C=CCCCCCNC1CCCCC1C 34a_100000211402_100000700193 [0,0,0,1,0,0|2,0,0]=3 8150 B15R1.220 C=CCCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000700193 [0,0,0,1,0,0|3,0,0]=4 8151 B15R1.220 C=CCCCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000700193 [0,0,0,1,0,0|3,0,0]=4 8152 B15R1.220 C=CCCCCCOC1CCCCC1=O 34a_100011214950_100000700193 [0,0,0,1,0,0|1,0,2]=4 8153 B15R1.220 C=CCCCCCOC1CCCCC1=O 34a_100011216702_100000754470 [0,0,0,1,0,0|1,0,2]=4 8154 B15R1.220 C=CCCCCCOC1CCCCC1=O 7a_100011216702_100000204591 [0,0,0,1,0,0|1,0,2]=4 8155 B15R1.220 C=CCCCCCOC1CCCCC1C 34a_100000211207_100000700193 [0,0,0,1,0,0|2,0,0]=3 8156 B15R1.220 C=CCCCCCOC1CCCCC1C 7a_100000211207_100000700193 [0,0,0,1,0,0|2,0,0]=3 8157 B15R1.220 C=CCCCCCOC1CCCCC1Cl 34a_100000038908_100000700193 [0,0,0,1,0,0|3,0,0]=4 8158 B15R1.220 C=CCCCCCOC1CCCCC1Cl 7a_100000038908_100000700193 [0,0,0,1,0,0|3,0,0]=4 8159 B15R1.220 C=CCCCCCOC1CCCCC1F 34a_100011216702_100015423560 [0,0,0,1,0,0|3,0,0]=4 8160 B15R1.220 C=CCCCCCOC1CCCCC1O 34a_100011216702_100000038908 [0,0,0,1,0,0|3,0,0]=4 8161 B15R1.220 C=CCCCCCOC1CCNCC1C 34a_100011998114_100000700193 [0,0,0,1,0,0|3,0,0]=4 8162 B15R1.220 C=CCCCCCOC1CNCCC1C 34a_100000696640_100000700193 [0,0,0,1,0,0|3,0,0]=4 8163 B15R1.220 C=CCCCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000700193 [0,0,0,1,0,0|3,0,0]=4 8164 B15R1.220 C=CCCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000700193 [0,0,0,1,0,0|3,0,0]=4 8165 B15R1.220 C=CCCCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000700193 [0,0,0,1,0,0|3,0,0]=4 8166 B15R1.220 C=CCCCCCSC1CCCCC1=O 62a_100000204591_100000700193 [0,0,0,1,0,0|1,0,2]=4 8167 B15R1.220 C=CCCCCCSC1CCCCC1=O 62a_100000700193_100000204591 [0,0,0,1,0,0|1,0,2]=4 8168 B15R1.220 C=CCCCCCSC1CCCCC1F 62a_100000700193_100015423560 [0,0,0,1,0,0|3,0,0]=4 8169 B15R1.220 C=CCCCCCSC1CCCCC1F 62a_100015423560_100000700193 [0,0,0,1,0,0|3,0,0]=4 8170 B15R1.220 C=CCCCCCSC1CCCCC1O 62a_100000038908_100000700193 [0,0,0,1,0,0|3,0,0]=4 8171 B15R1.220 C=CCCCCCSC1CCCCC1O 62a_100000700193_100000038908 [0,0,0,1,0,0|3,0,0]=4 8172 B15R1.220 C=CCCCCNCC1CCCCC1O 34a_100011216029_100011215482 [0,0,0,1,0,0|3,0,0]=4 8173 B15R1.220 C=CCCCCNCC1CCCCN1C 34a_100000703577_100015186950 [0,0,0,1,0,0|3,0,0]=4 8174 B15R1.220 C=CCCCCNCC1CCCCN1C 34a_100011228421_100011215482 [0,0,0,1,0,0|3,0,0]=4 8175 B15R1.220 C=CCCCCOCC1CCCCC1=O 34a_100009861125_100011215482 [0,0,0,1,0,0|1,0,2]=4 8176 B15R1.220 C=CCCCCOCC1CCCCC1=O 7a_100009861125_100011215482 [0,0,0,1,0,0|1,0,2]=4 8177 B15R1.220 C=CCCCCOCC1CCCCN1C 34a_100000225079_100011215482 [0,0,0,1,0,0|3,0,0]=4 8178 B15R1.220 C=CCCCCOCC1CCCCN1C 34a_100000766645_100015186950 [0,0,0,1,0,0|3,0,0]=4 8179 B15R1.220 C=CCCCCOCC1CCCCN1C 7a_100000766645_100015185383 [0,0,0,1,0,0|3,0,0]=4 8180 B15R1.220 C=CCCCCSCC1CCCCN1C 62a_100011215482_100015185383 [0,0,0,1,0,0|3,0,0]=4 8181 B15R1.220 C=CCCCCSCC1CCCCN1C 62a_100015185383_100011215482 [0,0,0,1,0,0|3,0,0]=4 8182 B15R1.220 C=CCCCNCCC1CCCCN1C 2230a_100000700776_100000211948 [0,0,0,1,0,0|3,0,0]=4 8183 B15R1.220 C=CCCCNCCC1CCCCN1C 34a_100000700776_100000211948 [0,0,0,1,0,0|3,0,0]=4 8184 B15R1.220 C=CCCCNCCN1CCCCC1C 2230a_100000739827_100011713584 [0,0,0,1,0,0|3,0,0]=4 8185 B15R1.220 C=CCCCNCCN1CCCCC1C 34a_100000739827_100000757094 [0,0,0,1,0,0|3,0,0]=4 8186 B15R1.220 C=CCCCOCCC1CCCCN1C 34a_100000758997_100000211948 [0,0,0,1,0,0|3,0,0]=4 8187 B15R1.220 C=CCCCOCCC1CCCCN1C 7a_100000758997_100000211948 [0,0,0,1,0,0|3,0,0]=4 8188 B15R1.220 C=CCCCOCCN1CCCCC1C 34a_100011305533_100000757094 [0,0,0,1,0,0|3,0,0]=4 8189 B15R1.220 C=CCCCSCCC1CCCCN1C 62a_100000211948_100000757094 [0,0,0,1,0,0|3,0,0]=4 8190 B15R1.220 C=CCCCSCCC1CCCCN1C 62a_100011713584_100000211948 [0,0,0,1,0,0|3,0,0]=4 8191 B15R1.220 C=CCCNCCCN1CCCCC1C 34a_100000212276_100000754431 [0,0,0,1,0,0|3,0,0]=4 8192 B15R1.220 C=CCCOCCCN1CCCCC1C 34a_100000213889_100000754431 [0,0,0,1,0,0|3,0,0]=4 8193 B15R1.220 C=CCCOCCCN1CCCCC1C 7a_100000213889_100000754431 [0,0,0,1,0,0|3,0,0]=4 8194 B15R1.220 CC/C=C/CCCOC1CCCCC1=O 34a_100016287902_100000754470 [0,0,0,1,0,0|1,0,2]=4 8195 B15R1.220 CC/C=C/CCCOC1CCCCC1=O 7a_100016287902_100000204591 [0,0,0,1,0,0|1,0,2]=4 8196 B15R1.220 CC/C=C\CCOCC1CCCCC1=O 34a_100009861125_100015370543 [0,0,0,1,0,0|1,0,2]=4 8197 B15R1.220 CC/C=C\CCOCC1CCCCC1=O 7a_100009861125_100015370543 [0,0,0,1,0,0|1,0,2]=4 8198 B15R1.220 CC1CCCCC1NCCCCCC#N 2230a_100000211402_100009813376 [0,0,0,1,0,0|2,0,1]=4 8199 B15R1.220 CC1CCCCC1NCCCCCC#N 270004a_100000061152_100000210921 [0,0,0,1,0,0|2,0,1]=4 8200 B15R1.220 CC1CCCCC1NCCCCCC=O 2230a_100000211402_100000139337 [0,0,0,1,0,0|1,0,0]=2 8201 B15R1.220 CC1CCCCC1NCCCCCCF 2230a_100000211402_100015922095 [0,0,0,1,0,0|2,0,1]=4 8202 B15R1.220 CC1CCCCC1NCCCCCCF 34a_100000211402_100015922095 [0,0,0,1,0,0|2,0,1]=4 8203 B15R1.220 CC1CCCCC1NCCCCCCO 2230a_100000211402_100000766143 [0,0,0,1,0,0|1,0,2]=4 8204 B15R1.220 CC1CCCCC1NCCCCCCO 269862a_100000686447_100000210921 [0,0,0,1,0,0|1,0,2]=4 8205 B15R1.220 CC1CCCCC1NCCCCCCO 270004a_100000686447_100000210921 [0,0,0,1,0,0|1,0,2]=4 8206 B15R1.220 CC1CCCCC1NCCCCCCO 34a_100000211402_100000766143 [0,0,0,1,0,0|1,0,2]=4 8207 B15R1.220 CC1CCCCC1OCCCCCC#N 7a_100000211207_100009813376 [0,0,0,1,0,0|2,0,1]=4 8208 B15R1.220 CC1CCCCC1OCCCCCC=O 7a_100000211207_100000139337 [0,0,0,1,0,0|1,0,0]=2 8209 B15R1.220 CC1CCCCC1OCCCCCCF 34a_100000211207_100015922095 [0,0,0,1,0,0|2,0,1]=4 8210 B15R1.220 CC1CCCCC1OCCCCCCF 7a_100000211207_100015922095 [0,0,0,1,0,0|2,0,1]=4 8211 B15R1.220 CC1CCCCC1OCCCCCCO 34a_100000211207_100000766143 [0,0,0,1,0,0|1,0,2]=4 8212 B15R1.220 CC1CCCCC1OCCCCCCO 7a_100000211207_100000766143 [0,0,0,1,0,0|1,0,2]=4 8213 B15R1.220 CC1CCCCN1CCCCCCC#N 2230a_100000211376_100009813337 [0,0,0,1,0,0|2,0,1]=4 8214 B15R1.220 CC1CCCCN1CCCCCCC#N 269982a_100000211376_100009813337 [0,0,0,1,0,0|2,0,1]=4 8215 B15R1.220 CC1CCCCN1CCCCCCCO 2230a_100000211376_100000760002 [0,0,0,1,0,0|1,0,2]=4 8216 B15R1.220 CC1CCCCN1CCCCCCCO 269982a_100000211376_100000760002 [0,0,0,1,0,0|1,0,2]=4 8217 B15R1.220 CC1CCCCN1CCCCCCCO 34a_100000211376_100000760002 [0,0,0,1,0,0|1,0,2]=4 8218 B15R1.220 CC1CCCCN1CCNCCCC=O 2230a_100000739827_200011292268 [0,0,0,1,0,0|2,0,0]=3 8219 B15R1.220 CCCC#CCCOC1CCCCC1=O 34a_100000042726_100000754470 [0,0,0,1,0,0|1,0,2]=4 8220 B15R1.220 CCCC#CCCOC1CCCCC1=O 7a_100000042726_100000204591 [0,0,0,1,0,0|1,0,2]=4 8221 B15R1.220 CCCC/C=C/COC1CCCCC1=O 34a_200016272032_100000754470 [0,0,0,1,0,0|1,0,2]=4 8222 B15R1.220 CCCC/C=C/COC1CCCCC1=O 7a_200016272032_100000204591 [0,0,0,1,0,0|1,0,2]=4 8223 B15R1.220 CCCCC#CCOC1CCCCC1=O 34a_200000034558_100000754470 [0,0,0,1,0,0|1,0,2]=4 8224 B15R1.220 CCCCC#CCOC1CCCCC1=O 7a_200000034558_100000204591 [0,0,0,1,0,0|1,0,2]=4 8225 B15R1.220 CCCCCCCCN1CCCCC1C 2230a_100000211376_100000210759 [0,0,0,1,0,0|2,0,1]=4 8226 B15R1.220 CCCCCCCCN1CCCCC1C 269982a_100000211376_100000210759 [0,0,0,1,0,0|2,0,1]=4 8227 B15R1.220 CCCCCCCCN1CCCCC1C 34a_100000211376_100000210759 [0,0,0,1,0,0|2,0,1]=4 8228 B15R1.220 CCCCCCCNC1CCCCC1C 2230a_100000211402_100000210681 [0,0,0,1,0,0|2,0,1]=4 8229 B15R1.220 CCCCCCCNC1CCCCC1C 269862a_100000229938_100000210921 [0,0,0,1,0,0|2,0,1]=4 8230 B15R1.220 CCCCCCCNC1CCCCC1C 270004a_100000229938_100000210921 [0,0,0,1,0,0|2,0,1]=4 8231 B15R1.220 CCCCCCCNC1CCCCC1C 34a_100000211402_100000210614 [0,0,0,1,0,0|2,0,1]=4 8232 B15R1.220 CCCCCCCNC1CCCNC1=O 2230a_100000229938_100000687798 [0,0,0,1,0,0|2,0,0]=3 8233 B15R1.220 CCCCCCCNC1CCCNC1=O 2230a_100000747585_100000210681 [0,0,0,1,0,0|2,0,0]=3 8234 B15R1.220 CCCCCCCNC1CCCNC1=O 34a_100000747585_100000210614 [0,0,0,1,0,0|2,0,0]=3 8235 B15R1.220 CCCCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000210681 [0,0,0,1,0,0|2,0,1]=4 8236 B15R1.220 CCCCCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000210614 [0,0,0,1,0,0|2,0,1]=4 8237 B15R1.220 CCCCCCCOC1CCCCC1=O 34a_100000210272_100000754470 [0,0,0,1,0,0|1,0,0]=2 8238 B15R1.220 CCCCCCCOC1CCCCC1=O 34a_100011214950_100000210614 [0,0,0,1,0,0|1,0,0]=2 8239 B15R1.220 CCCCCCCOC1CCCCC1=O 7a_100000210272_100000204591 [0,0,0,1,0,0|1,0,0]=2 8240 B15R1.220 CCCCCCCOC1CCCCC1C 34a_100000211207_100000210614 [0,0,0,1,0,0|2,0,1]=4 8241 B15R1.220 CCCCCCCOC1CCCCC1C 7a_100000211207_100000210614 [0,0,0,1,0,0|2,0,1]=4 8242 B15R1.220 CCCCCCCOC1CCCCC1Cl 34a_100000038908_100000210614 [0,0,0,1,0,0|2,0,1]=4 8243 B15R1.220 CCCCCCCOC1CCCCC1Cl 7a_100000038908_100000210614 [0,0,0,1,0,0|2,0,1]=4 8244 B15R1.220 CCCCCCCOC1CCCCC1F 34a_100000210272_100015423560 [0,0,0,1,0,0|2,0,1]=4 8245 B15R1.220 CCCCCCCOC1CCCCC1O 34a_100000210272_100000038908 [0,0,0,1,0,0|1,0,2]=4 8246 B15R1.220 CCCCCCCOC1CCCNC1=O 34a_100000073722_100000210614 [0,0,0,1,0,0|2,0,0]=3 8247 B15R1.220 CCCCCCCOC1CCCNC1=O 34a_100000210272_100000687798 [0,0,0,1,0,0|2,0,0]=3 8248 B15R1.220 CCCCCCCOC1CCCNC1=O 7a_100000210272_100000687798 [0,0,0,1,0,0|2,0,0]=3 8249 B15R1.220 CCCCCCCOC1COCCC1=O 34a_100000210272_100012180262 [0,0,0,1,0,0|2,0,0]=3 8250 B15R1.220 CCCCCCCOC1COCCC1=O 7a_100000210272_100012180262 [0,0,0,1,0,0|2,0,0]=3 8251 B15R1.220 CCCCCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000210614 [0,0,0,1,0,0|2,0,1]=4 8252 B15R1.220 CCCCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000210614 [0,0,0,1,0,0|2,0,1]=4 8253 B15R1.220 CCCCCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000210614 [0,0,0,1,0,0|2,0,1]=4 8254 B15R1.220 CCCCCCCSC1CCCCC1=O 62a_100000204591_100000210316 [0,0,0,1,0,0|1,0,0]=2 8255 B15R1.220 CCCCCCCSC1CCCCC1=O 62a_100000210614_100000204591 [0,0,0,1,0,0|1,0,0]=2 8256 B15R1.220 CCCCCCCSC1CCCCC1F 62a_100000210614_100015423560 [0,0,0,1,0,0|2,0,1]=4 8257 B15R1.220 CCCCCCCSC1CCCCC1F 62a_100015423560_100000210316 [0,0,0,1,0,0|2,0,1]=4 8258 B15R1.220 CCCCCCCSC1CCCCC1O 62a_100000038908_100000210316 [0,0,0,1,0,0|1,0,2]=4 8259 B15R1.220 CCCCCCCSC1CCCCC1O 62a_100000210614_100000038908 [0,0,0,1,0,0|1,0,2]=4 8260 B15R1.220 CCCCCCCSC1CCCNC1=O 62a_100000210614_100000687798 [0,0,0,1,0,0|2,0,0]=3 8261 B15R1.220 CCCCCCCSC1CCCNC1=O 62a_100000687798_100000210316 [0,0,0,1,0,0|2,0,0]=3 8262 B15R1.220 CCCCCCCSC1COCCC1=O 62a_100000210614_100012180262 [0,0,0,1,0,0|2,0,0]=3 8263 B15R1.220 CCCCCCCSC1COCCC1=O 62a_100012180262_100000210316 [0,0,0,1,0,0|2,0,0]=3 8264 B15R1.220 CCCCCCNCC1CCCCC1O 34a_100011216029_100000210314 [0,0,0,1,0,0|1,0,2]=4 8265 B15R1.220 CCCCCCNCC1CCCCN1C 34a_100011228421_100000210314 [0,0,0,1,0,0|3,0,0]=4 8266 B15R1.220 CCCCCCOCC1CCCCC1=O 34a_100009861125_100000210314 [0,0,0,1,0,0|1,0,0]=2 8267 B15R1.220 CCCCCCOCC1CCCCC1=O 7a_100009861125_100000210314 [0,0,0,1,0,0|1,0,0]=2 8268 B15R1.220 CCCCCCOCC1CCCCN1C 34a_100000210259_100015186950 [0,0,0,1,0,0|3,0,0]=4 8269 B15R1.220 CCCCCCOCC1CCCCN1C 34a_100000225079_100000210314 [0,0,0,1,0,0|3,0,0]=4 8270 B15R1.220 CCCCCCOCC1CCCCN1C 7a_100000210259_100015185383 [0,0,0,1,0,0|3,0,0]=4 8271 B15R1.220 CCCCCCSCC1CCCCN1C 62a_100000210314_100015185383 [0,0,0,1,0,0|3,0,0]=4 8272 B15R1.220 CCCCCCSCC1CCCCN1C 62a_100015185383_100000210757 [0,0,0,1,0,0|3,0,0]=4 8273 B15R1.220 CCCCCNCCC1CCCCN1C 2230a_100000209983_100000211948 [0,0,0,1,0,0|3,0,0]=4 8274 B15R1.220 CCCCCNCCN1CCCCC1=O 2230a_100160573077_100000210326 [0,0,0,1,0,0|2,0,0]=3 8275 B15R1.220 CCCCCNCCN1CCCCC1=O 34a_100160573077_100000718602 [0,0,0,1,0,0|2,0,0]=3 8276 B15R1.220 CCCCCOCCC1CCCCN1C 34a_100000210253_100000211948 [0,0,0,1,0,0|3,0,0]=4 8277 B15R1.220 CCCCCOCCC1CCCCN1C 7a_100000210253_100000211948 [0,0,0,1,0,0|3,0,0]=4 8278 B15R1.220 CCCCCOCCC1NCCNC1=O 34a_100000044719_100000718602 [0,0,0,1,0,0|3,0,0]=4 8279 B15R1.220 CCCCCSCCC1CCCCN1C 62a_100000210326_100000211948 [0,0,0,1,0,0|3,0,0]=4 8280 B15R1.220 CCCCCSCCC1CCCCN1C 62a_100000211948_100000210326 [0,0,0,1,0,0|3,0,0]=4 8281 B15R1.220 CCCCOCCNC1CCCNC1=O 2230a_100000747585_100000743108 [0,0,0,1,0,0|3,0,0]=4 8282 B15R1.220 CCCCOCCNC1CCCNC1=O 34a_100000747585_100000743108 [0,0,0,1,0,0|3,0,0]=4 8283 B15R1.220 CCCCOCCOC1CCCCC1=O 34a_100000210238_100000754470 [0,0,0,1,0,0|2,0,0]=3 8284 B15R1.220 CCCCOCCOC1CCCCC1=O 34a_100011214950_100000743108 [0,0,0,1,0,0|2,0,0]=3 8285 B15R1.220 CCCCOCCOC1CCCCC1=O 7a_100000210238_100000204591 [0,0,0,1,0,0|2,0,0]=3 8286 B15R1.220 CCCCOCCOC1CCCNC1=O 34a_100000073722_100000743108 [0,0,0,1,0,0|3,0,0]=4 8287 B15R1.220 CCCCOCCOC1CCCNC1=O 34a_100000210238_100000687798 [0,0,0,1,0,0|3,0,0]=4 8288 B15R1.220 CCCCOCCOC1CCCNC1=O 7a_100000210238_100000687798 [0,0,0,1,0,0|3,0,0]=4 8289 B15R1.220 CCCCOCCOC1COCCC1=O 34a_100000210238_100012180262 [0,0,0,1,0,0|3,0,0]=4 8290 B15R1.220 CCCCOCCOC1COCCC1=O 7a_100000210238_100012180262 [0,0,0,1,0,0|3,0,0]=4 8291 B15R1.220 CCCCOCCSC1CCCCC1=O 62a_100000204591_100000743108 [0,0,0,1,0,0|2,0,0]=3 8292 B15R1.220 CCCCOCCSC1CCCCC1=O 62a_100000743108_100000204591 [0,0,0,1,0,0|2,0,0]=3 8293 B15R1.220 CCCCOCCSC1CCCNC1=O 62a_100000687798_100000743108 [0,0,0,1,0,0|3,0,0]=4 8294 B15R1.220 CCCCOCCSC1CCCNC1=O 62a_100000743108_100000687798 [0,0,0,1,0,0|3,0,0]=4 8295 B15R1.220 CCCCOCCSC1COCCC1=O 62a_100000743108_100012180262 [0,0,0,1,0,0|3,0,0]=4 8296 B15R1.220 CCCCOCCSC1COCCC1=O 62a_100012180262_100000743108 [0,0,0,1,0,0|3,0,0]=4 8297 B15R1.220 CCCCOCOCC1CCCCC1=O 34a_100009861125_100011995733 [0,0,0,1,0,0|2,0,0]=3 8298 B15R1.220 CCCCSCCNC1CCCNC1=O 2230a_100025743550_100000687798 [0,0,0,1,0,0|3,0,0]=4 8299 B15R1.220 CCCCSCCOC1CCCCC1=O 34a_200000230436_100000754470 [0,0,0,1,0,0|2,0,0]=3 8300 B15R1.220 CCCCSCCOC1CCCCC1=O 7a_200000230436_100000204591 [0,0,0,1,0,0|2,0,0]=3 8301 B15R1.220 CCCCSCCOC1CCCNC1=O 34a_200000230436_100000687798 [0,0,0,1,0,0|3,0,0]=4 8302 B15R1.220 CCCCSCCOC1CCCNC1=O 7a_200000230436_100000687798 [0,0,0,1,0,0|3,0,0]=4 8303 B15R1.220 CCCCSCCOC1COCCC1=O 34a_200000230436_100012180262 [0,0,0,1,0,0|3,0,0]=4 8304 B15R1.220 CCCCSCCOC1COCCC1=O 7a_200000230436_100012180262 [0,0,0,1,0,0|3,0,0]=4 8305 B15R1.220 CCCOCCCNC1CCCCC1=O 34a_100011217757_100000754470 [0,0,0,1,0,0|2,0,0]=3 8306 B15R1.220 CCCOCCCNC1CCCNC1=O 2230a_100011217757_100000687798 [0,0,0,1,0,0|3,0,0]=4 8307 B15R1.220 CCCOCCCNC1CCCNC1=O 34a_100011217757_100000687798 [0,0,0,1,0,0|3,0,0]=4 8308 B15R1.220 CCCOCCCNC1COCCC1=O 34a_100011217757_100012180262 [0,0,0,1,0,0|3,0,0]=4 8309 B15R1.220 CCCOCCOCC1CCCCC1=O 34a_100009861125_100011215938 [0,0,0,1,0,0|2,0,0]=3 8310 B15R1.220 CCCOCCOCC1CCCCC1=O 7a_100009861125_100011215938 [0,0,0,1,0,0|2,0,0]=3 8311 B15R1.220 CCOCCCOCC1CCCCC1=O 34a_100009861125_100012232248 [0,0,0,1,0,0|2,0,0]=3 8312 B15R1.220 CCOCCCOCC1CCCCC1=O 7a_100009861125_100012232248 [0,0,0,1,0,0|2,0,0]=3 8313 B15R1.220 CCOCCNCCN1CCCCC1=O 2230a_100160573077_100011215890 [0,0,0,1,0,0|3,0,0]=4 8314 B15R1.220 CCOCCNCCN1CCCCC1=O 34a_100160573077_100000210147 [0,0,0,1,0,0|3,0,0]=4 8315 B15R1.220 CCSCCNCCN1CCCCC1=O 2230a_100160573077_100000757381 [0,0,0,1,0,0|3,0,0]=4 8316 B15R1.220 CCSCCNCCN1CCCCC1=O 34a_100160573077_100000757381 [0,0,0,1,0,0|3,0,0]=4 8317 B15R1.220 CN1CCCCC1CCSCCCC=O 62a_100000211948_200011292268 [0,0,0,1,0,0|2,0,0]=3 8318 B15R1.220 CN1CCCCC1CCSCCCC=O 62a_200011292268_100000211948 [0,0,0,1,0,0|2,0,0]=3 8319 B15R1.220 CN1CCCCC1CSCCCCC=O 62a_100000139335_100015185383 [0,0,0,1,0,0|2,0,0]=3 8320 B15R1.220 CN1CCCCC1CSCCCCC=O 62a_100015185383_100000139335 [0,0,0,1,0,0|2,0,0]=3 8321 B15R1.220 CNCCCCCOC1CCCCC1=O 34a_100000722520_100000754470 [0,0,0,1,0,0|2,0,0]=3 8322 B15R1.220 CNCCCCCOC1CCCNC1=O 34a_100000722520_100000687798 [0,0,0,1,0,0|3,0,0]=4 8323 B15R1.220 CNCCCCCOC1COCCC1=O 34a_100000722520_100012180262 [0,0,0,1,0,0|3,0,0]=4 8324 B15R1.220 CNCCOCCOC1CCCCC1=O 34a_100000228057_100000754470 [0,0,0,1,0,0|3,0,0]=4 8325 B15R1.220 COCCCCCCN1CCCCC1C 2230a_100000211376_100011998445 [0,0,0,1,0,0|3,0,0]=4 8326 B15R1.220 COCCCCCCN1CCCCC1C 269982a_100000211376_100011998445 [0,0,0,1,0,0|3,0,0]=4 8327 B15R1.220 COCCCCCCN1CCCCC1C 34a_100000211376_100011998445 [0,0,0,1,0,0|3,0,0]=4 8328 B15R1.220 COCCCCCNC1CCCCC1=O 34a_100000747528_100000754470 [0,0,0,1,0,0|2,0,0]=3 8329 B15R1.220 COCCCCCNC1CCCCC1C 269862a_100000747528_100000210921 [0,0,0,1,0,0|3,0,0]=4 8330 B15R1.220 COCCCCCNC1CCCCC1C 270004a_100000747528_100000210921 [0,0,0,1,0,0|3,0,0]=4 8331 B15R1.220 COCCCCCNC1CCCNC1=O 2230a_100000747528_100000687798 [0,0,0,1,0,0|3,0,0]=4 8332 B15R1.220 COCCCCCNC1CCCNC1=O 34a_100000747528_100000687798 [0,0,0,1,0,0|3,0,0]=4 8333 B15R1.220 COCCCCCNC1COCCC1=O 34a_100000747528_100012180262 [0,0,0,1,0,0|3,0,0]=4 8334 B15R1.220 COCCCCOCC1CCCCC1=O 34a_100009861125_100000755781 [0,0,0,1,0,0|2,0,0]=3 8335 B15R1.220 COCCCCOCC1CCCCC1=O 7a_100009861125_100000730899 [0,0,0,1,0,0|2,0,0]=3 8336 B15R1.220 COCCCNCCN1CCCCC1=O 2230a_100160573077_100000740836 [0,0,0,1,0,0|3,0,0]=4 8337 B15R1.220 COCCCNCCN1CCCCC1=O 34a_100160573077_100000740836 [0,0,0,1,0,0|3,0,0]=4 8338 B15R1.220 COCCOCCNC1CCCCC1=O 34a_100000745349_100000754470 [0,0,0,1,0,0|3,0,0]=4 8339 B15R1.220 COCCOCCOC1CCCCC1=O 34a_100011214950_100000695917 [0,0,0,1,0,0|3,0,0]=4 8340 B15R1.220 COCCOCCOC1CCCCC1=O 34a_100011215163_100000754470 [0,0,0,1,0,0|3,0,0]=4 8341 B15R1.220 COCCOCCOC1CCCCC1=O 7a_100011215163_100000204591 [0,0,0,1,0,0|3,0,0]=4 8342 B15R1.220 COCCOCCSC1CCCCC1=O 62a_100000204591_100000695917 [0,0,0,1,0,0|3,0,0]=4 8343 B15R1.220 COCCOCCSC1CCCCC1=O 62a_100000695917_100000204591 [0,0,0,1,0,0|3,0,0]=4 8344 B15R1.220 N#CCCCCCSC1CCCCC1=O 62a_100000204591_100009813376 [0,0,0,1,0,0|2,0,1]=4 8345 B15R1.220 N#CCCCCCSC1CCCCC1=O 62a_100009813376_100000204591 [0,0,0,1,0,0|2,0,1]=4 8346 B15R1.220 N#CCCCCOCC1CCCCC1=O 7a_100009861125_100000211819 [0,0,0,1,0,0|2,0,1]=4 8347 B15R1.220 NCCCCCCOC1CCCCC1=O 34a_100000686447_100000754470 [0,0,0,1,0,0|2,0,0]=3 8348 B15R1.220 NCCCCCCOC1CCCNC1=O 34a_100000686447_100000687798 [0,0,0,1,0,0|3,0,0]=4 8349 B15R1.220 NCCCCCCOC1COCCC1=O 34a_100000686447_100012180262 [0,0,0,1,0,0|3,0,0]=4 8350 B15R1.220 O=C1CCCCC1COCCCCCF 34a_100009861125_100000729378 [0,0,0,1,0,0|2,0,0]=3 8351 B15R1.220 O=C1CCCCC1COCCCCCF 7a_100009861125_100000729378 [0,0,0,1,0,0|2,0,0]=3 8352 B15R1.220 O=C1CCCCC1COCCCCCO 34a_100009861125_100000746330 [0,0,0,1,0,0|2,0,0]=3 8353 B15R1.220 O=C1CCCCC1COCCCCCO 7a_100009861125_100000746330 [0,0,0,1,0,0|2,0,0]=3 8354 B15R1.220 O=C1CCCCC1COCCOCCO 34a_100009861125_100000692535 [0,0,0,1,0,0|3,0,0]=4 8355 B15R1.220 O=C1CCCCC1COCCOCCO 7a_100009861125_100011215305 [0,0,0,1,0,0|3,0,0]=4 8356 B15R1.220 O=C1CCCCC1NCCCCCCO 34a_100000686447_100000754470 [0,0,0,1,0,0|2,0,0]=3 8357 B15R1.220 O=C1CCCCC1OCCCCCCBr 34a_100011215345_100000754470 [0,0,0,1,0,0|2,0,0]=3 8358 B15R1.220 O=C1CCCCC1OCCCCCCBr 7a_100011215345_100000204591 [0,0,0,1,0,0|2,0,0]=3 8359 B15R1.220 O=C1CCCCC1OCCCCCCCl 34a_100000766143_100000754470 [0,0,0,1,0,0|2,0,0]=3 8360 B15R1.220 O=C1CCCCC1OCCCCCCCl 7a_100000766143_100000204591 [0,0,0,1,0,0|2,0,0]=3 8361 B15R1.220 O=C1CCCCC1OCCCCCCF 34a_100000732779_100000754470 [0,0,0,1,0,0|2,0,0]=3 8362 B15R1.220 O=C1CCCCC1OCCCCCCF 34a_100011214950_100015922095 [0,0,0,1,0,0|2,0,0]=3 8363 B15R1.220 O=C1CCCCC1OCCCCCCF 7a_100000732779_100000204591 [0,0,0,1,0,0|2,0,0]=3 8364 B15R1.220 O=C1CCCCC1OCCCCCCO 34a_100011214950_100000766143 [0,0,0,1,0,0|2,0,0]=3 8365 B15R1.220 O=C1CCCCC1SCCCCCCF 62a_100000204591_100015922095 [0,0,0,1,0,0|2,0,0]=3 8366 B15R1.220 O=C1CCCCC1SCCCCCCF 62a_100015922095_100000204591 [0,0,0,1,0,0|2,0,0]=3 8367 B15R1.220 O=C1CCCCC1SCCCCCCO 62a_100000204591_100000766143 [0,0,0,1,0,0|2,0,0]=3 8368 B15R1.220 O=C1CCCCC1SCCCCCCO 62a_100000766143_100000204591 [0,0,0,1,0,0|2,0,0]=3 8369 B15R1.220 O=C1CCCCN1CCNCCCCF 2230a_100160573077_100000729493 [0,0,0,1,0,0|3,0,0]=4 8370 B15R1.220 O=C1CCCCN1CCNCCCCF 34a_100160573077_100000729493 [0,0,0,1,0,0|3,0,0]=4 8371 B15R1.220 O=C1CCCCN1CCNCCCCO 2230a_100160573077_100000210776 [0,0,0,1,0,0|3,0,0]=4 8372 B15R1.220 O=C1CCCCN1CCNCCCCO 34a_100160573077_100011216708 [0,0,0,1,0,0|3,0,0]=4 8373 B15R1.220 O=C1CCOCC1NCCCCCCO 34a_100000686447_100012180262 [0,0,0,1,0,0|3,0,0]=4 8374 B15R1.220 O=C1CCOCC1OCCCCCCBr 34a_100011215345_100012180262 [0,0,0,1,0,0|3,0,0]=4 8375 B15R1.220 O=C1CCOCC1OCCCCCCBr 7a_100011215345_100012180262 [0,0,0,1,0,0|3,0,0]=4 8376 B15R1.220 O=C1CCOCC1OCCCCCCCl 34a_100000766143_100012180262 [0,0,0,1,0,0|3,0,0]=4 8377 B15R1.220 O=C1CCOCC1OCCCCCCCl 7a_100000766143_100012180262 [0,0,0,1,0,0|3,0,0]=4 8378 B15R1.220 O=C1CCOCC1OCCCCCCF 34a_100000732779_100012180262 [0,0,0,1,0,0|3,0,0]=4 8379 B15R1.220 O=C1CCOCC1OCCCCCCF 7a_100000732779_100012180262 [0,0,0,1,0,0|3,0,0]=4 8380 B15R1.220 O=C1CCOCC1SCCCCCCF 62a_100012180262_100015922095 [0,0,0,1,0,0|3,0,0]=4 8381 B15R1.220 O=C1CCOCC1SCCCCCCF 62a_100015922095_100012180262 [0,0,0,1,0,0|3,0,0]=4 8382 B15R1.220 O=C1CCOCC1SCCCCCCO 62a_100000766143_100012180262 [0,0,0,1,0,0|3,0,0]=4 8383 B15R1.220 O=C1CCOCC1SCCCCCCO 62a_100012180262_100000766143 [0,0,0,1,0,0|3,0,0]=4 8384 B15R1.220 O=C1NCCCC1NCCCCCCF 2230a_100000747585_100015922095 [0,0,0,1,0,0|3,0,0]=4 8385 B15R1.220 O=C1NCCCC1NCCCCCCF 34a_100000747585_100015922095 [0,0,0,1,0,0|3,0,0]=4 8386 B15R1.220 O=C1NCCCC1NCCCCCCO 2230a_100000686447_100000687798 [0,0,0,1,0,0|3,0,0]=4 8387 B15R1.220 O=C1NCCCC1NCCCCCCO 2230a_100000747585_100000766143 [0,0,0,1,0,0|3,0,0]=4 8388 B15R1.220 O=C1NCCCC1NCCCCCCO 34a_100000686447_100000687798 [0,0,0,1,0,0|3,0,0]=4 8389 B15R1.220 O=C1NCCCC1NCCCCCCO 34a_100000747585_100000766143 [0,0,0,1,0,0|3,0,0]=4 8390 B15R1.220 O=C1NCCCC1OCCCCCCBr 34a_100011215345_100000687798 [0,0,0,1,0,0|3,0,0]=4 8391 B15R1.220 O=C1NCCCC1OCCCCCCBr 7a_100011215345_100000687798 [0,0,0,1,0,0|3,0,0]=4 8392 B15R1.220 O=C1NCCCC1OCCCCCCCl 34a_100000766143_100000687798 [0,0,0,1,0,0|3,0,0]=4 8393 B15R1.220 O=C1NCCCC1OCCCCCCCl 7a_100000766143_100000687798 [0,0,0,1,0,0|3,0,0]=4 8394 B15R1.220 O=C1NCCCC1OCCCCCCF 34a_100000073722_100015922095 [0,0,0,1,0,0|3,0,0]=4 8395 B15R1.220 O=C1NCCCC1OCCCCCCF 34a_100000732779_100000687798 [0,0,0,1,0,0|3,0,0]=4 8396 B15R1.220 O=C1NCCCC1OCCCCCCF 7a_100000732779_100000687798 [0,0,0,1,0,0|3,0,0]=4 8397 B15R1.220 O=C1NCCCC1OCCCCCCO 34a_100000073722_100000766143 [0,0,0,1,0,0|3,0,0]=4 8398 B15R1.220 O=C1NCCCC1SCCCCCCF 62a_100000687798_100015922095 [0,0,0,1,0,0|3,0,0]=4 8399 B15R1.220 O=C1NCCCC1SCCCCCCF 62a_100015922095_100000687798 [0,0,0,1,0,0|3,0,0]=4 8400 B15R1.220 O=C1NCCCC1SCCCCCCO 62a_100000687798_100000766143 [0,0,0,1,0,0|3,0,0]=4 8401 B15R1.220 O=C1NCCCC1SCCCCCCO 62a_100000766143_100000687798 [0,0,0,1,0,0|3,0,0]=4 8402 B15R1.220 O=CCCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000139337 [0,0,0,1,0,0|2,0,0]=3 8403 B15R1.220 O=CCCCCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100000139337 [0,0,0,1,0,0|3,0,0]=4 8404 B15R1.220 O=CCCCCCN[C@H]1CCOC[C@@H]1F 2230a_100016994078_100000139337 [0,0,0,1,0,0|3,0,0]=4 8405 B15R1.220 O=CCCCCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000139337 [0,0,0,1,0,0|3,0,0]=4 8406 B15R1.220 O=CCCCCCOC1CCCCC1Cl 7a_100000038908_100000139337 [0,0,0,1,0,0|2,0,0]=3 8407 B15R1.220 O=CCCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000139337 [0,0,0,1,0,0|2,0,0]=3 8408 B15R1.220 O=CCCCCCSC1CCCCC1=O 62a_100000139337_100000204591 [0,0,0,1,0,0|2,0,1]=4 8409 B15R1.220 O=CCCCCCSC1CCCCC1=O 62a_100000204591_100000139337 [0,0,0,1,0,0|2,0,1]=4 8410 B15R1.220 O=CCCCCCSC1CCCCC1F 62a_100000139337_100015423560 [0,0,0,1,0,0|2,0,0]=3 8411 B15R1.220 O=CCCCCCSC1CCCCC1F 62a_100015423560_100000139337 [0,0,0,1,0,0|2,0,0]=3 8412 B15R1.220 O=CCCCCCSC1CCCCC1O 62a_100000038908_100000139337 [0,0,0,1,0,0|2,0,0]=3 8413 B15R1.220 O=CCCCCCSC1CCCCC1O 62a_100000139337_100000038908 [0,0,0,1,0,0|2,0,0]=3 8414 B15R1.220 O=CCCCCOCC1CCCCC1=O 7a_100009861125_100000139335 [0,0,0,1,0,0|2,0,1]=4 8415 B15R1.228 C#CCCCCCCCOCC1CC1C 34a_100000744939_100153394163 [0,0,0,1,0,0|2,0,1]=4 8416 B15R1.228 C#CCCCCCCCOCC1CC1C 7a_100000744939_100153394163 [0,0,0,1,0,0|2,0,1]=4 8417 B15R1.228 C=CCCCCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100011933949 [0,0,0,1,0,0|3,0,0]=4 8418 B15R1.228 C=CCCCCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100011933949 [0,0,0,1,0,0|3,0,0]=4 8419 B15R1.228 C=CCCCCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100011933949 [0,0,0,1,0,0|3,0,0]=4 8420 B15R1.228 C=CCCCCCCCOCC1CC1C 34a_100000744939_100012355270 [0,0,0,1,0,0|2,0,0]=3 8421 B15R1.228 C=CCCCCCCCOCC1CC1C 7a_100000744939_100012355270 [0,0,0,1,0,0|2,0,0]=3 8422 B15R1.228 CC1CC1COCCCCCCCCO 34a_100000744939_100000033203 [0,0,0,1,0,0|1,0,2]=4 8423 B15R1.228 CC1CC1COCCCCCCCCO 7a_100000744939_100000033203 [0,0,0,1,0,0|1,0,2]=4 8424 B15R1.228 CCCCCCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100000210320 [0,0,0,1,0,0|2,0,1]=4 8425 B15R1.228 CCCCCCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100000210320 [0,0,0,1,0,0|2,0,1]=4 8426 B15R1.228 CCCCCCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100000210320 [0,0,0,1,0,0|2,0,1]=4 8427 B15R1.228 CCCCCCCCCOCC1CC1C 34a_100000744939_100011214924 [0,0,0,1,0,0|2,0,1]=4 8428 B15R1.228 CCCCCCCCCOCC1CC1C 7a_100000744939_100000210328 [0,0,0,1,0,0|2,0,1]=4 8429 B15R1.229 BrCCCCCCCCCOC1CCC1 34a_100009813782_100000749161 [0,0,0,1,0,0|2,0,1]=4 8430 B15R1.229 BrCCCCCCCCOCC1CCC1 34a_100009813846_100000763275 [0,0,0,1,0,0|2,0,1]=4 8431 B15R1.229 BrCCCCCCCCOCC1CCC1 7a_100009813846_100000763275 [0,0,0,1,0,0|2,0,1]=4 8432 B15R1.229 C#CCCCCCCCCOC1CCC1 34a_100000065265_100000749161 [0,0,0,1,0,0|2,0,1]=4 8433 B15R1.229 C#CCCCCCCCNCC1CCC1 2230a_100000738700_100153394163 [0,0,0,1,0,0|2,0,1]=4 8434 B15R1.229 C#CCCCCCCCNCC1CCC1 34a_100000738700_100153394163 [0,0,0,1,0,0|2,0,1]=4 8435 B15R1.229 C#CCCCCCCCOCC1CCC1 34a_100000054614_100000763275 [0,0,0,1,0,0|2,0,1]=4 8436 B15R1.229 C#CCCCCCCCOCC1CCC1 34a_100000760304_100153394163 [0,0,0,1,0,0|2,0,1]=4 8437 B15R1.229 C#CCCCCCCCOCC1CCC1 7a_100000054614_100000763275 [0,0,0,1,0,0|2,0,1]=4 8438 B15R1.229 C#CCCCCCCCSCC1CCC1 62a_100000763275_100153394163 [0,0,0,1,0,0|2,0,1]=4 8439 B15R1.229 C#CCCCCCCCSCC1CCC1 62a_100153394163_100000763275 [0,0,0,1,0,0|2,0,1]=4 8440 B15R1.229 C=CCCCCCCCCCN1CCC1 269982a_100000754969_100009814027 [0,0,0,1,0,0|2,0,0]=3 8441 B15R1.229 C=CCCCCCCCCNC1CCC1 2230a_100000749019_100011933949 [0,0,0,1,0,0|2,0,0]=3 8442 B15R1.229 C=CCCCCCCCCNC1CCC1 34a_100000749019_100011933949 [0,0,0,1,0,0|2,0,0]=3 8443 B15R1.229 C=CCCCCCCCCNC1COC1 2230a_100016991112_100011933949 [0,0,0,1,0,0|3,0,0]=4 8444 B15R1.229 C=CCCCCCCCCOC1CCC1 34a_100000748187_100011933949 [0,0,0,1,0,0|2,0,0]=3 8445 B15R1.229 C=CCCCCCCCCOC1CCC1 34a_100011215194_100000749161 [0,0,0,1,0,0|2,0,0]=3 8446 B15R1.229 C=CCCCCCCCCOC1COC1 34a_100011215194_100009818527 [0,0,0,1,0,0|3,0,0]=4 8447 B15R1.229 C=CCCCCCCCCOC1COC1 7a_100011215194_100009818527 [0,0,0,1,0,0|3,0,0]=4 8448 B15R1.229 C=CCCCCCCCCOC1CSC1 7a_100000072292_100011933949 [0,0,0,1,0,0|3,0,0]=4 8449 B15R1.229 C=CCCCCCCCCSC1CCC1 62a_100011933949_100000749161 [0,0,0,1,0,0|2,0,0]=3 8450 B15R1.229 C=CCCCCCCCCSC1COC1 62a_100011933949_100009818527 [0,0,0,1,0,0|3,0,0]=4 8451 B15R1.229 C=CCCCCCCCNCC1CCC1 2230a_100000738700_100012355270 [0,0,0,1,0,0|2,0,0]=3 8452 B15R1.229 C=CCCCCCCCNCC1CCC1 34a_100000738700_100012355270 [0,0,0,1,0,0|2,0,0]=3 8453 B15R1.229 C=CCCCCCCCNCC1COC1 2230a_100015281925_100012355270 [0,0,0,1,0,0|3,0,0]=4 8454 B15R1.229 C=CCCCCCCCNCC1COC1 34a_100015281925_100012355270 [0,0,0,1,0,0|3,0,0]=4 8455 B15R1.229 C=CCCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100012355270 [0,0,0,1,0,0|3,0,0]=4 8456 B15R1.229 C=CCCCCCCCNC[C@@H]1CCO1 34a_100020831831_100012355270 [0,0,0,1,0,0|3,0,0]=4 8457 B15R1.229 C=CCCCCCCCOCC1CCC1 34a_100000730831_100000763275 [0,0,0,1,0,0|2,0,0]=3 8458 B15R1.229 C=CCCCCCCCOCC1CCC1 34a_100000760304_100012355270 [0,0,0,1,0,0|2,0,0]=3 8459 B15R1.229 C=CCCCCCCCOCC1CCC1 7a_100000730831_100000763275 [0,0,0,1,0,0|2,0,0]=3 8460 B15R1.229 C=CCCCCCCCOCC1CCO1 34a_100000039022_100012355270 [0,0,0,1,0,0|3,0,0]=4 8461 B15R1.229 C=CCCCCCCCOCC1CCO1 34a_100000730831_100000103362 [0,0,0,1,0,0|3,0,0]=4 8462 B15R1.229 C=CCCCCCCCOCC1CCO1 7a_100000730831_100000103362 [0,0,0,1,0,0|3,0,0]=4 8463 B15R1.229 C=CCCCCCCCOCC1CNC1 34a_100016987283_100012355270 [0,0,0,1,0,0|3,0,0]=4 8464 B15R1.229 C=CCCCCCCCOCC1COC1 34a_100000060846_100012355270 [0,0,0,1,0,0|3,0,0]=4 8465 B15R1.229 C=CCCCCCCCOCC1COC1 34a_100000730831_100010264016 [0,0,0,1,0,0|3,0,0]=4 8466 B15R1.229 C=CCCCCCCCOCC1COC1 7a_100000730831_100010264016 [0,0,0,1,0,0|3,0,0]=4 8467 B15R1.229 C=CCCCCCCCSCC1CCC1 62a_100000763275_100012355270 [0,0,0,1,0,0|2,0,0]=3 8468 B15R1.229 C=CCCCCCCCSCC1CCC1 62a_100012355270_100000763275 [0,0,0,1,0,0|2,0,0]=3 8469 B15R1.229 C=CCCCCCCCSCC1CCO1 62a_100000103362_100012355270 [0,0,0,1,0,0|3,0,0]=4 8470 B15R1.229 C=CCCCCCCCSCC1CCO1 62a_100012355270_100000103362 [0,0,0,1,0,0|3,0,0]=4 8471 B15R1.229 C=CCCCCCCCSCC1COC1 62a_100010264016_100012355270 [0,0,0,1,0,0|3,0,0]=4 8472 B15R1.229 C=CCCCCCCCSCC1COC1 62a_100012355270_100010264016 [0,0,0,1,0,0|3,0,0]=4 8473 B15R1.229 C=CCCCCCCOCCC1COC1 34a_100009855314_100011215473 [0,0,0,1,0,0|3,0,0]=4 8474 B15R1.229 CCCCCCCCCCCN1CCC1 269982a_100000754969_100011215454 [0,0,0,1,0,0|2,0,1]=4 8475 B15R1.229 CCCCCCCCCCNC1CCC1 2230a_100000749019_100000210320 [0,0,0,1,0,0|2,0,1]=4 8476 B15R1.229 CCCCCCCCCCNC1CCC1 270004a_100000684558_100000241760 [0,0,0,1,0,0|2,0,1]=4 8477 B15R1.229 CCCCCCCCCCNC1CCC1 34a_100000684558_100000749161 [0,0,0,1,0,0|2,0,1]=4 8478 B15R1.229 CCCCCCCCCCNC1CCC1 34a_100000749019_100000210320 [0,0,0,1,0,0|2,0,1]=4 8479 B15R1.229 CCCCCCCCCCNC1COC1 2230a_100016991112_100000210320 [0,0,0,1,0,0|3,0,0]=4 8480 B15R1.229 CCCCCCCCCCNC1COC1 34a_100000684558_100009818527 [0,0,0,1,0,0|3,0,0]=4 8481 B15R1.229 CCCCCCCCCCOC1CCC1 34a_100000210711_100000749161 [0,0,0,1,0,0|2,0,1]=4 8482 B15R1.229 CCCCCCCCCCOC1CCC1 34a_100000748187_100000210320 [0,0,0,1,0,0|2,0,1]=4 8483 B15R1.229 CCCCCCCCCCOC1COC1 34a_100000210711_100009818527 [0,0,0,1,0,0|3,0,0]=4 8484 B15R1.229 CCCCCCCCCCOC1COC1 7a_100000210711_100009818527 [0,0,0,1,0,0|3,0,0]=4 8485 B15R1.229 CCCCCCCCCCOC1CSC1 7a_100000072292_100000210320 [0,0,0,1,0,0|3,0,0]=4 8486 B15R1.229 CCCCCCCCCNCC1CCC1 2230a_100000212291_100000763275 [0,0,0,1,0,0|2,0,1]=4 8487 B15R1.229 CCCCCCCCCNCC1CCC1 2230a_100000738700_100011214924 [0,0,0,1,0,0|2,0,1]=4 8488 B15R1.229 CCCCCCCCCNCC1CCC1 269862a_100000212291_100000753134 [0,0,0,1,0,0|2,0,1]=4 8489 B15R1.229 CCCCCCCCCNCC1CCC1 34a_100000212291_100000763275 [0,0,0,1,0,0|2,0,1]=4 8490 B15R1.229 CCCCCCCCCNCC1CCC1 34a_100000738700_100011214924 [0,0,0,1,0,0|2,0,1]=4 8491 B15R1.229 CCCCCCCCCNCC1CCO1 2230a_100000212291_100000103362 [0,0,0,1,0,0|1,0,2]=4 8492 B15R1.229 CCCCCCCCCNCC1CCO1 34a_100000212291_100000103362 [0,0,0,1,0,0|1,0,2]=4 8493 B15R1.229 CCCCCCCCCNCC1COC1 2230a_100000212291_100010264016 [0,0,0,1,0,0|3,0,0]=4 8494 B15R1.229 CCCCCCCCCNCC1COC1 2230a_100015281925_100011214924 [0,0,0,1,0,0|3,0,0]=4 8495 B15R1.229 CCCCCCCCCNCC1COC1 34a_100000212291_100010264016 [0,0,0,1,0,0|3,0,0]=4 8496 B15R1.229 CCCCCCCCCNCC1COC1 34a_100015281925_100011214924 [0,0,0,1,0,0|3,0,0]=4 8497 B15R1.229 CCCCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100011214924 [0,0,0,1,0,0|1,0,2]=4 8498 B15R1.229 CCCCCCCCCNC[C@@H]1CCO1 34a_100020831831_100011214924 [0,0,0,1,0,0|1,0,2]=4 8499 B15R1.229 CCCCCCCCCOCC1CCC1 34a_100000210712_100000763275 [0,0,0,1,0,0|2,0,1]=4 8500 B15R1.229 CCCCCCCCCOCC1CCC1 34a_100000760304_100011214924 [0,0,0,1,0,0|2,0,1]=4 8501 B15R1.229 CCCCCCCCCOCC1CCC1 7a_100000210712_100000763275 [0,0,0,1,0,0|2,0,1]=4 8502 B15R1.229 CCCCCCCCCOCC1CCO1 34a_100000039022_100011214924 [0,0,0,1,0,0|1,0,2]=4 8503 B15R1.229 CCCCCCCCCOCC1CCO1 34a_100000210712_100000103362 [0,0,0,1,0,0|1,0,2]=4 8504 B15R1.229 CCCCCCCCCOCC1CCO1 7a_100000210712_100000103362 [0,0,0,1,0,0|1,0,2]=4 8505 B15R1.229 CCCCCCCCCOCC1CNC1 34a_100016987283_100011214924 [0,0,0,1,0,0|3,0,0]=4 8506 B15R1.229 CCCCCCCCCOCC1COC1 34a_100000060846_100011214924 [0,0,0,1,0,0|3,0,0]=4 8507 B15R1.229 CCCCCCCCCOCC1COC1 34a_100000210712_100010264016 [0,0,0,1,0,0|3,0,0]=4 8508 B15R1.229 CCCCCCCCCOCC1COC1 7a_100000210712_100010264016 [0,0,0,1,0,0|3,0,0]=4 8509 B15R1.229 CCCCCCCCCSCC1CCC1 62a_100000763275_100000210670 [0,0,0,1,0,0|2,0,1]=4 8510 B15R1.229 CCCCCCCCCSCC1CCO1 62a_100000103362_100000210670 [0,0,0,1,0,0|1,0,2]=4 8511 B15R1.229 CCCCCCCCCSCC1COC1 62a_100010264016_100000210670 [0,0,0,1,0,0|3,0,0]=4 8512 B15R1.229 CCCCCCCCOCCC1COC1 34a_100009855314_100000210759 [0,0,0,1,0,0|3,0,0]=4 8513 B15R1.229 ClCCCCCCCCCOC1CCC1 34a_100009868337_100000749161 [0,0,0,1,0,0|2,0,1]=4 8514 B15R1.229 ClCCCCCCCCOCC1CCC1 34a_100000033203_100000763275 [0,0,0,1,0,0|2,0,1]=4 8515 B15R1.229 ClCCCCCCCCOCC1CCC1 7a_100000033203_100000763275 [0,0,0,1,0,0|2,0,1]=4 8516 B15R1.229 NCCCCCCCCCOC1CCC1 34a_100000078944_100000749161 [0,0,0,1,0,0|2,0,1]=4 8517 B15R1.229 NCCCCCCCCOCC1CCC1 34a_102515433106_100000763275 [0,0,0,1,0,0|2,0,1]=4 8518 B15R1.229 OCCCCCCCCCCN1CCC1 269982a_100000754969_100009813290 [0,0,0,1,0,0|1,0,2]=4 8519 B15R1.229 OCCCCCCCCCNC1CCC1 2230a_100000749019_100009813782 [0,0,0,1,0,0|1,0,2]=4 8520 B15R1.229 OCCCCCCCCCNC1CCC1 270004a_100000078944_100000241760 [0,0,0,1,0,0|1,0,2]=4 8521 B15R1.229 OCCCCCCCCCNC1CCC1 34a_100000078944_100000749161 [0,0,0,1,0,0|1,0,2]=4 8522 B15R1.229 OCCCCCCCCCNC1CCC1 34a_100000749019_100009813782 [0,0,0,1,0,0|1,0,2]=4 8523 B15R1.229 OCCCCCCCCCOC1CCC1 34a_100000748187_100009813782 [0,0,0,1,0,0|1,0,2]=4 8524 B15R1.229 OCCCCCCCCCSC1CCC1 62a_100009813782_100000749161 [0,0,0,1,0,0|1,0,2]=4 8525 B15R1.229 OCCCCCCCCNCC1CCC1 2230a_100000738700_100000033203 [0,0,0,1,0,0|1,0,2]=4 8526 B15R1.229 OCCCCCCCCNCC1CCC1 2230a_102515433106_100000763275 [0,0,0,1,0,0|1,0,2]=4 8527 B15R1.229 OCCCCCCCCNCC1CCC1 269862a_102515433106_100000753134 [0,0,0,1,0,0|1,0,2]=4 8528 B15R1.229 OCCCCCCCCNCC1CCC1 34a_100000738700_100000033203 [0,0,0,1,0,0|1,0,2]=4 8529 B15R1.229 OCCCCCCCCNCC1CCC1 34a_102515433106_100000763275 [0,0,0,1,0,0|1,0,2]=4 8530 B15R1.229 OCCCCCCCCOCC1CCC1 34a_100000760304_100000033203 [0,0,0,1,0,0|1,0,2]=4 8531 B15R1.229 OCCCCCCCCSCC1CCC1 62a_100000033203_100000763275 [0,0,0,1,0,0|1,0,2]=4 8532 B15R1.229 OCCCCCCCCSCC1CCC1 62a_100000763275_100000033203 [0,0,0,1,0,0|1,0,2]=4 8533 B15R1.242 C#CCCCCN1CCCCC1CCC 2230a_100000701414_100010269958 [0,0,0,1,0,0|2,0,1]=4 8534 B15R1.242 C#CCCCCN1CCCCC1CCC 269982a_100000701414_100010269958 [0,0,0,1,0,0|2,0,1]=4 8535 B15R1.242 C#CCCCCN1CCCCC1CCC 34a_100000701414_100010269958 [0,0,0,1,0,0|2,0,1]=4 8536 B15R1.242 C#CCCCNC1CCCCC1CCC 270004a_100000718082_100011218038 [0,0,0,1,0,0|2,0,1]=4 8537 B15R1.242 C#CCCCOC1CCCCC1CCC 34a_100011217265_100000695029 [0,0,0,1,0,0|2,0,1]=4 8538 B15R1.242 C#CCCCOC1CCCCC1CCC 7a_100011217265_100011215417 [0,0,0,1,0,0|2,0,1]=4 8539 B15R1.242 C=CCC1CCCCC1NCCCCC 269862a_100000209983_100011214939 [0,0,0,1,0,0|2,0,0]=3 8540 B15R1.242 C=CCC1CCCCC1NCCCCC 270004a_100000209983_100011214939 [0,0,0,1,0,0|2,0,0]=3 8541 B15R1.242 C=CCC1CCCCC1NCCCCO 269862a_100000750430_100011214939 [0,0,0,1,0,0|3,0,0]=4 8542 B15R1.242 C=CCC1CCCCC1NCCCCO 270004a_100000750430_100011214939 [0,0,0,1,0,0|3,0,0]=4 8543 B15R1.242 C=CCC1CCCCC1NCCCOC 269862a_100150723488_100011214939 [0,0,0,1,0,0|3,0,0]=4 8544 B15R1.242 C=CCC1CCCCC1NCCCOC 270004a_100150723488_100011214939 [0,0,0,1,0,0|3,0,0]=4 8545 B15R1.242 C=CCC1CCCCC1NCCCSC 269862a_100000749238_100011214939 [0,0,0,1,0,0|3,0,0]=4 8546 B15R1.242 C=CCC1CCCCC1NCCCSC 270004a_100000749238_100011214939 [0,0,0,1,0,0|3,0,0]=4 8547 B15R1.242 C=CCC1CCCCC1NCCOCC 269862a_100011200944_100011214939 [0,0,0,1,0,0|3,0,0]=4 8548 B15R1.242 C=CCC1CCCCC1NCCOCC 270004a_102516460346_100011214939 [0,0,0,1,0,0|3,0,0]=4 8549 B15R1.242 C=CCC1CCCCC1NCCSCC 269862a_100000106463_100011214939 [0,0,0,1,0,0|3,0,0]=4 8550 B15R1.242 C=CCC1CCCCC1NCCSCC 270004a_100000106463_100011214939 [0,0,0,1,0,0|3,0,0]=4 8551 B15R1.242 C=CCCCCN1CCCCC1CCC 2230a_100000701414_100011215482 [0,0,0,1,0,0|2,0,0]=3 8552 B15R1.242 C=CCCCCN1CCCCC1CCC 269982a_100000701414_100011215482 [0,0,0,1,0,0|2,0,0]=3 8553 B15R1.242 C=CCCCCN1CCCCC1CCC 34a_100000701414_100011215482 [0,0,0,1,0,0|2,0,0]=3 8554 B15R1.242 C=CCCCCN1CCCCC1CCO 2230a_100000211664_100011215482 [0,0,0,1,0,0|3,0,0]=4 8555 B15R1.242 C=CCCCCN1CCCCC1CCO 269982a_100000211664_100011215482 [0,0,0,1,0,0|3,0,0]=4 8556 B15R1.242 C=CCCCCN1CCCCC1CCO 34a_100000211664_100011215482 [0,0,0,1,0,0|3,0,0]=4 8557 B15R1.242 C=CCCCCN1CCCCC1COC 2230a_100015184032_100011215482 [0,0,0,1,0,0|3,0,0]=4 8558 B15R1.242 C=CCCCCN1CCCCC1COC 269982a_100015184032_100011215482 [0,0,0,1,0,0|3,0,0]=4 8559 B15R1.242 C=CCCCCN1CCCCC1COC 34a_100015184032_100011215482 [0,0,0,1,0,0|3,0,0]=4 8560 B15R1.242 C=CCCCCN1CCOCC1CCC 2230a_102495339903_100011215482 [0,0,0,1,0,0|3,0,0]=4 8561 B15R1.242 C=CCCCCN1CCOCC1CCC 269982a_102495339903_100011215482 [0,0,0,1,0,0|3,0,0]=4 8562 B15R1.242 C=CCCCCN1CCOCC1CCC 34a_102495339903_100011215482 [0,0,0,1,0,0|3,0,0]=4 8563 B15R1.242 C=CCCCNC1CCCCC1CCC 269862a_100000700776_100011218038 [0,0,0,1,0,0|2,0,0]=3 8564 B15R1.242 C=CCCCNC1CCCCC1CCC 270004a_100000700776_100011218038 [0,0,0,1,0,0|2,0,0]=3 8565 B15R1.242 C=CCCCNC1CCCCC1OCC 270004a_100000700776_200000031474 [0,0,0,1,0,0|3,0,0]=4 8566 B15R1.242 C=CCCCOC1CCCCC1CCC 34a_100011217265_100000757094 [0,0,0,1,0,0|2,0,0]=3 8567 B15R1.242 C=CCCCOC1CCCCC1CCC 7a_100011217265_100000757094 [0,0,0,1,0,0|2,0,0]=3 8568 B15R1.242 C=COCCOC1CCCCC1CCC 34a_100011217265_100000039644 [0,0,0,1,0,0|3,0,0]=4 8569 B15R1.242 C=COCCOC1CCCCC1CCC 7a_100011217265_100000039644 [0,0,0,1,0,0|3,0,0]=4 8570 B15R1.242 CCCC1CCCCC1NCCCCO 269862a_100000750430_100011218038 [0,0,0,1,0,0|1,0,2]=4 8571 B15R1.242 CCCC1CCCCC1NCCCCO 270004a_100000750430_100011218038 [0,0,0,1,0,0|1,0,2]=4 8572 B15R1.242 CCCC1CCCCC1NCCCOC 269862a_100150723488_100011218038 [0,0,0,1,0,0|3,0,0]=4 8573 B15R1.242 CCCC1CCCCC1NCCCOC 270004a_100150723488_100011218038 [0,0,0,1,0,0|3,0,0]=4 8574 B15R1.242 CCCC1CCCCC1NCCCSC 269862a_100000749238_100011218038 [0,0,0,1,0,0|3,0,0]=4 8575 B15R1.242 CCCC1CCCCC1NCCCSC 270004a_100000749238_100011218038 [0,0,0,1,0,0|3,0,0]=4 8576 B15R1.242 CCCC1CCCCC1OCCCC#N 7a_100011217265_100000687738 [0,0,0,1,0,0|2,0,1]=4 8577 B15R1.242 CCCC1CCCCC1OCCCC=O 7a_100011217265_200011292268 [0,0,0,1,0,0|1,0,0]=2 8578 B15R1.242 CCCC1CCCCC1OCCCCF 34a_100011217265_100000729493 [0,0,0,1,0,0|2,0,1]=4 8579 B15R1.242 CCCC1CCCCC1OCCCCF 7a_100011217265_100000729493 [0,0,0,1,0,0|2,0,1]=4 8580 B15R1.242 CCCC1CCCCC1OCCCCO 34a_100011217265_100011216708 [0,0,0,1,0,0|1,0,2]=4 8581 B15R1.242 CCCC1CCCCC1OCCCCO 7a_100011217265_100000210776 [0,0,0,1,0,0|1,0,2]=4 8582 B15R1.242 CCCC1CCCCC1OCCCOC 34a_100011217265_100000740836 [0,0,0,1,0,0|3,0,0]=4 8583 B15R1.242 CCCC1CCCCC1OCCCOC 7a_100011217265_100000740836 [0,0,0,1,0,0|3,0,0]=4 8584 B15R1.242 CCCC1CCCCN1CCCCC#N 2230a_100000701414_100000211819 [0,0,0,1,0,0|2,0,1]=4 8585 B15R1.242 CCCC1CCCCN1CCCCC#N 269982a_100000701414_100011219923 [0,0,0,1,0,0|2,0,1]=4 8586 B15R1.242 CCCC1CCCCN1CCCCC=O 2230a_100000701414_100000139335 [0,0,0,1,0,0|1,0,0]=2 8587 B15R1.242 CCCC1CCCCN1CCCCC=O 269982a_100000701414_100000139335 [0,0,0,1,0,0|1,0,0]=2 8588 B15R1.242 CCCC1CCCCN1CCCCCF 2230a_100000701414_100000729378 [0,0,0,1,0,0|2,0,1]=4 8589 B15R1.242 CCCC1CCCCN1CCCCCF 269982a_100000701414_100000729378 [0,0,0,1,0,0|2,0,1]=4 8590 B15R1.242 CCCC1CCCCN1CCCCCF 34a_100000701414_100000729378 [0,0,0,1,0,0|2,0,1]=4 8591 B15R1.242 CCCC1CCCCN1CCCCCO 2230a_100000701414_100000746330 [0,0,0,1,0,0|1,0,2]=4 8592 B15R1.242 CCCC1CCCCN1CCCCCO 269982a_100000701414_100000746330 [0,0,0,1,0,0|1,0,2]=4 8593 B15R1.242 CCCC1CCCCN1CCCCCO 34a_100000701414_100000746330 [0,0,0,1,0,0|1,0,2]=4 8594 B15R1.242 CCCC1CCCCN1CCCCOC 2230a_100000701414_100000730899 [0,0,0,1,0,0|3,0,0]=4 8595 B15R1.242 CCCC1CCCCN1CCCCOC 269982a_100000701414_100000730899 [0,0,0,1,0,0|3,0,0]=4 8596 B15R1.242 CCCC1CCCCN1CCCCOC 34a_100000701414_100000755781 [0,0,0,1,0,0|3,0,0]=4 8597 B15R1.242 CCCC1COCCN1CCCCC=O 2230a_102495339903_100000139335 [0,0,0,1,0,0|2,0,0]=3 8598 B15R1.242 CCCC1COCCN1CCCCC=O 269982a_102495339903_100000139335 [0,0,0,1,0,0|2,0,0]=3 8599 B15R1.242 CCCCCCN1CCCCC1CC#N 2230a_100000133382_100000210314 [0,0,0,1,0,0|2,0,1]=4 8600 B15R1.242 CCCCCCN1CCCCC1CC#N 34a_100000133382_100000210314 [0,0,0,1,0,0|2,0,1]=4 8601 B15R1.242 CCCCCCN1CCCCC1CCC 2230a_100000701414_100000210314 [0,0,0,1,0,0|2,0,1]=4 8602 B15R1.242 CCCCCCN1CCCCC1CCC 269982a_100000701414_100000210757 [0,0,0,1,0,0|2,0,1]=4 8603 B15R1.242 CCCCCCN1CCCCC1CCC 34a_100000701414_100000210314 [0,0,0,1,0,0|2,0,1]=4 8604 B15R1.242 CCCCCCN1CCCCC1CCO 2230a_100000211664_100000210314 [0,0,0,1,0,0|1,0,2]=4 8605 B15R1.242 CCCCCCN1CCCCC1CCO 269982a_100000211664_100000210757 [0,0,0,1,0,0|1,0,2]=4 8606 B15R1.242 CCCCCCN1CCCCC1CCO 34a_100000211664_100000210314 [0,0,0,1,0,0|1,0,2]=4 8607 B15R1.242 CCCCCCN1CCCCC1COC 2230a_100015184032_100000210314 [0,0,0,1,0,0|3,0,0]=4 8608 B15R1.242 CCCCCCN1CCCCC1COC 269982a_100015184032_100000210757 [0,0,0,1,0,0|3,0,0]=4 8609 B15R1.242 CCCCCCN1CCCCC1COC 34a_100015184032_100000210314 [0,0,0,1,0,0|3,0,0]=4 8610 B15R1.242 CCCCCNC1CCCCC1CC#N 270004a_100000209983_100009866218 [0,0,0,1,0,0|2,0,1]=4 8611 B15R1.242 CCCCCNC1CCCCC1CCC 269862a_100000209983_100011218038 [0,0,0,1,0,0|2,0,1]=4 8612 B15R1.242 CCCCCNC1CCCCC1CCC 270004a_100000209983_100011218038 [0,0,0,1,0,0|2,0,1]=4 8613 B15R1.242 CCCCCOC1CCCCC1CCC 34a_100011217265_100000718602 [0,0,0,1,0,0|2,0,1]=4 8614 B15R1.242 CCCCCOC1CCCCC1CCC 7a_100011217265_100000210326 [0,0,0,1,0,0|2,0,1]=4 8615 B15R1.242 COCC1CCCCN1CCCCC=O 2230a_100015184032_100000139335 [0,0,0,1,0,0|2,0,0]=3 8616 B15R1.242 COCC1CCCCN1CCCCC=O 269982a_100015184032_100000139335 [0,0,0,1,0,0|2,0,0]=3 8617 B15R1.242 COC[C@H]1COCCN1CCCCC=O 2230a_100016989928_100000139335 [0,0,0,1,0,0|3,0,0]=4 8618 B15R1.242 COC[C@H]1COCCN1CCCCC=O 269982a_100016989928_100000139335 [0,0,0,1,0,0|3,0,0]=4 8619 B15R1.242 N#CCC1CCCCN1CCCCC=O 2230a_100000133382_100000139335 [0,0,0,1,0,0|2,0,1]=4 8620 B15R1.242 O=CCCCCN1CCCCC1CCO 2230a_100000211664_100000139335 [0,0,0,1,0,0|2,0,0]=3 8621 B15R1.242 O=CCCCCN1CCCCC1CCO 269982a_100000211664_100000139335 [0,0,0,1,0,0|2,0,0]=3 8622 B15R1.249 C#CCCCNC1CCCC1CCCC 270004a_100000718082_100000750825 [0,0,0,1,0,0|2,0,1]=4 8623 B15R1.249 C=CCCCNC1CCCC1CCCC 269862a_100000700776_100000750825 [0,0,0,1,0,0|2,0,0]=3 8624 B15R1.249 C=CCCCNC1CCCC1CCCC 270004a_100000700776_100000750825 [0,0,0,1,0,0|2,0,0]=3 8625 B15R1.249 C=CCNC1CCCC1CCCCCC 270004a_100020586998_100000189428 [0,0,0,1,0,0|2,0,0]=3 8626 B15R1.249 CCCCC1C=CCN1CCCCC=O 2230a_100015184376_100000139335 [0,0,0,1,0,0|1,0,2]=4 8627 B15R1.249 CCCCC1C=CCN1CCCCC=O 269982a_100015184376_100000139335 [0,0,0,1,0,0|1,0,2]=4 8628 B15R1.249 CCCCC1CCCC1NCCCCO 269862a_100000750430_100000750825 [0,0,0,1,0,0|1,0,2]=4 8629 B15R1.249 CCCCC1CCCC1NCCCCO 270004a_100000750430_100000750825 [0,0,0,1,0,0|1,0,2]=4 8630 B15R1.249 CCCCC1CCCC1NCCCOC 269862a_100150723488_100000750825 [0,0,0,1,0,0|3,0,0]=4 8631 B15R1.249 CCCCC1CCCC1NCCCOC 270004a_100150723488_100000750825 [0,0,0,1,0,0|3,0,0]=4 8632 B15R1.249 CCCCC1CCCC1NCCCSC 269862a_100000749238_100000750825 [0,0,0,1,0,0|3,0,0]=4 8633 B15R1.249 CCCCC1CCCC1NCCCSC 270004a_100000749238_100000750825 [0,0,0,1,0,0|3,0,0]=4 8634 B15R1.249 CCCCCCC1CCCC1NCCC 269862a_100020643023_100000189428 [0,0,0,1,0,0|2,0,1]=4 8635 B15R1.249 CCCCCCC1CCCC1NCCC 270004a_100020643023_100000189428 [0,0,0,1,0,0|2,0,1]=4 8636 B15R1.249 CCCCCCC1CCCC1NCCF 269862a_100000724931_100000189428 [0,0,0,1,0,0|2,0,1]=4 8637 B15R1.249 CCCCCCC1CCCC1NCCO 269862a_100000210304_100000189428 [0,0,0,1,0,0|1,0,2]=4 8638 B15R1.249 CCCCCCC1CCCC1NCCO 270004a_100000210304_100000189428 [0,0,0,1,0,0|1,0,2]=4 8639 B15R1.249 CCCCCNC1CCCC1CCC#N 270004a_100000209983_100000073560 [0,0,0,1,0,0|2,0,1]=4 8640 B15R1.249 CCCCCNC1CCCC1CCCC 269862a_100000209983_100000750825 [0,0,0,1,0,0|2,0,1]=4 8641 B15R1.249 CCCCCNC1CCCC1CCCC 270004a_100000209983_100000750825 [0,0,0,1,0,0|2,0,1]=4 8642 B15R1.528 BrCCCCCCCCOC1CCCC1 34a_100009813846_100000179811 [0,0,0,1,0,0|2,0,1]=4 8643 B15R1.528 BrCCCCCCCCOC1CCCC1 7a_100009813846_100000179811 [0,0,0,1,0,0|2,0,1]=4 8644 B15R1.528 BrCCCCCCCOCC1CCCC1 34a_100000760002_100000740388 [0,0,0,1,0,0|2,0,1]=4 8645 B15R1.528 BrCCCCCCCOCC1CCCC1 7a_100000760002_100000740388 [0,0,0,1,0,0|2,0,1]=4 8646 B15R1.528 BrCCCCCCOCCC1CCCC1 34a_100011215345_100000760354 [0,0,0,1,0,0|2,0,1]=4 8647 B15R1.528 BrCCCCCCOCCC1CCCC1 7a_100011215345_100000760354 [0,0,0,1,0,0|2,0,1]=4 8648 B15R1.528 BrCCCCCOCCCC1CCCC1 34a_100000746331_100011713738 [0,0,0,1,0,0|2,0,1]=4 8649 B15R1.528 BrCCCCCOCCCC1CCCC1 7a_100000746331_100011713738 [0,0,0,1,0,0|2,0,1]=4 8650 B15R1.528 C#CCCCCCCCNC1CCCC1 2230a_100000211070_100153394163 [0,0,0,1,0,0|2,0,1]=4 8651 B15R1.528 C#CCCCCCCCNC1CCCC1 34a_100000211070_100153394163 [0,0,0,1,0,0|2,0,1]=4 8652 B15R1.528 C#CCCCCCCCOC1CCCC1 34a_100000054614_100000179811 [0,0,0,1,0,0|2,0,1]=4 8653 B15R1.528 C#CCCCCCCCOC1CCCC1 34a_100000210269_100153394163 [0,0,0,1,0,0|2,0,1]=4 8654 B15R1.528 C#CCCCCCCCOC1CCCC1 7a_100000054614_100000179811 [0,0,0,1,0,0|2,0,1]=4 8655 B15R1.528 C#CCCCCCCCOC1CCCC1 7a_100000210269_100153394163 [0,0,0,1,0,0|2,0,1]=4 8656 B15R1.528 C#CCCCCCCCSC1CCCC1 62a_100011217020_100153394163 [0,0,0,1,0,0|2,0,1]=4 8657 B15R1.528 C#CCCCCCCCSC1CCCC1 62a_100153394163_100000179811 [0,0,0,1,0,0|2,0,1]=4 8658 B15R1.528 C#CCCCCCCNCC1CCCC1 2230a_100000737975_100012276617 [0,0,0,1,0,0|2,0,1]=4 8659 B15R1.528 C#CCCCCCCNCC1CCCC1 34a_100000737975_100012276617 [0,0,0,1,0,0|2,0,1]=4 8660 B15R1.528 C#CCCCCCCOCC1CCCC1 34a_100000742336_100012276617 [0,0,0,1,0,0|2,0,1]=4 8661 B15R1.528 C#CCCCCCCOCC1CCCC1 34a_100011217361_100000740388 [0,0,0,1,0,0|2,0,1]=4 8662 B15R1.528 C#CCCCCCCOCC1CCCC1 7a_100000742336_100012276617 [0,0,0,1,0,0|2,0,1]=4 8663 B15R1.528 C#CCCCCCCOCC1CCCC1 7a_100011217361_100000740388 [0,0,0,1,0,0|2,0,1]=4 8664 B15R1.528 C#CCCCCCCSCC1CCCC1 62a_100000740388_100012276617 [0,0,0,1,0,0|2,0,1]=4 8665 B15R1.528 C#CCCCCCCSCC1CCCC1 62a_100012276617_100000740388 [0,0,0,1,0,0|2,0,1]=4 8666 B15R1.528 C#CCCCCCNCCC1CCCC1 2230a_100000739158_100012094781 [0,0,0,1,0,0|2,0,1]=4 8667 B15R1.528 C#CCCCCCNCCC1CCCC1 34a_100000739158_100012094781 [0,0,0,1,0,0|2,0,1]=4 8668 B15R1.528 C#CCCCCCOCCC1CCCC1 34a_100000749090_100012094781 [0,0,0,1,0,0|2,0,1]=4 8669 B15R1.528 C#CCCCCCOCCC1CCCC1 34a_100000766912_100000760354 [0,0,0,1,0,0|2,0,1]=4 8670 B15R1.528 C#CCCCCCOCCC1CCCC1 7a_100000749090_100012094781 [0,0,0,1,0,0|2,0,1]=4 8671 B15R1.528 C#CCCCCCOCCC1CCCC1 7a_100000766912_100000760354 [0,0,0,1,0,0|2,0,1]=4 8672 B15R1.528 C#CCCCCCSCCC1CCCC1 62a_100000760354_100012094781 [0,0,0,1,0,0|2,0,1]=4 8673 B15R1.528 C#CCCCCCSCCC1CCCC1 62a_100012094781_100000760354 [0,0,0,1,0,0|2,0,1]=4 8674 B15R1.528 C#CCCCCNCCCC1CCCC1 2230a_100000706060_100011713738 [0,0,0,1,0,0|2,0,1]=4 8675 B15R1.528 C#CCCCCNCCCC1CCCC1 2230a_100000736752_100010269958 [0,0,0,1,0,0|2,0,1]=4 8676 B15R1.528 C#CCCCCNCCCC1CCCC1 34a_100000706060_100011713738 [0,0,0,1,0,0|2,0,1]=4 8677 B15R1.528 C#CCCCCNCCCC1CCCC1 34a_100000736752_100010269958 [0,0,0,1,0,0|2,0,1]=4 8678 B15R1.528 C#CCCCCOCCCC1CCCC1 34a_100000766709_100011713738 [0,0,0,1,0,0|2,0,1]=4 8679 B15R1.528 C#CCCCCOCCCC1CCCC1 34a_100011215328_100010269958 [0,0,0,1,0,0|2,0,1]=4 8680 B15R1.528 C#CCCCCOCCCC1CCCC1 7a_100000766709_100011713738 [0,0,0,1,0,0|2,0,1]=4 8681 B15R1.528 C#CCCCCOCCCC1CCCC1 7a_100011215328_100010269958 [0,0,0,1,0,0|2,0,1]=4 8682 B15R1.528 C#CCCCCSCCCC1CCCC1 62a_100010269958_100011713738 [0,0,0,1,0,0|2,0,1]=4 8683 B15R1.528 C#CCCCCSCCCC1CCCC1 62a_100011713738_100010269958 [0,0,0,1,0,0|2,0,1]=4 8684 B15R1.528 C=CCCCCCCCCN1CCCC1 2230a_100000188435_100011933949 [0,0,0,1,0,0|2,0,0]=3 8685 B15R1.528 C=CCCCCCCCCN1CCCC1 269982a_100000188435_100011933949 [0,0,0,1,0,0|2,0,0]=3 8686 B15R1.528 C=CCCCCCCCCN1CCSC1 2230a_100011215254_100011933949 [0,0,0,1,0,0|3,0,0]=4 8687 B15R1.528 C=CCCCCCCCCN1CCSC1 269982a_100011215254_100011933949 [0,0,0,1,0,0|3,0,0]=4 8688 B15R1.528 C=CCCCCCCCNC1CCCC1 2230a_100000211070_100012355270 [0,0,0,1,0,0|2,0,0]=3 8689 B15R1.528 C=CCCCCCCCNC1CCCC1 34a_100000211070_100012355270 [0,0,0,1,0,0|2,0,0]=3 8690 B15R1.528 C=CCCCCCCCN[C@@H]1CCOC1 2230a_200015188469_100012355270 [0,0,0,1,0,0|3,0,0]=4 8691 B15R1.528 C=CCCCCCCCN[C@H]1CCOC1 2230a_100015188467_100012355270 [0,0,0,1,0,0|3,0,0]=4 8692 B15R1.528 C=CCCCCCCCN[C@H]1CCOC1 34a_100015188467_100012355270 [0,0,0,1,0,0|3,0,0]=4 8693 B15R1.528 C=CCCCCCCCOC1CCCC1 34a_100000210269_100012355270 [0,0,0,1,0,0|2,0,0]=3 8694 B15R1.528 C=CCCCCCCCOC1CCCC1 34a_100000730831_100000179811 [0,0,0,1,0,0|2,0,0]=3 8695 B15R1.528 C=CCCCCCCCOC1CCCC1 7a_100000210269_100012355270 [0,0,0,1,0,0|2,0,0]=3 8696 B15R1.528 C=CCCCCCCCOC1CCCC1 7a_100000730831_100000179811 [0,0,0,1,0,0|2,0,0]=3 8697 B15R1.528 C=CCCCCCCCOC1CCCO1 34a_100000085407_100012355270 [0,0,0,1,0,0|3,0,0]=4 8698 B15R1.528 C=CCCCCCCCOC1CCOC1 34a_100000730831_100000690089 [0,0,0,1,0,0|3,0,0]=4 8699 B15R1.528 C=CCCCCCCCOC1CCOC1 7a_100000730831_100000731011 [0,0,0,1,0,0|3,0,0]=4 8700 B15R1.528 C=CCCCCCCCOC1CCSC1 7a_100011232664_100012355270 [0,0,0,1,0,0|3,0,0]=4 8701 B15R1.528 C=CCCCCCCCO[C@H]1CCOC1 34a_100000717292_100012355270 [0,0,0,1,0,0|3,0,0]=4 8702 B15R1.528 C=CCCCCCCCSC1CCCC1 62a_100011217020_100012355270 [0,0,0,1,0,0|2,0,0]=3 8703 B15R1.528 C=CCCCCCCCSC1CCCC1 62a_100012355270_100000179811 [0,0,0,1,0,0|2,0,0]=3 8704 B15R1.528 C=CCCCCCCCSC1CCOC1 62a_100012355270_100000690089 [0,0,0,1,0,0|3,0,0]=4 8705 B15R1.528 C=CCCCCCCNCC1CCCC1 2230a_100000737975_100011215473 [0,0,0,1,0,0|2,0,0]=3 8706 B15R1.528 C=CCCCCCCNCC1CCCC1 34a_100000737975_100011215473 [0,0,0,1,0,0|2,0,0]=3 8707 B15R1.528 C=CCCCCCCNCC1CCOC1 2230a_100000737293_100011215473 [0,0,0,1,0,0|3,0,0]=4 8708 B15R1.528 C=CCCCCCCNCC1CCOC1 34a_100000737293_100011215473 [0,0,0,1,0,0|3,0,0]=4 8709 B15R1.528 C=CCCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100011215473 [0,0,0,1,0,0|3,0,0]=4 8710 B15R1.528 C=CCCCCCCNC[C@@H]1CCCO1 34a_100020590478_100011215473 [0,0,0,1,0,0|3,0,0]=4 8711 B15R1.528 C=CCCCCCCOCC1CCCC1 34a_100000742336_100011215473 [0,0,0,1,0,0|2,0,0]=3 8712 B15R1.528 C=CCCCCCCOCC1CCCC1 34a_200011216477_100000740388 [0,0,0,1,0,0|2,0,0]=3 8713 B15R1.528 C=CCCCCCCOCC1CCCC1 7a_100000742336_100011215473 [0,0,0,1,0,0|2,0,0]=3 8714 B15R1.528 C=CCCCCCCOCC1CCCC1 7a_200011216477_100000740388 [0,0,0,1,0,0|2,0,0]=3 8715 B15R1.528 C=CCCCCCCOCC1CCCO1 34a_100000210270_100011215473 [0,0,0,1,0,0|3,0,0]=4 8716 B15R1.528 C=CCCCCCCOCC1CCCO1 7a_100000210270_100011215473 [0,0,0,1,0,0|3,0,0]=4 8717 B15R1.528 C=CCCCCCCOCC1CCCO1 7a_200011216477_100000203698 [0,0,0,1,0,0|3,0,0]=4 8718 B15R1.528 C=CCCCCCCOCC1CCNC1 34a_100000748654_100011215473 [0,0,0,1,0,0|3,0,0]=4 8719 B15R1.528 C=CCCCCCCOCC1CCOC1 34a_100000740260_100011215473 [0,0,0,1,0,0|3,0,0]=4 8720 B15R1.528 C=CCCCCCCOCC1CCOC1 34a_200011216477_100011261433 [0,0,0,1,0,0|3,0,0]=4 8721 B15R1.528 C=CCCCCCCOCC1CCOC1 7a_200011216477_100000702531 [0,0,0,1,0,0|3,0,0]=4 8722 B15R1.528 C=CCCCCCCOC[C@H]1CCCN1 34a_100000745186_100011215473 [0,0,0,1,0,0|3,0,0]=4 8723 B15R1.528 C=CCCCCCCSCC1CCCC1 62a_100000740388_100011215473 [0,0,0,1,0,0|2,0,0]=3 8724 B15R1.528 C=CCCCCCCSCC1CCCC1 62a_100011215473_100000740388 [0,0,0,1,0,0|2,0,0]=3 8725 B15R1.528 C=CCCCCCCSCC1CCCO1 62a_100000203698_100011215473 [0,0,0,1,0,0|3,0,0]=4 8726 B15R1.528 C=CCCCCCCSCC1CCCO1 62a_100011215473_100000203698 [0,0,0,1,0,0|3,0,0]=4 8727 B15R1.528 C=CCCCCCCSCC1CCOC1 62a_100000702531_100011215473 [0,0,0,1,0,0|3,0,0]=4 8728 B15R1.528 C=CCCCCCCSCC1CCOC1 62a_100011215473_100000702531 [0,0,0,1,0,0|3,0,0]=4 8729 B15R1.528 C=CCCCCCNCCC1CCCC1 2230a_100000739158_100000700193 [0,0,0,1,0,0|2,0,0]=3 8730 B15R1.528 C=CCCCCCNCCC1CCCC1 34a_100000739158_100000700193 [0,0,0,1,0,0|2,0,0]=3 8731 B15R1.528 C=CCCCCCOCCC1CCCC1 34a_100000749090_100000700193 [0,0,0,1,0,0|2,0,0]=3 8732 B15R1.528 C=CCCCCCOCCC1CCCC1 34a_100011216702_100000760354 [0,0,0,1,0,0|2,0,0]=3 8733 B15R1.528 C=CCCCCCOCCC1CCCC1 7a_100000749090_100000700193 [0,0,0,1,0,0|2,0,0]=3 8734 B15R1.528 C=CCCCCCOCCC1CCCC1 7a_100011216702_100000760354 [0,0,0,1,0,0|2,0,0]=3 8735 B15R1.528 C=CCCCCCOCCC1CCNC1 34a_100016987287_100000700193 [0,0,0,1,0,0|3,0,0]=4 8736 B15R1.528 C=CCCCCCOCCC1CCOC1 34a_100011879284_100000700193 [0,0,0,1,0,0|3,0,0]=4 8737 B15R1.528 C=CCCCCCOCCN1CCCC1 7a_100011216702_100000004467 [0,0,0,1,0,0|3,0,0]=4 8738 B15R1.528 C=CCCCCCSCCC1CCCC1 62a_100000700193_100000760354 [0,0,0,1,0,0|2,0,0]=3 8739 B15R1.528 C=CCCCCCSCCC1CCCC1 62a_100000760354_100000700193 [0,0,0,1,0,0|2,0,0]=3 8740 B15R1.528 C=CCCCCCSCCN1CCCC1 62a_100000700193_100000004467 [0,0,0,1,0,0|3,0,0]=4 8741 B15R1.528 C=CCCCCCSCCN1CCCC1 62a_100000700749_100000700193 [0,0,0,1,0,0|3,0,0]=4 8742 B15R1.528 C=CCCCCNCCCC1CCCC1 2230a_100000703577_100011713738 [0,0,0,1,0,0|2,0,0]=3 8743 B15R1.528 C=CCCCCNCCCC1CCCC1 2230a_100000736752_100011215482 [0,0,0,1,0,0|2,0,0]=3 8744 B15R1.528 C=CCCCCNCCCC1CCCC1 34a_100000703577_100011713738 [0,0,0,1,0,0|2,0,0]=3 8745 B15R1.528 C=CCCCCNCCCC1CCCC1 34a_100000736752_100011215482 [0,0,0,1,0,0|2,0,0]=3 8746 B15R1.528 C=CCCCCNCCCN1CCCC1 2230a_100000703577_100011445909 [0,0,0,1,0,0|3,0,0]=4 8747 B15R1.528 C=CCCCCNCCCN1CCCC1 34a_100000703577_100016991639 [0,0,0,1,0,0|3,0,0]=4 8748 B15R1.528 C=CCCCCNCCOC1CCCC1 34a_100000741755_100011215482 [0,0,0,1,0,0|3,0,0]=4 8749 B15R1.528 C=CCCCCOCCCC1CCCC1 34a_100000766645_100011713738 [0,0,0,1,0,0|2,0,0]=3 8750 B15R1.528 C=CCCCCOCCCC1CCCC1 34a_100011215328_100011215482 [0,0,0,1,0,0|2,0,0]=3 8751 B15R1.528 C=CCCCCOCCCC1CCCC1 7a_100000766645_100011713738 [0,0,0,1,0,0|2,0,0]=3 8752 B15R1.528 C=CCCCCOCCCC1CCCC1 7a_100011215328_100011215482 [0,0,0,1,0,0|2,0,0]=3 8753 B15R1.528 C=CCCCCOCCCN1CCCC1 34a_100000766645_100016991639 [0,0,0,1,0,0|3,0,0]=4 8754 B15R1.528 C=CCCCCOCCCN1CCCC1 7a_100000766645_100011445909 [0,0,0,1,0,0|3,0,0]=4 8755 B15R1.528 C=CCCCCOCCNC1CCCC1 34a_200000200444_100011215482 [0,0,0,1,0,0|3,0,0]=4 8756 B15R1.528 C=CCCCCOCCOC1CCCC1 34a_100000738311_100011215482 [0,0,0,1,0,0|3,0,0]=4 8757 B15R1.528 C=CCCCCOCCOC1CCCC1 7a_100000738311_100011215482 [0,0,0,1,0,0|3,0,0]=4 8758 B15R1.528 C=CCCCCSCCCC1CCCC1 62a_100011215482_100011713738 [0,0,0,1,0,0|2,0,0]=3 8759 B15R1.528 C=CCCCCSCCCC1CCCC1 62a_100011713738_100011215482 [0,0,0,1,0,0|2,0,0]=3 8760 B15R1.528 C=CCCCCSCCCN1CCCC1 62a_100011215482_100011445909 [0,0,0,1,0,0|3,0,0]=4 8761 B15R1.528 C=CCCCCSCCCN1CCCC1 62a_100016991639_100011215482 [0,0,0,1,0,0|3,0,0]=4 8762 B15R1.528 C=CCCCNCCCOC1CCCC1 34a_100000747560_100000757094 [0,0,0,1,0,0|3,0,0]=4 8763 B15R1.528 C=CCOCCOCCCC1CCCC1 34a_100000037705_100011713738 [0,0,0,1,0,0|3,0,0]=4 8764 B15R1.528 C=CCOCCOCCCC1CCCC1 7a_100000037705_100011713738 [0,0,0,1,0,0|3,0,0]=4 8765 B15R1.528 C=COCCCCOCCC1CCCC1 34a_100000031558_100000760354 [0,0,0,1,0,0|3,0,0]=4 8766 B15R1.528 C=COCCCCOCCC1CCCC1 7a_100000031558_100000760354 [0,0,0,1,0,0|3,0,0]=4 8767 B15R1.528 C=COCCCNCCCC1CCCC1 2230a_100000210767_100011713738 [0,0,0,1,0,0|3,0,0]=4 8768 B15R1.528 C=COCCCNCCCC1CCCC1 34a_100000210767_100011713738 [0,0,0,1,0,0|3,0,0]=4 8769 B15R1.528 CC=CCCCOCCCC1CCCC1 34a_100020645299_100011713738 [0,0,0,1,0,0|2,0,1]=4 8770 B15R1.528 CCCCCCCCCCN1CC=CC1 269982a_100015195280_100000210320 [0,0,0,1,0,0|2,0,1]=4 8771 B15R1.528 CCCCCCCCCCN1CCCC1 2230a_100000188435_100000210320 [0,0,0,1,0,0|2,0,1]=4 8772 B15R1.528 CCCCCCCCCCN1CCCC1 269982a_100000188435_100000210320 [0,0,0,1,0,0|2,0,1]=4 8773 B15R1.528 CCCCCCCCCCN1CCSC1 2230a_100011215254_100000210320 [0,0,0,1,0,0|3,0,0]=4 8774 B15R1.528 CCCCCCCCCCN1CCSC1 269982a_100011215254_100000210320 [0,0,0,1,0,0|3,0,0]=4 8775 B15R1.528 CCCCCCCCCNC1CC=CC1 2230a_100015188752_100011214924 [0,0,0,1,0,0|2,0,1]=4 8776 B15R1.528 CCCCCCCCCNC1CCCC1 2230a_100000211070_100011214924 [0,0,0,1,0,0|2,0,1]=4 8777 B15R1.528 CCCCCCCCCNC1CCCC1 2230a_100000212291_100000179811 [0,0,0,1,0,0|2,0,1]=4 8778 B15R1.528 CCCCCCCCCNC1CCCC1 270004a_100000212291_100000210133 [0,0,0,1,0,0|2,0,1]=4 8779 B15R1.528 CCCCCCCCCNC1CCCC1 34a_100000211070_100011214924 [0,0,0,1,0,0|2,0,1]=4 8780 B15R1.528 CCCCCCCCCNC1CCCC1 34a_100000212291_100000179811 [0,0,0,1,0,0|2,0,1]=4 8781 B15R1.528 CCCCCCCCCNC1CCOC1 2230a_100000212291_100000731011 [0,0,0,1,0,0|3,0,0]=4 8782 B15R1.528 CCCCCCCCCNC1CCOC1 270004a_100000212291_100000752484 [0,0,0,1,0,0|3,0,0]=4 8783 B15R1.528 CCCCCCCCCNC1CCOC1 34a_100000212291_100000690089 [0,0,0,1,0,0|3,0,0]=4 8784 B15R1.528 CCCCCCCCCNC1CCSC1 270004a_100000212291_100000212027 [0,0,0,1,0,0|3,0,0]=4 8785 B15R1.528 CCCCCCCCCN[C@@H]1CCOC1 2230a_200015188469_100011214924 [0,0,0,1,0,0|3,0,0]=4 8786 B15R1.528 CCCCCCCCCN[C@H]1CCOC1 2230a_100015188467_100011214924 [0,0,0,1,0,0|3,0,0]=4 8787 B15R1.528 CCCCCCCCCN[C@H]1CCOC1 34a_100015188467_100011214924 [0,0,0,1,0,0|3,0,0]=4 8788 B15R1.528 CCCCCCCCCOC1CCCC1 34a_100000210269_100011214924 [0,0,0,1,0,0|2,0,1]=4 8789 B15R1.528 CCCCCCCCCOC1CCCC1 34a_100000210712_100000179811 [0,0,0,1,0,0|2,0,1]=4 8790 B15R1.528 CCCCCCCCCOC1CCCC1 7a_100000210269_100000210328 [0,0,0,1,0,0|2,0,1]=4 8791 B15R1.528 CCCCCCCCCOC1CCCC1 7a_100000210712_100000179811 [0,0,0,1,0,0|2,0,1]=4 8792 B15R1.528 CCCCCCCCCOC1CCCO1 34a_100000085407_100011214924 [0,0,0,1,0,0|1,0,2]=4 8793 B15R1.528 CCCCCCCCCOC1CCOC1 34a_100000210712_100000690089 [0,0,0,1,0,0|3,0,0]=4 8794 B15R1.528 CCCCCCCCCOC1CCOC1 7a_100000210712_100000731011 [0,0,0,1,0,0|3,0,0]=4 8795 B15R1.528 CCCCCCCCCOC1CCSC1 7a_100011232664_100000210328 [0,0,0,1,0,0|3,0,0]=4 8796 B15R1.528 CCCCCCCCCO[C@H]1CCOC1 34a_100000717292_100011214924 [0,0,0,1,0,0|3,0,0]=4 8797 B15R1.528 CCCCCCCCCSC1CCCC1 62a_100011217020_100000210670 [0,0,0,1,0,0|2,0,1]=4 8798 B15R1.528 CCCCCCCCNCC1CCCC1 2230a_100000229939_100000740388 [0,0,0,1,0,0|2,0,1]=4 8799 B15R1.528 CCCCCCCCNCC1CCCC1 2230a_100000737975_100000210759 [0,0,0,1,0,0|2,0,1]=4 8800 B15R1.528 CCCCCCCCNCC1CCCC1 269862a_100000229939_100000746403 [0,0,0,1,0,0|2,0,1]=4 8801 B15R1.528 CCCCCCCCNCC1CCCC1 34a_100000229939_100000740388 [0,0,0,1,0,0|2,0,1]=4 8802 B15R1.528 CCCCCCCCNCC1CCCC1 34a_100000737975_100000210759 [0,0,0,1,0,0|2,0,1]=4 8803 B15R1.528 CCCCCCCCNCC1CCCO1 2230a_100000229939_100000203698 [0,0,0,1,0,0|1,0,2]=4 8804 B15R1.528 CCCCCCCCNCC1CCOC1 2230a_100000229939_100000702531 [0,0,0,1,0,0|3,0,0]=4 8805 B15R1.528 CCCCCCCCNCC1CCOC1 2230a_100000737293_100000210759 [0,0,0,1,0,0|3,0,0]=4 8806 B15R1.528 CCCCCCCCNCC1CCOC1 34a_100000229939_100011261433 [0,0,0,1,0,0|3,0,0]=4 8807 B15R1.528 CCCCCCCCNCC1CCOC1 34a_100000737293_100000210759 [0,0,0,1,0,0|3,0,0]=4 8808 B15R1.528 CCCCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210759 [0,0,0,1,0,0|1,0,2]=4 8809 B15R1.528 CCCCCCCCNC[C@@H]1CCCO1 34a_100020590478_100000210759 [0,0,0,1,0,0|1,0,2]=4 8810 B15R1.528 CCCCCCCCOCC1CC=CC1 34a_100000688395_100000210759 [0,0,0,1,0,0|2,0,1]=4 8811 B15R1.528 CCCCCCCCOCC1CCCC1 34a_100000210232_100000740388 [0,0,0,1,0,0|2,0,1]=4 8812 B15R1.528 CCCCCCCCOCC1CCCC1 34a_100000742336_100000210759 [0,0,0,1,0,0|2,0,1]=4 8813 B15R1.528 CCCCCCCCOCC1CCCC1 7a_100000210232_100000740388 [0,0,0,1,0,0|2,0,1]=4 8814 B15R1.528 CCCCCCCCOCC1CCCC1 7a_100000742336_100000210759 [0,0,0,1,0,0|2,0,1]=4 8815 B15R1.528 CCCCCCCCOCC1CCCO1 34a_100000210270_100000210759 [0,0,0,1,0,0|1,0,2]=4 8816 B15R1.528 CCCCCCCCOCC1CCCO1 7a_100000210232_100000203698 [0,0,0,1,0,0|1,0,2]=4 8817 B15R1.528 CCCCCCCCOCC1CCCO1 7a_100000210270_100000210759 [0,0,0,1,0,0|1,0,2]=4 8818 B15R1.528 CCCCCCCCOCC1CCNC1 34a_100000748654_100000210759 [0,0,0,1,0,0|3,0,0]=4 8819 B15R1.528 CCCCCCCCOCC1CCOC1 34a_100000210232_100011261433 [0,0,0,1,0,0|3,0,0]=4 8820 B15R1.528 CCCCCCCCOCC1CCOC1 34a_100000740260_100000210759 [0,0,0,1,0,0|3,0,0]=4 8821 B15R1.528 CCCCCCCCOCC1CCOC1 7a_100000210232_100000702531 [0,0,0,1,0,0|3,0,0]=4 8822 B15R1.528 CCCCCCCCOC[C@H]1CCCN1 34a_100000745186_100000210759 [0,0,0,1,0,0|2,0,1]=4 8823 B15R1.528 CCCCCCCCSCC1CCCC1 62a_100000210759_100000740388 [0,0,0,1,0,0|2,0,1]=4 8824 B15R1.528 CCCCCCCCSCC1CCCC1 62a_100000740388_100000210317 [0,0,0,1,0,0|2,0,1]=4 8825 B15R1.528 CCCCCCCCSCC1CCCO1 62a_100000203698_100000210317 [0,0,0,1,0,0|1,0,2]=4 8826 B15R1.528 CCCCCCCCSCC1CCCO1 62a_100000210759_100000203698 [0,0,0,1,0,0|1,0,2]=4 8827 B15R1.528 CCCCCCCCSCC1CCOC1 62a_100000210759_100000702531 [0,0,0,1,0,0|3,0,0]=4 8828 B15R1.528 CCCCCCCCSCC1CCOC1 62a_100000702531_100000210317 [0,0,0,1,0,0|3,0,0]=4 8829 B15R1.528 CCCCCCCNCCC1CCCC1 2230a_100000229938_100000760354 [0,0,0,1,0,0|2,0,1]=4 8830 B15R1.528 CCCCCCCNCCC1CCCC1 2230a_100000739158_100000210681 [0,0,0,1,0,0|2,0,1]=4 8831 B15R1.528 CCCCCCCNCCC1CCCC1 34a_100000739158_100000210614 [0,0,0,1,0,0|2,0,1]=4 8832 B15R1.528 CCCCCCCOCCC1CCCC1 34a_100000210272_100000760354 [0,0,0,1,0,0|2,0,1]=4 8833 B15R1.528 CCCCCCCOCCC1CCCC1 34a_100000749090_100000210614 [0,0,0,1,0,0|2,0,1]=4 8834 B15R1.528 CCCCCCCOCCC1CCCC1 7a_100000210272_100000760354 [0,0,0,1,0,0|2,0,1]=4 8835 B15R1.528 CCCCCCCOCCC1CCCC1 7a_100000749090_100000210614 [0,0,0,1,0,0|2,0,1]=4 8836 B15R1.528 CCCCCCCOCCC1CCNC1 34a_100016987287_100000210614 [0,0,0,1,0,0|3,0,0]=4 8837 B15R1.528 CCCCCCCOCCC1CCOC1 34a_100011879284_100000210614 [0,0,0,1,0,0|3,0,0]=4 8838 B15R1.528 CCCCCCCSCCC1CCCC1 62a_100000210614_100000760354 [0,0,0,1,0,0|2,0,1]=4 8839 B15R1.528 CCCCCCCSCCC1CCCC1 62a_100000760354_100000210316 [0,0,0,1,0,0|2,0,1]=4 8840 B15R1.528 CCCCCCNCCCC1CCCC1 2230a_100000210581_100011713738 [0,0,0,1,0,0|2,0,1]=4 8841 B15R1.528 CCCCCCNCCCC1CCCC1 2230a_100000736752_100000210314 [0,0,0,1,0,0|2,0,1]=4 8842 B15R1.528 CCCCCCNCCCC1CCCC1 34a_100000736752_100000210314 [0,0,0,1,0,0|2,0,1]=4 8843 B15R1.528 CCCCCCOCCCC1CCCC1 34a_100000210259_100011713738 [0,0,0,1,0,0|2,0,1]=4 8844 B15R1.528 CCCCCCOCCCC1CCCC1 34a_100011215328_100000210314 [0,0,0,1,0,0|2,0,1]=4 8845 B15R1.528 CCCCCCOCCCC1CCCC1 7a_100000210259_100011713738 [0,0,0,1,0,0|2,0,1]=4 8846 B15R1.528 CCCCCCOCCCC1CCCC1 7a_100011215328_100000210314 [0,0,0,1,0,0|2,0,1]=4 8847 B15R1.528 CCCCCCSCCCC1CCCC1 62a_100000210314_100011713738 [0,0,0,1,0,0|2,0,1]=4 8848 B15R1.528 CCCCCCSCCCC1CCCC1 62a_100011713738_100000210757 [0,0,0,1,0,0|2,0,1]=4 8849 B15R1.528 CNCCCCCOCCC1CCCC1 34a_100000722520_100000760354 [0,0,0,1,0,0|3,0,0]=4 8850 B15R1.528 COCCCCCCNCC1CCCC1 2230a_100000737975_100011998445 [0,0,0,1,0,0|3,0,0]=4 8851 B15R1.528 COCCCCCCNCC1CCCC1 34a_100000737975_100011998445 [0,0,0,1,0,0|3,0,0]=4 8852 B15R1.528 COCCCCCCOCC1CCCC1 34a_100000742336_100011998445 [0,0,0,1,0,0|3,0,0]=4 8853 B15R1.528 COCCCCCCOCC1CCCC1 34a_200012092642_100000740388 [0,0,0,1,0,0|3,0,0]=4 8854 B15R1.528 COCCCCCCOCC1CCCC1 7a_100000742336_100011998445 [0,0,0,1,0,0|3,0,0]=4 8855 B15R1.528 COCCCCCCOCC1CCCC1 7a_200012092642_100000740388 [0,0,0,1,0,0|3,0,0]=4 8856 B15R1.528 COCCCCCCSCC1CCCC1 62a_100000740388_100011998445 [0,0,0,1,0,0|3,0,0]=4 8857 B15R1.528 COCCCCCCSCC1CCCC1 62a_100011998445_100000740388 [0,0,0,1,0,0|3,0,0]=4 8858 B15R1.528 COCCCCCNCCC1CCCC1 2230a_100000747528_100000760354 [0,0,0,1,0,0|3,0,0]=4 8859 B15R1.528 COCCCCCNCCC1CCCC1 34a_100000747528_100000760354 [0,0,0,1,0,0|3,0,0]=4 8860 B15R1.528 COCCCCNCCCC1CCCC1 2230a_100000736752_100000730899 [0,0,0,1,0,0|3,0,0]=4 8861 B15R1.528 COCCCCNCCCC1CCCC1 34a_100000736752_100000755781 [0,0,0,1,0,0|3,0,0]=4 8862 B15R1.528 COCCCCOCCCC1CCCC1 34a_100000740925_100011713738 [0,0,0,1,0,0|3,0,0]=4 8863 B15R1.528 COCCCCOCCCC1CCCC1 34a_100011215328_100000755781 [0,0,0,1,0,0|3,0,0]=4 8864 B15R1.528 COCCCCOCCCC1CCCC1 7a_100011215328_100000730899 [0,0,0,1,0,0|3,0,0]=4 8865 B15R1.528 COCCCCSCCCC1CCCC1 62a_100000730899_100011713738 [0,0,0,1,0,0|3,0,0]=4 8866 B15R1.528 COCCCCSCCCC1CCCC1 62a_100011713738_100000730899 [0,0,0,1,0,0|3,0,0]=4 8867 B15R1.528 CSCCCCOCCCC1CCCC1 34a_100011217163_100011713738 [0,0,0,1,0,0|3,0,0]=4 8868 B15R1.528 CSCCCCOCCCC1CCCC1 7a_100011217163_100011713738 [0,0,0,1,0,0|3,0,0]=4 8869 B15R1.528 ClCCCCCCCCOC1CCCC1 34a_100000033203_100000179811 [0,0,0,1,0,0|2,0,1]=4 8870 B15R1.528 ClCCCCCCCCOC1CCCC1 7a_100000033203_100000179811 [0,0,0,1,0,0|2,0,1]=4 8871 B15R1.528 ClCCCCCCOCCC1CCCC1 34a_100000766143_100000760354 [0,0,0,1,0,0|2,0,1]=4 8872 B15R1.528 ClCCCCCCOCCC1CCCC1 7a_100000766143_100000760354 [0,0,0,1,0,0|2,0,1]=4 8873 B15R1.528 ClCCCCCOCCCC1CCCC1 34a_100000746330_100011713738 [0,0,0,1,0,0|2,0,1]=4 8874 B15R1.528 ClCCCCCOCCCC1CCCC1 7a_100000746330_100011713738 [0,0,0,1,0,0|2,0,1]=4 8875 B15R1.528 FCCCCCCNCCC1CCCC1 2230a_100000739158_100015922095 [0,0,0,1,0,0|2,0,1]=4 8876 B15R1.528 FCCCCCCNCCC1CCCC1 34a_100000739158_100015922095 [0,0,0,1,0,0|2,0,1]=4 8877 B15R1.528 FCCCCCCOCCC1CCCC1 34a_100000732779_100000760354 [0,0,0,1,0,0|2,0,1]=4 8878 B15R1.528 FCCCCCCOCCC1CCCC1 34a_100000749090_100015922095 [0,0,0,1,0,0|2,0,1]=4 8879 B15R1.528 FCCCCCCOCCC1CCCC1 7a_100000732779_100000760354 [0,0,0,1,0,0|2,0,1]=4 8880 B15R1.528 FCCCCCCOCCC1CCCC1 7a_100000749090_100015922095 [0,0,0,1,0,0|2,0,1]=4 8881 B15R1.528 FCCCCCCSCCC1CCCC1 62a_100000760354_100015922095 [0,0,0,1,0,0|2,0,1]=4 8882 B15R1.528 FCCCCCCSCCC1CCCC1 62a_100015922095_100000760354 [0,0,0,1,0,0|2,0,1]=4 8883 B15R1.528 FCCCCCNCCCC1CCCC1 2230a_100000736752_100000729378 [0,0,0,1,0,0|2,0,1]=4 8884 B15R1.528 FCCCCCNCCCC1CCCC1 34a_100000736752_100000729378 [0,0,0,1,0,0|2,0,1]=4 8885 B15R1.528 FCCCCCOCCCC1CCCC1 34a_100011215328_100000729378 [0,0,0,1,0,0|2,0,1]=4 8886 B15R1.528 FCCCCCOCCCC1CCCC1 7a_100011215328_100000729378 [0,0,0,1,0,0|2,0,1]=4 8887 B15R1.528 FCCCCCSCCCC1CCCC1 62a_100000729378_100011713738 [0,0,0,1,0,0|2,0,1]=4 8888 B15R1.528 FCCCCCSCCCC1CCCC1 62a_100011713738_100000729378 [0,0,0,1,0,0|2,0,1]=4 8889 B15R1.528 ICCCCCOCCCC1CCCC1 34a_200012148887_100011713738 [0,0,0,1,0,0|2,0,1]=4 8890 B15R1.528 ICCCCCOCCCC1CCCC1 7a_200012148887_100011713738 [0,0,0,1,0,0|2,0,1]=4 8891 B15R1.528 N#CCCCCCCNCC1CCCC1 2230a_100000737975_100009813337 [0,0,0,1,0,0|2,0,1]=4 8892 B15R1.528 N#CCCCCCCOCC1CCCC1 7a_100000742336_100009813337 [0,0,0,1,0,0|2,0,1]=4 8893 B15R1.528 N#CCCCCCCSCC1CCCC1 62a_100000740388_100009813337 [0,0,0,1,0,0|2,0,1]=4 8894 B15R1.528 N#CCCCCCCSCC1CCCC1 62a_100009813337_100000740388 [0,0,0,1,0,0|2,0,1]=4 8895 B15R1.528 N#CCCCCCNCCC1CCCC1 2230a_100000739158_100009813376 [0,0,0,1,0,0|2,0,1]=4 8896 B15R1.528 N#CCCCCCOCCC1CCCC1 7a_100000749090_100009813376 [0,0,0,1,0,0|2,0,1]=4 8897 B15R1.528 N#CCCCCCSCCC1CCCC1 62a_100000760354_100009813376 [0,0,0,1,0,0|2,0,1]=4 8898 B15R1.528 N#CCCCCCSCCC1CCCC1 62a_100009813376_100000760354 [0,0,0,1,0,0|2,0,1]=4 8899 B15R1.528 N#CCCCCNCCCC1CCCC1 2230a_100000736752_100000211819 [0,0,0,1,0,0|2,0,1]=4 8900 B15R1.528 N#CCCCCOCCCC1CCCC1 7a_100011215328_100000211819 [0,0,0,1,0,0|2,0,1]=4 8901 B15R1.528 N#CCCCCSCCCC1CCCC1 62a_100011219923_100011713738 [0,0,0,1,0,0|2,0,1]=4 8902 B15R1.528 N#CCCCCSCCCC1CCCC1 62a_100011713738_100000211819 [0,0,0,1,0,0|2,0,1]=4 8903 B15R1.528 NCCCCCCCCOC1CCCC1 34a_102515433106_100000179811 [0,0,0,1,0,0|2,0,1]=4 8904 B15R1.528 NCCCCCCCOCC1CCCC1 34a_100011996573_100000740388 [0,0,0,1,0,0|2,0,1]=4 8905 B15R1.528 NCCCCCCOCCC1CCCC1 34a_100000686447_100000760354 [0,0,0,1,0,0|2,0,1]=4 8906 B15R1.528 NCCCCCOCCCC1CCCC1 34a_100000762737_100011713738 [0,0,0,1,0,0|2,0,1]=4 8907 B15R1.528 O=CCCCCCNCCC1CCCC1 2230a_100000739158_100000139337 [0,0,0,1,0,0|1,0,0]=2 8908 B15R1.528 O=CCCCCCNCCC1OCCO1 2230a_100000034215_100000139337 [0,0,0,1,0,0|3,0,0]=4 8909 B15R1.528 O=CCCCCCOCCC1CCCC1 7a_100000749090_100000139337 [0,0,0,1,0,0|1,0,0]=2 8910 B15R1.528 O=CCCCCCSCCC1CCCC1 62a_100000139337_100000760354 [0,0,0,1,0,0|1,0,0]=2 8911 B15R1.528 O=CCCCCCSCCC1CCCC1 62a_100000760354_100000139337 [0,0,0,1,0,0|1,0,0]=2 8912 B15R1.528 O=CCCCCCSCCC1OCCO1 62a_100000139337_100000740749 [0,0,0,1,0,0|3,0,0]=4 8913 B15R1.528 O=CCCCCCSCCN1CCCC1 62a_100000139337_100000004467 [0,0,0,1,0,0|2,0,0]=3 8914 B15R1.528 O=CCCCCCSCCN1CCCC1 62a_100000700749_100000139337 [0,0,0,1,0,0|2,0,0]=3 8915 B15R1.528 O=CCCCCNCCCC1CCCC1 2230a_100000736752_100000139335 [0,0,0,1,0,0|1,0,0]=2 8916 B15R1.528 O=CCCCCOCCCC1CCCC1 7a_100011215328_100000139335 [0,0,0,1,0,0|1,0,0]=2 8917 B15R1.528 O=CCCCCOCCCC1OCCO1 7a_100009871617_100000139335 [0,0,0,1,0,0|3,0,0]=4 8918 B15R1.528 O=CCCCCOCCOC1CCCC1 7a_100000738311_100000139335 [0,0,0,1,0,0|2,0,0]=3 8919 B15R1.528 O=CCCCCSCCCC1CCCC1 62a_100000139335_100011713738 [0,0,0,1,0,0|1,0,0]=2 8920 B15R1.528 O=CCCCCSCCCC1CCCC1 62a_100011713738_100000139335 [0,0,0,1,0,0|1,0,0]=2 8921 B15R1.528 O=CCCCCSCCCC1OCCO1 62a_100000139335_100000042513 [0,0,0,1,0,0|3,0,0]=4 8922 B15R1.528 O=CCCCCSCCCN1CCCC1 62a_100000139335_100011445909 [0,0,0,1,0,0|2,0,0]=3 8923 B15R1.528 O=CCCCCSCCCN1CCCC1 62a_100016991639_100000139335 [0,0,0,1,0,0|2,0,0]=3 8924 B15R1.528 O=CCCCSCCCCC1OCCO1 62a_200011292268_100000034956 [0,0,0,1,0,0|3,0,0]=4 8925 B15R1.528 OCCCCCCCCCN1CCCC1 2230a_100000188435_100009813782 [0,0,0,1,0,0|1,0,2]=4 8926 B15R1.528 OCCCCCCCCCN1CCCC1 269982a_100000188435_100009813782 [0,0,0,1,0,0|1,0,2]=4 8927 B15R1.528 OCCCCCCCCNC1CCCC1 2230a_100000211070_100000033203 [0,0,0,1,0,0|1,0,2]=4 8928 B15R1.528 OCCCCCCCCNC1CCCC1 2230a_102515433106_100000179811 [0,0,0,1,0,0|1,0,2]=4 8929 B15R1.528 OCCCCCCCCNC1CCCC1 270004a_102515433106_100000210133 [0,0,0,1,0,0|1,0,2]=4 8930 B15R1.528 OCCCCCCCCNC1CCCC1 34a_100000211070_100000033203 [0,0,0,1,0,0|1,0,2]=4 8931 B15R1.528 OCCCCCCCCNC1CCCC1 34a_102515433106_100000179811 [0,0,0,1,0,0|1,0,2]=4 8932 B15R1.528 OCCCCCCCCOC1CCCC1 34a_100000210269_100000033203 [0,0,0,1,0,0|1,0,2]=4 8933 B15R1.528 OCCCCCCCCOC1CCCC1 7a_100000210269_100000033203 [0,0,0,1,0,0|1,0,2]=4 8934 B15R1.528 OCCCCCCCCSC1CCCC1 62a_100000033203_100000179811 [0,0,0,1,0,0|1,0,2]=4 8935 B15R1.528 OCCCCCCCCSC1CCCC1 62a_100011217020_100000033203 [0,0,0,1,0,0|1,0,2]=4 8936 B15R1.528 OCCCCCCCNCC1CCCC1 2230a_100000737975_100000760002 [0,0,0,1,0,0|1,0,2]=4 8937 B15R1.528 OCCCCCCCNCC1CCCC1 2230a_100011996573_100000740388 [0,0,0,1,0,0|1,0,2]=4 8938 B15R1.528 OCCCCCCCNCC1CCCC1 269862a_100011996573_100000746403 [0,0,0,1,0,0|1,0,2]=4 8939 B15R1.528 OCCCCCCCNCC1CCCC1 34a_100000737975_100000760002 [0,0,0,1,0,0|1,0,2]=4 8940 B15R1.528 OCCCCCCCNCC1CCCC1 34a_100011996573_100000740388 [0,0,0,1,0,0|1,0,2]=4 8941 B15R1.528 OCCCCCCCOCC1CCCC1 34a_100000742336_100000760002 [0,0,0,1,0,0|1,0,2]=4 8942 B15R1.528 OCCCCCCCOCC1CCCC1 7a_100000742336_100000760002 [0,0,0,1,0,0|1,0,2]=4 8943 B15R1.528 OCCCCCCCSCC1CCCC1 62a_100000740388_100000760002 [0,0,0,1,0,0|1,0,2]=4 8944 B15R1.528 OCCCCCCCSCC1CCCC1 62a_100000760002_100000740388 [0,0,0,1,0,0|1,0,2]=4 8945 B15R1.528 OCCCCCCNCCC1CCCC1 2230a_100000686447_100000760354 [0,0,0,1,0,0|1,0,2]=4 8946 B15R1.528 OCCCCCCNCCC1CCCC1 2230a_100000739158_100000766143 [0,0,0,1,0,0|1,0,2]=4 8947 B15R1.528 OCCCCCCNCCC1CCCC1 34a_100000686447_100000760354 [0,0,0,1,0,0|1,0,2]=4 8948 B15R1.528 OCCCCCCNCCC1CCCC1 34a_100000739158_100000766143 [0,0,0,1,0,0|1,0,2]=4 8949 B15R1.528 OCCCCCCOCCC1CCCC1 34a_100000749090_100000766143 [0,0,0,1,0,0|1,0,2]=4 8950 B15R1.528 OCCCCCCOCCC1CCCC1 7a_100000749090_100000766143 [0,0,0,1,0,0|1,0,2]=4 8951 B15R1.528 OCCCCCCSCCC1CCCC1 62a_100000760354_100000766143 [0,0,0,1,0,0|1,0,2]=4 8952 B15R1.528 OCCCCCCSCCC1CCCC1 62a_100000766143_100000760354 [0,0,0,1,0,0|1,0,2]=4 8953 B15R1.528 OCCCCCNCCCC1CCCC1 2230a_100000736752_100000746330 [0,0,0,1,0,0|1,0,2]=4 8954 B15R1.528 OCCCCCNCCCC1CCCC1 2230a_100000762737_100011713738 [0,0,0,1,0,0|1,0,2]=4 8955 B15R1.528 OCCCCCNCCCC1CCCC1 34a_100000736752_100000746330 [0,0,0,1,0,0|1,0,2]=4 8956 B15R1.528 OCCCCCNCCCC1CCCC1 34a_100000762737_100011713738 [0,0,0,1,0,0|1,0,2]=4 8957 B15R1.528 OCCCCCOCCCC1CCCC1 34a_100011215328_100000746330 [0,0,0,1,0,0|1,0,2]=4 8958 B15R1.528 OCCCCCOCCCC1CCCC1 7a_100011215328_100000746330 [0,0,0,1,0,0|1,0,2]=4 8959 B15R1.528 OCCCCCSCCCC1CCCC1 62a_100000746330_100011713738 [0,0,0,1,0,0|1,0,2]=4 8960 B15R1.528 OCCCCCSCCCC1CCCC1 62a_100011713738_100000746330 [0,0,0,1,0,0|1,0,2]=4 8961 B15R1.553 C#CCCCCCCN1CCCC1CC 2230a_100000754278_100012276617 [0,0,0,1,0,0|2,0,1]=4 8962 B15R1.553 C#CCCCCCCN1CCCC1CC 269982a_100000754278_100012276617 [0,0,0,1,0,0|2,0,1]=4 8963 B15R1.553 C#CCCCCCCN1CCCC1CC 34a_100000754278_100012276617 [0,0,0,1,0,0|2,0,1]=4 8964 B15R1.553 C=CCCCCCCN1CCCC1CC 2230a_100000754278_100011215473 [0,0,0,1,0,0|2,0,0]=3 8965 B15R1.553 C=CCCCCCCN1CCCC1CC 269982a_100000754278_100011215473 [0,0,0,1,0,0|2,0,0]=3 8966 B15R1.553 C=CCCCCCCN1CCCC1CC 34a_100000754278_100011215473 [0,0,0,1,0,0|2,0,0]=3 8967 B15R1.553 C=CCCCCCCN1CCC[C@@H]1CO 2230a_100000745186_100011215473 [0,0,0,1,0,0|3,0,0]=4 8968 B15R1.553 C=CCCCCCCN1CCC[C@@H]1CO 269982a_100000745186_100011215473 [0,0,0,1,0,0|3,0,0]=4 8969 B15R1.553 C=CCCCCCCN1CCC[C@@H]1CO 34a_100000745186_100011215473 [0,0,0,1,0,0|3,0,0]=4 8970 B15R1.553 C=CCCCCNCC1CCCN1CC 2230a_100000211693_100011215482 [0,0,0,1,0,0|3,0,0]=4 8971 B15R1.553 C=CCCCCOC[C@H]1CCCN1CC 34a_100011739246_100011215482 [0,0,0,1,0,0|3,0,0]=4 8972 B15R1.553 C=CCCCCOC[C@H]1CCCN1CC 7a_100011739246_100011215482 [0,0,0,1,0,0|3,0,0]=4 8973 B15R1.553 CCC1CCCC1NCCCCCC#N 270004a_100000061152_100000749056 [0,0,0,1,0,0|2,0,1]=4 8974 B15R1.553 CCC1CCCC1NCCCCCCO 269862a_100000686447_100000749056 [0,0,0,1,0,0|1,0,2]=4 8975 B15R1.553 CCC1CCCC1NCCCCCCO 270004a_100000686447_100000749056 [0,0,0,1,0,0|1,0,2]=4 8976 B15R1.553 CCC1CCCC1NCCCCCOC 269862a_100000747528_100000749056 [0,0,0,1,0,0|3,0,0]=4 8977 B15R1.553 CCC1CCCC1NCCCCCOC 270004a_100000747528_100000749056 [0,0,0,1,0,0|3,0,0]=4 8978 B15R1.553 CCC1CCCN1CCCCCCC#N 2230a_100000754278_100009813337 [0,0,0,1,0,0|2,0,1]=4 8979 B15R1.553 CCC1CCCN1CCCCCCC#N 269982a_100000754278_100009813337 [0,0,0,1,0,0|2,0,1]=4 8980 B15R1.553 CCC1CCCN1CCCCCCCO 2230a_100000754278_100000760002 [0,0,0,1,0,0|1,0,2]=4 8981 B15R1.553 CCC1CCCN1CCCCCCCO 269982a_100000754278_100000760002 [0,0,0,1,0,0|1,0,2]=4 8982 B15R1.553 CCC1CCCN1CCCCCCCO 34a_100000754278_100000760002 [0,0,0,1,0,0|1,0,2]=4 8983 B15R1.553 CCC1CCCN1CCCCCCOC 2230a_100000754278_100011998445 [0,0,0,1,0,0|3,0,0]=4 8984 B15R1.553 CCC1CCCN1CCCCCCOC 269982a_100000754278_100011998445 [0,0,0,1,0,0|3,0,0]=4 8985 B15R1.553 CCC1CCCN1CCCCCCOC 34a_100000754278_100011998445 [0,0,0,1,0,0|3,0,0]=4 8986 B15R1.553 CCCCCCCCN1CCCC1C#N 2230a_100000701862_100000210759 [0,0,0,1,0,0|2,0,1]=4 8987 B15R1.553 CCCCCCCCN1CCCC1CC 2230a_100000754278_100000210759 [0,0,0,1,0,0|2,0,1]=4 8988 B15R1.553 CCCCCCCCN1CCCC1CC 269982a_100000754278_100000210759 [0,0,0,1,0,0|2,0,1]=4 8989 B15R1.553 CCCCCCCCN1CCCC1CC 34a_100000754278_100000210759 [0,0,0,1,0,0|2,0,1]=4 8990 B15R1.553 CCCCCCCCN1CCC[C@@H]1C#N 2230a_106645074975_100000210759 [0,0,0,1,0,0|2,0,1]=4 8991 B15R1.553 CCCCCCCCN1CCC[C@@H]1C#N 269982a_106645074975_100000210759 [0,0,0,1,0,0|2,0,1]=4 8992 B15R1.553 CCCCCCCCN1CCC[C@@H]1CO 2230a_100000745186_100000210759 [0,0,0,1,0,0|1,0,2]=4 8993 B15R1.553 CCCCCCCCN1CCC[C@@H]1CO 269982a_100000745186_100000210759 [0,0,0,1,0,0|1,0,2]=4 8994 B15R1.553 CCCCCCCCN1CCC[C@@H]1CO 34a_100000745186_100000210759 [0,0,0,1,0,0|1,0,2]=4 8995 B15R1.553 CCCCCCCNC1CCCC1CC 269862a_100000229938_100000749056 [0,0,0,1,0,0|2,0,1]=4 8996 B15R1.553 CCCCCCCNC1CCCC1CC 270004a_100000229938_100000749056 [0,0,0,1,0,0|2,0,1]=4 8997 B15R1.553 CCCCCCCO[C@@H]1CCC[C@H]1C#N 34a_100011907464_100000210614 [0,0,0,1,0,0|2,0,1]=4 8998 B15R1.553 CCCCCCCO[C@@H]1CCC[C@H]1C#N 7a_100011907464_100000210614 [0,0,0,1,0,0|2,0,1]=4 8999 B15R1.553 CCN1CCCC1CNCCCCC=O 2230a_100000211693_100000139335 [0,0,0,1,0,0|2,0,0]=3 9000 B15R1.553 CCN1CCC[C@@H]1COCCCCC=O 7a_100011739246_100000139335 [0,0,0,1,0,0|2,0,0]=3 9001 B15R1.553 N#C[C@@H]1CCC[C@H]1OCCCCCC=O 7a_100011907464_100000139337 [0,0,0,1,0,0|2,0,1]=4 9002 B15R1.1045 C#CC1CCCCN1CCCCCC=O 2230a_200020621307_100000139337 [0,0,0,1,0,0|1,0,2]=4 9003 B15R1.1045 C#CC1CCCCN1CCCCCC=O 269982a_200020621307_100000139337 [0,0,0,1,0,0|1,0,2]=4 9004 B15R1.1045 C#CC1CCCCN1CCCCCCC 2230a_200020621307_100000210681 [0,0,0,1,0,0|2,0,1]=4 9005 B15R1.1045 C#CC1CCCCN1CCCCCCC 269982a_200020621307_100000210681 [0,0,0,1,0,0|2,0,1]=4 9006 B15R1.1045 C#CC1CCCCN1CCCCCCC 34a_200020621307_100000210614 [0,0,0,1,0,0|2,0,1]=4 9007 B15R1.1045 C#CCCCCCN1CCCCC1CC 2230a_100000210034_100012094781 [0,0,0,1,0,0|2,0,1]=4 9008 B15R1.1045 C#CCCCCCN1CCCCC1CC 269982a_100000210034_100012094781 [0,0,0,1,0,0|2,0,1]=4 9009 B15R1.1045 C#CCCCCCN1CCCCC1CC 34a_100000210034_100012094781 [0,0,0,1,0,0|2,0,1]=4 9010 B15R1.1045 C#CCCCCOC1CCCCC1CC 34a_100000210738_100010269958 [0,0,0,1,0,0|2,0,1]=4 9011 B15R1.1045 C#CCCCCOC1CCCCC1CC 7a_100000210738_100010269958 [0,0,0,1,0,0|2,0,1]=4 9012 B15R1.1045 C=CCCCCCN1CCCCC1CC 2230a_100000210034_100000700193 [0,0,0,1,0,0|2,0,0]=3 9013 B15R1.1045 C=CCCCCCN1CCCCC1CC 269982a_100000210034_100000700193 [0,0,0,1,0,0|2,0,0]=3 9014 B15R1.1045 C=CCCCCCN1CCCCC1CC 34a_100000210034_100000700193 [0,0,0,1,0,0|2,0,0]=3 9015 B15R1.1045 C=CCCCCCN1CCCCC1CO 2230a_100000210821_100000700193 [0,0,0,1,0,0|3,0,0]=4 9016 B15R1.1045 C=CCCCCCN1CCCCC1CO 269982a_100000210821_100000700193 [0,0,0,1,0,0|3,0,0]=4 9017 B15R1.1045 C=CCCCCCN1CCCCC1CO 34a_100000210821_100000700193 [0,0,0,1,0,0|3,0,0]=4 9018 B15R1.1045 C=CCCCCCN1CCOC[C@@H]1CC 2230a_100016988097_100000700193 [0,0,0,1,0,0|3,0,0]=4 9019 B15R1.1045 C=CCCCCCN1CCOC[C@@H]1CC 269982a_100016988097_100000700193 [0,0,0,1,0,0|3,0,0]=4 9020 B15R1.1045 C=CCCCCCN1CCOC[C@@H]1CC 34a_100016988097_100000700193 [0,0,0,1,0,0|3,0,0]=4 9021 B15R1.1045 C=CCCCCNC1CCCCC1CC 269862a_100000703577_100000757040 [0,0,0,1,0,0|2,0,0]=3 9022 B15R1.1045 C=CCCCCNC1CCCCC1CC 270004a_100000703577_100000757040 [0,0,0,1,0,0|2,0,0]=3 9023 B15R1.1045 C=CCCCCNC1CCCCC1CO 270004a_100000703577_100009861125 [0,0,0,1,0,0|3,0,0]=4 9024 B15R1.1045 C=CCCCCNC1CCCCC1OC 270004a_100000703577_100000740605 [0,0,0,1,0,0|3,0,0]=4 9025 B15R1.1045 C=CCCCCNC1CCCCC1OC 34a_100011208099_100011215482 [0,0,0,1,0,0|3,0,0]=4 9026 B15R1.1045 C=CCCCCOC1CCCCC1CC 34a_100000210738_100011215482 [0,0,0,1,0,0|2,0,0]=3 9027 B15R1.1045 C=CCCCCOC1CCCCC1CC 7a_100000210738_100011215482 [0,0,0,1,0,0|2,0,0]=3 9028 B15R1.1045 C=CCCCCOC1CCCCC1CN 34a_100011216029_100011215482 [0,0,0,1,0,0|3,0,0]=4 9029 B15R1.1045 C=CCCCCO[C@@H]1CCCC[C@H]1NC 34a_100000708425_100011215482 [0,0,0,1,0,0|3,0,0]=4 9030 B15R1.1045 C=CCCCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100011215482 [0,0,0,1,0,0|3,0,0]=4 9031 B15R1.1045 C=CCCCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100011215482 [0,0,0,1,0,0|3,0,0]=4 9032 B15R1.1045 C=CCCCNCC1CCCCN1CC 2230a_100000754393_100011713584 [0,0,0,1,0,0|3,0,0]=4 9033 B15R1.1045 C=CCCCNCC1CCCCN1CC 34a_100000754393_100000757094 [0,0,0,1,0,0|3,0,0]=4 9034 B15R1.1045 C=CCCCOCC1CCCCN1CC 34a_100000225091_100000757094 [0,0,0,1,0,0|3,0,0]=4 9035 B15R1.1045 C=CCCCOCC1CCCCN1CC 7a_100000225091_100000757094 [0,0,0,1,0,0|3,0,0]=4 9036 B15R1.1045 C=CCCNCCN1CCCCC1CC 2230a_100000755458_100000754431 [0,0,0,1,0,0|3,0,0]=4 9037 B15R1.1045 C=CCCNCCN1CCCCC1CC 34a_100000755458_100000754431 [0,0,0,1,0,0|3,0,0]=4 9038 B15R1.1045 C=CCNCCCN1CCCCC1CC 34a_100011191702_100015514636 [0,0,0,1,0,0|3,0,0]=4 9039 B15R1.1045 C=COCCCNC1CCCCC1CC 269862a_100000210767_100000757040 [0,0,0,1,0,0|3,0,0]=4 9040 B15R1.1045 C=COCCCNC1CCCCC1CC 270004a_100000210767_100000757040 [0,0,0,1,0,0|3,0,0]=4 9041 B15R1.1045 CCC1CCCCC1NCCCCC#N 270004a_100000751965_100000757040 [0,0,0,1,0,0|2,0,1]=4 9042 B15R1.1045 CCC1CCCCC1NCCCCCO 269862a_100000762737_100000757040 [0,0,0,1,0,0|1,0,2]=4 9043 B15R1.1045 CCC1CCCCC1NCCCCCO 270004a_100000762737_100000757040 [0,0,0,1,0,0|1,0,2]=4 9044 B15R1.1045 CCC1CCCCC1OCCCCC#N 7a_100000210738_100000211819 [0,0,0,1,0,0|2,0,1]=4 9045 B15R1.1045 CCC1CCCCC1OCCCCC=O 7a_100000210738_100000139335 [0,0,0,1,0,0|1,0,0]=2 9046 B15R1.1045 CCC1CCCCC1OCCCCCF 34a_100000210738_100000729378 [0,0,0,1,0,0|2,0,1]=4 9047 B15R1.1045 CCC1CCCCC1OCCCCCF 7a_100000210738_100000729378 [0,0,0,1,0,0|2,0,1]=4 9048 B15R1.1045 CCC1CCCCC1OCCCCCO 34a_100000210738_100000746330 [0,0,0,1,0,0|1,0,2]=4 9049 B15R1.1045 CCC1CCCCC1OCCCCCO 7a_100000210738_100000746330 [0,0,0,1,0,0|1,0,2]=4 9050 B15R1.1045 CCC1CCCCC1OCCCCOC 34a_100000210738_100000755781 [0,0,0,1,0,0|3,0,0]=4 9051 B15R1.1045 CCC1CCCCC1OCCCCOC 7a_100000210738_100000730899 [0,0,0,1,0,0|3,0,0]=4 9052 B15R1.1045 CCC1CCCCN1CCCCCC#N 2230a_100000210034_100009813376 [0,0,0,1,0,0|2,0,1]=4 9053 B15R1.1045 CCC1CCCCN1CCCCCC#N 269982a_100000210034_100009813376 [0,0,0,1,0,0|2,0,1]=4 9054 B15R1.1045 CCC1CCCCN1CCCCCC=O 2230a_100000210034_100000139337 [0,0,0,1,0,0|1,0,0]=2 9055 B15R1.1045 CCC1CCCCN1CCCCCC=O 269982a_100000210034_100000139337 [0,0,0,1,0,0|1,0,0]=2 9056 B15R1.1045 CCC1CCCCN1CCCCCCF 2230a_100000210034_100015922095 [0,0,0,1,0,0|2,0,1]=4 9057 B15R1.1045 CCC1CCCCN1CCCCCCF 269982a_100000210034_100015922095 [0,0,0,1,0,0|2,0,1]=4 9058 B15R1.1045 CCC1CCCCN1CCCCCCF 34a_100000210034_100015922095 [0,0,0,1,0,0|2,0,1]=4 9059 B15R1.1045 CCC1CCCCN1CCCCCCO 2230a_100000210034_100000766143 [0,0,0,1,0,0|1,0,2]=4 9060 B15R1.1045 CCC1CCCCN1CCCCCCO 269982a_100000210034_100000766143 [0,0,0,1,0,0|1,0,2]=4 9061 B15R1.1045 CCC1CCCCN1CCCCCCO 34a_100000210034_100000766143 [0,0,0,1,0,0|1,0,2]=4 9062 B15R1.1045 CCC1CCCCN1CCCNCC=O 34a_100011191702_200009817547 [0,0,0,1,0,0|2,0,0]=3 9063 B15R1.1045 CCCCCCCN1CCCCC1C#N 34a_100016989756_100000210614 [0,0,0,1,0,0|2,0,1]=4 9064 B15R1.1045 CCCCCCCN1CCCCC1CC 2230a_100000210034_100000210681 [0,0,0,1,0,0|2,0,1]=4 9065 B15R1.1045 CCCCCCCN1CCCCC1CC 269982a_100000210034_100000210681 [0,0,0,1,0,0|2,0,1]=4 9066 B15R1.1045 CCCCCCCN1CCCCC1CC 34a_100000210034_100000210614 [0,0,0,1,0,0|2,0,1]=4 9067 B15R1.1045 CCCCCCCN1CCCCC1CO 2230a_100000210821_100000210681 [0,0,0,1,0,0|1,0,2]=4 9068 B15R1.1045 CCCCCCCN1CCCCC1CO 269982a_100000210821_100000210681 [0,0,0,1,0,0|1,0,2]=4 9069 B15R1.1045 CCCCCCCN1CCCCC1CO 34a_100000210821_100000210614 [0,0,0,1,0,0|1,0,2]=4 9070 B15R1.1045 CCCCCCNC1CCCCC1CC 269862a_100000210581_100000757040 [0,0,0,1,0,0|2,0,1]=4 9071 B15R1.1045 CCCCCCNC1CCCCC1CC 270004a_100000210581_100000757040 [0,0,0,1,0,0|2,0,1]=4 9072 B15R1.1045 CCCCCCNC1CCCCC1CO 270004a_100000210581_100009861125 [0,0,0,1,0,0|1,0,2]=4 9073 B15R1.1045 CCCCCCNC1CCCCC1OC 270004a_100000210581_100000740605 [0,0,0,1,0,0|3,0,0]=4 9074 B15R1.1045 CCCCCCNC1CCCCC1OC 34a_100011208099_100000210314 [0,0,0,1,0,0|3,0,0]=4 9075 B15R1.1045 CCCCCCOC1CCCCC1CC 34a_100000210738_100000210314 [0,0,0,1,0,0|2,0,1]=4 9076 B15R1.1045 CCCCCCOC1CCCCC1CC 7a_100000210738_100000210314 [0,0,0,1,0,0|2,0,1]=4 9077 B15R1.1045 CCCCCCOC1CCCCC1CN 34a_100011216029_100000210314 [0,0,0,1,0,0|2,0,1]=4 9078 B15R1.1045 CCCCCCO[C@@H]1CCCC[C@H]1NC 34a_100000708425_100000210314 [0,0,0,1,0,0|3,0,0]=4 9079 B15R1.1045 CCCCCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000210314 [0,0,0,1,0,0|3,0,0]=4 9080 B15R1.1045 CCCCCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000210314 [0,0,0,1,0,0|3,0,0]=4 9081 B15R1.1045 CCN1CCCCC1CNCCCC=O 2230a_100000754393_200011292268 [0,0,0,1,0,0|2,0,0]=3 9082 B15R1.1045 CCN1CCCCC1COCCCC=O 7a_100000225091_200011292268 [0,0,0,1,0,0|2,0,0]=3 9083 B15R1.1045 CC[C@H]1COCCN1CCCCCC=O 2230a_100016988097_100000139337 [0,0,0,1,0,0|2,0,0]=3 9084 B15R1.1045 CC[C@H]1COCCN1CCCCCC=O 269982a_100016988097_100000139337 [0,0,0,1,0,0|2,0,0]=3 9085 B15R1.1045 CO[C@H]1CCCC[C@@H]1OCCCCC=O 7a_200009815850_100000139335 [0,0,0,1,0,0|2,0,0]=3 9086 B15R1.1045 O=CCCCCCN1CCCCC1CO 2230a_100000210821_100000139337 [0,0,0,1,0,0|2,0,0]=3 9087 B15R1.1045 O=CCCCCCN1CCCCC1CO 269982a_100000210821_100000139337 [0,0,0,1,0,0|2,0,0]=3 9088 B15R1.1045 O=CCCCCCN1CCOC[C@H]1CO 2230a_100000717676_100000139337 [0,0,0,1,0,0|3,0,0]=4 9089 B15R1.1045 O=CCCCCCN1CCOC[C@H]1CO 269982a_100000717676_100000139337 [0,0,0,1,0,0|3,0,0]=4 9090 B15R1.1045 O=CCCCCNC1CCOCC1CO 2230a_214813039666_100000139335 [0,0,0,1,0,0|3,0,0]=4 9091 B15R1.1045 O=CCNCCCN1CCCCC1CO 34a_200011473794_200009817547 [0,0,0,1,0,0|3,0,0]=4 9092 B15R1.1137 CNC1CCCCCCCCCCC1=O 2230a_106832991635_200009990614 [0,0,0,1,0,0|1,0,0]=2 9093 B15R1.1137 CNC1CCCCCCCCCCC1=O 34a_100102657272_200009990614 [0,0,0,1,0,0|1,0,0]=2 9094 B15R1.1137 CNC1CCCCCCCCCCC1=O 7a_106832991635_200009990614 [0,0,0,1,0,0|1,0,0]=2 9095 B15R1.1137 COC1CCCCCCCCCCC1=O 34a_100138415774_200009990614 [0,0,0,1,0,0|1,0,0]=2 9096 B15R1.1137 CSC1CCCCCCCCCCC1=O 62a_200000210301_200009990614 [0,0,0,1,0,0|1,0,0]=2 9097 B15R1.1137 CSC1CCCCCCCCCCC1=O 62a_200009990614_200000210301 [0,0,0,1,0,0|1,0,0]=2 9098 B15R1.1137 [13CH3]SC1CCCCCCCCCCC1=O 62a_200009990614_200025704644 [0,0,0,1,0,0|1,0,0]=2 9099 B15R1.1137 [13CH3]SC1CCCCCCCCCCC1=O 62a_200025704644_200009990614 [0,0,0,1,0,0|1,0,0]=2 9100 B15R1.1189 C=CCCCN1CCCCC1CCCO 2230a_100011934581_100011713584 [0,0,0,1,0,0|3,0,0]=4 9101 B15R1.1189 C=CCCCN1CCCCC1CCCO 269982a_100011934581_100000757094 [0,0,0,1,0,0|3,0,0]=4 9102 B15R1.1189 C=CCCCN1CCCCC1CCCO 34a_100011934581_100000757094 [0,0,0,1,0,0|3,0,0]=4 9103 B15R1.1189 C=CCCCN1CCCCC1CCOC 2230a_100015186528_100011713584 [0,0,0,1,0,0|3,0,0]=4 9104 B15R1.1189 C=CCCCN1CCCCC1CCOC 269982a_100015186528_100000757094 [0,0,0,1,0,0|3,0,0]=4 9105 B15R1.1189 C=CCCCN1CCCCC1CCOC 34a_100015186528_100000757094 [0,0,0,1,0,0|3,0,0]=4 9106 B15R1.1189 C=CCCN1CCCCC1CCCOC 2230a_100011804088_100000754431 [0,0,0,1,0,0|3,0,0]=4 9107 B15R1.1189 C=CCCN1CCCCC1CCCOC 269982a_100011804088_100000754431 [0,0,0,1,0,0|3,0,0]=4 9108 B15R1.1189 C=CCCN1CCCCC1CCCOC 34a_100011804088_100000754431 [0,0,0,1,0,0|3,0,0]=4 9109 B15R1.1189 CCCCCN1CCCCC1CCCO 2230a_100011934581_100000210326 [0,0,0,1,0,0|1,0,2]=4 9110 B15R1.1189 CCCCCN1CCCCC1CCCO 269982a_100011934581_100000210215 [0,0,0,1,0,0|1,0,2]=4 9111 B15R1.1189 CCCCCN1CCCCC1CCCO 34a_100011934581_100000718602 [0,0,0,1,0,0|1,0,2]=4 9112 B15R1.1189 CCCCCN1CCCCC1CCOC 2230a_100015186528_100000210326 [0,0,0,1,0,0|3,0,0]=4 9113 B15R1.1189 CCCCCN1CCCCC1CCOC 269982a_100015186528_100000210215 [0,0,0,1,0,0|3,0,0]=4 9114 B15R1.1189 CCCCCN1CCCCC1CCOC 34a_100015186528_100000718602 [0,0,0,1,0,0|3,0,0]=4 9115 B15R1.1189 CCCCN1CCCCC1CCCOC 2230a_100011804088_100000210211 [0,0,0,1,0,0|3,0,0]=4 9116 B15R1.1189 CCCCN1CCCCC1CCCOC 269982a_100011804088_100000210211 [0,0,0,1,0,0|3,0,0]=4 9117 B15R1.1189 CCCCN1CCCCC1CCCOC 34a_100011804088_100000210210 [0,0,0,1,0,0|3,0,0]=4 9118 B15R1.1189 CCCCNC1CCCCC1CCC#N 270004a_100000102301_100000034616 [0,0,0,1,0,0|2,0,1]=4 9119 B15R1.1189 COCCC1CCCCN1CCCC=O 2230a_100015186528_200011292268 [0,0,0,1,0,0|2,0,0]=3 9120 B15R1.1189 COCCC1CCCCN1CCCC=O 269982a_100015186528_200011292268 [0,0,0,1,0,0|2,0,0]=3 9121 B15R1.1189 NCCCN1CCCCC1COCC=O 34a_200011473794_200009817547 [0,0,0,1,0,0|3,0,0]=4 9122 B15R1.1189 O=CCCCN1CCCCC1CCCO 2230a_100011934581_200011292268 [0,0,0,1,0,0|2,0,0]=3 9123 B15R1.1189 O=CCCCN1CCCCC1CCCO 269982a_100011934581_200011292268 [0,0,0,1,0,0|2,0,0]=3 9124 B15R1.1202 C=CCCNC1CCCC1CCCCC 269862a_100015191253_200000198059 [0,0,0,1,0,0|2,0,0]=3 9125 B15R1.1202 C=CCCNC1CCCC1CCCCC 270004a_100015191253_200000198059 [0,0,0,1,0,0|2,0,0]=3 9126 B15R1.1202 CCCCCC1CCCC1NCCC#N 270004a_100000720768_200000198059 [0,0,0,1,0,0|2,0,1]=4 9127 B15R1.1202 CCCCCC1CCCC1NCCCC 269862a_100000102301_200000198059 [0,0,0,1,0,0|2,0,1]=4 9128 B15R1.1202 CCCCCC1CCCC1NCCCC 270004a_100000102301_200000198059 [0,0,0,1,0,0|2,0,1]=4 9129 B15R1.1202 CCCCCC1CCCC1NCCCF 269862a_100015189416_200000198059 [0,0,0,1,0,0|2,0,1]=4 9130 B15R1.1202 CCCCCC1CCCC1NCCCF 270004a_100015189416_200000198059 [0,0,0,1,0,0|2,0,1]=4 9131 B15R1.1202 CCCCCC1CCCC1NCCCO 269862a_100000182051_200000198059 [0,0,0,1,0,0|1,0,2]=4 9132 B15R1.1202 CCCCCC1CCCC1NCCCO 270004a_100000182051_200000198059 [0,0,0,1,0,0|1,0,2]=4 9133 B15R1.1202 CCCCCC1CCCC1NCCOC 269862a_100000209980_200000198059 [0,0,0,1,0,0|3,0,0]=4 9134 B15R1.1202 CCCCCC1CCCC1NCCOC 270004a_100000209980_200000198059 [0,0,0,1,0,0|3,0,0]=4 9135 B15R1.1202 CCCCCC1CCCC1NCCSC 269862a_100020590264_200000198059 [0,0,0,1,0,0|3,0,0]=4 9136 B15R1.1202 CCCCCC1CCCC1NCCSC 270004a_100020590264_200000198059 [0,0,0,1,0,0|3,0,0]=4 9137 B15R1.1948 C=CCCCCCN1CCC[C@H]1COC 2230a_100020646714_100000700193 [0,0,0,1,0,0|3,0,0]=4 9138 B15R1.1948 C=CCCCCCN1CCC[C@H]1COC 269982a_100020646714_100000700193 [0,0,0,1,0,0|3,0,0]=4 9139 B15R1.1948 C=CCCCCCN1CCC[C@H]1COC 34a_100020646714_100000700193 [0,0,0,1,0,0|3,0,0]=4 9140 B15R1.1948 C=CCCCCNC1CCCC1CCC 269862a_100000703577_100000723119 [0,0,0,1,0,0|2,0,0]=3 9141 B15R1.1948 C=CCCCCNC1CCCC1CCC 270004a_100000703577_100000723119 [0,0,0,1,0,0|2,0,0]=3 9142 B15R1.1948 C=CCCCOCC1CCCN1CCC 34a_200000694710_100000757094 [0,0,0,1,0,0|3,0,0]=4 9143 B15R1.1948 C=CCCCOCC1CCCN1CCC 7a_200000694710_100000757094 [0,0,0,1,0,0|3,0,0]=4 9144 B15R1.1948 C=COCCCNC1CCCC1CCC 269862a_100000210767_100000723119 [0,0,0,1,0,0|3,0,0]=4 9145 B15R1.1948 C=COCCCNC1CCCC1CCC 270004a_100000210767_100000723119 [0,0,0,1,0,0|3,0,0]=4 9146 B15R1.1948 CCCC1CCCC1NCCCCC#N 270004a_100000751965_100000723119 [0,0,0,1,0,0|2,0,1]=4 9147 B15R1.1948 CCCC1CCCC1NCCCCCO 269862a_100000762737_100000723119 [0,0,0,1,0,0|1,0,2]=4 9148 B15R1.1948 CCCC1CCCC1NCCCCCO 270004a_100000762737_100000723119 [0,0,0,1,0,0|1,0,2]=4 9149 B15R1.1948 CCCCCCCC1CCCC1NCC 269862a_100015525214_200011216720 [0,0,0,1,0,0|2,0,1]=4 9150 B15R1.1948 CCCCCCCC1CCCC1NCC 270004a_100015525214_200011216720 [0,0,0,1,0,0|2,0,1]=4 9151 B15R1.1948 CCCCCCCN1CCC[C@H]1COC 2230a_100020646714_100000210681 [0,0,0,1,0,0|3,0,0]=4 9152 B15R1.1948 CCCCCCCN1CCC[C@H]1COC 269982a_100020646714_100000210681 [0,0,0,1,0,0|3,0,0]=4 9153 B15R1.1948 CCCCCCCN1CCC[C@H]1COC 34a_100020646714_100000210614 [0,0,0,1,0,0|3,0,0]=4 9154 B15R1.1948 CCCCCCNC1CCCC1CCC 269862a_100000210581_100000723119 [0,0,0,1,0,0|2,0,1]=4 9155 B15R1.1948 CCCCCCNC1CCCC1CCC 270004a_100000210581_100000723119 [0,0,0,1,0,0|2,0,1]=4 9156 B15R1.1948 CCCN1CCCC1COCCCC=O 7a_200000694710_200011292268 [0,0,0,1,0,0|2,0,0]=3 9157 B15R1.1948 COC[C@@H]1CCCN1CCCCCC=O 2230a_100020646714_100000139337 [0,0,0,1,0,0|2,0,0]=3 9158 B15R1.1948 COC[C@@H]1CCCN1CCCCCC=O 269982a_100020646714_100000139337 [0,0,0,1,0,0|2,0,0]=3 9159 B15R1.1951 C#CCCCCCN1CCCCCCC1 2230a_100000211400_100012094781 [0,0,0,1,0,0|2,0,1]=4 9160 B15R1.1951 C#CCCCCCN1CCCCCCC1 269982a_100000211400_100012094781 [0,0,0,1,0,0|2,0,1]=4 9161 B15R1.1951 C#CCCCCCN1CCCCCCC1 34a_100000211400_100012094781 [0,0,0,1,0,0|2,0,1]=4 9162 B15R1.1951 C#CCCCCNC1CCCCCCC1 2230a_100000211152_100010269958 [0,0,0,1,0,0|2,0,1]=4 9163 B15R1.1951 C#CCCCCNC1CCCCCCC1 34a_100000211152_100010269958 [0,0,0,1,0,0|2,0,1]=4 9164 B15R1.1951 C#CCCCCOC1CCCCCCC1 34a_100000210054_100010269958 [0,0,0,1,0,0|2,0,1]=4 9165 B15R1.1951 C#CCCCCOC1CCCCCCC1 7a_100000210054_100010269958 [0,0,0,1,0,0|2,0,1]=4 9166 B15R1.1951 C#CCCCOCC1CCCCCCC1 34a_100011216312_100000695029 [0,0,0,1,0,0|2,0,1]=4 9167 B15R1.1951 C#CCCCOCC1CCCCCCC1 7a_100011216312_100011215417 [0,0,0,1,0,0|2,0,1]=4 9168 B15R1.1951 C#CCCNCCC1CCCCCCC1 2230a_100011532352_100000688953 [0,0,0,1,0,0|2,0,1]=4 9169 B15R1.1951 C#CCCNCCC1CCCCCCC1 34a_100011532352_100000688953 [0,0,0,1,0,0|2,0,1]=4 9170 B15R1.1951 C/C=C/CNCCC1CCCCCCC1 34a_100011532352_100102629194 [0,0,0,1,0,0|2,0,1]=4 9171 B15R1.1951 C=CCCCCCN1CCCCCCC1 2230a_100000211400_100000700193 [0,0,0,1,0,0|2,0,0]=3 9172 B15R1.1951 C=CCCCCCN1CCCCCCC1 269982a_100000211400_100000700193 [0,0,0,1,0,0|2,0,0]=3 9173 B15R1.1951 C=CCCCCCN1CCCCCCC1 34a_100000211400_100000700193 [0,0,0,1,0,0|2,0,0]=3 9174 B15R1.1951 C=CCCCCNC1CCCCCCC1 2230a_100000211152_100011215482 [0,0,0,1,0,0|2,0,0]=3 9175 B15R1.1951 C=CCCCCNC1CCCCCCC1 270004a_100000703577_100000210524 [0,0,0,1,0,0|2,0,0]=3 9176 B15R1.1951 C=CCCCCNC1CCCCCCC1 34a_100000211152_100011215482 [0,0,0,1,0,0|2,0,0]=3 9177 B15R1.1951 C=CCCCCOC1CCCCCCC1 34a_100000210054_100011215482 [0,0,0,1,0,0|2,0,0]=3 9178 B15R1.1951 C=CCCCCOC1CCCCCCC1 7a_100000210054_100011215482 [0,0,0,1,0,0|2,0,0]=3 9179 B15R1.1951 C=CCCCOCC1CCCCCCC1 34a_100011216312_100000757094 [0,0,0,1,0,0|2,0,0]=3 9180 B15R1.1951 C=CCCCOCC1CCCCCCC1 7a_100011216312_100000757094 [0,0,0,1,0,0|2,0,0]=3 9181 B15R1.1951 C=CCCNCCC1CCCCCCC1 2230a_100011532352_100000754431 [0,0,0,1,0,0|2,0,0]=3 9182 B15R1.1951 C=CCCNCCC1CCCCCCC1 34a_100011532352_100000754431 [0,0,0,1,0,0|2,0,0]=3 9183 B15R1.1951 C=COCCCNC1CCCCCCC1 270004a_100000210767_100000210524 [0,0,0,1,0,0|3,0,0]=4 9184 B15R1.1951 C=COCCOCC1CCCCCCC1 34a_100011216312_100000039644 [0,0,0,1,0,0|3,0,0]=4 9185 B15R1.1951 C=COCCOCC1CCCCCCC1 7a_100011216312_100000039644 [0,0,0,1,0,0|3,0,0]=4 9186 B15R1.1951 CC=CCNCCC1CCCCCCC1 2230a_100011532352_100000070051 [0,0,0,1,0,0|2,0,1]=4 9187 B15R1.1951 CC=CCNCCC1CCCCCCC1 34a_100011532352_100000070051 [0,0,0,1,0,0|2,0,1]=4 9188 B15R1.1951 CCCCCCCN1CCCCCCC1 2230a_100000211400_100000210681 [0,0,0,1,0,0|2,0,1]=4 9189 B15R1.1951 CCCCCCCN1CCCCCCC1 269982a_100000211400_100000210681 [0,0,0,1,0,0|2,0,1]=4 9190 B15R1.1951 CCCCCCCN1CCCCCCC1 34a_100000211400_100000210614 [0,0,0,1,0,0|2,0,1]=4 9191 B15R1.1951 CCCCCCNC1CCCCCCC1 2230a_100000211152_100000210314 [0,0,0,1,0,0|2,0,1]=4 9192 B15R1.1951 CCCCCCNC1CCCCCCC1 270004a_100000210581_100000210524 [0,0,0,1,0,0|2,0,1]=4 9193 B15R1.1951 CCCCCCNC1CCCCCCC1 34a_100000211152_100000210314 [0,0,0,1,0,0|2,0,1]=4 9194 B15R1.1951 CCCCCCOC1C=CCCCCC1 34a_100000688657_100000210314 [0,0,0,1,0,0|2,0,0]=3 9195 B15R1.1951 CCCCCCOC1CCCCCCC1 34a_100000210054_100000210314 [0,0,0,1,0,0|2,0,1]=4 9196 B15R1.1951 CCCCCCOC1CCCCCCC1 7a_100000210054_100000210314 [0,0,0,1,0,0|2,0,1]=4 9197 B15R1.1951 CCCCCOCC1CCCCCCC1 34a_100011216312_100000718602 [0,0,0,1,0,0|2,0,1]=4 9198 B15R1.1951 CCCCCOCC1CCCCCCC1 7a_100011216312_100000210326 [0,0,0,1,0,0|2,0,1]=4 9199 B15R1.1951 CCCCNCCC1CCCCCCC1 2230a_100011532352_100000210211 [0,0,0,1,0,0|2,0,1]=4 9200 B15R1.1951 CCCCNCCC1CCCCCCC1 34a_100011532352_100000210210 [0,0,0,1,0,0|2,0,1]=4 9201 B15R1.1951 CCCCOCOC1C=CCCCCC1 34a_100000688657_100011995733 [0,0,0,1,0,0|3,0,0]=4 9202 B15R1.1951 CCCOCCOC1C=CCCCCC1 34a_100000688657_100011215938 [0,0,0,1,0,0|3,0,0]=4 9203 B15R1.1951 CCOCCCOC1C=CCCCCC1 34a_100000688657_100012232248 [0,0,0,1,0,0|3,0,0]=4 9204 B15R1.1951 COCCCCNC1CCCCCCC1 2230a_100000211152_100000730899 [0,0,0,1,0,0|3,0,0]=4 9205 B15R1.1951 COCCCCNC1CCCCCCC1 34a_100000211152_100000755781 [0,0,0,1,0,0|3,0,0]=4 9206 B15R1.1951 COCCCCOC1C=CCCCCC1 34a_100000688657_100000755781 [0,0,0,1,0,0|3,0,0]=4 9207 B15R1.1951 COCCCCOC1CCCCCCC1 34a_100000210054_100000755781 [0,0,0,1,0,0|3,0,0]=4 9208 B15R1.1951 COCCCCOC1CCCCCCC1 7a_100000210054_100000730899 [0,0,0,1,0,0|3,0,0]=4 9209 B15R1.1951 COCCCOCC1CCCCCCC1 34a_100011216312_100000740836 [0,0,0,1,0,0|3,0,0]=4 9210 B15R1.1951 COCCCOCC1CCCCCCC1 7a_100011216312_100000740836 [0,0,0,1,0,0|3,0,0]=4 9211 B15R1.1951 COCCNCCC1CCCCCCC1 2230a_100011532352_100011201679 [0,0,0,1,0,0|3,0,0]=4 9212 B15R1.1951 COCCNCCC1CCCCCCC1 34a_100011532352_100011201679 [0,0,0,1,0,0|3,0,0]=4 9213 B15R1.1951 CSCCNCCC1CCCCCCC1 2230a_100011532352_100000751147 [0,0,0,1,0,0|3,0,0]=4 9214 B15R1.1951 CSCCNCCC1CCCCCCC1 34a_100011532352_100000212216 [0,0,0,1,0,0|3,0,0]=4 9215 B15R1.1951 FCCCCCCN1CCCCCCC1 2230a_100000211400_100015922095 [0,0,0,1,0,0|2,0,1]=4 9216 B15R1.1951 FCCCCCCN1CCCCCCC1 269982a_100000211400_100015922095 [0,0,0,1,0,0|2,0,1]=4 9217 B15R1.1951 FCCCCCCN1CCCCCCC1 34a_100000211400_100015922095 [0,0,0,1,0,0|2,0,1]=4 9218 B15R1.1951 FCCCCCNC1CCCCCCC1 2230a_100000211152_100000729378 [0,0,0,1,0,0|2,0,1]=4 9219 B15R1.1951 FCCCCCNC1CCCCCCC1 34a_100000211152_100000729378 [0,0,0,1,0,0|2,0,1]=4 9220 B15R1.1951 FCCCCCOC1C=CCCCCC1 34a_100000688657_100000729378 [0,0,0,1,0,0|3,0,0]=4 9221 B15R1.1951 FCCCCCOC1CCCCCCC1 34a_100000210054_100000729378 [0,0,0,1,0,0|2,0,1]=4 9222 B15R1.1951 FCCCCCOC1CCCCCCC1 7a_100000210054_100000729378 [0,0,0,1,0,0|2,0,1]=4 9223 B15R1.1951 FCCCCOCC1CCCCCCC1 34a_100011216312_100000729493 [0,0,0,1,0,0|2,0,1]=4 9224 B15R1.1951 FCCCCOCC1CCCCCCC1 7a_100011216312_100000729493 [0,0,0,1,0,0|2,0,1]=4 9225 B15R1.1951 FCCCNCCC1CCCCCCC1 2230a_100011532352_100011934791 [0,0,0,1,0,0|2,0,1]=4 9226 B15R1.1951 FCCCNCCC1CCCCCCC1 34a_100011532352_100011934791 [0,0,0,1,0,0|2,0,1]=4 9227 B15R1.1951 N#CCCCCCN1CCCCCCC1 2230a_100000211400_100009813376 [0,0,0,1,0,0|2,0,1]=4 9228 B15R1.1951 N#CCCCCCN1CCCCCCC1 269982a_100000211400_100009813376 [0,0,0,1,0,0|2,0,1]=4 9229 B15R1.1951 N#CCCCCNC1CCCCCCC1 2230a_100000211152_100000211819 [0,0,0,1,0,0|2,0,1]=4 9230 B15R1.1951 N#CCCCCNC1CCCCCCC1 270004a_100000751965_100000210524 [0,0,0,1,0,0|2,0,1]=4 9231 B15R1.1951 N#CCCCCOC1CCCCCCC1 7a_100000210054_100000211819 [0,0,0,1,0,0|2,0,1]=4 9232 B15R1.1951 N#CCCCOCC1CCCCCCC1 7a_100011216312_100000687738 [0,0,0,1,0,0|2,0,1]=4 9233 B15R1.1951 N#CCCNCCC1CCCCCCC1 2230a_100011532352_100011215226 [0,0,0,1,0,0|2,0,1]=4 9234 B15R1.1951 O=CCCCCCN1CCCCCCC1 2230a_100000211400_100000139337 [0,0,0,1,0,0|1,0,0]=2 9235 B15R1.1951 O=CCCCCCN1CCCCCCC1 269982a_100000211400_100000139337 [0,0,0,1,0,0|1,0,0]=2 9236 B15R1.1951 O=CCCCCNC1CCCCCCC1 2230a_100000211152_100000139335 [0,0,0,1,0,0|1,0,0]=2 9237 B15R1.1951 O=CCCCCOC1CCCCCCC1 7a_100000210054_100000139335 [0,0,0,1,0,0|1,0,0]=2 9238 B15R1.1951 O=CCCCCSC1CC/C=C\CCC1 62a_100000139335_100021000466 [0,0,0,1,0,0|1,0,2]=4 9239 B15R1.1951 O=CCCCCSC1CC/C=C\CCC1 62a_100021000466_100000139335 [0,0,0,1,0,0|1,0,2]=4 9240 B15R1.1951 O=CCCCNCC1CC/C=C\CCC1 2230a_100102730862_200011292268 [0,0,0,1,0,0|1,0,2]=4 9241 B15R1.1951 O=CCCCOCC1CCCCCCC1 7a_100011216312_200011292268 [0,0,0,1,0,0|1,0,0]=2 9242 B15R1.1951 OCCCCCCN1CCCCCCC1 2230a_100000211400_100000766143 [0,0,0,1,0,0|1,0,2]=4 9243 B15R1.1951 OCCCCCCN1CCCCCCC1 269982a_100000211400_100000766143 [0,0,0,1,0,0|1,0,2]=4 9244 B15R1.1951 OCCCCCCN1CCCCCCC1 34a_100000211400_100000766143 [0,0,0,1,0,0|1,0,2]=4 9245 B15R1.1951 OCCCCCNC1CCCCCCC1 2230a_100000211152_100000746330 [0,0,0,1,0,0|1,0,2]=4 9246 B15R1.1951 OCCCCCNC1CCCCCCC1 270004a_100000762737_100000210524 [0,0,0,1,0,0|1,0,2]=4 9247 B15R1.1951 OCCCCCNC1CCCCCCC1 34a_100000211152_100000746330 [0,0,0,1,0,0|1,0,2]=4 9248 B15R1.1951 OCCCCCOC1C=CCCCCC1 34a_100000688657_100000746330 [0,0,0,1,0,0|3,0,0]=4 9249 B15R1.1951 OCCCCCOC1CCCCCCC1 34a_100000210054_100000746330 [0,0,0,1,0,0|1,0,2]=4 9250 B15R1.1951 OCCCCCOC1CCCCCCC1 7a_100000210054_100000746330 [0,0,0,1,0,0|1,0,2]=4 9251 B15R1.1951 OCCCCOCC1CCCCCCC1 34a_100011216312_100011216708 [0,0,0,1,0,0|1,0,2]=4 9252 B15R1.1951 OCCCCOCC1CCCCCCC1 7a_100011216312_100000210776 [0,0,0,1,0,0|1,0,2]=4 9253 B15R1.1951 OCCCNCCC1CCCCCCC1 2230a_100011532352_100000230001 [0,0,0,1,0,0|1,0,2]=4 9254 B15R1.1951 OCCCNCCC1CCCCCCC1 34a_100011532352_100000230001 [0,0,0,1,0,0|1,0,2]=4 9255 B15R1.3515 C#CCCCCCCCN1CCC[C@@H]1C 2230a_100020605311_100153394163 [0,0,0,1,0,0|2,0,1]=4 9256 B15R1.3515 C#CCCCCCCCN1CCC[C@@H]1C 269982a_100020605311_100153394163 [0,0,0,1,0,0|2,0,1]=4 9257 B15R1.3515 C#CCCCCCCCN1CCC[C@H]1C 2230a_100015189458_100153394163 [0,0,0,1,0,0|2,0,1]=4 9258 B15R1.3515 C#CCCCCCCCN1CCC[C@H]1C 269982a_100015189458_100153394163 [0,0,0,1,0,0|2,0,1]=4 9259 B15R1.3515 C#CCCCCCCCN1CCC[C@H]1C 34a_100015189458_100153394163 [0,0,0,1,0,0|2,0,1]=4 9260 B15R1.3515 C#CCCCCCCOC1CCCC1=O 34a_100011217361_100000709159 [0,0,0,1,0,0|1,0,2]=4 9261 B15R1.3515 C#CCCCCCCOC1CCCC1=O 34a_200000719330_100012276617 [0,0,0,1,0,0|1,0,2]=4 9262 B15R1.3515 C#CCCCCCCOC1CCCC1=O 7a_100011217361_100000211823 [0,0,0,1,0,0|1,0,2]=4 9263 B15R1.3515 C#CCCCCCCOC1CCCC1C 34a_100011216460_100012276617 [0,0,0,1,0,0|2,0,1]=4 9264 B15R1.3515 C#CCCCCCCOC1CCCC1C 7a_100011216460_100012276617 [0,0,0,1,0,0|2,0,1]=4 9265 B15R1.3515 C#CCCCCCCSC1CCCC1=O 62a_100000211823_100012276617 [0,0,0,1,0,0|1,0,2]=4 9266 B15R1.3515 C#CCCCCCCSC1CCCC1=O 62a_100012276617_100000211823 [0,0,0,1,0,0|1,0,2]=4 9267 B15R1.3515 C=CCCCCCCCN1CCC[C@@H]1C 2230a_100020605311_100012355270 [0,0,0,1,0,0|2,0,0]=3 9268 B15R1.3515 C=CCCCCCCCN1CCC[C@@H]1C 269982a_100020605311_100012355270 [0,0,0,1,0,0|2,0,0]=3 9269 B15R1.3515 C=CCCCCCCCN1CCC[C@H]1C 2230a_100015189458_100012355270 [0,0,0,1,0,0|2,0,0]=3 9270 B15R1.3515 C=CCCCCCCCN1CCC[C@H]1C 269982a_100015189458_100012355270 [0,0,0,1,0,0|2,0,0]=3 9271 B15R1.3515 C=CCCCCCCCN1CCC[C@H]1C 34a_100015189458_100012355270 [0,0,0,1,0,0|2,0,0]=3 9272 B15R1.3515 C=CCCCCCCCN1CCSC1C 2230a_200011216479_100012355270 [0,0,0,1,0,0|3,0,0]=4 9273 B15R1.3515 C=CCCCCCCCN1CCSC1C 269982a_200011216479_100012355270 [0,0,0,1,0,0|3,0,0]=4 9274 B15R1.3515 C=CCCCCCCCN1CCSC1C 34a_200011216479_100012355270 [0,0,0,1,0,0|3,0,0]=4 9275 B15R1.3515 C=CCCCCCCOC1CCCC1=O 34a_200000719330_100011215473 [0,0,0,1,0,0|1,0,2]=4 9276 B15R1.3515 C=CCCCCCCOC1CCCC1=O 34a_200011216477_100000709159 [0,0,0,1,0,0|1,0,2]=4 9277 B15R1.3515 C=CCCCCCCOC1CCCC1=O 7a_200011216477_100000211823 [0,0,0,1,0,0|1,0,2]=4 9278 B15R1.3515 C=CCCCCCCOC1CCCC1C 34a_100011216460_100011215473 [0,0,0,1,0,0|2,0,0]=3 9279 B15R1.3515 C=CCCCCCCOC1CCCC1C 7a_100011216460_100011215473 [0,0,0,1,0,0|2,0,0]=3 9280 B15R1.3515 C=CCCCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100011215473 [0,0,0,1,0,0|3,0,0]=4 9281 B15R1.3515 C=CCCCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100011215473 [0,0,0,1,0,0|3,0,0]=4 9282 B15R1.3515 C=CCCCCCCO[C@H]1CNC[C@H]1C 34a_200015306588_100011215473 [0,0,0,1,0,0|3,0,0]=4 9283 B15R1.3515 C=CCCCCCCSC1CCCC1=O 62a_100000211823_100011215473 [0,0,0,1,0,0|1,0,2]=4 9284 B15R1.3515 C=CCCCCCCSC1CCCC1=O 62a_100011215473_100000211823 [0,0,0,1,0,0|1,0,2]=4 9285 B15R1.3515 C=CCCCCCCS[C@@H]1CCC[C@H]1O 62a_100011215473_200016002552 [0,0,0,1,0,0|3,0,0]=4 9286 B15R1.3515 C=CCCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100011215473 [0,0,0,1,0,0|3,0,0]=4 9287 B15R1.3515 C=CCCCCCOCC1CCCN1C 34a_100000743107_100000700193 [0,0,0,1,0,0|3,0,0]=4 9288 B15R1.3515 C=CCCCCNCCC1CCCN1C 2230a_100000703577_100000005710 [0,0,0,1,0,0|3,0,0]=4 9289 B15R1.3515 C=CCCCCNCCC1CCCN1C 34a_100000703577_100000005710 [0,0,0,1,0,0|3,0,0]=4 9290 B15R1.3515 C=CCCCCOCCC1CCCN1C 34a_100000766645_100000005710 [0,0,0,1,0,0|3,0,0]=4 9291 B15R1.3515 C=CCCCCOCCC1CCCN1C 34a_100011215177_100011215482 [0,0,0,1,0,0|3,0,0]=4 9292 B15R1.3515 C=CCCCCOCCC1CCCN1C 7a_100000766645_100000005710 [0,0,0,1,0,0|3,0,0]=4 9293 B15R1.3515 C=CCCCCOCCC1CCCN1C 7a_100011215177_100011215482 [0,0,0,1,0,0|3,0,0]=4 9294 B15R1.3515 C=CCCCCSCCC1CCCN1C 62a_100000005710_100011215482 [0,0,0,1,0,0|3,0,0]=4 9295 B15R1.3515 C=CCCCCSCCC1CCCN1C 62a_100011215482_100000005710 [0,0,0,1,0,0|3,0,0]=4 9296 B15R1.3515 CC/C=C\CCCCOC1CCCC1=O 34a_100016287862_100000709159 [0,0,0,1,0,0|1,0,2]=4 9297 B15R1.3515 CC/C=C\CCCCOC1CCCC1=O 7a_100016287862_100000211823 [0,0,0,1,0,0|1,0,2]=4 9298 B15R1.3515 CC1CCCC1NCCCCCCCO 269862a_100011996573_100000752053 [0,0,0,1,0,0|1,0,2]=4 9299 B15R1.3515 CC1CCCC1OCCCCCCC#N 7a_100011216460_100009813337 [0,0,0,1,0,0|2,0,1]=4 9300 B15R1.3515 CC1CCCC1OCCCCCCCO 34a_100011216460_100000760002 [0,0,0,1,0,0|1,0,2]=4 9301 B15R1.3515 CC1CCCC1OCCCCCCCO 7a_100011216460_100000760002 [0,0,0,1,0,0|1,0,2]=4 9302 B15R1.3515 CCCC/C=C\CCOC1CCCC1=O 34a_200016286491_100000709159 [0,0,0,1,0,0|1,0,2]=4 9303 B15R1.3515 CCCC/C=C\CCOC1CCCC1=O 7a_200016286491_100000211823 [0,0,0,1,0,0|1,0,2]=4 9304 B15R1.3515 CCCCC#CCCOC1CCCC1=O 34a_100000037610_100000709159 [0,0,0,1,0,0|1,0,2]=4 9305 B15R1.3515 CCCCC#CCCOC1CCCC1=O 7a_100000037610_100000211823 [0,0,0,1,0,0|1,0,2]=4 9306 B15R1.3515 CCCCC/C=C/COC1CCCC1=O 34a_100016258190_100000709159 [0,0,0,1,0,0|1,0,2]=4 9307 B15R1.3515 CCCCC/C=C/COC1CCCC1=O 7a_100016258190_100000211823 [0,0,0,1,0,0|1,0,2]=4 9308 B15R1.3515 CCCCCC#CCOC1CCCC1=O 34a_200000033628_100000709159 [0,0,0,1,0,0|1,0,2]=4 9309 B15R1.3515 CCCCCC#CCOC1CCCC1=O 34a_200000719330_100009816472 [0,0,0,1,0,0|1,0,2]=4 9310 B15R1.3515 CCCCCC#CCOC1CCCC1=O 7a_200000033628_100000211823 [0,0,0,1,0,0|1,0,2]=4 9311 B15R1.3515 CCCCCC#CCSC1CCCC1=O 62a_100000211823_100009816472 [0,0,0,1,0,0|1,0,2]=4 9312 B15R1.3515 CCCCCC#CCSC1CCCC1=O 62a_100009816472_100000211823 [0,0,0,1,0,0|1,0,2]=4 9313 B15R1.3515 CCCCCCCCCN1CCC[C@@H]1C 2230a_100020605311_100011214924 [0,0,0,1,0,0|2,0,1]=4 9314 B15R1.3515 CCCCCCCCCN1CCC[C@@H]1C 269982a_100020605311_100000210670 [0,0,0,1,0,0|2,0,1]=4 9315 B15R1.3515 CCCCCCCCCN1CCC[C@H]1C 2230a_100015189458_100011214924 [0,0,0,1,0,0|2,0,1]=4 9316 B15R1.3515 CCCCCCCCCN1CCC[C@H]1C 269982a_100015189458_100000210670 [0,0,0,1,0,0|2,0,1]=4 9317 B15R1.3515 CCCCCCCCCN1CCC[C@H]1C 34a_100015189458_100011214924 [0,0,0,1,0,0|2,0,1]=4 9318 B15R1.3515 CCCCCCCCNC1CCCC1=O 2230a_100000229939_100000211823 [0,0,0,1,0,0|1,0,0]=2 9319 B15R1.3515 CCCCCCCCNC1CCCC1=O 34a_100000229939_100000709159 [0,0,0,1,0,0|1,0,0]=2 9320 B15R1.3515 CCCCCCCCNC1CCCC1C 269862a_100000229939_100000752053 [0,0,0,1,0,0|2,0,1]=4 9321 B15R1.3515 CCCCCCCCNC1CCNC1=O 2230a_100016995588_100000210759 [0,0,0,1,0,0|2,0,0]=3 9322 B15R1.3515 CCCCCCCCNC1CCNC1=O 34a_100016995588_100000210759 [0,0,0,1,0,0|2,0,0]=3 9323 B15R1.3515 CCCCCCCCNC1CCOC1=O 2230a_100000229939_100000211211 [0,0,0,1,0,0|2,0,0]=3 9324 B15R1.3515 CCCCCCCCNC1CCOC1=O 34a_100000229939_100000211211 [0,0,0,1,0,0|2,0,0]=3 9325 B15R1.3515 CCCCCCCCN[C@@H]1CONC1=O 2230a_100000765999_100000210759 [0,0,0,1,0,0|3,0,0]=4 9326 B15R1.3515 CCCCCCCCN[C@@H]1CONC1=O 34a_100000765999_100000210759 [0,0,0,1,0,0|3,0,0]=4 9327 B15R1.3515 CCCCCCCCOC1CCCC1=O 34a_100000210232_100000709159 [0,0,0,1,0,0|1,0,0]=2 9328 B15R1.3515 CCCCCCCCOC1CCCC1=O 34a_200000719330_100000210759 [0,0,0,1,0,0|1,0,0]=2 9329 B15R1.3515 CCCCCCCCOC1CCCC1=O 7a_100000210232_100000211823 [0,0,0,1,0,0|1,0,0]=2 9330 B15R1.3515 CCCCCCCCOC1CCCC1C 34a_100011216460_100000210759 [0,0,0,1,0,0|2,0,1]=4 9331 B15R1.3515 CCCCCCCCOC1CCCC1C 7a_100011216460_100000210759 [0,0,0,1,0,0|2,0,1]=4 9332 B15R1.3515 CCCCCCCCOC1CCOC1=O 34a_100000210232_100000211211 [0,0,0,1,0,0|2,0,0]=3 9333 B15R1.3515 CCCCCCCCOC1CCOC1=O 7a_100000210232_100000211211 [0,0,0,1,0,0|2,0,0]=3 9334 B15R1.3515 CCCCCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000210759 [0,0,0,1,0,0|2,0,1]=4 9335 B15R1.3515 CCCCCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000210759 [0,0,0,1,0,0|2,0,1]=4 9336 B15R1.3515 CCCCCCCCO[C@H]1CCNC1=O 34a_100000688343_100000210759 [0,0,0,1,0,0|2,0,0]=3 9337 B15R1.3515 CCCCCCCCSC1CCCC1=O 62a_100000210759_100000211823 [0,0,0,1,0,0|1,0,0]=2 9338 B15R1.3515 CCCCCCCCSC1CCCC1=O 62a_100000211823_100000210317 [0,0,0,1,0,0|1,0,0]=2 9339 B15R1.3515 CCCCCCCCSC1CCOC1=O 62a_100000210759_100000211211 [0,0,0,1,0,0|2,0,0]=3 9340 B15R1.3515 CCCCCCCCSC1CCOC1=O 62a_100000211211_100000210317 [0,0,0,1,0,0|2,0,0]=3 9341 B15R1.3515 CCCCCCCCS[C@@H]1CCC[C@H]1O 62a_100000210759_200016002552 [0,0,0,1,0,0|1,0,2]=4 9342 B15R1.3515 CCCCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000210317 [0,0,0,1,0,0|1,0,2]=4 9343 B15R1.3515 CCCCCCCOCC1=CCCC1=O 34a_100000087531_100000210614 [0,0,0,1,0,0|1,0,2]=4 9344 B15R1.3515 CCCCCCCOCC1CCCN1C 34a_100000743107_100000210614 [0,0,0,1,0,0|3,0,0]=4 9345 B15R1.3515 CCCCCCCOCC1CCNC1=O 34a_100000133458_100000210614 [0,0,0,1,0,0|2,0,0]=3 9346 B15R1.3515 CCCCCCCSCN1CCCC1=O 62a_100000026320_100000210316 [0,0,0,1,0,0|2,0,0]=3 9347 B15R1.3515 CCCCCCCSCN1CCCC1=O 62a_100000210614_100000026320 [0,0,0,1,0,0|2,0,0]=3 9348 B15R1.3515 CCCCCCNCCC1CCCN1C 2230a_100000210581_100000005710 [0,0,0,1,0,0|3,0,0]=4 9349 B15R1.3515 CCCCCCNCCN1CCCC1=O 2230a_100000210581_100000739059 [0,0,0,1,0,0|2,0,0]=3 9350 B15R1.3515 CCCCCCNCCN1CCCC1=O 2230a_100011200922_100000210314 [0,0,0,1,0,0|2,0,0]=3 9351 B15R1.3515 CCCCCCNCCN1CCNC1=O 2230a_100000210581_100000090651 [0,0,0,1,0,0|3,0,0]=4 9352 B15R1.3515 CCCCCCNCCN1CCNC1=O 2230a_100011207550_100000210314 [0,0,0,1,0,0|3,0,0]=4 9353 B15R1.3515 CCCCCCOCCC1CCCN1C 34a_100000210259_100000005710 [0,0,0,1,0,0|3,0,0]=4 9354 B15R1.3515 CCCCCCOCCC1CCCN1C 34a_100011215177_100000210314 [0,0,0,1,0,0|3,0,0]=4 9355 B15R1.3515 CCCCCCOCCC1CCCN1C 7a_100000210259_100000005710 [0,0,0,1,0,0|3,0,0]=4 9356 B15R1.3515 CCCCCCOCCC1CCCN1C 7a_100011215177_100000210314 [0,0,0,1,0,0|3,0,0]=4 9357 B15R1.3515 CCCCCCOCCN1CCCC1=O 34a_100000210259_100000739059 [0,0,0,1,0,0|2,0,0]=3 9358 B15R1.3515 CCCCCCOCCN1CCCC1=O 34a_100000211209_100000210314 [0,0,0,1,0,0|2,0,0]=3 9359 B15R1.3515 CCCCCCOCCN1CCCC1=O 7a_100000210259_100000739059 [0,0,0,1,0,0|2,0,0]=3 9360 B15R1.3515 CCCCCCOCCN1CCCC1=O 7a_100000211209_100000210314 [0,0,0,1,0,0|2,0,0]=3 9361 B15R1.3515 CCCCCCOCCN1CCNC1=O 34a_100000216532_100000210314 [0,0,0,1,0,0|3,0,0]=4 9362 B15R1.3515 CCCCCCOCCN1CCNC1=O 7a_100000210259_100000090651 [0,0,0,1,0,0|3,0,0]=4 9363 B15R1.3515 CCCCCCSCCC1CCCN1C 62a_100000005710_100000210757 [0,0,0,1,0,0|3,0,0]=4 9364 B15R1.3515 CCCCCCSCCC1CCCN1C 62a_100000210314_100000005710 [0,0,0,1,0,0|3,0,0]=4 9365 B15R1.3515 CCCCCCSCCN1CCCC1=O 62a_100000210314_100000739059 [0,0,0,1,0,0|2,0,0]=3 9366 B15R1.3515 CCCCCCSCCN1CCCC1=O 62a_100000739059_100000210757 [0,0,0,1,0,0|2,0,0]=3 9367 B15R1.3515 CCCCCCSCCN1CCNC1=O 62a_100000090651_100000210757 [0,0,0,1,0,0|3,0,0]=4 9368 B15R1.3515 CCCCCCSCCN1CCNC1=O 62a_100000210314_100000090651 [0,0,0,1,0,0|3,0,0]=4 9369 B15R1.3515 CCCCCNCCCN1CCCC1=O 2230a_100000210347_100000210326 [0,0,0,1,0,0|2,0,0]=3 9370 B15R1.3515 CCCCCNCCCN1CCCC1=O 34a_100000210347_100000718602 [0,0,0,1,0,0|2,0,0]=3 9371 B15R1.3515 CCCCCNCCOC1CCCC1=O 34a_100000224656_100000709159 [0,0,0,1,0,0|2,0,0]=3 9372 B15R1.3515 CCCCCNCCOC1CCOC1=O 34a_100000224656_100000211211 [0,0,0,1,0,0|3,0,0]=4 9373 B15R1.3515 CCCCCOCCCN1CCCC1=O 34a_100011216539_100000718602 [0,0,0,1,0,0|2,0,0]=3 9374 B15R1.3515 CCCCCOCCCN1CCCC1=O 7a_100011216539_100000210326 [0,0,0,1,0,0|2,0,0]=3 9375 B15R1.3515 CCCCCOCCOC1CCCC1=O 34a_100011215259_100000709159 [0,0,0,1,0,0|2,0,0]=3 9376 B15R1.3515 CCCCCOCCOC1CCCC1=O 7a_100011215259_100000211823 [0,0,0,1,0,0|2,0,0]=3 9377 B15R1.3515 CCCCCOCCOC1CCOC1=O 34a_100011215259_100000211211 [0,0,0,1,0,0|3,0,0]=4 9378 B15R1.3515 CCCCCOCCOC1CCOC1=O 7a_100011215259_100000211211 [0,0,0,1,0,0|3,0,0]=4 9379 B15R1.3515 CCCCOCCCNC1CCCC1=O 2230a_200000211371_100000211823 [0,0,0,1,0,0|2,0,0]=3 9380 B15R1.3515 CCCCOCCCNC1CCCC1=O 34a_200000211371_100000709159 [0,0,0,1,0,0|2,0,0]=3 9381 B15R1.3515 CCCCOCCCNC1CCOC1=O 2230a_200000211371_100000211211 [0,0,0,1,0,0|3,0,0]=4 9382 B15R1.3515 CCCCOCCCNC1CCOC1=O 34a_200000211371_100000211211 [0,0,0,1,0,0|3,0,0]=4 9383 B15R1.3515 CCCCOCCCOC1CCCC1=O 34a_200011215613_100000709159 [0,0,0,1,0,0|2,0,0]=3 9384 B15R1.3515 CCCCOCCCOC1CCCC1=O 7a_200011215613_100000211823 [0,0,0,1,0,0|2,0,0]=3 9385 B15R1.3515 CCCCOCCCOC1CCOC1=O 34a_200011215613_100000211211 [0,0,0,1,0,0|3,0,0]=4 9386 B15R1.3515 CCCCOCCCOC1CCOC1=O 7a_200011215613_100000211211 [0,0,0,1,0,0|3,0,0]=4 9387 B15R1.3515 CCCCOCCOCC1CCNC1=O 34a_100000133458_100000743108 [0,0,0,1,0,0|3,0,0]=4 9388 B15R1.3515 CCCCOCCSCN1CCCC1=O 62a_100000026320_100000743108 [0,0,0,1,0,0|3,0,0]=4 9389 B15R1.3515 CCCCOCCSCN1CCCC1=O 62a_100000743108_100000026320 [0,0,0,1,0,0|3,0,0]=4 9390 B15R1.3515 CCCCOCNCCN1CCCC1=O 2230a_100011200922_100011995733 [0,0,0,1,0,0|3,0,0]=4 9391 B15R1.3515 CCCCOCOCCN1CCCC1=O 34a_100000211209_100011995733 [0,0,0,1,0,0|3,0,0]=4 9392 B15R1.3515 CCCCOCSCCN1CCCC1=O 62a_100000739059_100011995733 [0,0,0,1,0,0|3,0,0]=4 9393 B15R1.3515 CCCCOCSCCN1CCCC1=O 62a_100011995733_100000739059 [0,0,0,1,0,0|3,0,0]=4 9394 B15R1.3515 CCCOCCNCCN1CCCC1=O 2230a_100011200922_100011215938 [0,0,0,1,0,0|3,0,0]=4 9395 B15R1.3515 CCCOCCNCCN1CCCC1=O 2230a_100161115042_100000739059 [0,0,0,1,0,0|3,0,0]=4 9396 B15R1.3515 CCCOCCNCCN1CCCC1=O 34a_100161115042_100000739059 [0,0,0,1,0,0|3,0,0]=4 9397 B15R1.3515 CCCOCCOCCN1CCCC1=O 34a_100000211209_100011215938 [0,0,0,1,0,0|3,0,0]=4 9398 B15R1.3515 CCCOCCOCCN1CCCC1=O 34a_100000752267_100000739059 [0,0,0,1,0,0|3,0,0]=4 9399 B15R1.3515 CCCOCCOCCN1CCCC1=O 7a_100000211209_100011215938 [0,0,0,1,0,0|3,0,0]=4 9400 B15R1.3515 CCCOCCOCCN1CCCC1=O 7a_100000752267_100000739059 [0,0,0,1,0,0|3,0,0]=4 9401 B15R1.3515 CCCOCCSCCN1CCCC1=O 62a_100000739059_100011215938 [0,0,0,1,0,0|3,0,0]=4 9402 B15R1.3515 CCCOCCSCCN1CCCC1=O 62a_100011215938_100000739059 [0,0,0,1,0,0|3,0,0]=4 9403 B15R1.3515 CCCSCCNCCN1CCCC1=O 2230a_100020603323_100000739059 [0,0,0,1,0,0|3,0,0]=4 9404 B15R1.3515 CCCSCCOCCN1CCCC1=O 34a_200000230433_100000739059 [0,0,0,1,0,0|3,0,0]=4 9405 B15R1.3515 CCCSCCOCCN1CCCC1=O 7a_200000230433_100000739059 [0,0,0,1,0,0|3,0,0]=4 9406 B15R1.3515 CCOCCCNCCN1CCCC1=O 2230a_100000210961_100000739059 [0,0,0,1,0,0|3,0,0]=4 9407 B15R1.3515 CCOCCCNCCN1CCCC1=O 2230a_100011200922_100012232248 [0,0,0,1,0,0|3,0,0]=4 9408 B15R1.3515 CCOCCCNCCN1CCCC1=O 34a_100000210961_100000739059 [0,0,0,1,0,0|3,0,0]=4 9409 B15R1.3515 CCOCCCOCCN1CCCC1=O 34a_100000211209_100012232248 [0,0,0,1,0,0|3,0,0]=4 9410 B15R1.3515 CCOCCCOCCN1CCCC1=O 34a_100000757476_100000739059 [0,0,0,1,0,0|3,0,0]=4 9411 B15R1.3515 CCOCCCOCCN1CCCC1=O 7a_100000211209_100012232248 [0,0,0,1,0,0|3,0,0]=4 9412 B15R1.3515 CCOCCCOCCN1CCCC1=O 7a_100000757476_100000739059 [0,0,0,1,0,0|3,0,0]=4 9413 B15R1.3515 CCOCCCSCCN1CCCC1=O 62a_100000739059_100012232248 [0,0,0,1,0,0|3,0,0]=4 9414 B15R1.3515 CCOCCCSCCN1CCCC1=O 62a_100012232248_100000739059 [0,0,0,1,0,0|3,0,0]=4 9415 B15R1.3515 CCOCCNCCCN1CCCC1=O 2230a_100000210347_100011215890 [0,0,0,1,0,0|3,0,0]=4 9416 B15R1.3515 CCOCCNCCCN1CCCC1=O 34a_100000210347_100000210147 [0,0,0,1,0,0|3,0,0]=4 9417 B15R1.3515 CCOCCOCCCN1CCCC1=O 34a_100011216539_100000210147 [0,0,0,1,0,0|3,0,0]=4 9418 B15R1.3515 CCOCCOCCCN1CCCC1=O 7a_100011216539_100011215890 [0,0,0,1,0,0|3,0,0]=4 9419 B15R1.3515 CCOCCOCCNC1CCCC1=O 2230a_100102712874_100000211823 [0,0,0,1,0,0|3,0,0]=4 9420 B15R1.3515 CCOCCOCCNC1CCCC1=O 34a_100102712874_100000709159 [0,0,0,1,0,0|3,0,0]=4 9421 B15R1.3515 CCOCCOCCOC1CCCC1=O 34a_100000210240_100000709159 [0,0,0,1,0,0|3,0,0]=4 9422 B15R1.3515 CCOCCOCCOC1CCCC1=O 34a_200000719330_100011211534 [0,0,0,1,0,0|3,0,0]=4 9423 B15R1.3515 CCOCCOCCOC1CCCC1=O 7a_100000210240_100000211823 [0,0,0,1,0,0|3,0,0]=4 9424 B15R1.3515 CCOCCOCCSC1CCCC1=O 62a_100000211823_100011211534 [0,0,0,1,0,0|3,0,0]=4 9425 B15R1.3515 CCOCCOCCSC1CCCC1=O 62a_100011211534_100000211823 [0,0,0,1,0,0|3,0,0]=4 9426 B15R1.3515 CCSCCCOCCN1CCCC1=O 34a_100011216438_100000739059 [0,0,0,1,0,0|3,0,0]=4 9427 B15R1.3515 CCSCCCOCCN1CCCC1=O 7a_100011216438_100000739059 [0,0,0,1,0,0|3,0,0]=4 9428 B15R1.3515 CCSCCNCCCN1CCCC1=O 2230a_100000210347_100000757381 [0,0,0,1,0,0|3,0,0]=4 9429 B15R1.3515 CCSCCNCCCN1CCCC1=O 34a_100000210347_100000757381 [0,0,0,1,0,0|3,0,0]=4 9430 B15R1.3515 CCSCCOCCCN1CCCC1=O 34a_100011216539_100000757381 [0,0,0,1,0,0|3,0,0]=4 9431 B15R1.3515 CCSCCOCCCN1CCCC1=O 7a_100011216539_100000757381 [0,0,0,1,0,0|3,0,0]=4 9432 B15R1.3515 CN1CCCC1CCOCCCCC=O 7a_100011215177_100000139335 [0,0,0,1,0,0|2,0,0]=3 9433 B15R1.3515 CN1CCCC1CCSCCCCC=O 62a_100000005710_100000139335 [0,0,0,1,0,0|2,0,0]=3 9434 B15R1.3515 CN1CCCC1CCSCCCCC=O 62a_100000139335_100000005710 [0,0,0,1,0,0|2,0,0]=3 9435 B15R1.3515 COCCCCCCNC1CCNC1=O 2230a_100016995588_100011998445 [0,0,0,1,0,0|3,0,0]=4 9436 B15R1.3515 COCCCCCCNC1CCNC1=O 34a_100016995588_100011998445 [0,0,0,1,0,0|3,0,0]=4 9437 B15R1.3515 COCCCCCCOC1CCCC1=O 34a_200000719330_100011998445 [0,0,0,1,0,0|2,0,0]=3 9438 B15R1.3515 COCCCCCCOC1CCCC1=O 34a_200012092642_100000709159 [0,0,0,1,0,0|2,0,0]=3 9439 B15R1.3515 COCCCCCCOC1CCCC1=O 7a_200012092642_100000211823 [0,0,0,1,0,0|2,0,0]=3 9440 B15R1.3515 COCCCCCCOC1CCCC1C 34a_100011216460_100011998445 [0,0,0,1,0,0|3,0,0]=4 9441 B15R1.3515 COCCCCCCOC1CCCC1C 7a_100011216460_100011998445 [0,0,0,1,0,0|3,0,0]=4 9442 B15R1.3515 COCCCCCCOC1CCOC1=O 34a_200012092642_100000211211 [0,0,0,1,0,0|3,0,0]=4 9443 B15R1.3515 COCCCCCCOC1CCOC1=O 7a_200012092642_100000211211 [0,0,0,1,0,0|3,0,0]=4 9444 B15R1.3515 COCCCCCCO[C@H]1CCNC1=O 34a_100000688343_100011998445 [0,0,0,1,0,0|3,0,0]=4 9445 B15R1.3515 COCCCCCCSC1CCCC1=O 62a_100000211823_100011998445 [0,0,0,1,0,0|2,0,0]=3 9446 B15R1.3515 COCCCCCCSC1CCCC1=O 62a_100011998445_100000211823 [0,0,0,1,0,0|2,0,0]=3 9447 B15R1.3515 COCCCCCCSC1CCOC1=O 62a_100000211211_100011998445 [0,0,0,1,0,0|3,0,0]=4 9448 B15R1.3515 COCCCCCCSC1CCOC1=O 62a_100011998445_100000211211 [0,0,0,1,0,0|3,0,0]=4 9449 B15R1.3515 COCCCCNCCN1CCCC1=O 2230a_100011200922_100000730899 [0,0,0,1,0,0|3,0,0]=4 9450 B15R1.3515 COCCCCOCCN1CCCC1=O 34a_100000211209_100000755781 [0,0,0,1,0,0|3,0,0]=4 9451 B15R1.3515 COCCCCOCCN1CCCC1=O 34a_100000740925_100000739059 [0,0,0,1,0,0|3,0,0]=4 9452 B15R1.3515 COCCCCOCCN1CCCC1=O 7a_100000211209_100000730899 [0,0,0,1,0,0|3,0,0]=4 9453 B15R1.3515 COCCCCSCCN1CCCC1=O 62a_100000730899_100000739059 [0,0,0,1,0,0|3,0,0]=4 9454 B15R1.3515 COCCCCSCCN1CCCC1=O 62a_100000739059_100000730899 [0,0,0,1,0,0|3,0,0]=4 9455 B15R1.3515 COCCCNCCCN1CCCC1=O 2230a_100000210347_100000740836 [0,0,0,1,0,0|3,0,0]=4 9456 B15R1.3515 COCCCNCCCN1CCCC1=O 34a_100000210347_100000740836 [0,0,0,1,0,0|3,0,0]=4 9457 B15R1.3515 COCCCOCCCN1CCCC1=O 34a_100011216539_100000740836 [0,0,0,1,0,0|3,0,0]=4 9458 B15R1.3515 COCCCOCCCN1CCCC1=O 7a_100011216539_100000740836 [0,0,0,1,0,0|3,0,0]=4 9459 B15R1.3515 COCCOCCCNC1CCCC1=O 2230a_100000206027_100000211823 [0,0,0,1,0,0|3,0,0]=4 9460 B15R1.3515 COCCOCCCNC1CCCC1=O 34a_100000206027_100000709159 [0,0,0,1,0,0|3,0,0]=4 9461 B15R1.3515 COCCOCCCOC1CCCC1=O 34a_200000719330_100011216529 [0,0,0,1,0,0|3,0,0]=4 9462 B15R1.3515 COCCOCCCSC1CCCC1=O 62a_100000211823_100011216529 [0,0,0,1,0,0|3,0,0]=4 9463 B15R1.3515 COCCOCCCSC1CCCC1=O 62a_100011216529_100000211823 [0,0,0,1,0,0|3,0,0]=4 9464 B15R1.3515 CSCCCCOCCN1CCCC1=O 34a_100011217163_100000739059 [0,0,0,1,0,0|3,0,0]=4 9465 B15R1.3515 CSCCCCOCCN1CCCC1=O 7a_100011217163_100000739059 [0,0,0,1,0,0|3,0,0]=4 9466 B15R1.3515 C[C@@H]1CCCN1CCCCCCCCO 2230a_100015189458_100000033203 [0,0,0,1,0,0|1,0,2]=4 9467 B15R1.3515 C[C@@H]1CCCN1CCCCCCCCO 269982a_100015189458_100000033203 [0,0,0,1,0,0|1,0,2]=4 9468 B15R1.3515 C[C@@H]1CCCN1CCCCCCCCO 34a_100015189458_100000033203 [0,0,0,1,0,0|1,0,2]=4 9469 B15R1.3515 C[C@H]1CCCN1CCCCCCCCO 2230a_100020605311_100000033203 [0,0,0,1,0,0|1,0,2]=4 9470 B15R1.3515 C[C@H]1CCCN1CCCCCCCCO 269982a_100020605311_100000033203 [0,0,0,1,0,0|1,0,2]=4 9471 B15R1.3515 N#CCCCCCCSC1CCCC1=O 62a_100000211823_100009813337 [0,0,0,1,0,0|2,0,1]=4 9472 B15R1.3515 N#CCCCCCCSC1CCCC1=O 62a_100009813337_100000211823 [0,0,0,1,0,0|2,0,1]=4 9473 B15R1.3515 NCCCCCCCOC1CCCC1=O 34a_100011996573_100000709159 [0,0,0,1,0,0|2,0,0]=3 9474 B15R1.3515 NCCCCCCCOC1CCOC1=O 34a_100011996573_100000211211 [0,0,0,1,0,0|3,0,0]=4 9475 B15R1.3515 NCCCCCOCCN1CCCC1=O 34a_100000762737_100000739059 [0,0,0,1,0,0|3,0,0]=4 9476 B15R1.3515 NCCCOCCCOC1CCCC1=O 34a_100011310245_100000709159 [0,0,0,1,0,0|3,0,0]=4 9477 B15R1.3515 O=C1CCCC1NCCCCCCCO 2230a_100011996573_100000211823 [0,0,0,1,0,0|2,0,0]=3 9478 B15R1.3515 O=C1CCCC1NCCCCCCCO 34a_100011996573_100000709159 [0,0,0,1,0,0|2,0,0]=3 9479 B15R1.3515 O=C1CCCC1NCCCOCCCO 2230a_100011310245_100000211823 [0,0,0,1,0,0|3,0,0]=4 9480 B15R1.3515 O=C1CCCC1NCCCOCCCO 34a_100011310245_100000709159 [0,0,0,1,0,0|3,0,0]=4 9481 B15R1.3515 O=C1CCCC1OCCCCCCCBr 34a_100000760002_100000709159 [0,0,0,1,0,0|2,0,0]=3 9482 B15R1.3515 O=C1CCCC1OCCCCCCCBr 7a_100000760002_100000211823 [0,0,0,1,0,0|2,0,0]=3 9483 B15R1.3515 O=C1CCCC1OCCCCCCCO 34a_200000719330_100000760002 [0,0,0,1,0,0|2,0,0]=3 9484 B15R1.3515 O=C1CCCC1SCCCCCCCO 62a_100000211823_100000760002 [0,0,0,1,0,0|2,0,0]=3 9485 B15R1.3515 O=C1CCCC1SCCCCCCCO 62a_100000760002_100000211823 [0,0,0,1,0,0|2,0,0]=3 9486 B15R1.3515 O=C1CCCN1CCCNCCCCF 2230a_100000210347_100000729493 [0,0,0,1,0,0|3,0,0]=4 9487 B15R1.3515 O=C1CCCN1CCCNCCCCF 34a_100000210347_100000729493 [0,0,0,1,0,0|3,0,0]=4 9488 B15R1.3515 O=C1CCCN1CCCNCCCCO 2230a_100000210347_100000210776 [0,0,0,1,0,0|3,0,0]=4 9489 B15R1.3515 O=C1CCCN1CCCNCCCCO 34a_100000210347_100011216708 [0,0,0,1,0,0|3,0,0]=4 9490 B15R1.3515 O=C1CCCN1CCCOCCCCF 34a_100011216539_100000729493 [0,0,0,1,0,0|3,0,0]=4 9491 B15R1.3515 O=C1CCCN1CCCOCCCCF 7a_100011216539_100000729493 [0,0,0,1,0,0|3,0,0]=4 9492 B15R1.3515 O=C1CCCN1CCCOCCCCO 34a_100011216539_100011216708 [0,0,0,1,0,0|3,0,0]=4 9493 B15R1.3515 O=C1CCCN1CCCOCCCCO 7a_100011216539_100000210776 [0,0,0,1,0,0|3,0,0]=4 9494 B15R1.3515 O=C1CCCN1CCNCCCCCF 2230a_100011200922_100000729378 [0,0,0,1,0,0|3,0,0]=4 9495 B15R1.3515 O=C1CCCN1CCNCCCCCO 2230a_100000762737_100000739059 [0,0,0,1,0,0|3,0,0]=4 9496 B15R1.3515 O=C1CCCN1CCNCCCCCO 2230a_100011200922_100000746330 [0,0,0,1,0,0|3,0,0]=4 9497 B15R1.3515 O=C1CCCN1CCNCCCCCO 34a_100000762737_100000739059 [0,0,0,1,0,0|3,0,0]=4 9498 B15R1.3515 O=C1CCCN1CCOCCCCCBr 34a_100000746331_100000739059 [0,0,0,1,0,0|3,0,0]=4 9499 B15R1.3515 O=C1CCCN1CCOCCCCCBr 7a_100000746331_100000739059 [0,0,0,1,0,0|3,0,0]=4 9500 B15R1.3515 O=C1CCCN1CCOCCCCCCl 34a_100000746330_100000739059 [0,0,0,1,0,0|3,0,0]=4 9501 B15R1.3515 O=C1CCCN1CCOCCCCCCl 7a_100000746330_100000739059 [0,0,0,1,0,0|3,0,0]=4 9502 B15R1.3515 O=C1CCCN1CCOCCCCCF 34a_100000211209_100000729378 [0,0,0,1,0,0|3,0,0]=4 9503 B15R1.3515 O=C1CCCN1CCOCCCCCF 7a_100000211209_100000729378 [0,0,0,1,0,0|3,0,0]=4 9504 B15R1.3515 O=C1CCCN1CCOCCCCCI 34a_200012148887_100000739059 [0,0,0,1,0,0|3,0,0]=4 9505 B15R1.3515 O=C1CCCN1CCOCCCCCI 7a_200012148887_100000739059 [0,0,0,1,0,0|3,0,0]=4 9506 B15R1.3515 O=C1CCCN1CCOCCCCCO 34a_100000211209_100000746330 [0,0,0,1,0,0|3,0,0]=4 9507 B15R1.3515 O=C1CCCN1CCOCCCCCO 7a_100000211209_100000746330 [0,0,0,1,0,0|3,0,0]=4 9508 B15R1.3515 O=C1CCCN1CCSCCCCCF 62a_100000729378_100000739059 [0,0,0,1,0,0|3,0,0]=4 9509 B15R1.3515 O=C1CCCN1CCSCCCCCF 62a_100000739059_100000729378 [0,0,0,1,0,0|3,0,0]=4 9510 B15R1.3515 O=C1CCCN1CCSCCCCCO 62a_100000739059_100000746330 [0,0,0,1,0,0|3,0,0]=4 9511 B15R1.3515 O=C1CCCN1CCSCCCCCO 62a_100000746330_100000739059 [0,0,0,1,0,0|3,0,0]=4 9512 B15R1.3515 O=C1CCCN1CSCCCCCCF 62a_100000026320_100015922095 [0,0,0,1,0,0|3,0,0]=4 9513 B15R1.3515 O=C1CCCN1CSCCCCCCF 62a_100015922095_100000026320 [0,0,0,1,0,0|3,0,0]=4 9514 B15R1.3515 O=C1CCCN1CSCCCCCCO 62a_100000026320_100000766143 [0,0,0,1,0,0|3,0,0]=4 9515 B15R1.3515 O=C1CCCN1CSCCCCCCO 62a_100000766143_100000026320 [0,0,0,1,0,0|3,0,0]=4 9516 B15R1.3515 O=C1NCCC1COCCCCCCF 34a_100000133458_100015922095 [0,0,0,1,0,0|3,0,0]=4 9517 B15R1.3515 O=C1NCCC1COCCCCCCO 34a_100000133458_100000766143 [0,0,0,1,0,0|3,0,0]=4 9518 B15R1.3515 O=C1NCCC1NCCCCCCCO 2230a_100016995588_100000760002 [0,0,0,1,0,0|3,0,0]=4 9519 B15R1.3515 O=C1NCCC1NCCCCCCCO 34a_100016995588_100000760002 [0,0,0,1,0,0|3,0,0]=4 9520 B15R1.3515 O=C1NCC[C@@H]1OCCCCCCCO 34a_100000688343_100000760002 [0,0,0,1,0,0|3,0,0]=4 9521 B15R1.3515 O=C1OCCC1NCCCCCCCO 2230a_100011996573_100000211211 [0,0,0,1,0,0|3,0,0]=4 9522 B15R1.3515 O=C1OCCC1NCCCCCCCO 34a_100011996573_100000211211 [0,0,0,1,0,0|3,0,0]=4 9523 B15R1.3515 O=C1OCCC1OCCCCCCCBr 34a_100000760002_100000211211 [0,0,0,1,0,0|3,0,0]=4 9524 B15R1.3515 O=C1OCCC1OCCCCCCCBr 7a_100000760002_100000211211 [0,0,0,1,0,0|3,0,0]=4 9525 B15R1.3515 O=C1OCCC1SCCCCCCCO 62a_100000211211_100000760002 [0,0,0,1,0,0|3,0,0]=4 9526 B15R1.3515 O=C1OCCC1SCCCCCCCO 62a_100000760002_100000211211 [0,0,0,1,0,0|3,0,0]=4 9527 B15R1.3523 C#CCCCCCCCOC1CCC1=O 34a_100000054614_100009892977 [0,0,0,1,0,0|1,0,2]=4 9528 B15R1.3523 C#CCCCCCCCOC1CCC1=O 7a_100000054614_100009892977 [0,0,0,1,0,0|1,0,2]=4 9529 B15R1.3523 C#CCCCCCCCSC1CCC1=O 62a_100009892977_100153394163 [0,0,0,1,0,0|1,0,2]=4 9530 B15R1.3523 C#CCCCCCCCSC1CCC1=O 62a_100153394163_100009892977 [0,0,0,1,0,0|1,0,2]=4 9531 B15R1.3523 C#CCCCCCOCCC1CCC1=O 7a_100000766912_200016118888 [0,0,0,1,0,0|1,0,2]=4 9532 B15R1.3523 C#CCCCCCSCCC1CCC1=O 62a_100012094781_200016118888 [0,0,0,1,0,0|1,0,2]=4 9533 B15R1.3523 C#CCCCCCSCCC1CCC1=O 62a_200016118888_100012094781 [0,0,0,1,0,0|1,0,2]=4 9534 B15R1.3523 C=CCCCCCCCCN1CCC1C 269982a_100000755817_100011933949 [0,0,0,1,0,0|2,0,0]=3 9535 B15R1.3523 C=CCCCCCCCCN1CCC1C 34a_100000755817_100011933949 [0,0,0,1,0,0|2,0,0]=3 9536 B15R1.3523 C=CCCCCCCCOC1CCC1=O 34a_100000730831_100009892977 [0,0,0,1,0,0|1,0,2]=4 9537 B15R1.3523 C=CCCCCCCCOC1CCC1=O 7a_100000730831_100009892977 [0,0,0,1,0,0|1,0,2]=4 9538 B15R1.3523 C=CCCCCCCCSC1CCC1=O 62a_100009892977_100012355270 [0,0,0,1,0,0|1,0,2]=4 9539 B15R1.3523 C=CCCCCCCCSC1CCC1=O 62a_100012355270_100009892977 [0,0,0,1,0,0|1,0,2]=4 9540 B15R1.3523 C=CCCCCCOCCC1CCC1=O 7a_100011216702_200016118888 [0,0,0,1,0,0|1,0,2]=4 9541 B15R1.3523 C=CCCCCCSCCC1CCC1=O 62a_100000700193_200016118888 [0,0,0,1,0,0|1,0,2]=4 9542 B15R1.3523 C=CCCCCCSCCC1CCC1=O 62a_200016118888_100000700193 [0,0,0,1,0,0|1,0,2]=4 9543 B15R1.3523 CC/C=C/CCCOCCC1CCC1=O 7a_100016287902_200016118888 [0,0,0,1,0,0|1,0,2]=4 9544 B15R1.3523 CC/C=C\CCCCCOC1CCC1=O 34a_100016268722_100009892977 [0,0,0,1,0,0|1,0,2]=4 9545 B15R1.3523 CC/C=C\CCCCCOC1CCC1=O 7a_100016268722_100009892977 [0,0,0,1,0,0|1,0,2]=4 9546 B15R1.3523 CC1CCN1CCCCCCCCCO 269982a_100000755817_100009813782 [0,0,0,1,0,0|1,0,2]=4 9547 B15R1.3523 CC1CCN1CCCCCCCCCO 34a_100000755817_100009813782 [0,0,0,1,0,0|1,0,2]=4 9548 B15R1.3523 CCCC#CCCOCCC1CCC1=O 7a_100000042726_200016118888 [0,0,0,1,0,0|1,0,2]=4 9549 B15R1.3523 CCCC/C=C/COCCC1CCC1=O 7a_200016272032_200016118888 [0,0,0,1,0,0|1,0,2]=4 9550 B15R1.3523 CCCCC#CCCCSC1CCC1=O 62a_100009892977_200000047210 [0,0,0,1,0,0|1,0,2]=4 9551 B15R1.3523 CCCCC#CCCCSC1CCC1=O 62a_200000047210_100009892977 [0,0,0,1,0,0|1,0,2]=4 9552 B15R1.3523 CCCCC#CCOCCC1CCC1=O 7a_200000034558_200016118888 [0,0,0,1,0,0|1,0,2]=4 9553 B15R1.3523 CCCCC/C=C\CCOC1CCC1=O 34a_100016277358_100009892977 [0,0,0,1,0,0|1,0,2]=4 9554 B15R1.3523 CCCCC/C=C\CCOC1CCC1=O 7a_100016277358_100009892977 [0,0,0,1,0,0|1,0,2]=4 9555 B15R1.3523 CCCCCC#CCCOC1CCC1=O 34a_200000042877_100009892977 [0,0,0,1,0,0|1,0,2]=4 9556 B15R1.3523 CCCCCC#CCCOC1CCC1=O 7a_200000042877_100009892977 [0,0,0,1,0,0|1,0,2]=4 9557 B15R1.3523 CCCCCC/C=C/COC1CCC1=O 34a_200016276170_100009892977 [0,0,0,1,0,0|1,0,2]=4 9558 B15R1.3523 CCCCCC/C=C/COC1CCC1=O 7a_200016276170_100009892977 [0,0,0,1,0,0|1,0,2]=4 9559 B15R1.3523 CCCCCCC#CCOC1CCC1=O 34a_200000037284_100009892977 [0,0,0,1,0,0|1,0,2]=4 9560 B15R1.3523 CCCCCCC#CCOC1CCC1=O 7a_200000037284_100009892977 [0,0,0,1,0,0|1,0,2]=4 9561 B15R1.3523 CCCCCCCCCCN1CCC1C 269982a_100000755817_100000210320 [0,0,0,1,0,0|2,0,1]=4 9562 B15R1.3523 CCCCCCCCCCN1CCC1C 34a_100000755817_100000210320 [0,0,0,1,0,0|2,0,1]=4 9563 B15R1.3523 CCCCCCCCCNC1CCC1=O 34a_100000212291_100009892977 [0,0,0,1,0,0|1,0,0]=2 9564 B15R1.3523 CCCCCCCCCOC1CCC1=O 34a_100000210712_100009892977 [0,0,0,1,0,0|1,0,0]=2 9565 B15R1.3523 CCCCCCCCCOC1CCC1=O 7a_100000210712_100009892977 [0,0,0,1,0,0|1,0,0]=2 9566 B15R1.3523 CCCCCCCCCSC1CCC1=O 62a_100009892977_100000210670 [0,0,0,1,0,0|1,0,0]=2 9567 B15R1.3523 CCCCCCCNCCC1CCC1=O 2230a_100000229938_200016118888 [0,0,0,1,0,0|1,0,0]=2 9568 B15R1.3523 CCCCCCCOCCC1CCC1=O 7a_100000210272_200016118888 [0,0,0,1,0,0|1,0,0]=2 9569 B15R1.3523 CCCCCCCSCCC1CCC1=O 62a_100000210614_200016118888 [0,0,0,1,0,0|1,0,0]=2 9570 B15R1.3523 CCCCCCCSCCC1CCC1=O 62a_200016118888_100000210316 [0,0,0,1,0,0|1,0,0]=2 9571 B15R1.3523 CCCCCCOCCOC1CCC1=O 34a_100000691444_100009892977 [0,0,0,1,0,0|2,0,0]=3 9572 B15R1.3523 CCCCCCOCCOC1CCC1=O 7a_100000691444_100009892977 [0,0,0,1,0,0|2,0,0]=3 9573 B15R1.3523 CCCCNCCCCOC1CCC1=O 34a_200011216965_100009892977 [0,0,0,1,0,0|2,0,0]=3 9574 B15R1.3523 CCCCOCCCCOC1CCC1=O 34a_200000760531_100009892977 [0,0,0,1,0,0|2,0,0]=3 9575 B15R1.3523 CCCCOCCCCOC1CCC1=O 7a_200000760531_100009892977 [0,0,0,1,0,0|2,0,0]=3 9576 B15R1.3523 CCCCOCCOCCC1CCC1=O 7a_100000210238_200016118888 [0,0,0,1,0,0|2,0,0]=3 9577 B15R1.3523 CCCCOCCSCCC1CCC1=O 62a_100000743108_200016118888 [0,0,0,1,0,0|2,0,0]=3 9578 B15R1.3523 CCCCOCCSCCC1CCC1=O 62a_200016118888_100000743108 [0,0,0,1,0,0|2,0,0]=3 9579 B15R1.3523 CCCCSCCNCCC1CCC1=O 2230a_100025743550_200016118888 [0,0,0,1,0,0|2,0,0]=3 9580 B15R1.3523 CCCCSCCOCCC1CCC1=O 7a_200000230436_200016118888 [0,0,0,1,0,0|2,0,0]=3 9581 B15R1.3523 CCCOCCCNCCC1CCC1=O 2230a_100011217757_200016118888 [0,0,0,1,0,0|2,0,0]=3 9582 B15R1.3523 CCCOCCOCCNC1CCC1=O 34a_200011904461_100009892977 [0,0,0,1,0,0|3,0,0]=4 9583 B15R1.3523 COCCCCCNCCC1CCC1=O 2230a_100000747528_200016118888 [0,0,0,1,0,0|2,0,0]=3 9584 B15R1.3523 COCCCOCCCOC1CCC1=O 34a_200011215475_100009892977 [0,0,0,1,0,0|3,0,0]=4 9585 B15R1.3523 COCCCOCCCOC1CCC1=O 7a_200011215475_100009892977 [0,0,0,1,0,0|3,0,0]=4 9586 B15R1.3523 COCCOCCNCCC1CCC1=O 2230a_100000745349_200016118888 [0,0,0,1,0,0|3,0,0]=4 9587 B15R1.3523 COCCOCCOCCC1CCC1=O 7a_100011215163_200016118888 [0,0,0,1,0,0|3,0,0]=4 9588 B15R1.3523 COCCOCCSCCC1CCC1=O 62a_100000695917_200016118888 [0,0,0,1,0,0|3,0,0]=4 9589 B15R1.3523 COCCOCCSCCC1CCC1=O 62a_200016118888_100000695917 [0,0,0,1,0,0|3,0,0]=4 9590 B15R1.3523 N#CCCCCCSCCC1CCC1=O 62a_100009813376_200016118888 [0,0,0,1,0,0|2,0,1]=4 9591 B15R1.3523 N#CCCCCCSCCC1CCC1=O 62a_200016118888_100009813376 [0,0,0,1,0,0|2,0,1]=4 9592 B15R1.3523 NCCCCCCCCOC1CCC1=O 34a_102515433106_100009892977 [0,0,0,1,0,0|2,0,0]=3 9593 B15R1.3523 NCCNCCCCCOC1CCC1=O 34a_103619048469_100009892977 [0,0,0,1,0,0|3,0,0]=4 9594 B15R1.3523 O=C1CCC1CCNCCCCCCO 2230a_100000686447_200016118888 [0,0,0,1,0,0|2,0,0]=3 9595 B15R1.3523 O=C1CCC1CCOCCCCCCBr 7a_100011215345_200016118888 [0,0,0,1,0,0|2,0,0]=3 9596 B15R1.3523 O=C1CCC1CCOCCCCCCCl 7a_100000766143_200016118888 [0,0,0,1,0,0|2,0,0]=3 9597 B15R1.3523 O=C1CCC1CCOCCCCCCF 7a_100000732779_200016118888 [0,0,0,1,0,0|2,0,0]=3 9598 B15R1.3523 O=C1CCC1CCSCCCCCCF 62a_100015922095_200016118888 [0,0,0,1,0,0|2,0,0]=3 9599 B15R1.3523 O=C1CCC1CCSCCCCCCF 62a_200016118888_100015922095 [0,0,0,1,0,0|2,0,0]=3 9600 B15R1.3523 O=C1CCC1CCSCCCCCCO 62a_100000766143_200016118888 [0,0,0,1,0,0|2,0,0]=3 9601 B15R1.3523 O=C1CCC1CCSCCCCCCO 62a_200016118888_100000766143 [0,0,0,1,0,0|2,0,0]=3 9602 B15R1.3523 O=C1CCC1NCCCCCCCCO 34a_102515433106_100009892977 [0,0,0,1,0,0|2,0,0]=3 9603 B15R1.3523 O=C1CCC1OCCCCCCCCBr 34a_100009813846_100009892977 [0,0,0,1,0,0|2,0,0]=3 9604 B15R1.3523 O=C1CCC1OCCCCCCCCBr 7a_100009813846_100009892977 [0,0,0,1,0,0|2,0,0]=3 9605 B15R1.3523 O=C1CCC1OCCCCCCCCCl 34a_100000033203_100009892977 [0,0,0,1,0,0|2,0,0]=3 9606 B15R1.3523 O=C1CCC1OCCCCCCCCCl 7a_100000033203_100009892977 [0,0,0,1,0,0|2,0,0]=3 9607 B15R1.3523 O=C1CCC1SCCCCCCCCO 62a_100000033203_100009892977 [0,0,0,1,0,0|2,0,0]=3 9608 B15R1.3523 O=C1CCC1SCCCCCCCCO 62a_100009892977_100000033203 [0,0,0,1,0,0|2,0,0]=3 9609 B15R1.3523 O=CCCCCCSCCC1CCC1=O 62a_100000139337_200016118888 [0,0,0,1,0,0|2,0,1]=4 9610 B15R1.3523 O=CCCCCCSCCC1CCC1=O 62a_200016118888_100000139337 [0,0,0,1,0,0|2,0,1]=4 9611 B15R1.3873 CCNC1CCCCCCCCCCC1 2230a_100011194316_100000210202 [0,0,0,1,0,0|2,0,1]=4 9612 B15R1.3873 CCNC1CCCCCCCCCCC1 270004a_100015525214_100000210130 [0,0,0,1,0,0|2,0,1]=4 9613 B15R1.3873 CCNC1CCCCCCCCCCC1 34a_100011194316_100000210202 [0,0,0,1,0,0|2,0,1]=4 9614 B15R1.3873 CCOC1CCCCCCCCCCC1 34a_100000211378_100000210202 [0,0,0,1,0,0|2,0,1]=4 9615 B15R1.3873 CCOC1CCCCCCCCCCC1 7a_100000211378_100000210202 [0,0,0,1,0,0|2,0,1]=4 9616 B15R1.3873 FCNC1CCCCCCCCCCC1 34a_100011194316_100015361967 [0,0,0,1,0,0|2,0,1]=4 9617 B15R1.3873 FCOC1CCCCCCCCCCC1 34a_100000211378_100015361967 [0,0,0,1,0,0|2,0,1]=4 9618 B15R1.3873 FCOC1CCCCCCCCCCC1 7a_100000211378_100015361967 [0,0,0,1,0,0|2,0,1]=4 9619 B15R1.5367 C=CCCCCCCN1CCC1COC 2230a_100015195929_100011215473 [0,0,0,1,0,0|3,0,0]=4 9620 B15R1.5367 C=CCCCCCCN1CCC1COC 269982a_100015195929_100011215473 [0,0,0,1,0,0|3,0,0]=4 9621 B15R1.5367 C=CCCCCCCN1CCC1COC 34a_100015195929_100011215473 [0,0,0,1,0,0|3,0,0]=4 9622 B15R1.5367 CCCCCCCCN1CCC1COC 2230a_100015195929_100000210759 [0,0,0,1,0,0|3,0,0]=4 9623 B15R1.5367 CCCCCCCCN1CCC1COC 269982a_100015195929_100000210759 [0,0,0,1,0,0|3,0,0]=4 9624 B15R1.5367 CCCCCCCCN1CCC1COC 34a_100015195929_100000210759 [0,0,0,1,0,0|3,0,0]=4 9625 B15R1.6328 BrCCCCCCOC1CCCCCC1 34a_100011215345_100011217769 [0,0,0,1,0,0|2,0,1]=4 9626 B15R1.6328 BrCCCCCOCC1CCCCCC1 34a_100000746331_200000696569 [0,0,0,1,0,0|2,0,1]=4 9627 B15R1.6328 BrCCCCCOCC1CCCCCC1 7a_100000746331_200000696569 [0,0,0,1,0,0|2,0,1]=4 9628 B15R1.6328 C#CCCCCCCN1CCCCCC1 2230a_100000185865_100012276617 [0,0,0,1,0,0|2,0,1]=4 9629 B15R1.6328 C#CCCCCCCN1CCCCCC1 269982a_100000185865_100012276617 [0,0,0,1,0,0|2,0,1]=4 9630 B15R1.6328 C#CCCCCCCN1CCCCCC1 34a_100000185865_100012276617 [0,0,0,1,0,0|2,0,1]=4 9631 B15R1.6328 C#CCCCCCNC1CCCCCC1 2230a_100000210984_100012094781 [0,0,0,1,0,0|2,0,1]=4 9632 B15R1.6328 C#CCCCCCNC1CCCCCC1 34a_100000210984_100012094781 [0,0,0,1,0,0|2,0,1]=4 9633 B15R1.6328 C#CCCCCCOC1CCCCCC1 34a_100000210887_100012094781 [0,0,0,1,0,0|2,0,1]=4 9634 B15R1.6328 C#CCCCCCOC1CCCCCC1 34a_100000766912_100011217769 [0,0,0,1,0,0|2,0,1]=4 9635 B15R1.6328 C#CCCCCCOC1CCCCCC1 7a_100000210887_100012094781 [0,0,0,1,0,0|2,0,1]=4 9636 B15R1.6328 C#CCCCCCSC1CCCCCC1 62a_100011217769_100012094781 [0,0,0,1,0,0|2,0,1]=4 9637 B15R1.6328 C#CCCCCCSC1CCCCCC1 62a_100012094781_100011217769 [0,0,0,1,0,0|2,0,1]=4 9638 B15R1.6328 C#CCCCCNCC1CCCCCC1 2230a_100000706060_200000696569 [0,0,0,1,0,0|2,0,1]=4 9639 B15R1.6328 C#CCCCCNCC1CCCCCC1 2230a_100015204231_100010269958 [0,0,0,1,0,0|2,0,1]=4 9640 B15R1.6328 C#CCCCCNCC1CCCCCC1 34a_100000706060_200000696569 [0,0,0,1,0,0|2,0,1]=4 9641 B15R1.6328 C#CCCCCNCC1CCCCCC1 34a_100015204231_100010269958 [0,0,0,1,0,0|2,0,1]=4 9642 B15R1.6328 C#CCCCCOCC1CCCCCC1 34a_100000699130_100010269958 [0,0,0,1,0,0|2,0,1]=4 9643 B15R1.6328 C#CCCCCOCC1CCCCCC1 34a_100000766709_200000696569 [0,0,0,1,0,0|2,0,1]=4 9644 B15R1.6328 C#CCCCCOCC1CCCCCC1 7a_100000699130_100010269958 [0,0,0,1,0,0|2,0,1]=4 9645 B15R1.6328 C#CCCCCOCC1CCCCCC1 7a_100000766709_200000696569 [0,0,0,1,0,0|2,0,1]=4 9646 B15R1.6328 C#CCCCCSCC1CCCCCC1 62a_100010269958_200000696569 [0,0,0,1,0,0|2,0,1]=4 9647 B15R1.6328 C#CCCCCSCC1CCCCCC1 62a_200000696569_100010269958 [0,0,0,1,0,0|2,0,1]=4 9648 B15R1.6328 C#CCCCNCCC1CCCCCC1 2230a_100011532351_100000731252 [0,0,0,1,0,0|2,0,1]=4 9649 B15R1.6328 C#CCCCNCCC1CCCCCC1 34a_100011532351_100000695029 [0,0,0,1,0,0|2,0,1]=4 9650 B15R1.6328 C=CCCCCCCN1CCCCCC1 2230a_100000185865_100011215473 [0,0,0,1,0,0|2,0,0]=3 9651 B15R1.6328 C=CCCCCCCN1CCCCCC1 269982a_100000185865_100011215473 [0,0,0,1,0,0|2,0,0]=3 9652 B15R1.6328 C=CCCCCCCN1CCCCCC1 34a_100000185865_100011215473 [0,0,0,1,0,0|2,0,0]=3 9653 B15R1.6328 C=CCCCCCCN1CCCOCC1 2230a_100000685342_100011215473 [0,0,0,1,0,0|3,0,0]=4 9654 B15R1.6328 C=CCCCCCCN1CCCOCC1 269982a_100000685342_100011215473 [0,0,0,1,0,0|3,0,0]=4 9655 B15R1.6328 C=CCCCCCCN1CCCOCC1 34a_100000685342_100011215473 [0,0,0,1,0,0|3,0,0]=4 9656 B15R1.6328 C=CCCCCCNC1CCCCCC1 2230a_100000210984_100000700193 [0,0,0,1,0,0|2,0,0]=3 9657 B15R1.6328 C=CCCCCCNC1CCCCCC1 34a_100000210984_100000700193 [0,0,0,1,0,0|2,0,0]=3 9658 B15R1.6328 C=CCCCCCOC1CCCCCC1 34a_100000210887_100000700193 [0,0,0,1,0,0|2,0,0]=3 9659 B15R1.6328 C=CCCCCCOC1CCCCCC1 34a_100011216702_100011217769 [0,0,0,1,0,0|2,0,0]=3 9660 B15R1.6328 C=CCCCCCOC1CCCCCC1 7a_100000210887_100000700193 [0,0,0,1,0,0|2,0,0]=3 9661 B15R1.6328 C=CCCCCCSC1CCCCCC1 62a_100000700193_100011217769 [0,0,0,1,0,0|2,0,0]=3 9662 B15R1.6328 C=CCCCCCSC1CCCCCC1 62a_100011217769_100000700193 [0,0,0,1,0,0|2,0,0]=3 9663 B15R1.6328 C=CCCCCNCC1CCCCCC1 2230a_100000703577_200000696569 [0,0,0,1,0,0|2,0,0]=3 9664 B15R1.6328 C=CCCCCNCC1CCCCCC1 2230a_100015204231_100011215482 [0,0,0,1,0,0|2,0,0]=3 9665 B15R1.6328 C=CCCCCNCC1CCCCCC1 269862a_100000703577_200000763224 [0,0,0,1,0,0|2,0,0]=3 9666 B15R1.6328 C=CCCCCNCC1CCCCCC1 34a_100000703577_200000696569 [0,0,0,1,0,0|2,0,0]=3 9667 B15R1.6328 C=CCCCCNCC1CCCCCC1 34a_100015204231_100011215482 [0,0,0,1,0,0|2,0,0]=3 9668 B15R1.6328 C=CCCCCOCC1CCCCCC1 34a_100000699130_100011215482 [0,0,0,1,0,0|2,0,0]=3 9669 B15R1.6328 C=CCCCCOCC1CCCCCC1 34a_100000766645_200000696569 [0,0,0,1,0,0|2,0,0]=3 9670 B15R1.6328 C=CCCCCOCC1CCCCCC1 7a_100000699130_100011215482 [0,0,0,1,0,0|2,0,0]=3 9671 B15R1.6328 C=CCCCCOCC1CCCCCC1 7a_100000766645_200000696569 [0,0,0,1,0,0|2,0,0]=3 9672 B15R1.6328 C=CCCCCSCC1CCCCCC1 62a_100011215482_200000696569 [0,0,0,1,0,0|2,0,0]=3 9673 B15R1.6328 C=CCCCCSCC1CCCCCC1 62a_200000696569_100011215482 [0,0,0,1,0,0|2,0,0]=3 9674 B15R1.6328 C=CCCCNCCC1CCCCCC1 2230a_100011532351_100011713584 [0,0,0,1,0,0|2,0,0]=3 9675 B15R1.6328 C=CCCCNCCC1CCCCCC1 34a_100011532351_100000757094 [0,0,0,1,0,0|2,0,0]=3 9676 B15R1.6328 C=CCCCOCCN1CCCCCC1 34a_100000238007_100000757094 [0,0,0,1,0,0|3,0,0]=4 9677 B15R1.6328 C=CCCCOCCN1CCCCCC1 7a_100000758997_100000722644 [0,0,0,1,0,0|3,0,0]=4 9678 B15R1.6328 C=CCCCSCCN1CCCCCC1 62a_100000722644_100000757094 [0,0,0,1,0,0|3,0,0]=4 9679 B15R1.6328 C=CCCCSCCN1CCCCCC1 62a_100011713584_100000722644 [0,0,0,1,0,0|3,0,0]=4 9680 B15R1.6328 C=CCCOCCCN1CCCCCC1 34a_100102886287_100000754431 [0,0,0,1,0,0|3,0,0]=4 9681 B15R1.6328 C=CCCOCCCN1CCCCCC1 7a_100102886287_100000754431 [0,0,0,1,0,0|3,0,0]=4 9682 B15R1.6328 C=CCOCCCCN1CCCCCC1 34a_100011305542_100015514636 [0,0,0,1,0,0|3,0,0]=4 9683 B15R1.6328 C=CCOCCOCC1CCCCCC1 34a_100000037705_200000696569 [0,0,0,1,0,0|3,0,0]=4 9684 B15R1.6328 C=CCOCCOCC1CCCCCC1 7a_100000037705_200000696569 [0,0,0,1,0,0|3,0,0]=4 9685 B15R1.6328 C=COCCCCOC1CCCCCC1 34a_100000031558_100011217769 [0,0,0,1,0,0|3,0,0]=4 9686 B15R1.6328 C=COCCCNCC1CCCCCC1 2230a_100000210767_200000696569 [0,0,0,1,0,0|3,0,0]=4 9687 B15R1.6328 C=COCCCNCC1CCCCCC1 269862a_100000210767_200000763224 [0,0,0,1,0,0|3,0,0]=4 9688 B15R1.6328 C=COCCCNCC1CCCCCC1 34a_100000210767_200000696569 [0,0,0,1,0,0|3,0,0]=4 9689 B15R1.6328 C=COCCNCCC1CCCCCC1 2230a_100011532351_100000039644 [0,0,0,1,0,0|3,0,0]=4 9690 B15R1.6328 C=COCCNCCC1CCCCCC1 34a_100011532351_100000039644 [0,0,0,1,0,0|3,0,0]=4 9691 B15R1.6328 CC=CCCCOCC1CCCCCC1 34a_100020645299_200000696569 [0,0,0,1,0,0|2,0,1]=4 9692 B15R1.6328 CCCCCCCCN1CCCCCC1 2230a_100000185865_100000210759 [0,0,0,1,0,0|2,0,1]=4 9693 B15R1.6328 CCCCCCCCN1CCCCCC1 269982a_100000185865_100000210759 [0,0,0,1,0,0|2,0,1]=4 9694 B15R1.6328 CCCCCCCCN1CCCCCC1 34a_100000185865_100000210759 [0,0,0,1,0,0|2,0,1]=4 9695 B15R1.6328 CCCCCCCNC1CCCCCC1 2230a_100000210984_100000210681 [0,0,0,1,0,0|2,0,1]=4 9696 B15R1.6328 CCCCCCCNC1CCCCCC1 270004a_100000229938_100000210131 [0,0,0,1,0,0|2,0,1]=4 9697 B15R1.6328 CCCCCCCNC1CCCCCC1 34a_100000210984_100000210614 [0,0,0,1,0,0|2,0,1]=4 9698 B15R1.6328 CCCCCCCOC1CCCCCC1 34a_100000210272_100011217769 [0,0,0,1,0,0|2,0,1]=4 9699 B15R1.6328 CCCCCCCOC1CCCCCC1 34a_100000210887_100000210614 [0,0,0,1,0,0|2,0,1]=4 9700 B15R1.6328 CCCCCCCOC1CCCCCC1 7a_100000210887_100000210614 [0,0,0,1,0,0|2,0,1]=4 9701 B15R1.6328 CCCCCCCSC1CCCCCC1 62a_100000210614_100011217769 [0,0,0,1,0,0|2,0,1]=4 9702 B15R1.6328 CCCCCCCSC1CCCCCC1 62a_100011217769_100000210316 [0,0,0,1,0,0|2,0,1]=4 9703 B15R1.6328 CCCCCCNCC1CCCCCC1 2230a_100000210581_200000696569 [0,0,0,1,0,0|2,0,1]=4 9704 B15R1.6328 CCCCCCNCC1CCCCCC1 2230a_100015204231_100000210314 [0,0,0,1,0,0|2,0,1]=4 9705 B15R1.6328 CCCCCCNCC1CCCCCC1 269862a_100000210581_200000763224 [0,0,0,1,0,0|2,0,1]=4 9706 B15R1.6328 CCCCCCNCC1CCCCCC1 34a_100015204231_100000210314 [0,0,0,1,0,0|2,0,1]=4 9707 B15R1.6328 CCCCCCOCC1CCCCCC1 34a_100000210259_200000696569 [0,0,0,1,0,0|2,0,1]=4 9708 B15R1.6328 CCCCCCOCC1CCCCCC1 34a_100000699130_100000210314 [0,0,0,1,0,0|2,0,1]=4 9709 B15R1.6328 CCCCCCOCC1CCCCCC1 7a_100000210259_200000696569 [0,0,0,1,0,0|2,0,1]=4 9710 B15R1.6328 CCCCCCOCC1CCCCCC1 7a_100000699130_100000210314 [0,0,0,1,0,0|2,0,1]=4 9711 B15R1.6328 CCCCCCSCC1CCCCCC1 62a_100000210314_200000696569 [0,0,0,1,0,0|2,0,1]=4 9712 B15R1.6328 CCCCCCSCC1CCCCCC1 62a_200000696569_100000210757 [0,0,0,1,0,0|2,0,1]=4 9713 B15R1.6328 CCCCCNCCC1CCCCCC1 2230a_100011532351_100000210326 [0,0,0,1,0,0|2,0,1]=4 9714 B15R1.6328 CCCCCNCCC1CCCCCC1 34a_100011532351_100000718602 [0,0,0,1,0,0|2,0,1]=4 9715 B15R1.6328 CNCCCCCOC1CCCCCC1 34a_100000722520_100011217769 [0,0,0,1,0,0|3,0,0]=4 9716 B15R1.6328 COCCCCCCN1CCCCCC1 2230a_100000185865_100011998445 [0,0,0,1,0,0|3,0,0]=4 9717 B15R1.6328 COCCCCCCN1CCCCCC1 269982a_100000185865_100011998445 [0,0,0,1,0,0|3,0,0]=4 9718 B15R1.6328 COCCCCCCN1CCCCCC1 34a_100000185865_100011998445 [0,0,0,1,0,0|3,0,0]=4 9719 B15R1.6328 COCCCCCNC1CCCCCC1 270004a_100000747528_100000210131 [0,0,0,1,0,0|3,0,0]=4 9720 B15R1.6328 COCCCCCNC1CCCCCC1 34a_100000747528_100011217769 [0,0,0,1,0,0|3,0,0]=4 9721 B15R1.6328 COCCCCNCC1CCCCCC1 2230a_100015204231_100000730899 [0,0,0,1,0,0|3,0,0]=4 9722 B15R1.6328 COCCCCNCC1CCCCCC1 34a_100015204231_100000755781 [0,0,0,1,0,0|3,0,0]=4 9723 B15R1.6328 COCCCCOCC1CCCCCC1 34a_100000699130_100000755781 [0,0,0,1,0,0|3,0,0]=4 9724 B15R1.6328 COCCCCOCC1CCCCCC1 34a_100000740925_200000696569 [0,0,0,1,0,0|3,0,0]=4 9725 B15R1.6328 COCCCCOCC1CCCCCC1 7a_100000699130_100000730899 [0,0,0,1,0,0|3,0,0]=4 9726 B15R1.6328 COCCCCSCC1CCCCCC1 62a_100000730899_200000696569 [0,0,0,1,0,0|3,0,0]=4 9727 B15R1.6328 COCCCCSCC1CCCCCC1 62a_200000696569_100000730899 [0,0,0,1,0,0|3,0,0]=4 9728 B15R1.6328 COCCCNCCC1CCCCCC1 2230a_100011532351_100000740836 [0,0,0,1,0,0|3,0,0]=4 9729 B15R1.6328 COCCCNCCC1CCCCCC1 34a_100011532351_100000740836 [0,0,0,1,0,0|3,0,0]=4 9730 B15R1.6328 CSCCCCOCC1CCCCCC1 34a_100011217163_200000696569 [0,0,0,1,0,0|3,0,0]=4 9731 B15R1.6328 CSCCCCOCC1CCCCCC1 7a_100011217163_200000696569 [0,0,0,1,0,0|3,0,0]=4 9732 B15R1.6328 ClCCCCCCOC1CCCCCC1 34a_100000766143_100011217769 [0,0,0,1,0,0|2,0,1]=4 9733 B15R1.6328 ClCCCCCOCC1CCCCCC1 34a_100000746330_200000696569 [0,0,0,1,0,0|2,0,1]=4 9734 B15R1.6328 ClCCCCCOCC1CCCCCC1 7a_100000746330_200000696569 [0,0,0,1,0,0|2,0,1]=4 9735 B15R1.6328 FCCCCCCNC1CCCCCC1 2230a_100000210984_100015922095 [0,0,0,1,0,0|2,0,1]=4 9736 B15R1.6328 FCCCCCCNC1CCCCCC1 34a_100000210984_100015922095 [0,0,0,1,0,0|2,0,1]=4 9737 B15R1.6328 FCCCCCCOC1CCCCCC1 34a_100000210887_100015922095 [0,0,0,1,0,0|2,0,1]=4 9738 B15R1.6328 FCCCCCCOC1CCCCCC1 34a_100000732779_100011217769 [0,0,0,1,0,0|2,0,1]=4 9739 B15R1.6328 FCCCCCCOC1CCCCCC1 7a_100000210887_100015922095 [0,0,0,1,0,0|2,0,1]=4 9740 B15R1.6328 FCCCCCCSC1CCCCCC1 62a_100011217769_100015922095 [0,0,0,1,0,0|2,0,1]=4 9741 B15R1.6328 FCCCCCCSC1CCCCCC1 62a_100015922095_100011217769 [0,0,0,1,0,0|2,0,1]=4 9742 B15R1.6328 FCCCCCNCC1CCCCCC1 2230a_100015204231_100000729378 [0,0,0,1,0,0|2,0,1]=4 9743 B15R1.6328 FCCCCCNCC1CCCCCC1 34a_100015204231_100000729378 [0,0,0,1,0,0|2,0,1]=4 9744 B15R1.6328 FCCCCCOCC1CCCCCC1 34a_100000699130_100000729378 [0,0,0,1,0,0|2,0,1]=4 9745 B15R1.6328 FCCCCCOCC1CCCCCC1 7a_100000699130_100000729378 [0,0,0,1,0,0|2,0,1]=4 9746 B15R1.6328 FCCCCCSCC1CCCCCC1 62a_100000729378_200000696569 [0,0,0,1,0,0|2,0,1]=4 9747 B15R1.6328 FCCCCCSCC1CCCCCC1 62a_200000696569_100000729378 [0,0,0,1,0,0|2,0,1]=4 9748 B15R1.6328 FCCCCNCCC1CCCCCC1 2230a_100011532351_100000729493 [0,0,0,1,0,0|2,0,1]=4 9749 B15R1.6328 FCCCCNCCC1CCCCCC1 34a_100011532351_100000729493 [0,0,0,1,0,0|2,0,1]=4 9750 B15R1.6328 ICCCCCOCC1CCCCCC1 34a_200012148887_200000696569 [0,0,0,1,0,0|2,0,1]=4 9751 B15R1.6328 ICCCCCOCC1CCCCCC1 7a_200012148887_200000696569 [0,0,0,1,0,0|2,0,1]=4 9752 B15R1.6328 N#CCCCCCCN1CCCCCC1 2230a_100000185865_100009813337 [0,0,0,1,0,0|2,0,1]=4 9753 B15R1.6328 N#CCCCCCCN1CCCCCC1 269982a_100000185865_100009813337 [0,0,0,1,0,0|2,0,1]=4 9754 B15R1.6328 N#CCCCCCNC1CCCCCC1 2230a_100000210984_100009813376 [0,0,0,1,0,0|2,0,1]=4 9755 B15R1.6328 N#CCCCCCNC1CCCCCC1 270004a_100000061152_100000210131 [0,0,0,1,0,0|2,0,1]=4 9756 B15R1.6328 N#CCCCCCOC1CCCCCC1 7a_100000210887_100009813376 [0,0,0,1,0,0|2,0,1]=4 9757 B15R1.6328 N#CCCCCCSC1CCCCCC1 62a_100009813376_100011217769 [0,0,0,1,0,0|2,0,1]=4 9758 B15R1.6328 N#CCCCCCSC1CCCCCC1 62a_100011217769_100009813376 [0,0,0,1,0,0|2,0,1]=4 9759 B15R1.6328 N#CCCCCNCC1CCCCCC1 2230a_100015204231_100000211819 [0,0,0,1,0,0|2,0,1]=4 9760 B15R1.6328 N#CCCCCOCC1CCCCCC1 7a_100000699130_100000211819 [0,0,0,1,0,0|2,0,1]=4 9761 B15R1.6328 N#CCCCCSCC1CCCCCC1 62a_100011219923_200000696569 [0,0,0,1,0,0|2,0,1]=4 9762 B15R1.6328 N#CCCCCSCC1CCCCCC1 62a_200000696569_100000211819 [0,0,0,1,0,0|2,0,1]=4 9763 B15R1.6328 N#CCCCNCCC1CCCCCC1 2230a_100011532351_100000687738 [0,0,0,1,0,0|2,0,1]=4 9764 B15R1.6328 NCCCCCCOC1CCCCCC1 34a_100000686447_100011217769 [0,0,0,1,0,0|2,0,1]=4 9765 B15R1.6328 NCCCCCOCC1CCCCCC1 34a_100000762737_200000696569 [0,0,0,1,0,0|2,0,1]=4 9766 B15R1.6328 O=CCCCCCNC1CCCCCC1 2230a_100000210984_100000139337 [0,0,0,1,0,0|1,0,0]=2 9767 B15R1.6328 O=CCCCCCOC1CCCCCC1 7a_100000210887_100000139337 [0,0,0,1,0,0|1,0,0]=2 9768 B15R1.6328 O=CCCCCCSC1CCCCCC1 62a_100000139337_100011217769 [0,0,0,1,0,0|1,0,0]=2 9769 B15R1.6328 O=CCCCCCSC1CCCCCC1 62a_100011217769_100000139337 [0,0,0,1,0,0|1,0,0]=2 9770 B15R1.6328 O=CCCCCNCC1CCCCCC1 2230a_100015204231_100000139335 [0,0,0,1,0,0|1,0,0]=2 9771 B15R1.6328 O=CCCCCOCC1CCCCCC1 7a_100000699130_100000139335 [0,0,0,1,0,0|1,0,0]=2 9772 B15R1.6328 O=CCCCCSCC1CCCCCC1 62a_100000139335_200000696569 [0,0,0,1,0,0|1,0,0]=2 9773 B15R1.6328 O=CCCCCSCC1CCCCCC1 62a_200000696569_100000139335 [0,0,0,1,0,0|1,0,0]=2 9774 B15R1.6328 O=CCCCNCCC1CCCCCC1 2230a_100011532351_200011292268 [0,0,0,1,0,0|1,0,0]=2 9775 B15R1.6328 O=CCCCSCCN1CCCCCC1 62a_100000722644_200011292268 [0,0,0,1,0,0|2,0,0]=3 9776 B15R1.6328 O=CCCCSCCN1CCCCCC1 62a_200011292268_100000722644 [0,0,0,1,0,0|2,0,0]=3 9777 B15R1.6328 O=CCOCCCCN1CCCCCC1 34a_100011305542_200009817547 [0,0,0,1,0,0|2,0,0]=3 9778 B15R1.6328 OCCCCCCCN1CCCCCC1 2230a_100000185865_100000760002 [0,0,0,1,0,0|1,0,2]=4 9779 B15R1.6328 OCCCCCCCN1CCCCCC1 269982a_100000185865_100000760002 [0,0,0,1,0,0|1,0,2]=4 9780 B15R1.6328 OCCCCCCCN1CCCCCC1 34a_100000185865_100000760002 [0,0,0,1,0,0|1,0,2]=4 9781 B15R1.6328 OCCCCCCNC1CCCCCC1 2230a_100000210984_100000766143 [0,0,0,1,0,0|1,0,2]=4 9782 B15R1.6328 OCCCCCCNC1CCCCCC1 270004a_100000686447_100000210131 [0,0,0,1,0,0|1,0,2]=4 9783 B15R1.6328 OCCCCCCNC1CCCCCC1 34a_100000210984_100000766143 [0,0,0,1,0,0|1,0,2]=4 9784 B15R1.6328 OCCCCCCNC1CCCCCC1 34a_100000686447_100011217769 [0,0,0,1,0,0|1,0,2]=4 9785 B15R1.6328 OCCCCCCOC1CCCCCC1 34a_100000210887_100000766143 [0,0,0,1,0,0|1,0,2]=4 9786 B15R1.6328 OCCCCCCOC1CCCCCC1 7a_100000210887_100000766143 [0,0,0,1,0,0|1,0,2]=4 9787 B15R1.6328 OCCCCCCSC1CCCCCC1 62a_100000766143_100011217769 [0,0,0,1,0,0|1,0,2]=4 9788 B15R1.6328 OCCCCCCSC1CCCCCC1 62a_100011217769_100000766143 [0,0,0,1,0,0|1,0,2]=4 9789 B15R1.6328 OCCCCCNCC1CCCCCC1 2230a_100000762737_200000696569 [0,0,0,1,0,0|1,0,2]=4 9790 B15R1.6328 OCCCCCNCC1CCCCCC1 2230a_100015204231_100000746330 [0,0,0,1,0,0|1,0,2]=4 9791 B15R1.6328 OCCCCCNCC1CCCCCC1 269862a_100000762737_200000763224 [0,0,0,1,0,0|1,0,2]=4 9792 B15R1.6328 OCCCCCNCC1CCCCCC1 34a_100000762737_200000696569 [0,0,0,1,0,0|1,0,2]=4 9793 B15R1.6328 OCCCCCNCC1CCCCCC1 34a_100015204231_100000746330 [0,0,0,1,0,0|1,0,2]=4 9794 B15R1.6328 OCCCCCOCC1CCCCCC1 34a_100000699130_100000746330 [0,0,0,1,0,0|1,0,2]=4 9795 B15R1.6328 OCCCCCOCC1CCCCCC1 7a_100000699130_100000746330 [0,0,0,1,0,0|1,0,2]=4 9796 B15R1.6328 OCCCCCSCC1CCCCCC1 62a_100000746330_200000696569 [0,0,0,1,0,0|1,0,2]=4 9797 B15R1.6328 OCCCCCSCC1CCCCCC1 62a_200000696569_100000746330 [0,0,0,1,0,0|1,0,2]=4 9798 B15R1.6328 OCCCCNCCC1CCCCCC1 2230a_100011532351_100000210776 [0,0,0,1,0,0|1,0,2]=4 9799 B15R1.6328 OCCCCNCCC1CCCCCC1 34a_100011532351_100011216708 [0,0,0,1,0,0|1,0,2]=4 9800 B15R1.9199 BrCCCCCCCCCCOC1CC1 34a_100009813290_100000211595 [0,0,0,1,0,0|2,0,1]=4 9801 B15R1.9199 BrCCCCCCCCCOCC1CC1 34a_100009813782_100000742324 [0,0,0,1,0,0|2,0,1]=4 9802 B15R1.9199 BrCCCCCCCCCOCC1CC1 7a_100009813782_100000742324 [0,0,0,1,0,0|2,0,1]=4 9803 B15R1.9199 BrCCCCCCCCOCCC1CC1 34a_100009813846_100000694398 [0,0,0,1,0,0|2,0,1]=4 9804 B15R1.9199 BrCCCCCCCCOCCC1CC1 7a_100009813846_100000764125 [0,0,0,1,0,0|2,0,1]=4 9805 B15R1.9199 C#CCCCCCCCCCOC1CC1 34a_100000034437_100000211595 [0,0,0,1,0,0|2,0,1]=4 9806 B15R1.9199 C#CCCCCCCCCOCC1CC1 34a_100000065265_100000742324 [0,0,0,1,0,0|2,0,1]=4 9807 B15R1.9199 C#CCCCCCCCCOCC1CC1 7a_100000065265_100000742324 [0,0,0,1,0,0|2,0,1]=4 9808 B15R1.9199 C#CCCCCCCCNCCC1CC1 34a_100000764129_100153394163 [0,0,0,1,0,0|2,0,1]=4 9809 B15R1.9199 C#CCCCCCCCOCCC1CC1 34a_100000054614_100000694398 [0,0,0,1,0,0|2,0,1]=4 9810 B15R1.9199 C#CCCCCCCCOCCC1CC1 34a_100000754188_100153394163 [0,0,0,1,0,0|2,0,1]=4 9811 B15R1.9199 C#CCCCCCCCOCCC1CC1 7a_100000054614_100000764125 [0,0,0,1,0,0|2,0,1]=4 9812 B15R1.9199 C#CCCCCCCCOCCC1CC1 7a_100000754188_100153394163 [0,0,0,1,0,0|2,0,1]=4 9813 B15R1.9199 C#CCCCCCCCSCCC1CC1 62a_100000764125_100153394163 [0,0,0,1,0,0|2,0,1]=4 9814 B15R1.9199 C#CCCCCCCCSCCC1CC1 62a_100153394163_100000764125 [0,0,0,1,0,0|2,0,1]=4 9815 B15R1.9199 C=CCCCCCCCCCNC1CC1 34a_100000081888_100000211595 [0,0,0,1,0,0|2,0,0]=3 9816 B15R1.9199 C=CCCCCCCCCCNC1CC1 34a_100000212008_100009814027 [0,0,0,1,0,0|2,0,0]=3 9817 B15R1.9199 C=CCCCCCCCCCOC1CC1 34a_100000038209_100000211595 [0,0,0,1,0,0|2,0,0]=3 9818 B15R1.9199 C=CCCCCCCCCCSC1CC1 62a_100009814027_100000211595 [0,0,0,1,0,0|2,0,0]=3 9819 B15R1.9199 C=CCCCCCCCCNCC1CC1 2230a_100000735609_100011933949 [0,0,0,1,0,0|2,0,0]=3 9820 B15R1.9199 C=CCCCCCCCCNCC1CC1 34a_100000735609_100011933949 [0,0,0,1,0,0|2,0,0]=3 9821 B15R1.9199 C=CCCCCCCCCOCC1CC1 34a_100000211283_100011933949 [0,0,0,1,0,0|2,0,0]=3 9822 B15R1.9199 C=CCCCCCCCCOCC1CC1 34a_100011215194_100000742324 [0,0,0,1,0,0|2,0,0]=3 9823 B15R1.9199 C=CCCCCCCCCOCC1CC1 7a_100011215194_100000742324 [0,0,0,1,0,0|2,0,0]=3 9824 B15R1.9199 C=CCCCCCCCCOCC1CO1 34a_100011215194_102125554688 [0,0,0,1,0,0|3,0,0]=4 9825 B15R1.9199 C=CCCCCCCCCOCC1CO1 7a_100011215194_102125554688 [0,0,0,1,0,0|3,0,0]=4 9826 B15R1.9199 C=CCCCCCCCCOCC1CS1 7a_100011215194_100000031435 [0,0,0,1,0,0|3,0,0]=4 9827 B15R1.9199 C=CCCCCCCCCOC[C@@H]1CO1 34a_100000757423_100011933949 [0,0,0,1,0,0|3,0,0]=4 9828 B15R1.9199 C=CCCCCCCCCOC[C@@H]1CO1 7a_100011215194_100000745022 [0,0,0,1,0,0|3,0,0]=4 9829 B15R1.9199 C=CCCCCCCCCSCC1CC1 62a_100000756562_100011933949 [0,0,0,1,0,0|2,0,0]=3 9830 B15R1.9199 C=CCCCCCCCCSCC1CC1 62a_100011933949_100000742324 [0,0,0,1,0,0|2,0,0]=3 9831 B15R1.9199 C=CCCCCCCCCSCC1CO1 62a_100011933949_102125554688 [0,0,0,1,0,0|3,0,0]=4 9832 B15R1.9199 C=CCCCCCCCCSCC1CO1 62a_102125554688_100011933949 [0,0,0,1,0,0|3,0,0]=4 9833 B15R1.9199 C=CCCCCCCCCSCC1CS1 62a_100000031435_100011933949 [0,0,0,1,0,0|3,0,0]=4 9834 B15R1.9199 C=CCCCCCCCCSCC1CS1 62a_100011933949_100000031435 [0,0,0,1,0,0|3,0,0]=4 9835 B15R1.9199 C=CCCCCCCCCSC[C@@H]1CO1 62a_100000745022_100011933949 [0,0,0,1,0,0|3,0,0]=4 9836 B15R1.9199 C=CCCCCCCCCSC[C@@H]1CO1 62a_100011933949_100000745022 [0,0,0,1,0,0|3,0,0]=4 9837 B15R1.9199 C=CCCCCCCCNCCC1CC1 34a_100000764129_100012355270 [0,0,0,1,0,0|2,0,0]=3 9838 B15R1.9199 C=CCCCCCCCOCCC1CC1 34a_100000730831_100000694398 [0,0,0,1,0,0|2,0,0]=3 9839 B15R1.9199 C=CCCCCCCCOCCC1CC1 34a_100000754188_100012355270 [0,0,0,1,0,0|2,0,0]=3 9840 B15R1.9199 C=CCCCCCCCOCCC1CC1 7a_100000730831_100000764125 [0,0,0,1,0,0|2,0,0]=3 9841 B15R1.9199 C=CCCCCCCCOCCC1CC1 7a_100000754188_100012355270 [0,0,0,1,0,0|2,0,0]=3 9842 B15R1.9199 C=CCCCCCCCOCCC1CO1 34a_100000730831_100000732470 [0,0,0,1,0,0|3,0,0]=4 9843 B15R1.9199 C=CCCCCCCCOCCC1CO1 7a_100000730831_100000732470 [0,0,0,1,0,0|3,0,0]=4 9844 B15R1.9199 C=CCCCCCCCOCC[C@@H]1CO1 34a_100009820653_100012355270 [0,0,0,1,0,0|3,0,0]=4 9845 B15R1.9199 C=CCCCCCCCSCCC1CC1 62a_100000764125_100012355270 [0,0,0,1,0,0|2,0,0]=3 9846 B15R1.9199 C=CCCCCCCCSCCC1CC1 62a_100012355270_100000764125 [0,0,0,1,0,0|2,0,0]=3 9847 B15R1.9199 C=CCCCCCCCSCCC1CO1 62a_100000732470_100012355270 [0,0,0,1,0,0|3,0,0]=4 9848 B15R1.9199 C=CCCCCCCCSCCC1CO1 62a_100012355270_100000732470 [0,0,0,1,0,0|3,0,0]=4 9849 B15R1.9199 C=CCCCCCCOCCCC1CO1 34a_200011216477_100000733510 [0,0,0,1,0,0|3,0,0]=4 9850 B15R1.9199 C=CCCCCCCOCCCC1CO1 7a_200011216477_100000733510 [0,0,0,1,0,0|3,0,0]=4 9851 B15R1.9199 C=CCCCCCCOCCNC1CC1 34a_100000738766_100011215473 [0,0,0,1,0,0|3,0,0]=4 9852 B15R1.9199 C=CCCCCCCSCCCC1CO1 62a_100000733510_100011215473 [0,0,0,1,0,0|3,0,0]=4 9853 B15R1.9199 C=CCCCCCCSCCCC1CO1 62a_100011215473_100000733510 [0,0,0,1,0,0|3,0,0]=4 9854 B15R1.9199 CCCCCCCCCCCNC1CC1 34a_100000212008_100011215454 [0,0,0,1,0,0|2,0,1]=4 9855 B15R1.9199 CCCCCCCCCCCNC1CC1 34a_200011215754_100000211595 [0,0,0,1,0,0|2,0,1]=4 9856 B15R1.9199 CCCCCCCCCCCOC1CC1 34a_100000210809_100000211595 [0,0,0,1,0,0|2,0,1]=4 9857 B15R1.9199 CCCCCCCCCCNCC1CC1 2230a_100000684558_100000742324 [0,0,0,1,0,0|2,0,1]=4 9858 B15R1.9199 CCCCCCCCCCNCC1CC1 2230a_100000735609_100000210320 [0,0,0,1,0,0|2,0,1]=4 9859 B15R1.9199 CCCCCCCCCCNCC1CC1 269862a_100000684558_100000741477 [0,0,0,1,0,0|2,0,1]=4 9860 B15R1.9199 CCCCCCCCCCNCC1CC1 34a_100000684558_100000742324 [0,0,0,1,0,0|2,0,1]=4 9861 B15R1.9199 CCCCCCCCCCNCC1CC1 34a_100000735609_100000210320 [0,0,0,1,0,0|2,0,1]=4 9862 B15R1.9199 CCCCCCCCCCNCC1CO1 2230a_100000684558_100011216344 [0,0,0,1,0,0|1,0,2]=4 9863 B15R1.9199 CCCCCCCCCCNCC1CO1 34a_100000684558_102125554688 [0,0,0,1,0,0|1,0,2]=4 9864 B15R1.9199 CCCCCCCCCCOCC1CC1 34a_100000210711_100000742324 [0,0,0,1,0,0|2,0,1]=4 9865 B15R1.9199 CCCCCCCCCCOCC1CC1 34a_100000211283_100000210320 [0,0,0,1,0,0|2,0,1]=4 9866 B15R1.9199 CCCCCCCCCCOCC1CC1 7a_100000210711_100000742324 [0,0,0,1,0,0|2,0,1]=4 9867 B15R1.9199 CCCCCCCCCCOCC1CO1 34a_100000210711_102125554688 [0,0,0,1,0,0|1,0,2]=4 9868 B15R1.9199 CCCCCCCCCCOCC1CO1 7a_100000210711_102125554688 [0,0,0,1,0,0|1,0,2]=4 9869 B15R1.9199 CCCCCCCCCCOCC1CS1 7a_100000210711_100000031435 [0,0,0,1,0,0|1,1,1]=4 9870 B15R1.9199 CCCCCCCCCCOC[C@@H]1CO1 34a_100000757423_100000210320 [0,0,0,1,0,0|1,0,2]=4 9871 B15R1.9199 CCCCCCCCCCOC[C@@H]1CO1 7a_100000210711_100000745022 [0,0,0,1,0,0|1,0,2]=4 9872 B15R1.9199 CCCCCCCCCCSCC1CC1 62a_100000756562_100000210320 [0,0,0,1,0,0|2,0,1]=4 9873 B15R1.9199 CCCCCCCCCCSCC1CO1 62a_102125554688_100000210320 [0,0,0,1,0,0|1,0,2]=4 9874 B15R1.9199 CCCCCCCCCCSCC1CS1 62a_100000031435_100000210320 [0,0,0,1,0,0|1,1,1]=4 9875 B15R1.9199 CCCCCCCCCCSC[C@@H]1CO1 62a_100000745022_100000210320 [0,0,0,1,0,0|1,0,2]=4 9876 B15R1.9199 CCCCCCCCCNCCC1CC1 2230a_100000212291_100000694398 [0,0,0,1,0,0|2,0,1]=4 9877 B15R1.9199 CCCCCCCCCNCCC1CC1 34a_100000212291_100000694398 [0,0,0,1,0,0|2,0,1]=4 9878 B15R1.9199 CCCCCCCCCNCCC1CC1 34a_100000764129_100011214924 [0,0,0,1,0,0|2,0,1]=4 9879 B15R1.9199 CCCCCCCCCNCCC1CO1 2230a_100000212291_100000732470 [0,0,0,1,0,0|1,0,2]=4 9880 B15R1.9199 CCCCCCCCCNCCC1CO1 34a_100000212291_100000732470 [0,0,0,1,0,0|1,0,2]=4 9881 B15R1.9199 CCCCCCCCCOCCC1CC1 34a_100000210712_100000694398 [0,0,0,1,0,0|2,0,1]=4 9882 B15R1.9199 CCCCCCCCCOCCC1CC1 34a_100000754188_100011214924 [0,0,0,1,0,0|2,0,1]=4 9883 B15R1.9199 CCCCCCCCCOCCC1CC1 7a_100000210712_100000764125 [0,0,0,1,0,0|2,0,1]=4 9884 B15R1.9199 CCCCCCCCCOCCC1CC1 7a_100000754188_100000210328 [0,0,0,1,0,0|2,0,1]=4 9885 B15R1.9199 CCCCCCCCCOCCC1CO1 34a_100000210712_100000732470 [0,0,0,1,0,0|1,0,2]=4 9886 B15R1.9199 CCCCCCCCCOCCC1CO1 7a_100000210712_100000732470 [0,0,0,1,0,0|1,0,2]=4 9887 B15R1.9199 CCCCCCCCCOCC[C@@H]1CO1 34a_100009820653_100011214924 [0,0,0,1,0,0|1,0,2]=4 9888 B15R1.9199 CCCCCCCCCSCCC1CC1 62a_100000764125_100000210670 [0,0,0,1,0,0|2,0,1]=4 9889 B15R1.9199 CCCCCCCCCSCCC1CO1 62a_100000732470_100000210670 [0,0,0,1,0,0|1,0,2]=4 9890 B15R1.9199 CCCCCCCCNCCCC1CO1 2230a_100000229939_100000733510 [0,0,0,1,0,0|1,0,2]=4 9891 B15R1.9199 CCCCCCCCNCCCC1CO1 34a_100000229939_100000733510 [0,0,0,1,0,0|1,0,2]=4 9892 B15R1.9199 CCCCCCCCOCCCC1CO1 34a_100000210232_100000733510 [0,0,0,1,0,0|1,0,2]=4 9893 B15R1.9199 CCCCCCCCOCCCC1CO1 7a_100000210232_100000733510 [0,0,0,1,0,0|1,0,2]=4 9894 B15R1.9199 CCCCCCCCSCCCC1CO1 62a_100000210759_100000733510 [0,0,0,1,0,0|1,0,2]=4 9895 B15R1.9199 CCCCCCCCSCCCC1CO1 62a_100000733510_100000210317 [0,0,0,1,0,0|1,0,2]=4 9896 B15R1.9199 ClCCCCCCCCCCOC1CC1 34a_200000033068_100000211595 [0,0,0,1,0,0|2,0,1]=4 9897 B15R1.9199 ClCCCCCCCCCOCC1CC1 34a_100009868337_100000742324 [0,0,0,1,0,0|2,0,1]=4 9898 B15R1.9199 ClCCCCCCCCCOCC1CC1 7a_100009868337_100000742324 [0,0,0,1,0,0|2,0,1]=4 9899 B15R1.9199 ClCCCCCCCCOCCC1CC1 34a_100000033203_100000694398 [0,0,0,1,0,0|2,0,1]=4 9900 B15R1.9199 ClCCCCCCCCOCCC1CC1 7a_100000033203_100000764125 [0,0,0,1,0,0|2,0,1]=4 9901 B15R1.9199 NCCCCCCCCCCOC1CC1 34a_100000066964_100000211595 [0,0,0,1,0,0|2,0,1]=4 9902 B15R1.9199 NCCCCCCCCCOCC1CC1 34a_100000078944_100000742324 [0,0,0,1,0,0|2,0,1]=4 9903 B15R1.9199 NCCCCCCCCOCCC1CC1 34a_102515433106_100000694398 [0,0,0,1,0,0|2,0,1]=4 9904 B15R1.9199 O=CCCCOCCCCOCC1CO1 7a_100010889290_200011292268 [0,0,0,1,0,0|3,0,0]=4 9905 B15R1.9199 OCCCCCCCCCCNC1CC1 34a_100000066964_100000211595 [0,0,0,1,0,0|1,0,2]=4 9906 B15R1.9199 OCCCCCCCCCCNC1CC1 34a_100000212008_100009813290 [0,0,0,1,0,0|1,0,2]=4 9907 B15R1.9199 OCCCCCCCCCCSC1CC1 62a_100009813290_100000211595 [0,0,0,1,0,0|1,0,2]=4 9908 B15R1.9199 OCCCCCCCCCNCC1CC1 2230a_100000078944_100000742324 [0,0,0,1,0,0|1,0,2]=4 9909 B15R1.9199 OCCCCCCCCCNCC1CC1 2230a_100000735609_100009813782 [0,0,0,1,0,0|1,0,2]=4 9910 B15R1.9199 OCCCCCCCCCNCC1CC1 269862a_100000078944_100000741477 [0,0,0,1,0,0|1,0,2]=4 9911 B15R1.9199 OCCCCCCCCCNCC1CC1 34a_100000078944_100000742324 [0,0,0,1,0,0|1,0,2]=4 9912 B15R1.9199 OCCCCCCCCCNCC1CC1 34a_100000735609_100009813782 [0,0,0,1,0,0|1,0,2]=4 9913 B15R1.9199 OCCCCCCCCCOCC1CC1 34a_100000211283_100009813782 [0,0,0,1,0,0|1,0,2]=4 9914 B15R1.9199 OCCCCCCCCCSCC1CC1 62a_100000756562_100009813782 [0,0,0,1,0,0|1,0,2]=4 9915 B15R1.9199 OCCCCCCCCCSCC1CC1 62a_100009813782_100000742324 [0,0,0,1,0,0|1,0,2]=4 9916 B15R1.9199 OCCCCCCCCNCCC1CC1 2230a_102515433106_100000694398 [0,0,0,1,0,0|1,0,2]=4 9917 B15R1.9199 OCCCCCCCCNCCC1CC1 34a_100000764129_100000033203 [0,0,0,1,0,0|1,0,2]=4 9918 B15R1.9199 OCCCCCCCCNCCC1CC1 34a_102515433106_100000694398 [0,0,0,1,0,0|1,0,2]=4 9919 B15R1.9199 OCCCCCCCCOCCC1CC1 34a_100000754188_100000033203 [0,0,0,1,0,0|1,0,2]=4 9920 B15R1.9199 OCCCCCCCCOCCC1CC1 7a_100000754188_100000033203 [0,0,0,1,0,0|1,0,2]=4 9921 B15R1.9199 OCCCCCCCCSCCC1CC1 62a_100000033203_100000764125 [0,0,0,1,0,0|1,0,2]=4 9922 B15R1.9199 OCCCCCCCCSCCC1CC1 62a_100000764125_100000033203 [0,0,0,1,0,0|1,0,2]=4 9923 B15R1.11854 C#CCCCCN1CCCCCCCC1 2230a_100000039187_100010269958 [0,0,0,1,0,0|2,0,1]=4 9924 B15R1.11854 C#CCCCCN1CCCCCCCC1 269982a_100000039187_100010269958 [0,0,0,1,0,0|2,0,1]=4 9925 B15R1.11854 C#CCCCCN1CCCCCCCC1 34a_100000039187_100010269958 [0,0,0,1,0,0|2,0,1]=4 9926 B15R1.11854 C#CCCCNC1CCCCCCCC1 270004a_100000718082_100000038600 [0,0,0,1,0,0|2,0,1]=4 9927 B15R1.11854 C=CCCCCN1CCCCCCCC1 2230a_100000039187_100011215482 [0,0,0,1,0,0|2,0,0]=3 9928 B15R1.11854 C=CCCCCN1CCCCCCCC1 269982a_100000039187_100011215482 [0,0,0,1,0,0|2,0,0]=3 9929 B15R1.11854 C=CCCCCN1CCCCCCCC1 34a_100000039187_100011215482 [0,0,0,1,0,0|2,0,0]=3 9930 B15R1.11854 C=CCCCNC1CCCCCCCC1 270004a_100000700776_100000038600 [0,0,0,1,0,0|2,0,0]=3 9931 B15R1.11854 CCCCCCN1CCCCCCCC1 2230a_100000039187_100000210314 [0,0,0,1,0,0|2,0,1]=4 9932 B15R1.11854 CCCCCCN1CCCCCCCC1 269982a_100000039187_100000210757 [0,0,0,1,0,0|2,0,1]=4 9933 B15R1.11854 CCCCCCN1CCCCCCCC1 34a_100000039187_100000210314 [0,0,0,1,0,0|2,0,1]=4 9934 B15R1.11854 CCCCCNC1CCCCCCCC1 270004a_100000209983_100000038600 [0,0,0,1,0,0|2,0,1]=4 9935 B15R1.11854 COCCCCN1CCCCCCCC1 2230a_100000039187_100000730899 [0,0,0,1,0,0|3,0,0]=4 9936 B15R1.11854 COCCCCN1CCCCCCCC1 269982a_100000039187_100000730899 [0,0,0,1,0,0|3,0,0]=4 9937 B15R1.11854 COCCCCN1CCCCCCCC1 34a_100000039187_100000755781 [0,0,0,1,0,0|3,0,0]=4 9938 B15R1.11854 COCCCNC1CCCCCCCC1 270004a_100150723488_100000038600 [0,0,0,1,0,0|3,0,0]=4 9939 B15R1.11854 CSCCCNC1CCCCCCCC1 270004a_100000749238_100000038600 [0,0,0,1,0,0|3,0,0]=4 9940 B15R1.11854 FCCCCCN1CCCCCCCC1 2230a_100000039187_100000729378 [0,0,0,1,0,0|2,0,1]=4 9941 B15R1.11854 FCCCCCN1CCCCCCCC1 269982a_100000039187_100000729378 [0,0,0,1,0,0|2,0,1]=4 9942 B15R1.11854 FCCCCCN1CCCCCCCC1 34a_100000039187_100000729378 [0,0,0,1,0,0|2,0,1]=4 9943 B15R1.11854 N#CCCCCN1CCCCCCCC1 2230a_100000039187_100000211819 [0,0,0,1,0,0|2,0,1]=4 9944 B15R1.11854 N#CCCCCN1CCCCCCCC1 269982a_100000039187_100011219923 [0,0,0,1,0,0|2,0,1]=4 9945 B15R1.11854 O=CCCCCN1CCCCCCCC1 2230a_100000039187_100000139335 [0,0,0,1,0,0|1,0,0]=2 9946 B15R1.11854 O=CCCCCN1CCCCCCCC1 269982a_100000039187_100000139335 [0,0,0,1,0,0|1,0,0]=2 9947 B15R1.11854 OCCCCCN1CCCCCCCC1 2230a_100000039187_100000746330 [0,0,0,1,0,0|1,0,2]=4 9948 B15R1.11854 OCCCCCN1CCCCCCCC1 269982a_100000039187_100000746330 [0,0,0,1,0,0|1,0,2]=4 9949 B15R1.11854 OCCCCCN1CCCCCCCC1 34a_100000039187_100000746330 [0,0,0,1,0,0|1,0,2]=4 9950 B15R1.11854 OCCCCNC1CCCCCCCC1 270004a_100000750430_100000038600 [0,0,0,1,0,0|1,0,2]=4 9951 B12R0.5 C=CCCCCCCCCCNC 2230a_100000081888_200000210301 [2,0,0,0,0,0|1,0,1]=4 9952 B12R0.5 C=CCCCCCCCCCNC 2230a_106832991635_100009814027 [2,0,0,0,0,0|1,0,1]=4 9953 B12R0.5 C=CCCCCCCCCCNC 34a_100000081888_200000210301 [2,0,0,0,0,0|1,0,1]=4 9954 B12R0.5 C=CCCCCCCCCCNC 34a_100102657272_100009814027 [2,0,0,0,0,0|1,0,1]=4 9955 B12R0.5 C=CCCCCCCCCCNC 7a_106832991635_100009814027 [2,0,0,0,0,0|1,0,1]=4 9956 B12R0.5 C=CCCCCCCCCCN[13CH3] 2230a_100000081888_200025704644 [2,0,0,0,0,0|1,0,1]=4 9957 B12R0.5 C=CCCCCCCCCCN[13CH3] 34a_100000081888_200025704644 [2,0,0,0,0,0|1,0,1]=4 9958 B12R0.5 C=CCCCCCCCCCOC 34a_100000038209_200000210301 [2,0,0,0,0,0|1,0,1]=4 9959 B12R0.5 C=CCCCCCCCCCOC 34a_100138415774_100009814027 [2,0,0,0,0,0|1,0,1]=4 9960 B12R0.5 C=CCCCCCCCCCOC 7a_100000038209_200000210301 [2,0,0,0,0,0|1,0,1]=4 9961 B12R0.5 C=CCCCCCCCCCO[13CH3] 34a_100000038209_200025704644 [2,0,0,0,0,0|1,0,1]=4 9962 B12R0.5 C=CCCCCCCCCCO[13CH3] 7a_100000038209_200025704644 [2,0,0,0,0,0|1,0,1]=4 9963 B12R0.5 C=CCCCCCCCCCSC 62a_100009814027_200000210301 [2,0,0,0,0,0|1,0,1]=4 9964 B12R0.5 C=CCCCCCCCCCSC 62a_200000210301_100009814027 [2,0,0,0,0,0|1,0,1]=4 9965 B12R0.5 C=CCCCCCCCCCS[13CH3] 62a_100009814027_200025704644 [2,0,0,0,0,0|1,0,1]=4 9966 B12R0.5 C=CCCCCCCCCCS[13CH3] 62a_200025704644_100009814027 [2,0,0,0,0,0|1,0,1]=4 9967 B12R0.5 C=CCCCCCCCCNCC 2230a_100015525214_100011933949 [2,0,0,0,0,0|1,0,1]=4 9968 B12R0.5 C=CCCCCCCCCOCC 34a_100011215194_100000210202 [2,0,0,0,0,0|1,0,1]=4 9969 B12R0.5 C=CCCCCCCCCOCC 34a_100121572206_100011933949 [2,0,0,0,0,0|1,0,1]=4 9970 B12R0.5 C=CCCCCCCCCOCC 7a_100011215194_100000210202 [2,0,0,0,0,0|1,0,1]=4 9971 B12R0.5 C=CCCCCCCCCSCC 62a_100000210202_100011933949 [2,0,0,0,0,0|1,0,1]=4 9972 B12R0.5 C=CCCCCCCCCSCC 62a_100011933949_100000210202 [2,0,0,0,0,0|1,0,1]=4 9973 B12R0.5 C=CCCCCCCCOCCC 34a_100000210258_100012355270 [2,0,0,0,0,0|1,0,1]=4 9974 B12R0.5 C=CCCCCCCCOCCC 34a_100000730831_100000210303 [2,0,0,0,0,0|1,0,1]=4 9975 B12R0.5 C=CCCCCCCCOCCC 7a_100000730831_100000210303 [2,0,0,0,0,0|1,0,1]=4 9976 B12R0.5 C=CCCCCCCCSCCC 62a_100000210303_100012355270 [2,0,0,0,0,0|1,0,1]=4 9977 B12R0.5 C=CCCCCCCCSCCC 62a_100012355270_100000210303 [2,0,0,0,0,0|1,0,1]=4 9978 B12R0.5 C=CCCCCCCNCCCC 2230a_100000102301_100011215473 [2,0,0,0,0,0|1,0,1]=4 9979 B12R0.5 C=CCCCCCCNCCCC 7a_106832991798_100011215473 [2,0,0,0,0,0|1,0,1]=4 9980 B12R0.5 C=CCCCCCCOCCCC 34a_100000210227_100011215473 [2,0,0,0,0,0|1,0,1]=4 9981 B12R0.5 C=CCCCCCCOCCCC 34a_200011216477_100000210210 [2,0,0,0,0,0|1,0,1]=4 9982 B12R0.5 C=CCCCCCCOCCCC 7a_100000210227_100011215473 [2,0,0,0,0,0|1,0,1]=4 9983 B12R0.5 C=CCCCCCCOCCCC 7a_200011216477_100000210211 [2,0,0,0,0,0|1,0,1]=4 9984 B12R0.5 C=CCCCCCCSCCCC 62a_100000210211_100011215473 [2,0,0,0,0,0|1,0,1]=4 9985 B12R0.5 C=CCCCCCCSCCCC 62a_100011215473_100000210210 [2,0,0,0,0,0|1,0,1]=4 9986 B12R0.5 C=CCCCCCNCCCCC 2230a_100000209983_100000700193 [2,0,0,0,0,0|1,0,1]=4 9987 B12R0.5 C=CCCCCCOCCCCC 34a_100000210253_100000700193 [2,0,0,0,0,0|1,0,1]=4 9988 B12R0.5 C=CCCCCCOCCCCC 34a_100011216702_100000718602 [2,0,0,0,0,0|1,0,1]=4 9989 B12R0.5 C=CCCCCCOCCCCC 7a_100000210253_100000700193 [2,0,0,0,0,0|1,0,1]=4 9990 B12R0.5 C=CCCCCCOCCCCC 7a_100011216702_100000210326 [2,0,0,0,0,0|1,0,1]=4 9991 B12R0.5 C=CCCCCCSCCCCC 62a_100000210326_100000700193 [2,0,0,0,0,0|1,0,1]=4 9992 B12R0.5 C=CCCCCCSCCCCC 62a_100000700193_100000210326 [2,0,0,0,0,0|1,0,1]=4 9993 B12R0.5 C=CCCCCNCCCCCC 2230a_100000210581_100011215482 [2,0,0,0,0,0|1,0,1]=4 9994 B12R0.5 C=CCCCCNCCCCCC 2230a_100000703577_100000210314 [2,0,0,0,0,0|1,0,1]=4 9995 B12R0.5 C=CCCCCNCCCCCC 34a_100000703577_100000210314 [2,0,0,0,0,0|1,0,1]=4 9996 B12R0.5 C=CCCCCOCCCCCC 34a_100000210259_100011215482 [2,0,0,0,0,0|1,0,1]=4 9997 B12R0.5 C=CCCCCOCCCCCC 34a_100000766645_100000210314 [2,0,0,0,0,0|1,0,1]=4 9998 B12R0.5 C=CCCCCOCCCCCC 7a_100000210259_100011215482 [2,0,0,0,0,0|1,0,1]=4 9999 B12R0.5 C=CCCCCOCCCCCC 7a_100000766645_100000210314 [2,0,0,0,0,0|1,0,1]=4 10000 B12R0.5 C=CCCCCSCCCCCC 62a_100000210314_100011215482 [2,0,0,0,0,0|1,0,1]=4 10001 B12R0.5 C=CCCCCSCCCCCC 62a_100011215482_100000210757 [2,0,0,0,0,0|1,0,1]=4 10002 B12R0.5 C=CCCCNCCCCCCC 2230a_100000229938_100011713584 [2,0,0,0,0,0|1,0,1]=4 10003 B12R0.5 C=CCCCNCCCCCCC 2230a_100000700776_100000210681 [2,0,0,0,0,0|1,0,1]=4 10004 B12R0.5 C=CCCCNCCCCCCC 34a_100000700776_100000210614 [2,0,0,0,0,0|1,0,1]=4 10005 B12R0.5 C=CCCCOCCCCCCC 34a_100000210272_100000757094 [2,0,0,0,0,0|1,0,1]=4 10006 B12R0.5 C=CCCCOCCCCCCC 34a_100000758997_100000210614 [2,0,0,0,0,0|1,0,1]=4 10007 B12R0.5 C=CCCCOCCCCCCC 7a_100000210272_100000757094 [2,0,0,0,0,0|1,0,1]=4 10008 B12R0.5 C=CCCCOCCCCCCC 7a_100000758997_100000210614 [2,0,0,0,0,0|1,0,1]=4 10009 B12R0.5 C=CCCCSCCCCCCC 62a_100000210614_100000757094 [2,0,0,0,0,0|1,0,1]=4 10010 B12R0.5 C=CCCCSCCCCCCC 62a_100011713584_100000210316 [2,0,0,0,0,0|1,0,1]=4 10011 B12R0.5 C=CCCNCCCCCCCC 2230a_100000229939_100000754431 [2,0,0,0,0,0|1,0,1]=4 10012 B12R0.5 C=CCCNCCCCCCCC 2230a_100015191253_100000210759 [2,0,0,0,0,0|1,0,1]=4 10013 B12R0.5 C=CCCNCCCCCCCC 34a_100000229939_100000754431 [2,0,0,0,0,0|1,0,1]=4 10014 B12R0.5 C=CCCOCCCCCCCC 34a_100000210232_100000754431 [2,0,0,0,0,0|1,0,1]=4 10015 B12R0.5 C=CCCOCCCCCCCC 34a_100011205117_100000210759 [2,0,0,0,0,0|1,0,1]=4 10016 B12R0.5 C=CCCOCCCCCCCC 7a_100000210232_100000754431 [2,0,0,0,0,0|1,0,1]=4 10017 B12R0.5 C=CCCSCCCCCCCC 62a_100000210759_100000754431 [2,0,0,0,0,0|1,0,1]=4 10018 B12R0.5 C=CCCSCCCCCCCC 62a_100000754431_100000210317 [2,0,0,0,0,0|1,0,1]=4 10019 B12R0.5 C=CCNCCCCCCCCC 2230a_100000212291_100000210623 [2,0,0,0,0,0|1,0,1]=4 10020 B12R0.5 C=CCNCCCCCCCCC 2230a_100020586998_100011214924 [2,0,0,0,0,0|1,0,1]=4 10021 B12R0.5 C=CCNCCCCCCCCC 34a_100000212291_100015514636 [2,0,0,0,0,0|1,0,1]=4 10022 B12R0.5 C=CCOCCCCCCCCC 34a_100000210712_100015514636 [2,0,0,0,0,0|1,0,1]=4 10023 B12R0.5 C=CCOCCCCCCCCC 34a_200000210373_100011214924 [2,0,0,0,0,0|1,0,1]=4 10024 B12R0.5 C=CCOCCCCCCCCC 7a_100000210712_100015514636 [2,0,0,0,0,0|1,0,1]=4 10025 B12R0.5 C=CCSCCCCCCCCC 62a_100000210623_100000210670 [2,0,0,0,0,0|1,0,1]=4 10026 B12R0.5 CCCCCCCCCCCNC 2230a_106832991635_100011215454 [2,0,0,0,0,0|1,0,0]=3 10027 B12R0.5 CCCCCCCCCCCNC 2230a_200011215754_200000210301 [2,0,0,0,0,0|1,0,0]=3 10028 B12R0.5 CCCCCCCCCCCNC 34a_100102657272_100011215454 [2,0,0,0,0,0|1,0,0]=3 10029 B12R0.5 CCCCCCCCCCCNC 34a_200011215754_200000210301 [2,0,0,0,0,0|1,0,0]=3 10030 B12R0.5 CCCCCCCCCCCNC 7a_106832991635_100011215454 [2,0,0,0,0,0|1,0,0]=3 10031 B12R0.5 CCCCCCCCCCCN[13CH3] 2230a_200011215754_200025704644 [2,0,0,0,0,0|1,0,0]=3 10032 B12R0.5 CCCCCCCCCCCN[13CH3] 34a_200011215754_200025704644 [2,0,0,0,0,0|1,0,0]=3 10033 B12R0.5 CCCCCCCCCCCOC 34a_100000210809_200000210301 [2,0,0,0,0,0|1,0,0]=3 10034 B12R0.5 CCCCCCCCCCCOC 34a_100138415774_100011215454 [2,0,0,0,0,0|1,0,0]=3 10035 B12R0.5 CCCCCCCCCCCOC 7a_100000210809_200000210301 [2,0,0,0,0,0|1,0,0]=3 10036 B12R0.5 CCCCCCCCCCCO[13CH3] 34a_100000210809_200025704644 [2,0,0,0,0,0|1,0,0]=3 10037 B12R0.5 CCCCCCCCCCCO[13CH3] 7a_100000210809_200025704644 [2,0,0,0,0,0|1,0,0]=3 10038 B12R0.5 CCCCCCCCCCCSC 62a_200000210301_100011215454 [2,0,0,0,0,0|1,0,0]=3 10039 B12R0.5 CCCCCCCCCCCS[13CH3] 62a_200025704644_100011215454 [2,0,0,0,0,0|1,0,0]=3 10040 B12R0.5 CCCCCCCCCCNCC 2230a_100000684558_100000210202 [2,0,0,0,0,0|1,0,0]=3 10041 B12R0.5 CCCCCCCCCCNCC 2230a_100015525214_100000210320 [2,0,0,0,0,0|1,0,0]=3 10042 B12R0.5 CCCCCCCCCCNCC 34a_100000684558_100000210202 [2,0,0,0,0,0|1,0,0]=3 10043 B12R0.5 CCCCCCCCCCNCF 34a_100000684558_100015361967 [2,0,0,0,0,0|2,0,0]=4 10044 B12R0.5 CCCCCCCCCCOCC 34a_100000210711_100000210202 [2,0,0,0,0,0|1,0,0]=3 10045 B12R0.5 CCCCCCCCCCOCC 34a_100121572206_100000210320 [2,0,0,0,0,0|1,0,0]=3 10046 B12R0.5 CCCCCCCCCCOCC 7a_100000210711_100000210202 [2,0,0,0,0,0|1,0,0]=3 10047 B12R0.5 CCCCCCCCCCOCF 34a_100000210711_100015361967 [2,0,0,0,0,0|2,0,0]=4 10048 B12R0.5 CCCCCCCCCCOCF 7a_100000210711_100015361967 [2,0,0,0,0,0|2,0,0]=4 10049 B12R0.5 CCCCCCCCCCSCC 62a_100000210202_100000210320 [2,0,0,0,0,0|1,0,0]=3 10050 B12R0.5 CCCCCCCCCCSCF 62a_100015361967_100000210320 [2,0,0,0,0,0|2,0,0]=4 10051 B12R0.5 CCCCCCCCCNCC=O 2230a_100000212291_200015260668 [2,0,0,0,0,0|1,0,0]=3 10052 B12R0.5 CCCCCCCCCNCC=O 34a_100000212291_200009817547 [2,0,0,0,0,0|1,0,0]=3 10053 B12R0.5 CCCCCCCCCNCCC 2230a_100000212291_100000210303 [2,0,0,0,0,0|1,0,0]=3 10054 B12R0.5 CCCCCCCCCNCCC 34a_100000212291_100000210303 [2,0,0,0,0,0|1,0,0]=3 10055 B12R0.5 CCCCCCCCCNCCF 2230a_100000212291_100011217306 [2,0,0,0,0,0|2,0,0]=4 10056 B12R0.5 CCCCCCCCCNCCF 34a_100000212291_100011217306 [2,0,0,0,0,0|2,0,0]=4 10057 B12R0.5 CCCCCCCCCNCCF 34a_100000724931_100011214924 [2,0,0,0,0,0|2,0,0]=4 10058 B12R0.5 CCCCCCCCCNCCO 2230a_100000212291_100000211926 [2,0,0,0,0,0|1,0,1]=4 10059 B12R0.5 CCCCCCCCCNCCO 2230a_100016997473_100011214924 [2,0,0,0,0,0|1,0,1]=4 10060 B12R0.5 CCCCCCCCCNCCO 34a_100000212291_100000211926 [2,0,0,0,0,0|1,0,1]=4 10061 B12R0.5 CCCCCCCCCNCCO 34a_100016990907_100011214924 [2,0,0,0,0,0|1,0,1]=4 10062 B12R0.5 CCCCCCCCCNCOC 2230a_100000212291_100000766300 [2,0,0,0,0,0|2,0,0]=4 10063 B12R0.5 CCCCCCCCCNCSC 2230a_100000212291_100011218213 [2,0,0,0,0,0|2,0,0]=4 10064 B12R0.5 CCCCCCCCCNCSC 34a_100000212291_100011218213 [2,0,0,0,0,0|2,0,0]=4 10065 B12R0.5 CCCCCCCCCOCC=O 34a_100000210712_200009817547 [2,0,0,0,0,0|1,0,0]=3 10066 B12R0.5 CCCCCCCCCOCC=O 7a_100000210712_200015260668 [2,0,0,0,0,0|1,0,0]=3 10067 B12R0.5 CCCCCCCCCOCCBr 34a_100000211926_100011214924 [2,0,0,0,0,0|2,0,0]=4 10068 B12R0.5 CCCCCCCCCOCCC 34a_100000210258_100011214924 [2,0,0,0,0,0|1,0,0]=3 10069 B12R0.5 CCCCCCCCCOCCC 34a_100000210712_100000210303 [2,0,0,0,0,0|1,0,0]=3 10070 B12R0.5 CCCCCCCCCOCCC 7a_100000210712_100000210303 [2,0,0,0,0,0|1,0,0]=3 10071 B12R0.5 CCCCCCCCCOCCF 34a_100000210712_100011217306 [2,0,0,0,0,0|2,0,0]=4 10072 B12R0.5 CCCCCCCCCOCCF 7a_100000210712_100011217306 [2,0,0,0,0,0|2,0,0]=4 10073 B12R0.5 CCCCCCCCCOCCN 34a_100000210304_100011214924 [2,0,0,0,0,0|2,0,0]=4 10074 B12R0.5 CCCCCCCCCOCCO 34a_100000210712_100000211926 [2,0,0,0,0,0|1,0,1]=4 10075 B12R0.5 CCCCCCCCCOCCO 7a_100000210712_100000211926 [2,0,0,0,0,0|1,0,1]=4 10076 B12R0.5 CCCCCCCCCOCSC 34a_100000210712_100011218213 [2,0,0,0,0,0|2,0,0]=4 10077 B12R0.5 CCCCCCCCCSCC=O 62a_200015260668_100000210670 [2,0,0,0,0,0|1,0,0]=3 10078 B12R0.5 CCCCCCCCCSCCC 62a_100000210303_100000210670 [2,0,0,0,0,0|1,0,0]=3 10079 B12R0.5 CCCCCCCCCSCCF 62a_100011217306_100000210670 [2,0,0,0,0,0|2,0,0]=4 10080 B12R0.5 CCCCCCCCCSCCO 62a_100000211926_100000210670 [2,0,0,0,0,0|1,0,1]=4 10081 B12R0.5 CCCCCCCCCSCOC 62a_100000766300_100000210670 [2,0,0,0,0,0|2,0,0]=4 10082 B12R0.5 CCCCCCCCCSCSC 62a_100011218213_100000210670 [2,0,0,0,0,0|2,0,0]=4 10083 B12R0.5 CCCCCCCCNCCCC 2230a_100000102301_100000210759 [2,0,0,0,0,0|1,0,0]=3 10084 B12R0.5 CCCCCCCCNCCCC 2230a_100000229939_100000210211 [2,0,0,0,0,0|1,0,0]=3 10085 B12R0.5 CCCCCCCCNCCCC 34a_100000229939_100000210210 [2,0,0,0,0,0|1,0,0]=3 10086 B12R0.5 CCCCCCCCNCCCC 7a_106832991798_100000210759 [2,0,0,0,0,0|1,0,0]=3 10087 B12R0.5 CCCCCCCCNCCCF 2230a_100000229939_100011934791 [2,0,0,0,0,0|2,0,0]=4 10088 B12R0.5 CCCCCCCCNCCCF 2230a_100015189416_100000210759 [2,0,0,0,0,0|2,0,0]=4 10089 B12R0.5 CCCCCCCCNCCCF 34a_100000229939_100011934791 [2,0,0,0,0,0|2,0,0]=4 10090 B12R0.5 CCCCCCCCNCCCF 34a_100015189416_100000210759 [2,0,0,0,0,0|2,0,0]=4 10091 B12R0.5 CCCCCCCCNCCCO 2230a_100000229939_100000230001 [2,0,0,0,0,0|1,0,1]=4 10092 B12R0.5 CCCCCCCCNCCCO 34a_100000229939_100000230001 [2,0,0,0,0,0|1,0,1]=4 10093 B12R0.5 CCCCCCCCNCCOC 2230a_100000209980_100000210759 [2,0,0,0,0,0|2,0,0]=4 10094 B12R0.5 CCCCCCCCNCCOC 2230a_100000229939_100011201679 [2,0,0,0,0,0|2,0,0]=4 10095 B12R0.5 CCCCCCCCNCCOC 34a_100000229939_100011201679 [2,0,0,0,0,0|2,0,0]=4 10096 B12R0.5 CCCCCCCCNCCSC 2230a_100000229939_100000751147 [2,0,0,0,0,0|2,0,0]=4 10097 B12R0.5 CCCCCCCCNCCSC 2230a_100020590264_100000210759 [2,0,0,0,0,0|2,0,0]=4 10098 B12R0.5 CCCCCCCCNCCSC 34a_100000229939_100000212216 [2,0,0,0,0,0|2,0,0]=4 10099 B12R0.5 CCCCCCCCOCCCBr 34a_100011217188_100000210759 [2,0,0,0,0,0|2,0,0]=4 10100 B12R0.5 CCCCCCCCOCCCC 34a_100000210227_100000210759 [2,0,0,0,0,0|1,0,0]=3 10101 B12R0.5 CCCCCCCCOCCCC 34a_100000210232_100000210210 [2,0,0,0,0,0|1,0,0]=3 10102 B12R0.5 CCCCCCCCOCCCC 7a_100000210227_100000210759 [2,0,0,0,0,0|1,0,0]=3 10103 B12R0.5 CCCCCCCCOCCCC 7a_100000210232_100000210211 [2,0,0,0,0,0|1,0,0]=3 10104 B12R0.5 CCCCCCCCOCCCCl 34a_100000230001_100000210759 [2,0,0,0,0,0|2,0,0]=4 10105 B12R0.5 CCCCCCCCOCCCF 34a_100000210232_100011934791 [2,0,0,0,0,0|2,0,0]=4 10106 B12R0.5 CCCCCCCCOCCCF 34a_100000759539_100000210759 [2,0,0,0,0,0|2,0,0]=4 10107 B12R0.5 CCCCCCCCOCCCF 7a_100000210232_100011934791 [2,0,0,0,0,0|2,0,0]=4 10108 B12R0.5 CCCCCCCCOCCCN 34a_100000182051_100000210759 [2,0,0,0,0,0|2,0,0]=4 10109 B12R0.5 CCCCCCCCOCCCO 34a_100000210232_100000230001 [2,0,0,0,0,0|1,0,1]=4 10110 B12R0.5 CCCCCCCCOCCCO 7a_100000210232_100011215043 [2,0,0,0,0,0|1,0,1]=4 10111 B12R0.5 CCCCCCCCOCCOC 34a_100000210232_100011201679 [2,0,0,0,0,0|2,0,0]=4 10112 B12R0.5 CCCCCCCCOCCOC 34a_100000210237_100000210759 [2,0,0,0,0,0|2,0,0]=4 10113 B12R0.5 CCCCCCCCOCCOC 7a_100000210232_100000233755 [2,0,0,0,0,0|2,0,0]=4 10114 B12R0.5 CCCCCCCCOCCSC 34a_100000210232_100000212216 [2,0,0,0,0,0|2,0,0]=4 10115 B12R0.5 CCCCCCCCOCCSC 34a_100000230434_100000210759 [2,0,0,0,0,0|2,0,0]=4 10116 B12R0.5 CCCCCCCCOCCSC 7a_100000210232_100000212216 [2,0,0,0,0,0|2,0,0]=4 10117 B12R0.5 CCCCCCCCOCCSC 7a_100000230434_100000210759 [2,0,0,0,0,0|2,0,0]=4 10118 B12R0.5 CCCCCCCCSCCCC 62a_100000210211_100000210317 [2,0,0,0,0,0|1,0,0]=3 10119 B12R0.5 CCCCCCCCSCCCC 62a_100000210759_100000210210 [2,0,0,0,0,0|1,0,0]=3 10120 B12R0.5 CCCCCCCCSCCCF 62a_100000210759_100011934791 [2,0,0,0,0,0|2,0,0]=4 10121 B12R0.5 CCCCCCCCSCCCF 62a_100011934791_100000210317 [2,0,0,0,0,0|2,0,0]=4 10122 B12R0.5 CCCCCCCCSCCCO 62a_100000210759_100011215043 [2,0,0,0,0,0|1,0,1]=4 10123 B12R0.5 CCCCCCCCSCCCO 62a_100011215043_100000210317 [2,0,0,0,0,0|1,0,1]=4 10124 B12R0.5 CCCCCCCCSCCOC 62a_100000210759_100000233755 [2,0,0,0,0,0|2,0,0]=4 10125 B12R0.5 CCCCCCCCSCCOC 62a_100000233755_100000210317 [2,0,0,0,0,0|2,0,0]=4 10126 B12R0.5 CCCCCCCCSCCSC 62a_100000210759_100000751147 [2,0,0,0,0,0|2,0,0]=4 10127 B12R0.5 CCCCCCCCSCCSC 62a_100000212216_100000210317 [2,0,0,0,0,0|2,0,0]=4 10128 B12R0.5 CCCCCCCCSCOCC 62a_100000210759_100000739092 [2,0,0,0,0,0|2,0,0]=4 10129 B12R0.5 CCCCCCCCSCOCC 62a_100000739092_100000210317 [2,0,0,0,0,0|2,0,0]=4 10130 B12R0.5 CCCCCCCNCCCC=O 2230a_100000229938_200011292268 [2,0,0,0,0,0|1,0,0]=3 10131 B12R0.5 CCCCCCCNCCCCC 2230a_100000209983_100000210681 [2,0,0,0,0,0|1,0,0]=3 10132 B12R0.5 CCCCCCCNCCCCC 2230a_100000229938_100000210326 [2,0,0,0,0,0|1,0,0]=3 10133 B12R0.5 CCCCCCCNCCCCF 2230a_100000229938_100000729493 [2,0,0,0,0,0|2,0,0]=4 10134 B12R0.5 CCCCCCCNCCCCO 2230a_100000229938_100000210776 [2,0,0,0,0,0|1,0,1]=4 10135 B12R0.5 CCCCCCCNCCCCO 2230a_100000750430_100000210681 [2,0,0,0,0,0|1,0,1]=4 10136 B12R0.5 CCCCCCCNCCCCO 34a_100000750430_100000210614 [2,0,0,0,0,0|1,0,1]=4 10137 B12R0.5 CCCCCCCNCCCOC 2230a_100000229938_100000740836 [2,0,0,0,0,0|2,0,0]=4 10138 B12R0.5 CCCCCCCNCCCOC 34a_100150723488_100000210614 [2,0,0,0,0,0|2,0,0]=4 10139 B12R0.5 CCCCCCCNCCCSC 2230a_100000749238_100000210681 [2,0,0,0,0,0|2,0,0]=4 10140 B12R0.5 CCCCCCCNCCOCC 2230a_100000229938_100011215890 [2,0,0,0,0,0|2,0,0]=4 10141 B12R0.5 CCCCCCCNCCOCC 2230a_102516460346_100000210681 [2,0,0,0,0,0|2,0,0]=4 10142 B12R0.5 CCCCCCCNCCOCC 34a_102516460346_100000210614 [2,0,0,0,0,0|2,0,0]=4 10143 B12R0.5 CCCCCCCNCCSCC 2230a_100000106463_100000210681 [2,0,0,0,0,0|2,0,0]=4 10144 B12R0.5 CCCCCCCNCCSCC 2230a_100000229938_100000757381 [2,0,0,0,0,0|2,0,0]=4 10145 B12R0.5 CCCCCCCOCCCC=O 7a_100000210272_200011292268 [2,0,0,0,0,0|1,0,0]=3 10146 B12R0.5 CCCCCCCOCCCCBr 34a_100011216708_100000210614 [2,0,0,0,0,0|2,0,0]=4 10147 B12R0.5 CCCCCCCOCCCCC 34a_100000210253_100000210614 [2,0,0,0,0,0|1,0,0]=3 10148 B12R0.5 CCCCCCCOCCCCC 34a_100000210272_100000718602 [2,0,0,0,0,0|1,0,0]=3 10149 B12R0.5 CCCCCCCOCCCCC 7a_100000210253_100000210614 [2,0,0,0,0,0|1,0,0]=3 10150 B12R0.5 CCCCCCCOCCCCC 7a_100000210272_100000210326 [2,0,0,0,0,0|1,0,0]=3 10151 B12R0.5 CCCCCCCOCCCCCl 34a_100000210776_100000210614 [2,0,0,0,0,0|2,0,0]=4 10152 B12R0.5 CCCCCCCOCCCCCl 7a_100000210776_100000210614 [2,0,0,0,0,0|2,0,0]=4 10153 B12R0.5 CCCCCCCOCCCCF 34a_100000210272_100000729493 [2,0,0,0,0,0|2,0,0]=4 10154 B12R0.5 CCCCCCCOCCCCF 34a_100011995726_100000210614 [2,0,0,0,0,0|2,0,0]=4 10155 B12R0.5 CCCCCCCOCCCCF 7a_100000210272_100000729493 [2,0,0,0,0,0|2,0,0]=4 10156 B12R0.5 CCCCCCCOCCCCF 7a_100011995726_100000210614 [2,0,0,0,0,0|2,0,0]=4 10157 B12R0.5 CCCCCCCOCCCCI 34a_200012148704_100000210614 [2,0,0,0,0,0|2,0,0]=4 10158 B12R0.5 CCCCCCCOCCCCN 34a_100000750430_100000210614 [2,0,0,0,0,0|2,0,0]=4 10159 B12R0.5 CCCCCCCOCCCCO 34a_100000210272_100011216708 [2,0,0,0,0,0|1,0,1]=4 10160 B12R0.5 CCCCCCCOCCCCO 7a_100000210272_100000210776 [2,0,0,0,0,0|1,0,1]=4 10161 B12R0.5 CCCCCCCOCCCNC 34a_100000213112_100000210614 [2,0,0,0,0,0|2,0,0]=4 10162 B12R0.5 CCCCCCCOCCCOC 34a_100000210272_100000740836 [2,0,0,0,0,0|2,0,0]=4 10163 B12R0.5 CCCCCCCOCCCOC 34a_100000740835_100000210614 [2,0,0,0,0,0|2,0,0]=4 10164 B12R0.5 CCCCCCCOCCCOC 7a_100000210272_100000740836 [2,0,0,0,0,0|2,0,0]=4 10165 B12R0.5 CCCCCCCOCCCSC 34a_100000690336_100000210614 [2,0,0,0,0,0|2,0,0]=4 10166 B12R0.5 CCCCCCCOCCCSC 7a_100000690336_100000210614 [2,0,0,0,0,0|2,0,0]=4 10167 B12R0.5 CCCCCCCOCCOCC 34a_100000210136_100000210614 [2,0,0,0,0,0|2,0,0]=4 10168 B12R0.5 CCCCCCCOCCOCC 34a_100000210272_100000210147 [2,0,0,0,0,0|2,0,0]=4 10169 B12R0.5 CCCCCCCOCCOCC 7a_100000210136_100000210614 [2,0,0,0,0,0|2,0,0]=4 10170 B12R0.5 CCCCCCCOCCOCC 7a_100000210272_100011215890 [2,0,0,0,0,0|2,0,0]=4 10171 B12R0.5 CCCCCCCOCCSCC 34a_100000210272_100000757381 [2,0,0,0,0,0|2,0,0]=4 10172 B12R0.5 CCCCCCCOCCSCC 34a_100000212035_100000210614 [2,0,0,0,0,0|2,0,0]=4 10173 B12R0.5 CCCCCCCOCCSCC 7a_100000210272_100000757381 [2,0,0,0,0,0|2,0,0]=4 10174 B12R0.5 CCCCCCCOCCSCC 7a_100000212035_100000210614 [2,0,0,0,0,0|2,0,0]=4 10175 B12R0.5 CCCCCCCSCCCC=O 62a_100000210614_200011292268 [2,0,0,0,0,0|1,0,0]=3 10176 B12R0.5 CCCCCCCSCCCC=O 62a_200011292268_100000210316 [2,0,0,0,0,0|1,0,0]=3 10177 B12R0.5 CCCCCCCSCCCCC 62a_100000210326_100000210316 [2,0,0,0,0,0|1,0,0]=3 10178 B12R0.5 CCCCCCCSCCCCC 62a_100000210614_100000210326 [2,0,0,0,0,0|1,0,0]=3 10179 B12R0.5 CCCCCCCSCCCCF 62a_100000210614_100000729493 [2,0,0,0,0,0|2,0,0]=4 10180 B12R0.5 CCCCCCCSCCCCF 62a_100000729493_100000210316 [2,0,0,0,0,0|2,0,0]=4 10181 B12R0.5 CCCCCCCSCCCCO 62a_100000210614_100000210776 [2,0,0,0,0,0|1,0,1]=4 10182 B12R0.5 CCCCCCCSCCCCO 62a_100000210776_100000210316 [2,0,0,0,0,0|1,0,1]=4 10183 B12R0.5 CCCCCCCSCCCOC 62a_100000210614_100000709357 [2,0,0,0,0,0|2,0,0]=4 10184 B12R0.5 CCCCCCCSCCCOC 62a_100000709357_100000210316 [2,0,0,0,0,0|2,0,0]=4 10185 B12R0.5 CCCCCCCSCCOCC 62a_100000210147_100000210316 [2,0,0,0,0,0|2,0,0]=4 10186 B12R0.5 CCCCCCCSCCOCC 62a_100000210614_100011215890 [2,0,0,0,0,0|2,0,0]=4 10187 B12R0.5 CCCCCCCSCCSCC 62a_100000210614_100000757381 [2,0,0,0,0,0|2,0,0]=4 10188 B12R0.5 CCCCCCCSCCSCC 62a_100000757381_100000210316 [2,0,0,0,0,0|2,0,0]=4 10189 B12R0.5 CCCCCCNCCCCC=O 2230a_100000210581_100000139335 [2,0,0,0,0,0|1,0,0]=3 10190 B12R0.5 CCCCCCNCCCCCC 2230a_100000210581_100000210314 [2,0,0,0,0,0|1,0,0]=3 10191 B12R0.5 CCCCCCNCCCCCF 2230a_100000210581_100000729378 [2,0,0,0,0,0|2,0,0]=4 10192 B12R0.5 CCCCCCNCCCCCO 2230a_100000210581_100000746330 [2,0,0,0,0,0|1,0,1]=4 10193 B12R0.5 CCCCCCNCCCCCO 2230a_100000762737_100000210314 [2,0,0,0,0,0|1,0,1]=4 10194 B12R0.5 CCCCCCNCCCCCO 34a_100000762737_100000210314 [2,0,0,0,0,0|1,0,1]=4 10195 B12R0.5 CCCCCCNCCCCOC 2230a_100000210581_100000730899 [2,0,0,0,0,0|2,0,0]=4 10196 B12R0.5 CCCCCCNCCCOCC 2230a_100000210581_100012232248 [2,0,0,0,0,0|2,0,0]=4 10197 B12R0.5 CCCCCCNCCCOCC 2230a_100000210961_100000210314 [2,0,0,0,0,0|2,0,0]=4 10198 B12R0.5 CCCCCCNCCCOCC 34a_100000210961_100000210314 [2,0,0,0,0,0|2,0,0]=4 10199 B12R0.5 CCCCCCNCCOCCC 2230a_100000210581_100011215938 [2,0,0,0,0,0|2,0,0]=4 10200 B12R0.5 CCCCCCNCCOCCC 2230a_100161115042_100000210314 [2,0,0,0,0,0|2,0,0]=4 10201 B12R0.5 CCCCCCNCCOCCC 34a_100161115042_100000210314 [2,0,0,0,0,0|2,0,0]=4 10202 B12R0.5 CCCCCCNCCSCCC 2230a_100020603323_100000210314 [2,0,0,0,0,0|2,0,0]=4 10203 B12R0.5 CCCCCCNCOCCCC 2230a_100000210581_100011995733 [2,0,0,0,0,0|2,0,0]=4 10204 B12R0.5 CCCCCCOCCCCC=O 7a_100000210259_100000139335 [2,0,0,0,0,0|1,0,0]=3 10205 B12R0.5 CCCCCCOCCCCCBr 34a_100000746331_100000210314 [2,0,0,0,0,0|2,0,0]=4 10206 B12R0.5 CCCCCCOCCCCCBr 7a_100000746331_100000210314 [2,0,0,0,0,0|2,0,0]=4 10207 B12R0.5 CCCCCCOCCCCCC 34a_100000210259_100000210314 [2,0,0,0,0,0|1,0,0]=3 10208 B12R0.5 CCCCCCOCCCCCC 7a_100000210259_100000210314 [2,0,0,0,0,0|1,0,0]=3 10209 B12R0.5 CCCCCCOCCCCCCl 34a_100000746330_100000210314 [2,0,0,0,0,0|2,0,0]=4 10210 B12R0.5 CCCCCCOCCCCCCl 7a_100000746330_100000210314 [2,0,0,0,0,0|2,0,0]=4 10211 B12R0.5 CCCCCCOCCCCCF 34a_100000210259_100000729378 [2,0,0,0,0,0|2,0,0]=4 10212 B12R0.5 CCCCCCOCCCCCF 7a_100000210259_100000729378 [2,0,0,0,0,0|2,0,0]=4 10213 B12R0.5 CCCCCCOCCCCCI 34a_200012148887_100000210314 [2,0,0,0,0,0|2,0,0]=4 10214 B12R0.5 CCCCCCOCCCCCI 7a_200012148887_100000210314 [2,0,0,0,0,0|2,0,0]=4 10215 B12R0.5 CCCCCCOCCCCCN 34a_100000762737_100000210314 [2,0,0,0,0,0|2,0,0]=4 10216 B12R0.5 CCCCCCOCCCCCO 34a_100000210259_100000746330 [2,0,0,0,0,0|1,0,1]=4 10217 B12R0.5 CCCCCCOCCCCCO 7a_100000210259_100000746330 [2,0,0,0,0,0|1,0,1]=4 10218 B12R0.5 CCCCCCOCCCCOC 34a_100000210259_100000755781 [2,0,0,0,0,0|2,0,0]=4 10219 B12R0.5 CCCCCCOCCCCOC 34a_100000740925_100000210314 [2,0,0,0,0,0|2,0,0]=4 10220 B12R0.5 CCCCCCOCCCCOC 7a_100000210259_100000730899 [2,0,0,0,0,0|2,0,0]=4 10221 B12R0.5 CCCCCCOCCCCSC 34a_100011217163_100000210314 [2,0,0,0,0,0|2,0,0]=4 10222 B12R0.5 CCCCCCOCCCCSC 7a_100011217163_100000210314 [2,0,0,0,0,0|2,0,0]=4 10223 B12R0.5 CCCCCCOCCCOCC 34a_100000210259_100012232248 [2,0,0,0,0,0|2,0,0]=4 10224 B12R0.5 CCCCCCOCCCOCC 34a_100000757476_100000210314 [2,0,0,0,0,0|2,0,0]=4 10225 B12R0.5 CCCCCCOCCCOCC 7a_100000210259_100012232248 [2,0,0,0,0,0|2,0,0]=4 10226 B12R0.5 CCCCCCOCCCOCC 7a_100000757476_100000210314 [2,0,0,0,0,0|2,0,0]=4 10227 B12R0.5 CCCCCCOCCCSCC 34a_100011216438_100000210314 [2,0,0,0,0,0|2,0,0]=4 10228 B12R0.5 CCCCCCOCCCSCC 7a_100011216438_100000210314 [2,0,0,0,0,0|2,0,0]=4 10229 B12R0.5 CCCCCCOCCOCC=O 34a_100000691444_200009817547 [2,0,0,0,0,0|2,0,0]=4 10230 B12R0.5 CCCCCCOCCOCC=O 7a_100000691444_200015260668 [2,0,0,0,0,0|2,0,0]=4 10231 B12R0.5 CCCCCCOCCOCCC 34a_100000210259_100011215938 [2,0,0,0,0,0|2,0,0]=4 10232 B12R0.5 CCCCCCOCCOCCC 34a_100000691444_100000210303 [2,0,0,0,0,0|2,0,0]=4 10233 B12R0.5 CCCCCCOCCOCCC 34a_100000752267_100000210314 [2,0,0,0,0,0|2,0,0]=4 10234 B12R0.5 CCCCCCOCCOCCC 7a_100000210259_100011215938 [2,0,0,0,0,0|2,0,0]=4 10235 B12R0.5 CCCCCCOCCOCCC 7a_100000691444_100000210303 [2,0,0,0,0,0|2,0,0]=4 10236 B12R0.5 CCCCCCOCCOCCC 7a_100000752267_100000210314 [2,0,0,0,0,0|2,0,0]=4 10237 B12R0.5 CCCCCCOCCSCCC 34a_200000230433_100000210314 [2,0,0,0,0,0|2,0,0]=4 10238 B12R0.5 CCCCCCOCCSCCC 7a_200000230433_100000210314 [2,0,0,0,0,0|2,0,0]=4 10239 B12R0.5 CCCCCCOCOCCCC 34a_100000210259_100011995733 [2,0,0,0,0,0|2,0,0]=4 10240 B12R0.5 CCCCCCSCCCCC=O 62a_100000139335_100000210757 [2,0,0,0,0,0|1,0,0]=3 10241 B12R0.5 CCCCCCSCCCCC=O 62a_100000210314_100000139335 [2,0,0,0,0,0|1,0,0]=3 10242 B12R0.5 CCCCCCSCCCCCC 62a_100000210314_100000210757 [2,0,0,0,0,0|1,0,0]=3 10243 B12R0.5 CCCCCCSCCCCCF 62a_100000210314_100000729378 [2,0,0,0,0,0|2,0,0]=4 10244 B12R0.5 CCCCCCSCCCCCF 62a_100000729378_100000210757 [2,0,0,0,0,0|2,0,0]=4 10245 B12R0.5 CCCCCCSCCCCCO 62a_100000210314_100000746330 [2,0,0,0,0,0|1,0,1]=4 10246 B12R0.5 CCCCCCSCCCCCO 62a_100000746330_100000210757 [2,0,0,0,0,0|1,0,1]=4 10247 B12R0.5 CCCCCCSCCCCOC 62a_100000210314_100000730899 [2,0,0,0,0,0|2,0,0]=4 10248 B12R0.5 CCCCCCSCCCCOC 62a_100000730899_100000210757 [2,0,0,0,0,0|2,0,0]=4 10249 B12R0.5 CCCCCCSCCCOCC 62a_100000210314_100012232248 [2,0,0,0,0,0|2,0,0]=4 10250 B12R0.5 CCCCCCSCCCOCC 62a_100012232248_100000210757 [2,0,0,0,0,0|2,0,0]=4 10251 B12R0.5 CCCCCCSCCOCCC 62a_100000210314_100011215938 [2,0,0,0,0,0|2,0,0]=4 10252 B12R0.5 CCCCCCSCCOCCC 62a_100011215938_100000210757 [2,0,0,0,0,0|2,0,0]=4 10253 B12R0.5 CCCCCCSCOCCCC 62a_100000210314_100011995733 [2,0,0,0,0,0|2,0,0]=4 10254 B12R0.5 CCCCCCSCOCCCC 62a_100011995733_100000210757 [2,0,0,0,0,0|2,0,0]=4 10255 B12R0.5 CCCCCNCCCCCC=O 2230a_100000209983_100000139337 [2,0,0,0,0,0|1,0,0]=3 10256 B12R0.5 CCCCCNCCCCCCF 2230a_100000209983_100015922095 [2,0,0,0,0,0|2,0,0]=4 10257 B12R0.5 CCCCCNCCCCCCO 2230a_100000209983_100000766143 [2,0,0,0,0,0|1,0,1]=4 10258 B12R0.5 CCCCCNCCCCCCO 2230a_100000686447_100000210326 [2,0,0,0,0,0|1,0,1]=4 10259 B12R0.5 CCCCCNCCCCCCO 34a_100000686447_100000718602 [2,0,0,0,0,0|1,0,1]=4 10260 B12R0.5 CCCCCNCCCCCOC 2230a_100000747528_100000210326 [2,0,0,0,0,0|2,0,0]=4 10261 B12R0.5 CCCCCNCCCCCOC 34a_100000747528_100000718602 [2,0,0,0,0,0|2,0,0]=4 10262 B12R0.5 CCCCCNCCCOCCC 2230a_100011217757_100000210326 [2,0,0,0,0,0|2,0,0]=4 10263 B12R0.5 CCCCCNCCCOCCC 34a_100011217757_100000718602 [2,0,0,0,0,0|2,0,0]=4 10264 B12R0.5 CCCCCNCCOCCCC 2230a_100000209983_100000743108 [2,0,0,0,0,0|2,0,0]=4 10265 B12R0.5 CCCCCNCCOCCCC 34a_100000224656_100000210210 [2,0,0,0,0,0|2,0,0]=4 10266 B12R0.5 CCCCCNCCSCCCC 2230a_100025743550_100000210326 [2,0,0,0,0,0|2,0,0]=4 10267 B12R0.5 CCCCCOCCCCCC=O 7a_100000210253_100000139337 [2,0,0,0,0,0|1,0,0]=3 10268 B12R0.5 CCCCCOCCCCCCBr 34a_100011215345_100000718602 [2,0,0,0,0,0|2,0,0]=4 10269 B12R0.5 CCCCCOCCCCCCBr 7a_100011215345_100000210326 [2,0,0,0,0,0|2,0,0]=4 10270 B12R0.5 CCCCCOCCCCCCCl 34a_100000766143_100000718602 [2,0,0,0,0,0|2,0,0]=4 10271 B12R0.5 CCCCCOCCCCCCCl 7a_100000766143_100000210326 [2,0,0,0,0,0|2,0,0]=4 10272 B12R0.5 CCCCCOCCCCCCF 34a_100000210253_100015922095 [2,0,0,0,0,0|2,0,0]=4 10273 B12R0.5 CCCCCOCCCCCCF 34a_100000732779_100000718602 [2,0,0,0,0,0|2,0,0]=4 10274 B12R0.5 CCCCCOCCCCCCF 7a_100000210253_100015922095 [2,0,0,0,0,0|2,0,0]=4 10275 B12R0.5 CCCCCOCCCCCCF 7a_100000732779_100000210326 [2,0,0,0,0,0|2,0,0]=4 10276 B12R0.5 CCCCCOCCCCCCN 34a_100000686447_100000718602 [2,0,0,0,0,0|2,0,0]=4 10277 B12R0.5 CCCCCOCCCCCCO 34a_100000210253_100000766143 [2,0,0,0,0,0|1,0,1]=4 10278 B12R0.5 CCCCCOCCCCCCO 7a_100000210253_100000766143 [2,0,0,0,0,0|1,0,1]=4 10279 B12R0.5 CCCCCOCCCCCNC 34a_100000722520_100000718602 [2,0,0,0,0,0|2,0,0]=4 10280 B12R0.5 CCCCCOCCOCCCC 34a_100000210238_100000718602 [2,0,0,0,0,0|2,0,0]=4 10281 B12R0.5 CCCCCOCCOCCCC 34a_100000210253_100000743108 [2,0,0,0,0,0|2,0,0]=4 10282 B12R0.5 CCCCCOCCOCCCC 34a_100011215259_100000210210 [2,0,0,0,0,0|2,0,0]=4 10283 B12R0.5 CCCCCOCCOCCCC 7a_100000210238_100000210326 [2,0,0,0,0,0|2,0,0]=4 10284 B12R0.5 CCCCCOCCOCCCC 7a_100000210253_100000743108 [2,0,0,0,0,0|2,0,0]=4 10285 B12R0.5 CCCCCOCCOCCCC 7a_100011215259_100000210211 [2,0,0,0,0,0|2,0,0]=4 10286 B12R0.5 CCCCCOCCSCCCC 34a_200000230436_100000718602 [2,0,0,0,0,0|2,0,0]=4 10287 B12R0.5 CCCCCOCCSCCCC 7a_200000230436_100000210326 [2,0,0,0,0,0|2,0,0]=4 10288 B12R0.5 CCCCCSCCCCCC=O 62a_100000139337_100000210326 [2,0,0,0,0,0|1,0,0]=3 10289 B12R0.5 CCCCCSCCCCCC=O 62a_100000210326_100000139337 [2,0,0,0,0,0|1,0,0]=3 10290 B12R0.5 CCCCCSCCCCCCF 62a_100000210326_100015922095 [2,0,0,0,0,0|2,0,0]=4 10291 B12R0.5 CCCCCSCCCCCCF 62a_100015922095_100000210326 [2,0,0,0,0,0|2,0,0]=4 10292 B12R0.5 CCCCCSCCCCCCO 62a_100000210326_100000766143 [2,0,0,0,0,0|1,0,1]=4 10293 B12R0.5 CCCCCSCCCCCCO 62a_100000766143_100000210326 [2,0,0,0,0,0|1,0,1]=4 10294 B12R0.5 CCCCCSCCOCCCC 62a_100000210326_100000743108 [2,0,0,0,0,0|2,0,0]=4 10295 B12R0.5 CCCCCSCCOCCCC 62a_100000743108_100000210326 [2,0,0,0,0,0|2,0,0]=4 10296 B12R0.5 CCCCNCCCCCCCO 2230a_100000102301_100000760002 [2,0,0,0,0,0|1,0,1]=4 10297 B12R0.5 CCCCNCCCCCCCO 2230a_100011996573_100000210211 [2,0,0,0,0,0|1,0,1]=4 10298 B12R0.5 CCCCNCCCCCCCO 34a_100011996573_100000210210 [2,0,0,0,0,0|1,0,1]=4 10299 B12R0.5 CCCCNCCCCCCCO 7a_106832991798_100000760002 [2,0,0,0,0,0|1,0,1]=4 10300 B12R0.5 CCCCNCCCCCCOC 2230a_100000102301_100011998445 [2,0,0,0,0,0|2,0,0]=4 10301 B12R0.5 CCCCNCCCCCCOC 7a_106832991798_100011998445 [2,0,0,0,0,0|2,0,0]=4 10302 B12R0.5 CCCCNCCCCOCC=O 34a_200011216965_200009817547 [2,0,0,0,0,0|2,0,0]=4 10303 B12R0.5 CCCCNCCCCOCCC 34a_200011216965_100000210303 [2,0,0,0,0,0|2,0,0]=4 10304 B12R0.5 CCCCNCCCOCCCC 2230a_200000211371_100000210211 [2,0,0,0,0,0|2,0,0]=4 10305 B12R0.5 CCCCNCCCOCCCC 34a_200000211371_100000210210 [2,0,0,0,0,0|2,0,0]=4 10306 B12R0.5 CCCCOCCCCCCCBr 34a_100000760002_100000210210 [2,0,0,0,0,0|2,0,0]=4 10307 B12R0.5 CCCCOCCCCCCCBr 7a_100000760002_100000210211 [2,0,0,0,0,0|2,0,0]=4 10308 B12R0.5 CCCCOCCCCCCCN 34a_100011996573_100000210210 [2,0,0,0,0,0|2,0,0]=4 10309 B12R0.5 CCCCOCCCCCCCO 34a_100000210227_100000760002 [2,0,0,0,0,0|1,0,1]=4 10310 B12R0.5 CCCCOCCCCCCCO 7a_100000210227_100000760002 [2,0,0,0,0,0|1,0,1]=4 10311 B12R0.5 CCCCOCCCCCCOC 34a_100000210227_100011998445 [2,0,0,0,0,0|2,0,0]=4 10312 B12R0.5 CCCCOCCCCCCOC 34a_200012092642_100000210210 [2,0,0,0,0,0|2,0,0]=4 10313 B12R0.5 CCCCOCCCCCCOC 7a_100000210227_100011998445 [2,0,0,0,0,0|2,0,0]=4 10314 B12R0.5 CCCCOCCCCCCOC 7a_200012092642_100000210211 [2,0,0,0,0,0|2,0,0]=4 10315 B12R0.5 CCCCOCCCCOCC=O 34a_200000760531_200009817547 [2,0,0,0,0,0|2,0,0]=4 10316 B12R0.5 CCCCOCCCCOCC=O 7a_200000760531_200015260668 [2,0,0,0,0,0|2,0,0]=4 10317 B12R0.5 CCCCOCCCCOCCC 34a_200000760531_100000210303 [2,0,0,0,0,0|2,0,0]=4 10318 B12R0.5 CCCCOCCCCOCCC 7a_200000760531_100000210303 [2,0,0,0,0,0|2,0,0]=4 10319 B12R0.5 CCCCOCCCOCCCC 34a_200011215613_100000210210 [2,0,0,0,0,0|2,0,0]=4 10320 B12R0.5 CCCCOCCCOCCCC 7a_200011215613_100000210211 [2,0,0,0,0,0|2,0,0]=4 10321 B12R0.5 CCCCOCCOCCCC=O 7a_100000210238_200011292268 [2,0,0,0,0,0|2,0,0]=4 10322 B12R0.5 CCCCOCCSCCCC=O 62a_100000743108_200011292268 [2,0,0,0,0,0|2,0,0]=4 10323 B12R0.5 CCCCOCCSCCCC=O 62a_200011292268_100000743108 [2,0,0,0,0,0|2,0,0]=4 10324 B12R0.5 CCCCOCSCCCCC=O 62a_100000139335_100011995733 [2,0,0,0,0,0|2,0,0]=4 10325 B12R0.5 CCCCOCSCCCCC=O 62a_100011995733_100000139335 [2,0,0,0,0,0|2,0,0]=4 10326 B12R0.5 CCCCSCCCCCCCO 62a_100000210211_100000760002 [2,0,0,0,0,0|1,0,1]=4 10327 B12R0.5 CCCCSCCCCCCCO 62a_100000760002_100000210210 [2,0,0,0,0,0|1,0,1]=4 10328 B12R0.5 CCCCSCCCCCCOC 62a_100000210211_100011998445 [2,0,0,0,0,0|2,0,0]=4 10329 B12R0.5 CCCCSCCCCCCOC 62a_100011998445_100000210210 [2,0,0,0,0,0|2,0,0]=4 10330 B12R0.5 CCCCSCCNCCCC=O 2230a_100025743550_200011292268 [2,0,0,0,0,0|2,0,0]=4 10331 B12R0.5 CCCCSCCOCCCC=O 7a_200000230436_200011292268 [2,0,0,0,0,0|2,0,0]=4 10332 B12R0.5 CCCNCCCCCCCCO 2230a_102515433106_100000210303 [2,0,0,0,0,0|1,0,1]=4 10333 B12R0.5 CCCNCCCCCCCCO 34a_102515433106_100000210303 [2,0,0,0,0,0|1,0,1]=4 10334 B12R0.5 CCCOCCCCCCCCBr 34a_100009813846_100000210303 [2,0,0,0,0,0|2,0,0]=4 10335 B12R0.5 CCCOCCCCCCCCBr 7a_100009813846_100000210303 [2,0,0,0,0,0|2,0,0]=4 10336 B12R0.5 CCCOCCCCCCCCCl 34a_100000033203_100000210303 [2,0,0,0,0,0|2,0,0]=4 10337 B12R0.5 CCCOCCCCCCCCCl 7a_100000033203_100000210303 [2,0,0,0,0,0|2,0,0]=4 10338 B12R0.5 CCCOCCCCCCCCN 34a_102515433106_100000210303 [2,0,0,0,0,0|2,0,0]=4 10339 B12R0.5 CCCOCCCCCCCCO 34a_100000210258_100000033203 [2,0,0,0,0,0|1,0,1]=4 10340 B12R0.5 CCCOCCCNCCCC=O 2230a_100011217757_200011292268 [2,0,0,0,0,0|2,0,0]=4 10341 B12R0.5 CCCOCCNCCCCC=O 2230a_100161115042_100000139335 [2,0,0,0,0,0|2,0,0]=4 10342 B12R0.5 CCCOCCOCCCCC=O 7a_100000752267_100000139335 [2,0,0,0,0,0|2,0,0]=4 10343 B12R0.5 CCCOCCSCCCCC=O 62a_100000139335_100011215938 [2,0,0,0,0,0|2,0,0]=4 10344 B12R0.5 CCCOCCSCCCCC=O 62a_100011215938_100000139335 [2,0,0,0,0,0|2,0,0]=4 10345 B12R0.5 CCCSCCCCCCCCO 62a_100000033203_100000210303 [2,0,0,0,0,0|1,0,1]=4 10346 B12R0.5 CCCSCCCCCCCCO 62a_100000210303_100000033203 [2,0,0,0,0,0|1,0,1]=4 10347 B12R0.5 CCCSCCNCCCCC=O 2230a_100020603323_100000139335 [2,0,0,0,0,0|2,0,0]=4 10348 B12R0.5 CCCSCCOCCCCC=O 7a_200000230433_100000139335 [2,0,0,0,0,0|2,0,0]=4 10349 B12R0.5 CCNCCCCCCCCCO 2230a_100000078944_100000210202 [2,0,0,0,0,0|1,0,1]=4 10350 B12R0.5 CCNCCCCCCCCCO 2230a_100015525214_100009813782 [2,0,0,0,0,0|1,0,1]=4 10351 B12R0.5 CCNCCCCCCCCCO 34a_100000078944_100000210202 [2,0,0,0,0,0|1,0,1]=4 10352 B12R0.5 CCOCCCCCCCCCBr 34a_100009813782_100000210202 [2,0,0,0,0,0|2,0,0]=4 10353 B12R0.5 CCOCCCCCCCCCBr 7a_100009813782_100000210202 [2,0,0,0,0,0|2,0,0]=4 10354 B12R0.5 CCOCCCCCCCCCCl 34a_100009868337_100000210202 [2,0,0,0,0,0|2,0,0]=4 10355 B12R0.5 CCOCCCCCCCCCCl 7a_100009868337_100000210202 [2,0,0,0,0,0|2,0,0]=4 10356 B12R0.5 CCOCCCCCCCCCN 34a_100000078944_100000210202 [2,0,0,0,0,0|2,0,0]=4 10357 B12R0.5 CCOCCCCCCCCCO 34a_100121572206_100009813782 [2,0,0,0,0,0|1,0,1]=4 10358 B12R0.5 CCOCCCNCCCCC=O 2230a_100000210961_100000139335 [2,0,0,0,0,0|2,0,0]=4 10359 B12R0.5 CCOCCCOCCCCC=O 7a_100000757476_100000139335 [2,0,0,0,0,0|2,0,0]=4 10360 B12R0.5 CCOCCCSCCCCC=O 62a_100000139335_100012232248 [2,0,0,0,0,0|2,0,0]=4 10361 B12R0.5 CCOCCCSCCCCC=O 62a_100012232248_100000139335 [2,0,0,0,0,0|2,0,0]=4 10362 B12R0.5 CCOCCNCCCCCC=O 2230a_102516460346_100000139337 [2,0,0,0,0,0|2,0,0]=4 10363 B12R0.5 CCOCCOCCCCCC=O 7a_100000210136_100000139337 [2,0,0,0,0,0|2,0,0]=4 10364 B12R0.5 CCOCCSCCCCCC=O 62a_100000139337_100011215890 [2,0,0,0,0,0|2,0,0]=4 10365 B12R0.5 CCOCCSCCCCCC=O 62a_100000210147_100000139337 [2,0,0,0,0,0|2,0,0]=4 10366 B12R0.5 CCSCCCCCCCCCO 62a_100000210202_100009813782 [2,0,0,0,0,0|1,0,1]=4 10367 B12R0.5 CCSCCCCCCCCCO 62a_100009813782_100000210202 [2,0,0,0,0,0|1,0,1]=4 10368 B12R0.5 CCSCCCOCCCCC=O 7a_100011216438_100000139335 [2,0,0,0,0,0|2,0,0]=4 10369 B12R0.5 CCSCCNCCCCCC=O 2230a_100000106463_100000139337 [2,0,0,0,0,0|2,0,0]=4 10370 B12R0.5 CCSCCOCCCCCC=O 7a_100000212035_100000139337 [2,0,0,0,0,0|2,0,0]=4 10371 B12R0.5 CCSCCSCCCCCC=O 62a_100000139337_100000757381 [2,0,0,0,0,0|2,0,0]=4 10372 B12R0.5 CCSCCSCCCCCC=O 62a_100000757381_100000139337 [2,0,0,0,0,0|2,0,0]=4 10373 B12R0.5 CNCCCCCCCCCCO 2230a_100000066964_200000210301 [2,0,0,0,0,0|1,0,1]=4 10374 B12R0.5 CNCCCCCCCCCCO 2230a_106832991635_100009813290 [2,0,0,0,0,0|1,0,1]=4 10375 B12R0.5 CNCCCCCCCCCCO 34a_100000066964_200000210301 [2,0,0,0,0,0|1,0,1]=4 10376 B12R0.5 CNCCCCCCCCCCO 34a_100102657272_100009813290 [2,0,0,0,0,0|1,0,1]=4 10377 B12R0.5 CNCCCCCCCCCCO 7a_106832991635_100009813290 [2,0,0,0,0,0|1,0,1]=4 10378 B12R0.5 COCCCCCCCCCCBr 34a_100009813290_200000210301 [2,0,0,0,0,0|2,0,0]=4 10379 B12R0.5 COCCCCCCCCCCBr 7a_100009813290_200000210301 [2,0,0,0,0,0|2,0,0]=4 10380 B12R0.5 COCCCCCCCCCCCl 34a_200000033068_200000210301 [2,0,0,0,0,0|2,0,0]=4 10381 B12R0.5 COCCCCCCCCCCCl 7a_200000033068_200000210301 [2,0,0,0,0,0|2,0,0]=4 10382 B12R0.5 COCCCCCCCCCCN 34a_100000066964_200000210301 [2,0,0,0,0,0|2,0,0]=4 10383 B12R0.5 COCCCCCCCCCCO 34a_100138415774_100009813290 [2,0,0,0,0,0|1,0,1]=4 10384 B12R0.5 COCCCCCNCCCC=O 2230a_100000747528_200011292268 [2,0,0,0,0,0|2,0,0]=4 10385 B12R0.5 COCCCCSCCCCC=O 62a_100000139335_100000730899 [2,0,0,0,0,0|2,0,0]=4 10386 B12R0.5 COCCCCSCCCCC=O 62a_100000730899_100000139335 [2,0,0,0,0,0|2,0,0]=4 10387 B12R0.5 COCCCSCCCCCC=O 62a_100000139337_100000709357 [2,0,0,0,0,0|2,0,0]=4 10388 B12R0.5 COCCCSCCCCCC=O 62a_100000709357_100000139337 [2,0,0,0,0,0|2,0,0]=4 10389 B12R0.5 CSCCCCCCCCCCO 62a_100009813290_200000210301 [2,0,0,0,0,0|1,0,1]=4 10390 B12R0.5 CSCCCCCCCCCCO 62a_200000210301_200000033068 [2,0,0,0,0,0|1,0,1]=4 10391 B12R0.5 CSCCCCOCCCCC=O 7a_100011217163_100000139335 [2,0,0,0,0,0|2,0,0]=4 10392 B12R0.5 CSCCCNCCCCCC=O 2230a_100000749238_100000139337 [2,0,0,0,0,0|2,0,0]=4 10393 B12R0.5 CSCCCOCCCCCC=O 7a_100000690336_100000139337 [2,0,0,0,0,0|2,0,0]=4 10394 B12R0.5 NCCCCCCCCOCC=O 34a_102515433106_200009817547 [2,0,0,0,0,0|2,0,0]=4 10395 B12R0.5 O=CCCCCCNCCCCO 2230a_100000750430_100000139337 [2,0,0,0,0,0|2,0,0]=4 10396 B12R0.5 O=CCCCCCOCCCCCl 7a_100000210776_100000139337 [2,0,0,0,0,0|2,0,0]=4 10397 B12R0.5 O=CCCCCCOCCCCF 7a_100011995726_100000139337 [2,0,0,0,0,0|2,0,0]=4 10398 B12R0.5 O=CCCCCCSCCCCF 62a_100000139337_100000729493 [2,0,0,0,0,0|2,0,0]=4 10399 B12R0.5 O=CCCCCCSCCCCF 62a_100000729493_100000139337 [2,0,0,0,0,0|2,0,0]=4 10400 B12R0.5 O=CCCCCCSCCCCO 62a_100000139337_100000210776 [2,0,0,0,0,0|2,0,0]=4 10401 B12R0.5 O=CCCCCCSCCCCO 62a_100000210776_100000139337 [2,0,0,0,0,0|2,0,0]=4 10402 B12R0.5 O=CCCCCNCCCCCO 2230a_100000762737_100000139335 [2,0,0,0,0,0|2,0,0]=4 10403 B12R0.5 O=CCCCCOCCCCCBr 7a_100000746331_100000139335 [2,0,0,0,0,0|2,0,0]=4 10404 B12R0.5 O=CCCCCOCCCCCCl 7a_100000746330_100000139335 [2,0,0,0,0,0|2,0,0]=4 10405 B12R0.5 O=CCCCCOCCCCCI 7a_200012148887_100000139335 [2,0,0,0,0,0|2,0,0]=4 10406 B12R0.5 O=CCCCCSCCCCCF 62a_100000139335_100000729378 [2,0,0,0,0,0|2,0,0]=4 10407 B12R0.5 O=CCCCCSCCCCCF 62a_100000729378_100000139335 [2,0,0,0,0,0|2,0,0]=4 10408 B12R0.5 O=CCCCCSCCCCCO 62a_100000139335_100000746330 [2,0,0,0,0,0|2,0,0]=4 10409 B12R0.5 O=CCCCCSCCCCCO 62a_100000746330_100000139335 [2,0,0,0,0,0|2,0,0]=4 10410 B12R0.5 O=CCCCNCCCCCCO 2230a_100000686447_200011292268 [2,0,0,0,0,0|2,0,0]=4 10411 B12R0.5 O=CCCCOCCCCCCBr 7a_100011215345_200011292268 [2,0,0,0,0,0|2,0,0]=4 10412 B12R0.5 O=CCCCOCCCCCCCl 7a_100000766143_200011292268 [2,0,0,0,0,0|2,0,0]=4 10413 B12R0.5 O=CCCCOCCCCCCF 7a_100000732779_200011292268 [2,0,0,0,0,0|2,0,0]=4 10414 B12R0.5 O=CCCCSCCCCCCF 62a_100015922095_200011292268 [2,0,0,0,0,0|2,0,0]=4 10415 B12R0.5 O=CCCCSCCCCCCF 62a_200011292268_100015922095 [2,0,0,0,0,0|2,0,0]=4 10416 B12R0.5 O=CCCCSCCCCCCO 62a_100000766143_200011292268 [2,0,0,0,0,0|2,0,0]=4 10417 B12R0.5 O=CCCCSCCCCCCO 62a_200011292268_100000766143 [2,0,0,0,0,0|2,0,0]=4 10418 B12R0.5 O=CCNCCCCCCCCO 2230a_102515433106_200015260668 [2,0,0,0,0,0|2,0,0]=4 10419 B12R0.5 O=CCNCCCCCCCCO 34a_102515433106_200009817547 [2,0,0,0,0,0|2,0,0]=4 10420 B12R0.5 O=CCOCCCCCCCCBr 34a_100009813846_200009817547 [2,0,0,0,0,0|2,0,0]=4 10421 B12R0.5 O=CCOCCCCCCCCBr 7a_100009813846_200015260668 [2,0,0,0,0,0|2,0,0]=4 10422 B12R0.5 O=CCOCCCCCCCCCl 34a_100000033203_200009817547 [2,0,0,0,0,0|2,0,0]=4 10423 B12R0.5 O=CCOCCCCCCCCCl 7a_100000033203_200015260668 [2,0,0,0,0,0|2,0,0]=4 10424 B12R0.5 O=CCSCCCCCCCCO 62a_100000033203_200015260668 [2,0,0,0,0,0|2,0,0]=4 10425 B12R0.5 O=CCSCCCCCCCCO 62a_200015260668_100000033203 [2,0,0,0,0,0|2,0,0]=4 10426 B12R0.5 [13CH3]NCCCCCCCCCCO 2230a_100000066964_200025704644 [2,0,0,0,0,0|1,0,1]=4 10427 B12R0.5 [13CH3]NCCCCCCCCCCO 34a_100000066964_200025704644 [2,0,0,0,0,0|1,0,1]=4 10428 B12R0.5 [13CH3]OCCCCCCCCCCBr 34a_100009813290_200025704644 [2,0,0,0,0,0|2,0,0]=4 10429 B12R0.5 [13CH3]OCCCCCCCCCCBr 7a_100009813290_200025704644 [2,0,0,0,0,0|2,0,0]=4 10430 B12R0.5 [13CH3]OCCCCCCCCCCCl 34a_200000033068_200025704644 [2,0,0,0,0,0|2,0,0]=4 10431 B12R0.5 [13CH3]OCCCCCCCCCCCl 7a_200000033068_200025704644 [2,0,0,0,0,0|2,0,0]=4 10432 B12R0.5 [13CH3]OCCCCCCCCCCN 34a_100000066964_200025704644 [2,0,0,0,0,0|2,0,0]=4 10433 B12R0.5 [13CH3]SCCCCCCCCCCO 62a_100009813290_200025704644 [2,0,0,0,0,0|1,0,1]=4 10434 B12R0.5 [13CH3]SCCCCCCCCCCO 62a_200025704644_200000033068 [2,0,0,0,0,0|1,0,1]=4 10435 B14R0.145 C=CCCCCC(=O)CCCCCCC 1458a_100000211969_100011215482 [1,1,0,0,0,0|0,0,2]=4 10436 B14R0.145 C=CCCCCC(=O)CCCCCCC 1458a_100011215552_100000210614 [1,1,0,0,0,0|0,0,2]=4 10437 B14R0.145 C=CCCCCCC(=O)CCCCCC 1458a_100011934241_100000210757 [1,1,0,0,0,0|0,0,2]=4 10438 B14R0.145 C=CCCCCCC(=O)CCCCCC 1458a_100102632555_100000700193 [1,1,0,0,0,0|0,0,2]=4 10439 B14R0.145 C=CCCCCCN(C)CCCCCC 2230a_106256046315_100000700193 [1,1,0,0,0,0|1,0,1]=4 10440 B14R0.145 C=CCCCCCN(C)CCCCCC 269982a_106256046315_100000700193 [1,1,0,0,0,0|1,0,1]=4 10441 B14R0.145 C=CCCCCN(C)CCCCCCC 2230a_100000228206_100011215482 [1,1,0,0,0,0|1,0,1]=4 10442 B14R0.145 C=CCCCCN(C)CCCCCCC 2230a_100012000471_100000210681 [1,1,0,0,0,0|1,0,1]=4 10443 B14R0.145 C=CCCCCN(C)CCCCCCC 269982a_100000228206_100011215482 [1,1,0,0,0,0|1,0,1]=4 10444 B14R0.145 C=CCCCCN(C)CCCCCCC 269982a_100012000471_100000210681 [1,1,0,0,0,0|1,0,1]=4 10445 B14R0.145 C=CCCCCNC(C)CCCCCC 2230a_100000210919_100011215482 [1,1,0,0,0,0|1,0,1]=4 10446 B14R0.145 C=CCCCCNC(C)CCCCCC 2230a_100000703577_100011215978 [1,1,0,0,0,0|1,0,1]=4 10447 B14R0.145 C=CCCCCNC(C)CCCCCC 270004a_100000703577_100000210826 [1,1,0,0,0,0|1,0,1]=4 10448 B14R0.145 C=CCCCCNC(C)CCCCCC 34a_100000210919_100011215482 [1,1,0,0,0,0|1,0,1]=4 10449 B14R0.145 C=CCCCCNC(C)CCCCCC 34a_100000703577_100011215978 [1,1,0,0,0,0|1,0,1]=4 10450 B14R0.145 C=CCCCCOC(C)CCCCCC 34a_100000210265_100011215482 [1,1,0,0,0,0|1,0,1]=4 10451 B14R0.145 C=CCCCCOC(C)CCCCCC 34a_100000766645_100011215978 [1,1,0,0,0,0|1,0,1]=4 10452 B14R0.145 C=CCCCCOC(C)CCCCCC 7a_100000210265_100011215482 [1,1,0,0,0,0|1,0,1]=4 10453 B14R0.145 C=CCCCCOC(C)CCCCCC 7a_100000766645_100011215978 [1,1,0,0,0,0|1,0,1]=4 10454 B14R0.145 C=CCCCCSC(C)CCCCCC 62a_100011215482_100011215978 [1,1,0,0,0,0|1,0,1]=4 10455 B14R0.145 C=CCCCCSC(C)CCCCCC 62a_100011215978_100011215482 [1,1,0,0,0,0|1,0,1]=4 10456 B14R0.145 C=CCCCNC(C)CCCCCCC 2230a_100000700776_200011218727 [1,1,0,0,0,0|1,0,1]=4 10457 B14R0.145 C=CCCCNC(C)CCCCCCC 270004a_100000700776_100000210596 [1,1,0,0,0,0|1,0,1]=4 10458 B14R0.145 C=CCCCNC(C)CCCCCCC 34a_100000700776_200011218727 [1,1,0,0,0,0|1,0,1]=4 10459 B14R0.145 C=CCCCOC(C)CCCCCCC 34a_100000758997_200011218727 [1,1,0,0,0,0|1,0,1]=4 10460 B14R0.145 C=CCCCOC(C)CCCCCCC 34a_200011215852_100000757094 [1,1,0,0,0,0|1,0,1]=4 10461 B14R0.145 C=CCCCOC(C)CCCCCCC 7a_100000758997_200011218727 [1,1,0,0,0,0|1,0,1]=4 10462 B14R0.145 C=CCCCOC(C)CCCCCCC 7a_200011215852_100000757094 [1,1,0,0,0,0|1,0,1]=4 10463 B14R0.145 C=CCCCSC(C)CCCCCCC 62a_100011713584_200011218727 [1,1,0,0,0,0|1,0,1]=4 10464 B14R0.145 C=CCCCSC(C)CCCCCCC 62a_200011218727_100000757094 [1,1,0,0,0,0|1,0,1]=4 10465 B14R0.145 C=CCCOCCC(C)CCCCCC 34a_200011024964_100000754431 [1,1,0,0,0,0|1,0,1]=4 10466 B14R0.145 C=CCCOCCC(C)CCCCCC 7a_200011024964_100000754431 [1,1,0,0,0,0|1,0,1]=4 10467 B14R0.145 CCCCCCC(=O)CCCCCCF 1458a_100102632555_100015922095 [1,1,0,0,0,0|1,0,1]=4 10468 B14R0.145 CCCCCCC(=O)CCCCCCO 1458a_100011996774_100000210757 [1,1,0,0,0,0|0,0,2]=4 10469 B14R0.145 CCCCCCC(=O)CCCCCCO 1458a_100102632555_100000766143 [1,1,0,0,0,0|0,0,2]=4 10470 B14R0.145 CCCCCCC(C)CCOCCCC 34a_200011024964_100000210210 [1,1,0,0,0,0|1,0,1]=4 10471 B14R0.145 CCCCCCC(C)CCOCCCC 7a_200011024964_100000210211 [1,1,0,0,0,0|1,0,1]=4 10472 B14R0.145 CCCCCCC(C)CCOCCCF 34a_200011024964_100011934791 [1,1,0,0,0,0|2,0,0]=4 10473 B14R0.145 CCCCCCC(C)CCOCCCF 7a_200011024964_100011934791 [1,1,0,0,0,0|2,0,0]=4 10474 B14R0.145 CCCCCCC(C)CCOCCCO 34a_200011024964_100000230001 [1,1,0,0,0,0|1,0,1]=4 10475 B14R0.145 CCCCCCC(C)CCOCCCO 7a_200011024964_100011215043 [1,1,0,0,0,0|1,0,1]=4 10476 B14R0.145 CCCCCCC(C)NCCCCC=O 2230a_100000210919_100000139335 [1,1,0,0,0,0|1,0,0]=3 10477 B14R0.145 CCCCCCC(C)NCCCCCF 2230a_100000210919_100000729378 [1,1,0,0,0,0|2,0,0]=4 10478 B14R0.145 CCCCCCC(C)NCCCCCF 34a_100000210919_100000729378 [1,1,0,0,0,0|2,0,0]=4 10479 B14R0.145 CCCCCCC(C)NCCCCCO 2230a_100000210919_100000746330 [1,1,0,0,0,0|1,0,1]=4 10480 B14R0.145 CCCCCCC(C)NCCCCCO 2230a_100000762737_100011215978 [1,1,0,0,0,0|1,0,1]=4 10481 B14R0.145 CCCCCCC(C)NCCCCCO 270004a_100000762737_100000210826 [1,1,0,0,0,0|1,0,1]=4 10482 B14R0.145 CCCCCCC(C)NCCCCCO 34a_100000210919_100000746330 [1,1,0,0,0,0|1,0,1]=4 10483 B14R0.145 CCCCCCC(C)NCCCCCO 34a_100000762737_100011215978 [1,1,0,0,0,0|1,0,1]=4 10484 B14R0.145 CCCCCCC(C)OCCCCC=O 7a_100000210265_100000139335 [1,1,0,0,0,0|1,0,0]=3 10485 B14R0.145 CCCCCCC(C)OCCCCCBr 34a_100000746331_100011215978 [1,1,0,0,0,0|2,0,0]=4 10486 B14R0.145 CCCCCCC(C)OCCCCCBr 7a_100000746331_100011215978 [1,1,0,0,0,0|2,0,0]=4 10487 B14R0.145 CCCCCCC(C)OCCCCCCl 34a_100000746330_100011215978 [1,1,0,0,0,0|2,0,0]=4 10488 B14R0.145 CCCCCCC(C)OCCCCCCl 7a_100000746330_100011215978 [1,1,0,0,0,0|2,0,0]=4 10489 B14R0.145 CCCCCCC(C)OCCCCCF 34a_100000210265_100000729378 [1,1,0,0,0,0|2,0,0]=4 10490 B14R0.145 CCCCCCC(C)OCCCCCF 7a_100000210265_100000729378 [1,1,0,0,0,0|2,0,0]=4 10491 B14R0.145 CCCCCCC(C)OCCCCCI 34a_200012148887_100011215978 [1,1,0,0,0,0|2,0,0]=4 10492 B14R0.145 CCCCCCC(C)OCCCCCI 7a_200012148887_100011215978 [1,1,0,0,0,0|2,0,0]=4 10493 B14R0.145 CCCCCCC(C)OCCCCCN 34a_100000762737_100011215978 [1,1,0,0,0,0|2,0,0]=4 10494 B14R0.145 CCCCCCC(C)OCCCCCO 34a_100000210265_100000746330 [1,1,0,0,0,0|1,0,1]=4 10495 B14R0.145 CCCCCCC(C)OCCCCCO 7a_100000210265_100000746330 [1,1,0,0,0,0|1,0,1]=4 10496 B14R0.145 CCCCCCC(C)SCCCCC=O 62a_100000139335_100011215978 [1,1,0,0,0,0|1,0,0]=3 10497 B14R0.145 CCCCCCC(C)SCCCCC=O 62a_100011215978_100000139335 [1,1,0,0,0,0|1,0,0]=3 10498 B14R0.145 CCCCCCC(C)SCCCCCF 62a_100000729378_100011215978 [1,1,0,0,0,0|2,0,0]=4 10499 B14R0.145 CCCCCCC(C)SCCCCCF 62a_100011215978_100000729378 [1,1,0,0,0,0|2,0,0]=4 10500 B14R0.145 CCCCCCC(C)SCCCCCO 62a_100000746330_100011215978 [1,1,0,0,0,0|1,0,1]=4 10501 B14R0.145 CCCCCCC(C)SCCCCCO 62a_100011215978_100000746330 [1,1,0,0,0,0|1,0,1]=4 10502 B14R0.145 CCCCCCCC(=O)CCCCCC 1458a_100000211969_100000210757 [1,1,0,0,0,0|0,0,2]=4 10503 B14R0.145 CCCCCCCC(=O)CCCCCC 1458a_100102632555_100000210614 [1,1,0,0,0,0|0,0,2]=4 10504 B14R0.145 CCCCCCCC(=O)CCCCCF 1458a_100000211969_100000729378 [1,1,0,0,0,0|1,0,1]=4 10505 B14R0.145 CCCCCCCC(=O)CCCCCO 1458a_100000211969_100000746330 [1,1,0,0,0,0|0,0,2]=4 10506 B14R0.145 CCCCCCCC(=O)CCCCCO 1458a_100102619762_100000210614 [1,1,0,0,0,0|0,0,2]=4 10507 B14R0.145 CCCCCCCC(C)NCCCCC 2230a_100000209983_200011218727 [1,1,0,0,0,0|1,0,1]=4 10508 B14R0.145 CCCCCCCC(C)NCCCCC 270004a_100000209983_100000210596 [1,1,0,0,0,0|1,0,1]=4 10509 B14R0.145 CCCCCCCC(C)NCCCCO 2230a_100000750430_200011218727 [1,1,0,0,0,0|1,0,1]=4 10510 B14R0.145 CCCCCCCC(C)NCCCCO 270004a_100000750430_100000210596 [1,1,0,0,0,0|1,0,1]=4 10511 B14R0.145 CCCCCCCC(C)NCCCCO 34a_100000750430_200011218727 [1,1,0,0,0,0|1,0,1]=4 10512 B14R0.145 CCCCCCCC(C)OCCCC=O 7a_200011215852_200011292268 [1,1,0,0,0,0|1,0,0]=3 10513 B14R0.145 CCCCCCCC(C)OCCCCBr 34a_100011216708_200011218727 [1,1,0,0,0,0|2,0,0]=4 10514 B14R0.145 CCCCCCCC(C)OCCCCC 34a_100000210253_200011218727 [1,1,0,0,0,0|1,0,1]=4 10515 B14R0.145 CCCCCCCC(C)OCCCCC 34a_200011215852_100000718602 [1,1,0,0,0,0|1,0,1]=4 10516 B14R0.145 CCCCCCCC(C)OCCCCC 7a_100000210253_200011218727 [1,1,0,0,0,0|1,0,1]=4 10517 B14R0.145 CCCCCCCC(C)OCCCCC 7a_200011215852_100000210326 [1,1,0,0,0,0|1,0,1]=4 10518 B14R0.145 CCCCCCCC(C)OCCCCCl 34a_100000210776_200011218727 [1,1,0,0,0,0|2,0,0]=4 10519 B14R0.145 CCCCCCCC(C)OCCCCCl 7a_100000210776_200011218727 [1,1,0,0,0,0|2,0,0]=4 10520 B14R0.145 CCCCCCCC(C)OCCCCF 34a_100011995726_200011218727 [1,1,0,0,0,0|2,0,0]=4 10521 B14R0.145 CCCCCCCC(C)OCCCCF 34a_200011215852_100000729493 [1,1,0,0,0,0|2,0,0]=4 10522 B14R0.145 CCCCCCCC(C)OCCCCF 7a_100011995726_200011218727 [1,1,0,0,0,0|2,0,0]=4 10523 B14R0.145 CCCCCCCC(C)OCCCCF 7a_200011215852_100000729493 [1,1,0,0,0,0|2,0,0]=4 10524 B14R0.145 CCCCCCCC(C)OCCCCI 34a_200012148704_200011218727 [1,1,0,0,0,0|2,0,0]=4 10525 B14R0.145 CCCCCCCC(C)OCCCCN 34a_100000750430_200011218727 [1,1,0,0,0,0|2,0,0]=4 10526 B14R0.145 CCCCCCCC(C)OCCCCO 34a_200011215852_100011216708 [1,1,0,0,0,0|1,0,1]=4 10527 B14R0.145 CCCCCCCC(C)OCCCCO 7a_200011215852_100000210776 [1,1,0,0,0,0|1,0,1]=4 10528 B14R0.145 CCCCCCCC(C)SCCCC=O 62a_200011218727_200011292268 [1,1,0,0,0,0|1,0,0]=3 10529 B14R0.145 CCCCCCCC(C)SCCCC=O 62a_200011292268_200011218727 [1,1,0,0,0,0|1,0,0]=3 10530 B14R0.145 CCCCCCCC(C)SCCCCC 62a_100000210326_200011218727 [1,1,0,0,0,0|1,0,1]=4 10531 B14R0.145 CCCCCCCC(C)SCCCCC 62a_200011218727_100000210326 [1,1,0,0,0,0|1,0,1]=4 10532 B14R0.145 CCCCCCCC(C)SCCCCF 62a_100000729493_200011218727 [1,1,0,0,0,0|2,0,0]=4 10533 B14R0.145 CCCCCCCC(C)SCCCCF 62a_200011218727_100000729493 [1,1,0,0,0,0|2,0,0]=4 10534 B14R0.145 CCCCCCCC(C)SCCCCO 62a_100000210776_200011218727 [1,1,0,0,0,0|1,0,1]=4 10535 B14R0.145 CCCCCCCC(C)SCCCCO 62a_200011218727_100000210776 [1,1,0,0,0,0|1,0,1]=4 10536 B14R0.145 CCCCCCCN(C)CCCCC=O 2230a_100000228206_100000139335 [1,1,0,0,0,0|1,0,0]=3 10537 B14R0.145 CCCCCCCN(C)CCCCC=O 269982a_100000228206_100000139335 [1,1,0,0,0,0|1,0,0]=3 10538 B14R0.145 CCCCCCCN(C)CCCCCC 2230a_100000228206_100000210314 [1,1,0,0,0,0|1,0,1]=4 10539 B14R0.145 CCCCCCCN(C)CCCCCC 2230a_106256046315_100000210681 [1,1,0,0,0,0|1,0,1]=4 10540 B14R0.145 CCCCCCCN(C)CCCCCC 269982a_100000228206_100000210757 [1,1,0,0,0,0|1,0,1]=4 10541 B14R0.145 CCCCCCCN(C)CCCCCC 269982a_106256046315_100000210681 [1,1,0,0,0,0|1,0,1]=4 10542 B14R0.145 CCCCCCCN(C)CCCCCF 2230a_100000228206_100000729378 [1,1,0,0,0,0|2,0,0]=4 10543 B14R0.145 CCCCCCCN(C)CCCCCF 269982a_100000228206_100000729378 [1,1,0,0,0,0|2,0,0]=4 10544 B14R0.145 CCCCCCCN(C)CCCCCO 2230a_100000228206_100000746330 [1,1,0,0,0,0|1,0,1]=4 10545 B14R0.145 CCCCCCCN(C)CCCCCO 2230a_100000722520_100000210681 [1,1,0,0,0,0|1,0,1]=4 10546 B14R0.145 CCCCCCCN(C)CCCCCO 269982a_100000228206_100000746330 [1,1,0,0,0,0|1,0,1]=4 10547 B14R0.145 CCCCCCCN(C)CCCCCO 269982a_100000722520_100000210681 [1,1,0,0,0,0|1,0,1]=4 10548 B14R0.145 CCCCCCN(C)CCCCCC=O 2230a_106256046315_100000139337 [1,1,0,0,0,0|1,0,0]=3 10549 B14R0.145 CCCCCCN(C)CCCCCC=O 269982a_106256046315_100000139337 [1,1,0,0,0,0|1,0,0]=3 10550 B14R0.145 CCCCCCN(C)CCCCCCF 2230a_106256046315_100015922095 [1,1,0,0,0,0|2,0,0]=4 10551 B14R0.145 CCCCCCN(C)CCCCCCF 269982a_106256046315_100015922095 [1,1,0,0,0,0|2,0,0]=4 10552 B14R0.145 CCCCCCN(C)CCCCCCO 2230a_106256046315_100000766143 [1,1,0,0,0,0|1,0,1]=4 10553 B14R0.145 CCCCCCN(C)CCCCCCO 269982a_106256046315_100000766143 [1,1,0,0,0,0|1,0,1]=4 10554 B14R0.145 CCCCCCNC(C)CCCCCC 2230a_100000210581_100011215978 [1,1,0,0,0,0|1,0,1]=4 10555 B14R0.145 CCCCCCNC(C)CCCCCC 2230a_100000210919_100000210314 [1,1,0,0,0,0|1,0,1]=4 10556 B14R0.145 CCCCCCNC(C)CCCCCC 270004a_100000210581_100000210826 [1,1,0,0,0,0|1,0,1]=4 10557 B14R0.145 CCCCCCNC(C)CCCCCC 34a_100000210919_100000210314 [1,1,0,0,0,0|1,0,1]=4 10558 B14R0.145 CCCCCCOC(C)CCCCCC 34a_100000210259_100011215978 [1,1,0,0,0,0|1,0,1]=4 10559 B14R0.145 CCCCCCOC(C)CCCCCC 34a_100000210265_100000210314 [1,1,0,0,0,0|1,0,1]=4 10560 B14R0.145 CCCCCCOC(C)CCCCCC 7a_100000210259_100011215978 [1,1,0,0,0,0|1,0,1]=4 10561 B14R0.145 CCCCCCOC(C)CCCCCC 7a_100000210265_100000210314 [1,1,0,0,0,0|1,0,1]=4 10562 B14R0.145 CCCCCCSC(C)CCCCCC 62a_100000210314_100011215978 [1,1,0,0,0,0|1,0,1]=4 10563 B14R0.145 CCCCCCSC(C)CCCCCC 62a_100011215978_100000210757 [1,1,0,0,0,0|1,0,1]=4 10564 B14R0.145 CCCCOCC(C)OCCCCC=O 7a_100011217071_100000139335 [1,1,0,0,0,0|2,0,0]=4 10565 B14R0.145 CN(CCCCCO)CCCCCC=O 2230a_100000722520_100000139337 [1,1,0,0,0,0|2,0,0]=4 10566 B14R0.145 CN(CCCCCO)CCCCCC=O 269982a_100000722520_100000139337 [1,1,0,0,0,0|2,0,0]=4 10567 B14R0.179 C=CCCCC(=O)CCCCCCCC 1458a_100000210188_100000757094 [1,1,0,0,0,0|0,0,2]=4 10568 B14R0.179 C=CCCCC(=O)CCCCCCCC 1458a_100000766728_100000210759 [1,1,0,0,0,0|0,0,2]=4 10569 B14R0.179 C=CCCCCCCC(=O)CCCCC 1458a_100000212188_100011215473 [1,1,0,0,0,0|0,0,2]=4 10570 B14R0.179 C=CCCCCCCC(=O)CCCCC 1458a_100011809334_100000210326 [1,1,0,0,0,0|0,0,2]=4 10571 B14R0.179 C=CCCCCCCN(C)CCCCC 2230a_100000223495_100011215473 [1,1,0,0,0,0|1,0,1]=4 10572 B14R0.179 C=CCCCCCCN(C)CCCCC 269982a_100000223495_100011215473 [1,1,0,0,0,0|1,0,1]=4 10573 B14R0.179 C=CCCCCCNC(C)CCCCC 2230a_100000211957_100000700193 [1,1,0,0,0,0|1,0,1]=4 10574 B14R0.179 C=CCCCCCOC(C)CCCCC 34a_100011215632_100000700193 [1,1,0,0,0,0|1,0,1]=4 10575 B14R0.179 C=CCCCCCOC(C)CCCCC 34a_100011216702_200011218191 [1,1,0,0,0,0|1,0,1]=4 10576 B14R0.179 C=CCCCCCOC(C)CCCCC 7a_100011215632_100000700193 [1,1,0,0,0,0|1,0,1]=4 10577 B14R0.179 C=CCCCCCOC(C)CCCCC 7a_100011216702_200011218191 [1,1,0,0,0,0|1,0,1]=4 10578 B14R0.179 C=CCCCCCSC(C)CCCCC 62a_100000700193_200011218191 [1,1,0,0,0,0|1,0,1]=4 10579 B14R0.179 C=CCCCCCSC(C)CCCCC 62a_200011218191_100000700193 [1,1,0,0,0,0|1,0,1]=4 10580 B14R0.179 C=CCCCN(C)CCCCCCCC 2230a_100000207567_100011713584 [1,1,0,0,0,0|1,0,1]=4 10581 B14R0.179 C=CCCCN(C)CCCCCCCC 269982a_100000207567_100000757094 [1,1,0,0,0,0|1,0,1]=4 10582 B14R0.179 C=CCCNC(C)CCCCCCCC 270004a_100015191253_100011216694 [1,1,0,0,0,0|1,0,1]=4 10583 B14R0.179 C=CCCOC(C)CCCCCCCC 34a_100000210740_100000754431 [1,1,0,0,0,0|1,0,1]=4 10584 B14R0.179 C=CCCOC(C)CCCCCCCC 7a_100000210740_100000754431 [1,1,0,0,0,0|1,0,1]=4 10585 B14R0.179 C=CCNCC(C)CCCCCCCC 270004a_100020586998_100011995885 [1,1,0,0,0,0|1,0,1]=4 10586 B14R0.179 C=CCOCC(C)CCCCCCCC 34a_200012125181_100015514636 [1,1,0,0,0,0|1,0,1]=4 10587 B14R0.179 C=CCOCC(C)CCCCCCCC 7a_200012125181_100015514636 [1,1,0,0,0,0|1,0,1]=4 10588 B14R0.179 CCCCCC(=O)CCCCCCCO 1458a_100000212188_100000760002 [1,1,0,0,0,0|0,0,2]=4 10589 B14R0.179 CCCCCC(=O)CCCCCCCO 1458a_100011219782_100000210326 [1,1,0,0,0,0|0,0,2]=4 10590 B14R0.179 CCCCCC(=O)CSCCCCC=O 62a_100000139335_200012276598 [1,1,0,0,0,0|1,0,1]=4 10591 B14R0.179 CCCCCC(=O)CSCCCCC=O 62a_200012276598_100000139335 [1,1,0,0,0,0|1,0,1]=4 10592 B14R0.179 CCCCCC(C)NCCCCCC=O 2230a_100000211957_100000139337 [1,1,0,0,0,0|1,0,0]=3 10593 B14R0.179 CCCCCC(C)NCCCCCCF 2230a_100000211957_100015922095 [1,1,0,0,0,0|2,0,0]=4 10594 B14R0.179 CCCCCC(C)NCCCCCCO 2230a_100000211957_100000766143 [1,1,0,0,0,0|1,0,1]=4 10595 B14R0.179 CCCCCC(C)NCCCCCCO 2230a_100000686447_200011218191 [1,1,0,0,0,0|1,0,1]=4 10596 B14R0.179 CCCCCC(C)NCCCCCCO 270004a_100000686447_100000211708 [1,1,0,0,0,0|1,0,1]=4 10597 B14R0.179 CCCCCC(C)NCCCCCCO 34a_100000686447_200011218191 [1,1,0,0,0,0|1,0,1]=4 10598 B14R0.179 CCCCCC(C)OCCCCCC=O 7a_100011215632_100000139337 [1,1,0,0,0,0|1,0,0]=3 10599 B14R0.179 CCCCCC(C)OCCCCCCBr 34a_100011215345_200011218191 [1,1,0,0,0,0|2,0,0]=4 10600 B14R0.179 CCCCCC(C)OCCCCCCBr 7a_100011215345_200011218191 [1,1,0,0,0,0|2,0,0]=4 10601 B14R0.179 CCCCCC(C)OCCCCCCCl 34a_100000766143_200011218191 [1,1,0,0,0,0|2,0,0]=4 10602 B14R0.179 CCCCCC(C)OCCCCCCCl 7a_100000766143_200011218191 [1,1,0,0,0,0|2,0,0]=4 10603 B14R0.179 CCCCCC(C)OCCCCCCF 34a_100000732779_200011218191 [1,1,0,0,0,0|2,0,0]=4 10604 B14R0.179 CCCCCC(C)OCCCCCCF 34a_100011215632_100015922095 [1,1,0,0,0,0|2,0,0]=4 10605 B14R0.179 CCCCCC(C)OCCCCCCF 7a_100000732779_200011218191 [1,1,0,0,0,0|2,0,0]=4 10606 B14R0.179 CCCCCC(C)OCCCCCCF 7a_100011215632_100015922095 [1,1,0,0,0,0|2,0,0]=4 10607 B14R0.179 CCCCCC(C)OCCCCCCN 34a_100000686447_200011218191 [1,1,0,0,0,0|2,0,0]=4 10608 B14R0.179 CCCCCC(C)OCCCCCCO 34a_100011215632_100000766143 [1,1,0,0,0,0|1,0,1]=4 10609 B14R0.179 CCCCCC(C)OCCCCCCO 7a_100011215632_100000766143 [1,1,0,0,0,0|1,0,1]=4 10610 B14R0.179 CCCCCC(C)SCCCCCC=O 62a_100000139337_200011218191 [1,1,0,0,0,0|1,0,0]=3 10611 B14R0.179 CCCCCC(C)SCCCCCC=O 62a_200011218191_100000139337 [1,1,0,0,0,0|1,0,0]=3 10612 B14R0.179 CCCCCC(C)SCCCCCCF 62a_100015922095_200011218191 [1,1,0,0,0,0|2,0,0]=4 10613 B14R0.179 CCCCCC(C)SCCCCCCF 62a_200011218191_100015922095 [1,1,0,0,0,0|2,0,0]=4 10614 B14R0.179 CCCCCC(C)SCCCCCCO 62a_100000766143_200011218191 [1,1,0,0,0,0|1,0,1]=4 10615 B14R0.179 CCCCCC(C)SCCCCCCO 62a_200011218191_100000766143 [1,1,0,0,0,0|1,0,1]=4 10616 B14R0.179 CCCCCCCCC(=O)CCCCC 1458a_100000210188_100000210326 [1,1,0,0,0,0|0,0,2]=4 10617 B14R0.179 CCCCCCCCC(=O)CCCCC 1458a_100000212188_100000210759 [1,1,0,0,0,0|0,0,2]=4 10618 B14R0.179 CCCCCCCCC(=O)CCCCF 1458a_100000210188_100000729493 [1,1,0,0,0,0|1,0,1]=4 10619 B14R0.179 CCCCCCCCC(=O)CCCCO 1458a_100000210188_100000210776 [1,1,0,0,0,0|0,0,2]=4 10620 B14R0.179 CCCCCCCCC(=O)CCCCO 1458a_100000695505_100000210759 [1,1,0,0,0,0|0,0,2]=4 10621 B14R0.179 CCCCCCCCC(C)CNCCC 270004a_100020643023_100011995885 [1,1,0,0,0,0|1,0,1]=4 10622 B14R0.179 CCCCCCCCC(C)CNCCO 270004a_100000210304_100011995885 [1,1,0,0,0,0|1,0,1]=4 10623 B14R0.179 CCCCCCCCC(C)COCC=O 34a_200012125181_200009817547 [1,1,0,0,0,0|1,0,0]=3 10624 B14R0.179 CCCCCCCCC(C)COCC=O 7a_200012125181_200015260668 [1,1,0,0,0,0|1,0,0]=3 10625 B14R0.179 CCCCCCCCC(C)COCCC 34a_200012125181_100000210303 [1,1,0,0,0,0|1,0,1]=4 10626 B14R0.179 CCCCCCCCC(C)COCCC 7a_200012125181_100000210303 [1,1,0,0,0,0|1,0,1]=4 10627 B14R0.179 CCCCCCCCC(C)COCCF 34a_200012125181_100011217306 [1,1,0,0,0,0|2,0,0]=4 10628 B14R0.179 CCCCCCCCC(C)COCCF 7a_200012125181_100011217306 [1,1,0,0,0,0|2,0,0]=4 10629 B14R0.179 CCCCCCCCC(C)COCCO 34a_200012125181_100000211926 [1,1,0,0,0,0|1,0,1]=4 10630 B14R0.179 CCCCCCCCC(C)COCCO 7a_200012125181_100000211926 [1,1,0,0,0,0|1,0,1]=4 10631 B14R0.179 CCCCCCCCC(C)NCCCC 270004a_100000102301_100011216694 [1,1,0,0,0,0|1,0,1]=4 10632 B14R0.179 CCCCCCCCC(C)NCCCF 270004a_100015189416_100011216694 [1,1,0,0,0,0|2,0,0]=4 10633 B14R0.179 CCCCCCCCC(C)NCCCO 270004a_100000182051_100011216694 [1,1,0,0,0,0|1,0,1]=4 10634 B14R0.179 CCCCCCCCC(C)OCCCC 34a_100000210740_100000210210 [1,1,0,0,0,0|1,0,1]=4 10635 B14R0.179 CCCCCCCCC(C)OCCCC 7a_100000210740_100000210211 [1,1,0,0,0,0|1,0,1]=4 10636 B14R0.179 CCCCCCCCC(C)OCCCF 34a_100000210740_100011934791 [1,1,0,0,0,0|2,0,0]=4 10637 B14R0.179 CCCCCCCCC(C)OCCCF 7a_100000210740_100011934791 [1,1,0,0,0,0|2,0,0]=4 10638 B14R0.179 CCCCCCCCC(C)OCCCO 34a_100000210740_100000230001 [1,1,0,0,0,0|1,0,1]=4 10639 B14R0.179 CCCCCCCCC(C)OCCCO 7a_100000210740_100011215043 [1,1,0,0,0,0|1,0,1]=4 10640 B14R0.179 CCCCCCCCN(C)CCCC=O 2230a_100000207567_200011292268 [1,1,0,0,0,0|1,0,0]=3 10641 B14R0.179 CCCCCCCCN(C)CCCC=O 269982a_100000207567_200011292268 [1,1,0,0,0,0|1,0,0]=3 10642 B14R0.179 CCCCCCCCN(C)CCCCC 2230a_100000207567_100000210326 [1,1,0,0,0,0|1,0,1]=4 10643 B14R0.179 CCCCCCCCN(C)CCCCC 2230a_100000223495_100000210759 [1,1,0,0,0,0|1,0,1]=4 10644 B14R0.179 CCCCCCCCN(C)CCCCC 2230a_200000207366_200000210301 [1,1,0,0,0,0|1,0,1]=4 10645 B14R0.179 CCCCCCCCN(C)CCCCC 269982a_100000207567_100000210215 [1,1,0,0,0,0|1,0,1]=4 10646 B14R0.179 CCCCCCCCN(C)CCCCC 269982a_100000223495_100000210759 [1,1,0,0,0,0|1,0,1]=4 10647 B14R0.179 CCCCCCCCN(C)CCCCC 269982a_200000207366_200000210301 [1,1,0,0,0,0|1,0,1]=4 10648 B14R0.179 CCCCCCCCN(C)CCCCF 2230a_100000207567_100000729493 [1,1,0,0,0,0|2,0,0]=4 10649 B14R0.179 CCCCCCCCN(C)CCCCF 269982a_100000207567_100000729493 [1,1,0,0,0,0|2,0,0]=4 10650 B14R0.179 CCCCCCCCN(C)CCCCO 2230a_100000207567_100000210776 [1,1,0,0,0,0|1,0,1]=4 10651 B14R0.179 CCCCCCCCN(C)CCCCO 2230a_100000717598_100000210759 [1,1,0,0,0,0|1,0,1]=4 10652 B14R0.179 CCCCCCCCN(C)CCCCO 269982a_100000207567_100000210776 [1,1,0,0,0,0|1,0,1]=4 10653 B14R0.179 CCCCCCCCN(C)CCCCO 269982a_100000717598_100000210759 [1,1,0,0,0,0|1,0,1]=4 10654 B14R0.179 CCCCCCCCN([13CH3])CCCCC 2230a_200000207366_200025704644 [1,1,0,0,0,0|1,0,1]=4 10655 B14R0.179 CCCCCCCCN([13CH3])CCCCC 269982a_200000207366_200025704644 [1,1,0,0,0,0|1,0,1]=4 10656 B14R0.179 CCCCCCCNC(C)CCCCC 2230a_100000211957_100000210681 [1,1,0,0,0,0|1,0,1]=4 10657 B14R0.179 CCCCCCCNC(C)CCCCC 2230a_100000229938_200011218191 [1,1,0,0,0,0|1,0,1]=4 10658 B14R0.179 CCCCCCCNC(C)CCCCC 270004a_100000229938_100000211708 [1,1,0,0,0,0|1,0,1]=4 10659 B14R0.179 CCCCCCCOC(C)CCCCC 34a_100000210272_200011218191 [1,1,0,0,0,0|1,0,1]=4 10660 B14R0.179 CCCCCCCOC(C)CCCCC 34a_100011215632_100000210614 [1,1,0,0,0,0|1,0,1]=4 10661 B14R0.179 CCCCCCCOC(C)CCCCC 7a_100000210272_200011218191 [1,1,0,0,0,0|1,0,1]=4 10662 B14R0.179 CCCCCCCOC(C)CCCCC 7a_100011215632_100000210614 [1,1,0,0,0,0|1,0,1]=4 10663 B14R0.179 CCCCCCCSC(C)CCCCC 62a_100000210614_200011218191 [1,1,0,0,0,0|1,0,1]=4 10664 B14R0.179 CCCCCCCSC(C)CCCCC 62a_200011218191_100000210316 [1,1,0,0,0,0|1,0,1]=4 10665 B14R0.179 CCCCCCOC[C@@H](N)CCCCN 34a_100016993712_100000210314 [1,1,0,0,0,0|2,0,0]=4 10666 B14R0.179 CCCCCN(C)CCCCCCCO 2230a_100000223495_100000760002 [1,1,0,0,0,0|1,0,1]=4 10667 B14R0.179 CCCCCN(C)CCCCCCCO 269982a_100000223495_100000760002 [1,1,0,0,0,0|1,0,1]=4 10668 B14R0.179 COCCCC(C)OCCCCCC=O 7a_200011539412_100000139337 [1,1,0,0,0,0|2,0,0]=4 10669 B14R0.337 C=CC(=O)CCCCCCCCCCC 1458a_100000185746_100011215454 [1,1,0,0,0,0|0,0,2]=4 10670 B14R0.337 C=CC(C)COCCCCCCCCC 34a_100011215527_100011214924 [1,1,0,0,0,0|1,0,1]=4 10671 B14R0.337 C=CC(C)COCCCCCCCCC 7a_100011215527_100000210328 [1,1,0,0,0,0|1,0,1]=4 10672 B14R0.337 C=CC(C)OCCCCCCCCCC 34a_100000695699_100000210320 [1,1,0,0,0,0|1,0,1]=4 10673 B14R0.337 C=CC(C)SCCCCCCCCCC 62a_100011215867_100000210320 [1,1,0,0,0,0|1,0,1]=4 10674 B14R0.337 C=CC(O)CNCCCCCCCCC 2230a_100000212291_100000730141 [1,1,0,0,0,0|1,0,1]=4 10675 B14R0.337 C=CC(O)CNCCCCCCCCC 34a_100000212291_100000730141 [1,1,0,0,0,0|1,0,1]=4 10676 B14R0.337 C=CC(O)COCCCCCCCCC 34a_100000210712_100000730141 [1,1,0,0,0,0|1,0,1]=4 10677 B14R0.337 C=CC(O)COCCCCCCCCC 7a_100000210712_100000730141 [1,1,0,0,0,0|1,0,1]=4 10678 B14R0.337 C=CC(O)CSCCCCCCCCC 62a_100000730141_100000210670 [1,1,0,0,0,0|1,0,1]=4 10679 B14R0.337 C=CCCCCCCCCCC(=O)CC 1458a_100000210414_100009814027 [1,1,0,0,0,0|0,0,2]=4 10680 B14R0.337 C=CCCCCCCCCCN(C)CC 2230a_100000225621_100009814027 [1,1,0,0,0,0|1,0,1]=4 10681 B14R0.337 C=CCCCCCCCCCN(C)CC 269982a_100000225621_100009814027 [1,1,0,0,0,0|1,0,1]=4 10682 B14R0.337 C=CCCCCCCCCNC(C)CC 2230a_100000209981_100011933949 [1,1,0,0,0,0|1,0,1]=4 10683 B14R0.337 C=CCCCCCCCCOC(C)CC 34a_100011215194_100011215416 [1,1,0,0,0,0|1,0,1]=4 10684 B14R0.337 C=CCCCCCCCCOC(C)CC 7a_100000210228_100011933949 [1,1,0,0,0,0|1,0,1]=4 10685 B14R0.337 C=CCCCCCCCCOC(C)CC 7a_100011215194_100000758301 [1,1,0,0,0,0|1,0,1]=4 10686 B14R0.337 C=CCCCCCCCCSC(C)CC 62a_100000758301_100011933949 [1,1,0,0,0,0|1,0,1]=4 10687 B14R0.337 C=CCCCCCCCCSC(C)CC 62a_100011933949_100000758301 [1,1,0,0,0,0|1,0,1]=4 10688 B14R0.337 C=CCCCCCCCNCC(C)CC 2230a_100020588543_100012355270 [1,1,0,0,0,0|1,0,1]=4 10689 B14R0.337 C=CCCCCCCCNCC(O)CC 2230a_100011218483_100012355270 [1,1,0,0,0,0|1,0,1]=4 10690 B14R0.337 C=CCCCCCCCOCC(C)CC 34a_100000730831_100000748023 [1,1,0,0,0,0|1,0,1]=4 10691 B14R0.337 C=CCCCCCCCOCC(C)CC 7a_100000730831_100000748023 [1,1,0,0,0,0|1,0,1]=4 10692 B14R0.337 C=CCCCCCCCOCC(O)CC 34a_100000730831_100011218378 [1,1,0,0,0,0|1,0,1]=4 10693 B14R0.337 C=CCCCCCCCOCC(O)CC 7a_100000730831_100011218378 [1,1,0,0,0,0|1,0,1]=4 10694 B14R0.337 C=CCCCCCCCOC[C@@H](C)CC 34a_100000730831_100009816398 [1,1,0,0,0,0|1,0,1]=4 10695 B14R0.337 C=CCCCCCCCOC[C@@H](C)CC 7a_100000730831_100009816398 [1,1,0,0,0,0|1,0,1]=4 10696 B14R0.337 C=CCCCCCCCOC[C@@H](C)CC 7a_100009816381_100012355270 [1,1,0,0,0,0|1,0,1]=4 10697 B14R0.337 C=CCCCCCCCSCC(C)CC 62a_100000748023_100012355270 [1,1,0,0,0,0|1,0,1]=4 10698 B14R0.337 C=CCCCCCCCSCC(C)CC 62a_100012355270_100000748023 [1,1,0,0,0,0|1,0,1]=4 10699 B14R0.337 C=CCCCCCCCSCC(O)CC 62a_100011218378_100012355270 [1,1,0,0,0,0|1,0,1]=4 10700 B14R0.337 C=CCCCCCCCSCC(O)CC 62a_100012355270_100011218378 [1,1,0,0,0,0|1,0,1]=4 10701 B14R0.337 C=CCCCCCCCSC[C@@H](C)CC 62a_100009816398_100012355270 [1,1,0,0,0,0|1,0,1]=4 10702 B14R0.337 C=CCCCCCCCSC[C@@H](C)CC 62a_100012355270_100009816398 [1,1,0,0,0,0|1,0,1]=4 10703 B14R0.337 C=CCCCCCCNCCC(C)CC 2230a_100020591266_100011215473 [1,1,0,0,0,0|1,0,1]=4 10704 B14R0.337 C=CCCCCCCOCCC(C)CC 7a_100011215188_100011215473 [1,1,0,0,0,0|1,0,1]=4 10705 B14R0.337 C=CCCCCCOCCCC(C)CC 7a_100011216074_100000700193 [1,1,0,0,0,0|1,0,1]=4 10706 B14R0.337 C=CCCCOCCCCCC(C)CC 7a_200000035636_100000757094 [1,1,0,0,0,0|1,0,1]=4 10707 B14R0.337 C=C[C@H](N)COCCCCCCCCC 34a_100016989147_100011214924 [1,1,0,0,0,0|1,0,1]=4 10708 B14R0.337 CCC(=O)CCCCCCCCCCO 1458a_100000210414_100009813290 [1,1,0,0,0,0|0,0,2]=4 10709 B14R0.337 CCC(C)CCCCCOCCCC=O 7a_200000035636_200011292268 [1,1,0,0,0,0|1,0,0]=3 10710 B14R0.337 CCC(C)CCCCCOCCCCF 7a_200000035636_100000729493 [1,1,0,0,0,0|2,0,0]=4 10711 B14R0.337 CCC(C)CCCCCOCCCCO 7a_200000035636_100000210776 [1,1,0,0,0,0|1,0,1]=4 10712 B14R0.337 CCC(C)CCCOCCCCCC=O 7a_100011216074_100000139337 [1,1,0,0,0,0|1,0,0]=3 10713 B14R0.337 CCC(C)CCCOCCCCCCF 7a_100011216074_100015922095 [1,1,0,0,0,0|2,0,0]=4 10714 B14R0.337 CCC(C)CCCOCCCCCCO 7a_100011216074_100000766143 [1,1,0,0,0,0|1,0,1]=4 10715 B14R0.337 CCC(C)CCNCCCCCCCO 2230a_100020591266_100000760002 [1,1,0,0,0,0|1,0,1]=4 10716 B14R0.337 CCC(C)CCOCCCCCCCO 7a_100011215188_100000760002 [1,1,0,0,0,0|1,0,1]=4 10717 B14R0.337 CCC(C)CNCCCCCCCCO 2230a_100020588543_100000033203 [1,1,0,0,0,0|1,0,1]=4 10718 B14R0.337 CCC(C)CNCCCCCCCCO 2230a_102515433106_100000748023 [1,1,0,0,0,0|1,0,1]=4 10719 B14R0.337 CCC(C)CNCCCCCCCCO 270004a_102515433106_100000243153 [1,1,0,0,0,0|1,0,1]=4 10720 B14R0.337 CCC(C)CNCCCCCCCCO 34a_102515433106_100000748023 [1,1,0,0,0,0|1,0,1]=4 10721 B14R0.337 CCC(C)COCCCCCCCCBr 34a_100009813846_100000748023 [1,1,0,0,0,0|2,0,0]=4 10722 B14R0.337 CCC(C)COCCCCCCCCBr 7a_100009813846_100000748023 [1,1,0,0,0,0|2,0,0]=4 10723 B14R0.337 CCC(C)COCCCCCCCCCl 34a_100000033203_100000748023 [1,1,0,0,0,0|2,0,0]=4 10724 B14R0.337 CCC(C)COCCCCCCCCCl 7a_100000033203_100000748023 [1,1,0,0,0,0|2,0,0]=4 10725 B14R0.337 CCC(C)COCCCCCCCCN 34a_102515433106_100000748023 [1,1,0,0,0,0|2,0,0]=4 10726 B14R0.337 CCC(C)CSCCCCCCCCO 62a_100000033203_100000748023 [1,1,0,0,0,0|1,0,1]=4 10727 B14R0.337 CCC(C)CSCCCCCCCCO 62a_100000748023_100000033203 [1,1,0,0,0,0|1,0,1]=4 10728 B14R0.337 CCC(C)NCCCCCCCCCO 2230a_100000078944_100000758301 [1,1,0,0,0,0|1,0,1]=4 10729 B14R0.337 CCC(C)NCCCCCCCCCO 2230a_100000209981_100009813782 [1,1,0,0,0,0|1,0,1]=4 10730 B14R0.337 CCC(C)NCCCCCCCCCO 34a_100000078944_100011215416 [1,1,0,0,0,0|1,0,1]=4 10731 B14R0.337 CCC(C)OCCCCCCCCCBr 34a_100009813782_100011215416 [1,1,0,0,0,0|2,0,0]=4 10732 B14R0.337 CCC(C)OCCCCCCCCCBr 7a_100009813782_100000758301 [1,1,0,0,0,0|2,0,0]=4 10733 B14R0.337 CCC(C)OCCCCCCCCCCl 34a_100009868337_100011215416 [1,1,0,0,0,0|2,0,0]=4 10734 B14R0.337 CCC(C)OCCCCCCCCCCl 7a_100009868337_100000758301 [1,1,0,0,0,0|2,0,0]=4 10735 B14R0.337 CCC(C)OCCCCCCCCCN 34a_100000078944_100011215416 [1,1,0,0,0,0|2,0,0]=4 10736 B14R0.337 CCC(C)OCCCCCCCCCO 7a_100000210228_100009813782 [1,1,0,0,0,0|1,0,1]=4 10737 B14R0.337 CCC(C)SCCCCCCCCCO 62a_100000758301_100009813782 [1,1,0,0,0,0|1,0,1]=4 10738 B14R0.337 CCC(C)SCCCCCCCCCO 62a_100009813782_100000758301 [1,1,0,0,0,0|1,0,1]=4 10739 B14R0.337 CCC(O)CNCCCCCCCCO 2230a_100011218483_100000033203 [1,1,0,0,0,0|1,0,1]=4 10740 B14R0.337 CCC(O)CNCCCCCCCCO 2230a_102515433106_100011218378 [1,1,0,0,0,0|1,0,1]=4 10741 B14R0.337 CCC(O)CNCCCCCCCCO 34a_102515433106_100011218378 [1,1,0,0,0,0|1,0,1]=4 10742 B14R0.337 CCC(O)COCCCCCCCCBr 34a_100009813846_100011218378 [1,1,0,0,0,0|2,0,0]=4 10743 B14R0.337 CCC(O)COCCCCCCCCBr 7a_100009813846_100011218378 [1,1,0,0,0,0|2,0,0]=4 10744 B14R0.337 CCC(O)COCCCCCCCCCl 34a_100000033203_100011218378 [1,1,0,0,0,0|2,0,0]=4 10745 B14R0.337 CCC(O)COCCCCCCCCCl 7a_100000033203_100011218378 [1,1,0,0,0,0|2,0,0]=4 10746 B14R0.337 CCC(O)COCCCCCCCCN 34a_102515433106_100011218378 [1,1,0,0,0,0|2,0,0]=4 10747 B14R0.337 CCC(O)CSCCCCCCCCO 62a_100000033203_100011218378 [1,1,0,0,0,0|1,0,1]=4 10748 B14R0.337 CCC(O)CSCCCCCCCCO 62a_100011218378_100000033203 [1,1,0,0,0,0|1,0,1]=4 10749 B14R0.337 CCCCCCCCCCCC(=O)CC 1458a_100000210414_100011215454 [1,1,0,0,0,0|0,0,2]=4 10750 B14R0.337 CCCCCCCCCCCC(=O)CC 1458a_100000210736_100000210202 [1,1,0,0,0,0|0,0,2]=4 10751 B14R0.337 CCCCCCCCCCCC(=O)CF 1458a_100000210736_100015361967 [1,1,0,0,0,0|1,0,1]=4 10752 B14R0.337 CCCCCCCCCCCC(=O)CO 1458a_100000210174_100011215454 [1,1,0,0,0,0|0,0,2]=4 10753 B14R0.337 CCCCCCCCCCCC(C)NC 270004a_106832991635_100011216755 [1,1,0,0,0,0|1,0,1]=4 10754 B14R0.337 CCCCCCCCCCCC(C)OC 34a_100011217895_200000210301 [1,1,0,0,0,0|1,0,1]=4 10755 B14R0.337 CCCCCCCCCCCC(C)OC 7a_100011217895_200000210301 [1,1,0,0,0,0|1,0,1]=4 10756 B14R0.337 CCCCCCCCCCCC(C)O[13CH3] 34a_100011217895_200025704644 [1,1,0,0,0,0|1,0,1]=4 10757 B14R0.337 CCCCCCCCCCCC(C)O[13CH3] 7a_100011217895_200025704644 [1,1,0,0,0,0|1,0,1]=4 10758 B14R0.337 CCCCCCCCCCCN(C)CC 2230a_100000225621_100011215454 [1,1,0,0,0,0|1,0,1]=4 10759 B14R0.337 CCCCCCCCCCCN(C)CC 269982a_100000225621_100011215454 [1,1,0,0,0,0|1,0,1]=4 10760 B14R0.337 CCCCCCCCCCNC(C)CC 2230a_100000209981_100000210320 [1,1,0,0,0,0|1,0,1]=4 10761 B14R0.337 CCCCCCCCCCNC(C)CC 2230a_100000684558_100000758301 [1,1,0,0,0,0|1,0,1]=4 10762 B14R0.337 CCCCCCCCCCNC(C)CC 34a_100000684558_100011215416 [1,1,0,0,0,0|1,0,1]=4 10763 B14R0.337 CCCCCCCCCCNC(C)CO 2230a_100000684558_100012180447 [1,1,0,0,0,0|1,0,1]=4 10764 B14R0.337 CCCCCCCCCCNC(C)CO 34a_100000684558_100012180447 [1,1,0,0,0,0|1,0,1]=4 10765 B14R0.337 CCCCCCCCCCN[C@H](C)CO 2230a_100000737577_100000210320 [1,1,0,0,0,0|1,0,1]=4 10766 B14R0.337 CCCCCCCCCCOC(C)CC 34a_100000210711_100011215416 [1,1,0,0,0,0|1,0,1]=4 10767 B14R0.337 CCCCCCCCCCOC(C)CC 7a_100000210228_100000210320 [1,1,0,0,0,0|1,0,1]=4 10768 B14R0.337 CCCCCCCCCCOC(C)CC 7a_100000210711_100000758301 [1,1,0,0,0,0|1,0,1]=4 10769 B14R0.337 CCCCCCCCCCOC(C)CF 34a_100016041109_100000210320 [1,1,0,0,0,0|2,0,0]=4 10770 B14R0.337 CCCCCCCCCCOC(C)CF 7a_100016041109_100000210320 [1,1,0,0,0,0|2,0,0]=4 10771 B14R0.337 CCCCCCCCCCOC(C)CN 34a_100000210904_100000210320 [1,1,0,0,0,0|2,0,0]=4 10772 B14R0.337 CCCCCCCCCCOC(C)CO 34a_100000210711_100012180447 [1,1,0,0,0,0|1,0,1]=4 10773 B14R0.337 CCCCCCCCCCOC(C)CO 7a_100000210711_100012180447 [1,1,0,0,0,0|1,0,1]=4 10774 B14R0.337 CCCCCCCCCCSC(C)CC 62a_100000758301_100000210320 [1,1,0,0,0,0|1,0,1]=4 10775 B14R0.337 CCCCCCCCCCSC(C)CO 62a_100012180447_100000210320 [1,1,0,0,0,0|1,0,1]=4 10776 B14R0.337 CCCCCCCCCCS[C@H](C)CO 62a_100016084084_100000210320 [1,1,0,0,0,0|1,0,1]=4 10777 B14R0.337 CCCCCCCCCNCC(C)CC 2230a_100000212291_100000748023 [1,1,0,0,0,0|1,0,1]=4 10778 B14R0.337 CCCCCCCCCNCC(C)CC 2230a_100020588543_100011214924 [1,1,0,0,0,0|1,0,1]=4 10779 B14R0.337 CCCCCCCCCNCC(C)CC 270004a_100000212291_100000243153 [1,1,0,0,0,0|1,0,1]=4 10780 B14R0.337 CCCCCCCCCNCC(C)CC 34a_100000212291_100000748023 [1,1,0,0,0,0|1,0,1]=4 10781 B14R0.337 CCCCCCCCCNCC(C)CO 34a_100000744482_100011214924 [1,1,0,0,0,0|1,0,1]=4 10782 B14R0.337 CCCCCCCCCNCC(O)CC 2230a_100000212291_100011218378 [1,1,0,0,0,0|1,0,1]=4 10783 B14R0.337 CCCCCCCCCNCC(O)CC 2230a_100011218483_100011214924 [1,1,0,0,0,0|1,0,1]=4 10784 B14R0.337 CCCCCCCCCNCC(O)CC 34a_100000212291_100011218378 [1,1,0,0,0,0|1,0,1]=4 10785 B14R0.337 CCCCCCCCCNCC(O)CO 2230a_100000212291_100011219619 [1,1,0,0,0,0|1,0,1]=4 10786 B14R0.337 CCCCCCCCCNCC(O)CO 34a_100000212291_100011219619 [1,1,0,0,0,0|1,0,1]=4 10787 B14R0.337 CCCCCCCCCNC[C@@H](C)CC 2230a_100000212291_100009816398 [1,1,0,0,0,0|1,0,1]=4 10788 B14R0.337 CCCCCCCCCNC[C@@H](C)CC 34a_100000212291_100009816398 [1,1,0,0,0,0|1,0,1]=4 10789 B14R0.337 CCCCCCCCCNC[C@@H](C)CO 2230a_100000212291_100000059175 [1,1,0,0,0,0|1,0,1]=4 10790 B14R0.337 CCCCCCCCCNC[C@@H](C)CO 34a_100000212291_100000059175 [1,1,0,0,0,0|1,0,1]=4 10791 B14R0.337 CCCCCCCCCNC[C@@H](F)CO 34a_100015665980_100011214924 [1,1,0,0,0,0|1,0,1]=4 10792 B14R0.337 CCCCCCCCCNC[C@@H](O)CF 2230a_100000212291_100015614560 [1,1,0,0,0,0|2,0,0]=4 10793 B14R0.337 CCCCCCCCCNC[C@@H](O)CF 34a_100000212291_100015614560 [1,1,0,0,0,0|2,0,0]=4 10794 B14R0.337 CCCCCCCCCNC[C@@H](O)CO 2230a_100000212291_100009815848 [1,1,0,0,0,0|1,0,1]=4 10795 B14R0.337 CCCCCCCCCNC[C@@H](O)CO 34a_100000212291_100009815848 [1,1,0,0,0,0|1,0,1]=4 10796 B14R0.337 CCCCCCCCCNC[C@H](O)CO 2230a_100020644852_100011214924 [1,1,0,0,0,0|1,0,1]=4 10797 B14R0.337 CCCCCCCCCOCC(C)CC 34a_100000210712_100000748023 [1,1,0,0,0,0|1,0,1]=4 10798 B14R0.337 CCCCCCCCCOCC(C)CC 7a_100000210712_100000748023 [1,1,0,0,0,0|1,0,1]=4 10799 B14R0.337 CCCCCCCCCOCC(C)CN 34a_100000744482_100011214924 [1,1,0,0,0,0|2,0,0]=4 10800 B14R0.337 CCCCCCCCCOCC(Cl)CCl 34a_100000033668_100011214924 [1,1,0,0,0,0|2,0,0]=4 10801 B14R0.337 CCCCCCCCCOCC(O)CC 34a_100000210712_100011218378 [1,1,0,0,0,0|1,0,1]=4 10802 B14R0.337 CCCCCCCCCOCC(O)CC 7a_100000210712_100011218378 [1,1,0,0,0,0|1,0,1]=4 10803 B14R0.337 CCCCCCCCCOCC(O)CO 34a_100000210712_100011219619 [1,1,0,0,0,0|1,0,1]=4 10804 B14R0.337 CCCCCCCCCOCC(O)CO 7a_100000210712_100011219619 [1,1,0,0,0,0|1,0,1]=4 10805 B14R0.337 CCCCCCCCCOC[C@@H](C)CC 34a_100000210712_100009816398 [1,1,0,0,0,0|1,0,1]=4 10806 B14R0.337 CCCCCCCCCOC[C@@H](C)CC 7a_100000210712_100009816398 [1,1,0,0,0,0|1,0,1]=4 10807 B14R0.337 CCCCCCCCCOC[C@@H](C)CC 7a_100009816381_100000210328 [1,1,0,0,0,0|1,0,1]=4 10808 B14R0.337 CCCCCCCCCOC[C@@H](C)CO 34a_100000210712_100000059175 [1,1,0,0,0,0|1,0,1]=4 10809 B14R0.337 CCCCCCCCCOC[C@@H](C)CO 7a_100000210712_100000059175 [1,1,0,0,0,0|1,0,1]=4 10810 B14R0.337 CCCCCCCCCOC[C@@H](O)CF 34a_100000210712_100015614560 [1,1,0,0,0,0|2,0,0]=4 10811 B14R0.337 CCCCCCCCCOC[C@@H](O)CF 7a_100000210712_100015614560 [1,1,0,0,0,0|2,0,0]=4 10812 B14R0.337 CCCCCCCCCOC[C@@H](O)CO 34a_100000210712_100009815848 [1,1,0,0,0,0|1,0,1]=4 10813 B14R0.337 CCCCCCCCCOC[C@@H](O)CO 7a_100000210712_100009815848 [1,1,0,0,0,0|1,0,1]=4 10814 B14R0.337 CCCCCCCCCOC[C@H](F)CN 34a_100015665980_100011214924 [1,1,0,0,0,0|2,0,0]=4 10815 B14R0.337 CCCCCCCCCSCC(C)CC 62a_100000748023_100000210670 [1,1,0,0,0,0|1,0,1]=4 10816 B14R0.337 CCCCCCCCCSCC(O)CC 62a_100011218378_100000210670 [1,1,0,0,0,0|1,0,1]=4 10817 B14R0.337 CCCCCCCCCSCC(O)CO 62a_100011219619_100000210670 [1,1,0,0,0,0|1,0,1]=4 10818 B14R0.337 CCCCCCCCCSC[C@@H](C)CC 62a_100009816398_100000210670 [1,1,0,0,0,0|1,0,1]=4 10819 B14R0.337 CCCCCCCCCSC[C@@H](C)CO 62a_100000059175_100000210670 [1,1,0,0,0,0|1,0,1]=4 10820 B14R0.337 CCCCCCCCCSC[C@@H](O)CF 62a_100015614560_100000210670 [1,1,0,0,0,0|2,0,0]=4 10821 B14R0.337 CCCCCCCCCSC[C@@H](O)CO 62a_100009815848_100000210670 [1,1,0,0,0,0|1,0,1]=4 10822 B14R0.337 CCCCCCCCNCCC(C)CC 2230a_100020591266_100000210759 [1,1,0,0,0,0|1,0,1]=4 10823 B14R0.337 CCCCCCCCNCCC(C)CO 2230a_106354213184_100000210759 [1,1,0,0,0,0|1,0,1]=4 10824 B14R0.337 CCCCCCCCNCCC(C)CO 34a_106354213184_100000210759 [1,1,0,0,0,0|1,0,1]=4 10825 B14R0.337 CCCCCCCCOCCC(C)CC 7a_100011215188_100000210759 [1,1,0,0,0,0|1,0,1]=4 10826 B14R0.337 CCCCCCCOCCCC(C)CC 7a_100011216074_100000210614 [1,1,0,0,0,0|1,0,1]=4 10827 B14R0.337 CCCCCCCOCCC[C@@H](C)CN 34a_100160569302_100000210614 [1,1,0,0,0,0|2,0,0]=4 10828 B14R0.337 CCCCCOCCCCCC(C)CC 7a_200000035636_100000210326 [1,1,0,0,0,0|1,0,1]=4 10829 B14R0.337 CCN(C)CCCCCCCCCCO 2230a_100000225621_100009813290 [1,1,0,0,0,0|1,0,1]=4 10830 B14R0.337 CCN(C)CCCCCCCCCCO 269982a_100000225621_100009813290 [1,1,0,0,0,0|1,0,1]=4 10831 B14R0.337 CCN(C)CCCSCCCCCC=O 62a_100000139337_100015186262 [1,1,0,0,0,0|2,0,0]=4 10832 B14R0.337 CC[C@H](C)CNCCCCCCCCO 2230a_102515433106_100009816398 [1,1,0,0,0,0|1,0,1]=4 10833 B14R0.337 CC[C@H](C)CNCCCCCCCCO 34a_102515433106_100009816398 [1,1,0,0,0,0|1,0,1]=4 10834 B14R0.337 CC[C@H](C)COCCCCCCCCBr 34a_100009813846_100009816398 [1,1,0,0,0,0|2,0,0]=4 10835 B14R0.337 CC[C@H](C)COCCCCCCCCBr 7a_100009813846_100009816398 [1,1,0,0,0,0|2,0,0]=4 10836 B14R0.337 CC[C@H](C)COCCCCCCCCCl 34a_100000033203_100009816398 [1,1,0,0,0,0|2,0,0]=4 10837 B14R0.337 CC[C@H](C)COCCCCCCCCCl 7a_100000033203_100009816398 [1,1,0,0,0,0|2,0,0]=4 10838 B14R0.337 CC[C@H](C)COCCCCCCCCN 34a_102515433106_100009816398 [1,1,0,0,0,0|2,0,0]=4 10839 B14R0.337 CC[C@H](C)COCCCCCCCCO 7a_100009816381_100000033203 [1,1,0,0,0,0|1,0,1]=4 10840 B14R0.337 CC[C@H](C)CSCCCCCCCCO 62a_100000033203_100009816398 [1,1,0,0,0,0|1,0,1]=4 10841 B14R0.337 CC[C@H](C)CSCCCCCCCCO 62a_100009816398_100000033203 [1,1,0,0,0,0|1,0,1]=4 10842 B14R0.393 C=CCC(=O)CCCCCCCCCC 1458a_100000210193_100000210319 [1,1,0,0,0,0|0,0,2]=4 10843 B14R0.393 C=CCC(=O)CCCCCCCCCC 1458a_100000210375_100000210623 [1,1,0,0,0,0|0,0,2]=4 10844 B14R0.393 C=CCC(C)COCCCCCCCC 34a_100009832082_100000210759 [1,1,0,0,0,0|1,0,1]=4 10845 B14R0.393 C=CCC(C)COCCCCCCCC 7a_100009832082_100000210759 [1,1,0,0,0,0|1,0,1]=4 10846 B14R0.393 C=CCCCCCCCCC(=O)CCC 1458a_100000211349_100000210303 [1,1,0,0,0,0|0,0,2]=4 10847 B14R0.393 C=CCCCCCCCCC(=O)CCC 1458a_100000211992_100011933949 [1,1,0,0,0,0|0,0,2]=4 10848 B14R0.393 C=CCCCCCCCCN(C)CCC 2230a_100000747261_100011933949 [1,1,0,0,0,0|1,0,1]=4 10849 B14R0.393 C=CCCCCCCCCN(C)CCC 269982a_100000747261_100011933949 [1,1,0,0,0,0|1,0,1]=4 10850 B14R0.393 C=CCCCCCCCNC(C)CCC 2230a_100000741246_100012355270 [1,1,0,0,0,0|1,0,1]=4 10851 B14R0.393 C=CCCCCCCCOC(C)CCC 34a_100000730831_100000766640 [1,1,0,0,0,0|1,0,1]=4 10852 B14R0.393 C=CCCCCCCCOC(C)CCC 34a_100000764384_100012355270 [1,1,0,0,0,0|1,0,1]=4 10853 B14R0.393 C=CCCCCCCCOC(C)CCC 7a_100000730831_100000766640 [1,1,0,0,0,0|1,0,1]=4 10854 B14R0.393 C=CCCCCCCCOC(C)CCC 7a_100000764384_100012355270 [1,1,0,0,0,0|1,0,1]=4 10855 B14R0.393 C=CCCCCCCCSC(C)CCC 62a_100000766640_100012355270 [1,1,0,0,0,0|1,0,1]=4 10856 B14R0.393 C=CCCCCCCCSC(C)CCC 62a_100012355270_100000766640 [1,1,0,0,0,0|1,0,1]=4 10857 B14R0.393 C=CCCCCCCOCC(C)CCC 34a_100000688023_100011215473 [1,1,0,0,0,0|1,0,1]=4 10858 B14R0.393 C=CCCCCCCOCC(C)CCC 34a_200011216477_100011216630 [1,1,0,0,0,0|1,0,1]=4 10859 B14R0.393 C=CCCCCCCOCC(C)CCC 7a_100000688023_100011215473 [1,1,0,0,0,0|1,0,1]=4 10860 B14R0.393 C=CCCCCCCOCC(C)CCC 7a_200011216477_100011216630 [1,1,0,0,0,0|1,0,1]=4 10861 B14R0.393 C=CCCCCCCOC[C@@H](N)CCC 34a_100000732646_100011215473 [1,1,0,0,0,0|1,0,1]=4 10862 B14R0.393 C=CCCCCCCSCC(C)CCC 62a_100011215473_100011216630 [1,1,0,0,0,0|1,0,1]=4 10863 B14R0.393 C=CCCCCCCSCC(C)CCC 62a_100011216630_100011215473 [1,1,0,0,0,0|1,0,1]=4 10864 B14R0.393 C=CCCCCCOCCC(C)CCC 34a_100011217855_100000700193 [1,1,0,0,0,0|1,0,1]=4 10865 B14R0.393 C=CCCCCCOCCC(C)CCC 7a_100011217855_100000700193 [1,1,0,0,0,0|1,0,1]=4 10866 B14R0.393 C=CCCCCCOCC[C@@H](N)CCC 34a_100015193777_100000700193 [1,1,0,0,0,0|1,0,1]=4 10867 B14R0.393 C=CCCCCOCCCC(C)CCC 34a_100011713154_100011215482 [1,1,0,0,0,0|1,0,1]=4 10868 B14R0.393 C=CCCCCOCCCC(C)CCC 7a_100011713154_100011215482 [1,1,0,0,0,0|1,0,1]=4 10869 B14R0.393 C=CCN(C)CCCCCCCCCC 2230a_100000207566_100000210623 [1,1,0,0,0,0|1,0,1]=4 10870 B14R0.393 C=CCN(C)CCCCCCCCCC 2230a_100000225617_100000210320 [1,1,0,0,0,0|1,0,1]=4 10871 B14R0.393 C=CCN(C)CCCCCCCCCC 269982a_100000207566_100000210623 [1,1,0,0,0,0|1,0,1]=4 10872 B14R0.393 C=CCN(C)CCCCCCCCCC 269982a_100000225617_100000210320 [1,1,0,0,0,0|1,0,1]=4 10873 B14R0.393 C=CC[C@@H](C)OCCCCCCCCC 34a_100000731007_100011214924 [1,1,0,0,0,0|1,0,1]=4 10874 B14R0.393 C=CC[C@@H](C)OCCCCCCCCC 7a_100000731007_100000210328 [1,1,0,0,0,0|1,0,1]=4 10875 B14R0.393 C=CC[C@@H](N)COCCCCCCCC 34a_100020615467_100000210759 [1,1,0,0,0,0|1,0,1]=4 10876 B14R0.393 CCCC(=O)CCCCCCCCCF 1458a_200009909015_100000210303 [1,1,0,0,0,0|1,0,1]=4 10877 B14R0.393 CCCC(=O)CCCCCCCCCO 1458a_100000211992_100009813782 [1,1,0,0,0,0|0,0,2]=4 10878 B14R0.393 CCCC(C)CCCOCCCCC=O 7a_100011713154_100000139335 [1,1,0,0,0,0|1,0,0]=3 10879 B14R0.393 CCCC(C)CCCOCCCCCF 34a_100011713154_100000729378 [1,1,0,0,0,0|2,0,0]=4 10880 B14R0.393 CCCC(C)CCCOCCCCCF 7a_100011713154_100000729378 [1,1,0,0,0,0|2,0,0]=4 10881 B14R0.393 CCCC(C)CCCOCCCCCO 34a_100011713154_100000746330 [1,1,0,0,0,0|1,0,1]=4 10882 B14R0.393 CCCC(C)CCCOCCCCCO 7a_100011713154_100000746330 [1,1,0,0,0,0|1,0,1]=4 10883 B14R0.393 CCCC(C)CCOCCCCCC=O 7a_100011217855_100000139337 [1,1,0,0,0,0|1,0,0]=3 10884 B14R0.393 CCCC(C)CCOCCCCCCF 34a_100011217855_100015922095 [1,1,0,0,0,0|2,0,0]=4 10885 B14R0.393 CCCC(C)CCOCCCCCCF 7a_100011217855_100015922095 [1,1,0,0,0,0|2,0,0]=4 10886 B14R0.393 CCCC(C)CCOCCCCCCO 34a_100011217855_100000766143 [1,1,0,0,0,0|1,0,1]=4 10887 B14R0.393 CCCC(C)CCOCCCCCCO 7a_100011217855_100000766143 [1,1,0,0,0,0|1,0,1]=4 10888 B14R0.393 CCCC(C)CNCCCCCCCO 2230a_100011996573_100011216630 [1,1,0,0,0,0|1,0,1]=4 10889 B14R0.393 CCCC(C)CNCCCCCCCO 270004a_100011996573_100000243154 [1,1,0,0,0,0|1,0,1]=4 10890 B14R0.393 CCCC(C)CNCCCCCCCO 34a_100011996573_100011216630 [1,1,0,0,0,0|1,0,1]=4 10891 B14R0.393 CCCC(C)COCCCCCCCBr 34a_100000760002_100011216630 [1,1,0,0,0,0|2,0,0]=4 10892 B14R0.393 CCCC(C)COCCCCCCCBr 7a_100000760002_100011216630 [1,1,0,0,0,0|2,0,0]=4 10893 B14R0.393 CCCC(C)COCCCCCCCN 34a_100011996573_100011216630 [1,1,0,0,0,0|2,0,0]=4 10894 B14R0.393 CCCC(C)COCCCCCCCO 34a_100000688023_100000760002 [1,1,0,0,0,0|1,0,1]=4 10895 B14R0.393 CCCC(C)COCCCCCCCO 7a_100000688023_100000760002 [1,1,0,0,0,0|1,0,1]=4 10896 B14R0.393 CCCC(C)CSCCCCCCCO 62a_100000760002_100011216630 [1,1,0,0,0,0|1,0,1]=4 10897 B14R0.393 CCCC(C)CSCCCCCCCO 62a_100011216630_100000760002 [1,1,0,0,0,0|1,0,1]=4 10898 B14R0.393 CCCC(C)NCCCCCCCCO 2230a_100000741246_100000033203 [1,1,0,0,0,0|1,0,1]=4 10899 B14R0.393 CCCC(C)NCCCCCCCCO 2230a_102515433106_100000766640 [1,1,0,0,0,0|1,0,1]=4 10900 B14R0.393 CCCC(C)NCCCCCCCCO 270004a_102515433106_100000211909 [1,1,0,0,0,0|1,0,1]=4 10901 B14R0.393 CCCC(C)NCCCCCCCCO 34a_102515433106_100000766640 [1,1,0,0,0,0|1,0,1]=4 10902 B14R0.393 CCCC(C)OCCCCCCCCBr 34a_100009813846_100000766640 [1,1,0,0,0,0|2,0,0]=4 10903 B14R0.393 CCCC(C)OCCCCCCCCBr 7a_100009813846_100000766640 [1,1,0,0,0,0|2,0,0]=4 10904 B14R0.393 CCCC(C)OCCCCCCCCCl 34a_100000033203_100000766640 [1,1,0,0,0,0|2,0,0]=4 10905 B14R0.393 CCCC(C)OCCCCCCCCCl 7a_100000033203_100000766640 [1,1,0,0,0,0|2,0,0]=4 10906 B14R0.393 CCCC(C)OCCCCCCCCN 34a_102515433106_100000766640 [1,1,0,0,0,0|2,0,0]=4 10907 B14R0.393 CCCC(C)OCCCCCCCCO 34a_100000764384_100000033203 [1,1,0,0,0,0|1,0,1]=4 10908 B14R0.393 CCCC(C)OCCCCCCCCO 7a_100000764384_100000033203 [1,1,0,0,0,0|1,0,1]=4 10909 B14R0.393 CCCC(C)SCCCCCCCCO 62a_100000033203_100000766640 [1,1,0,0,0,0|1,0,1]=4 10910 B14R0.393 CCCC(C)SCCCCCCCCO 62a_100000766640_100000033203 [1,1,0,0,0,0|1,0,1]=4 10911 B14R0.393 CCCCCCCCCCC(=O)CCC 1458a_100000210375_100000210303 [1,1,0,0,0,0|0,0,2]=4 10912 B14R0.393 CCCCCCCCCCC(=O)CCC 1458a_100000211992_100000210319 [1,1,0,0,0,0|0,0,2]=4 10913 B14R0.393 CCCCCCCCCCC(=O)CCF 1458a_100000210375_100011217306 [1,1,0,0,0,0|1,0,1]=4 10914 B14R0.393 CCCCCCCCCCC(=O)CCO 1458a_100000210375_100000211926 [1,1,0,0,0,0|0,0,2]=4 10915 B14R0.393 CCCCCCCCCCC(=O)CCO 1458a_100011216618_100000210319 [1,1,0,0,0,0|0,0,2]=4 10916 B14R0.393 CCCCCCCCCCC(C)NCC 270004a_100015525214_200011219864 [1,1,0,0,0,0|1,0,1]=4 10917 B14R0.393 CCCCCCCCCCC(C)OCC 34a_100011215000_100000210202 [1,1,0,0,0,0|1,0,1]=4 10918 B14R0.393 CCCCCCCCCCC(C)OCC 7a_100011215000_100000210202 [1,1,0,0,0,0|1,0,1]=4 10919 B14R0.393 CCCCCCCCCCC(C)OCF 34a_100011215000_100015361967 [1,1,0,0,0,0|2,0,0]=4 10920 B14R0.393 CCCCCCCCCCC(C)OCF 7a_100011215000_100015361967 [1,1,0,0,0,0|2,0,0]=4 10921 B14R0.393 CCCCCCCCCCN(C)CC=O 2230a_100000207566_200015260668 [1,1,0,0,0,0|1,0,0]=3 10922 B14R0.393 CCCCCCCCCCN(C)CC=O 269982a_100000207566_200015260668 [1,1,0,0,0,0|1,0,0]=3 10923 B14R0.393 CCCCCCCCCCN(C)CCC 2230a_100000207566_100000210303 [1,1,0,0,0,0|1,0,1]=4 10924 B14R0.393 CCCCCCCCCCN(C)CCC 2230a_100000747261_100000210320 [1,1,0,0,0,0|1,0,1]=4 10925 B14R0.393 CCCCCCCCCCN(C)CCC 269982a_100000207566_100000210303 [1,1,0,0,0,0|1,0,1]=4 10926 B14R0.393 CCCCCCCCCCN(C)CCC 269982a_100000747261_100000210320 [1,1,0,0,0,0|1,0,1]=4 10927 B14R0.393 CCCCCCCCCCN(C)CCF 2230a_100000207566_100011217306 [1,1,0,0,0,0|2,0,0]=4 10928 B14R0.393 CCCCCCCCCCN(C)CCF 269982a_100000207566_100011217306 [1,1,0,0,0,0|2,0,0]=4 10929 B14R0.393 CCCCCCCCCCN(C)CCO 2230a_100000207566_100000211926 [1,1,0,0,0,0|1,0,1]=4 10930 B14R0.393 CCCCCCCCCCN(C)CCO 2230a_100000210263_100000210320 [1,1,0,0,0,0|1,0,1]=4 10931 B14R0.393 CCCCCCCCCCN(C)CCO 269982a_100000207566_100000211926 [1,1,0,0,0,0|1,0,1]=4 10932 B14R0.393 CCCCCCCCCCN(C)CCO 269982a_100000210263_100000210320 [1,1,0,0,0,0|1,0,1]=4 10933 B14R0.393 CCCCCCCCCNC(C)CCC 2230a_100000212291_100000766640 [1,1,0,0,0,0|1,0,1]=4 10934 B14R0.393 CCCCCCCCCNC(C)CCC 2230a_100000741246_100011214924 [1,1,0,0,0,0|1,0,1]=4 10935 B14R0.393 CCCCCCCCCNC(C)CCC 270004a_100000212291_100000211909 [1,1,0,0,0,0|1,0,1]=4 10936 B14R0.393 CCCCCCCCCNC(C)CCC 34a_100000212291_100000766640 [1,1,0,0,0,0|1,0,1]=4 10937 B14R0.393 CCCCCCCCCNC(C)CCO 2230a_100000212291_100009893172 [1,1,0,0,0,0|1,0,1]=4 10938 B14R0.393 CCCCCCCCCNC(C)CCO 34a_100000212291_100009893172 [1,1,0,0,0,0|1,0,1]=4 10939 B14R0.393 CCCCCCCCCN[C@H](C)CCO 2230a_100000706166_100011214924 [1,1,0,0,0,0|1,0,1]=4 10940 B14R0.393 CCCCCCCCCN[C@H](C)CCO 34a_100000706166_100011214924 [1,1,0,0,0,0|1,0,1]=4 10941 B14R0.393 CCCCCCCCCOC(C)CCBr 34a_100012276601_100011214924 [1,1,0,0,0,0|2,0,0]=4 10942 B14R0.393 CCCCCCCCCOC(C)CCC 34a_100000210712_100000766640 [1,1,0,0,0,0|1,0,1]=4 10943 B14R0.393 CCCCCCCCCOC(C)CCC 34a_100000764384_100011214924 [1,1,0,0,0,0|1,0,1]=4 10944 B14R0.393 CCCCCCCCCOC(C)CCC 7a_100000210712_100000766640 [1,1,0,0,0,0|1,0,1]=4 10945 B14R0.393 CCCCCCCCCOC(C)CCC 7a_100000764384_100000210328 [1,1,0,0,0,0|1,0,1]=4 10946 B14R0.393 CCCCCCCCCOC(C)CCO 34a_100000210712_100009893172 [1,1,0,0,0,0|1,0,1]=4 10947 B14R0.393 CCCCCCCCCOC(C)CCO 7a_100000210712_100009893172 [1,1,0,0,0,0|1,0,1]=4 10948 B14R0.393 CCCCCCCCCSC(C)CCC 62a_100000766640_100000210670 [1,1,0,0,0,0|1,0,1]=4 10949 B14R0.393 CCCCCCCCCSC(C)CCO 62a_100009893172_100000210670 [1,1,0,0,0,0|1,0,1]=4 10950 B14R0.393 CCCCCCCCNCC(C)CCC 2230a_100000229939_100011216630 [1,1,0,0,0,0|1,0,1]=4 10951 B14R0.393 CCCCCCCCNCC(C)CCC 270004a_100000229939_100000243154 [1,1,0,0,0,0|1,0,1]=4 10952 B14R0.393 CCCCCCCCNCC(C)CCC 34a_100000229939_100011216630 [1,1,0,0,0,0|1,0,1]=4 10953 B14R0.393 CCCCCCCCOCC(C)CCC 34a_100000210232_100011216630 [1,1,0,0,0,0|1,0,1]=4 10954 B14R0.393 CCCCCCCCOCC(C)CCC 34a_100000688023_100000210759 [1,1,0,0,0,0|1,0,1]=4 10955 B14R0.393 CCCCCCCCOCC(C)CCC 7a_100000210232_100011216630 [1,1,0,0,0,0|1,0,1]=4 10956 B14R0.393 CCCCCCCCOCC(C)CCC 7a_100000688023_100000210759 [1,1,0,0,0,0|1,0,1]=4 10957 B14R0.393 CCCCCCCCOCC(C)CCN 34a_106354213184_100000210759 [1,1,0,0,0,0|2,0,0]=4 10958 B14R0.393 CCCCCCCCOC[C@@H](N)CCC 34a_100000732646_100000210759 [1,1,0,0,0,0|1,0,1]=4 10959 B14R0.393 CCCCCCCCSCC(C)CCC 62a_100000210759_100011216630 [1,1,0,0,0,0|1,0,1]=4 10960 B14R0.393 CCCCCCCCSCC(C)CCC 62a_100011216630_100000210317 [1,1,0,0,0,0|1,0,1]=4 10961 B14R0.393 CCCCCCCOCCC(C)CCC 34a_100011217855_100000210614 [1,1,0,0,0,0|1,0,1]=4 10962 B14R0.393 CCCCCCCOCCC(C)CCC 7a_100011217855_100000210614 [1,1,0,0,0,0|1,0,1]=4 10963 B14R0.393 CCCCCCCOCC[C@@H](N)CCC 34a_100015193777_100000210614 [1,1,0,0,0,0|1,0,1]=4 10964 B14R0.393 CCCCCCOCCCC(C)CCC 34a_100011713154_100000210314 [1,1,0,0,0,0|1,0,1]=4 10965 B14R0.393 CCCCCCOCCCC(C)CCC 7a_100011713154_100000210314 [1,1,0,0,0,0|1,0,1]=4 10966 B14R0.393 CCCN(C)CCCCCCCCCO 2230a_100000747261_100009813782 [1,1,0,0,0,0|1,0,1]=4 10967 B14R0.393 CCCN(C)CCCCCCCCCO 269982a_100000747261_100009813782 [1,1,0,0,0,0|1,0,1]=4 10968 B14R0.393 CCC[C@H](N)CCOCCCCCCF 34a_100015193777_100015922095 [1,1,0,0,0,0|2,0,0]=4 10969 B14R0.393 CCC[C@H](N)CCOCCCCCCO 34a_100015193777_100000766143 [1,1,0,0,0,0|1,0,1]=4 10970 B14R0.393 CCC[C@H](N)COCCCCCCCO 34a_100000732646_100000760002 [1,1,0,0,0,0|1,0,1]=4 10971 B14R0.394 C=C(Br)CCOCCCCCCCCC 34a_100009813270_100011214924 [1,1,0,0,0,0|1,0,1]=4 10972 B14R0.394 C=C(C)CCNCCCCCCCCC 2230a_100000212291_100000730704 [1,1,0,0,0,0|1,0,1]=4 10973 B14R0.394 C=C(C)CCNCCCCCCCCC 34a_100000212291_100000730704 [1,1,0,0,0,0|1,0,1]=4 10974 B14R0.394 C=C(C)CCOCCCCCCCCC 34a_100000210712_100000730704 [1,1,0,0,0,0|1,0,1]=4 10975 B14R0.394 C=C(C)CCOCCCCCCCCC 34a_100000764851_100011214924 [1,1,0,0,0,0|1,0,1]=4 10976 B14R0.394 C=C(C)CCOCCCCCCCCC 7a_100000210712_100000730704 [1,1,0,0,0,0|1,0,1]=4 10977 B14R0.394 C=C(C)CCSCCCCCCCCC 62a_100000730704_100000210670 [1,1,0,0,0,0|1,0,1]=4 10978 B14R0.394 C=C(C)CNCCCCCCCCCC 2230a_100000684558_100000748629 [1,1,0,0,0,0|1,0,1]=4 10979 B14R0.394 C=C(C)CNCCCCCCCCCC 34a_100000684558_100000748629 [1,1,0,0,0,0|1,0,1]=4 10980 B14R0.394 C=C(C)COCCCCCCCCCC 34a_100000210245_100000210320 [1,1,0,0,0,0|1,0,1]=4 10981 B14R0.394 C=C(C)COCCCCCCCCCC 34a_100000210711_100000748629 [1,1,0,0,0,0|1,0,1]=4 10982 B14R0.394 C=C(C)COCCCCCCCCCC 7a_100000210711_100000748629 [1,1,0,0,0,0|1,0,1]=4 10983 B14R0.394 C=C(C)CSCCCCCCCCCC 62a_100000748629_100000210320 [1,1,0,0,0,0|1,0,1]=4 10984 B14R0.394 C=C(F)CNCCCCCCCCCC 2230a_100000684558_100009893438 [1,1,0,0,0,0|1,0,1]=4 10985 B14R0.394 C=C(F)CNCCCCCCCCCC 34a_100000684558_100009893438 [1,1,0,0,0,0|1,0,1]=4 10986 B14R0.394 C=C(F)COCCCCCCCCCC 34a_100000210711_100009893438 [1,1,0,0,0,0|1,0,1]=4 10987 B14R0.394 C=C(F)COCCCCCCCCCC 34a_200010262243_100000210320 [1,1,0,0,0,0|1,0,1]=4 10988 B14R0.394 C=C(F)COCCCCCCCCCC 7a_100000210711_100000042424 [1,1,0,0,0,0|1,0,1]=4 10989 B14R0.394 C=C(F)CSCCCCCCCCCC 62a_100000042424_100000210320 [1,1,0,0,0,0|1,0,1]=4 10990 B14R0.394 C=CCCCCCCCCCCC(=O)C 1458a_100000070787_100011093070 [1,1,0,0,0,0|0,0,2]=4 10991 B14R0.394 C=CCCCCCCCCCCN(C)C 2230a_100102631434_100011093070 [1,1,0,0,0,0|1,0,1]=4 10992 B14R0.394 C=CCCCCCCCCCCN(C)C 269982a_100102631434_100011093070 [1,1,0,0,0,0|1,0,1]=4 10993 B14R0.394 C=CCCCCCCCCCNC(C)C 2230a_100000081888_100000210206 [1,1,0,0,0,0|1,0,1]=4 10994 B14R0.394 C=CCCCCCCCCCNC(C)C 2230a_100138425928_100009814027 [1,1,0,0,0,0|1,0,1]=4 10995 B14R0.394 C=CCCCCCCCCCNC(C)C 34a_100000081888_100000210206 [1,1,0,0,0,0|1,0,1]=4 10996 B14R0.394 C=CCCCCCCCCCNC(C)C 34a_100138425928_100009814027 [1,1,0,0,0,0|1,0,1]=4 10997 B14R0.394 C=CCCCCCCCCCOC(C)C 34a_100000038209_100000210206 [1,1,0,0,0,0|1,0,1]=4 10998 B14R0.394 C=CCCCCCCCCCOC(C)C 34a_100000212225_100009814027 [1,1,0,0,0,0|1,0,1]=4 10999 B14R0.394 C=CCCCCCCCCCOC(C)C 7a_100000038209_100000210206 [1,1,0,0,0,0|1,0,1]=4 11000 B14R0.394 C=CCCCCCCCCCSC(C)C 62a_100000210206_100009814027 [1,1,0,0,0,0|1,0,1]=4 11001 B14R0.394 C=CCCCCCCCCCSC(C)C 62a_100009814027_100000210206 [1,1,0,0,0,0|1,0,1]=4 11002 B14R0.394 C=CCCCCCCCCNCC(C)C 2230a_100000210953_100011933949 [1,1,0,0,0,0|1,0,1]=4 11003 B14R0.394 C=CCCCCCCCCNCC(C)C 34a_100000210953_100011933949 [1,1,0,0,0,0|1,0,1]=4 11004 B14R0.394 C=CCCCCCCCCNCC(C)O 2230a_100000210904_100011933949 [1,1,0,0,0,0|1,0,1]=4 11005 B14R0.394 C=CCCCCCCCCNCC(C)O 34a_100000210904_100011933949 [1,1,0,0,0,0|1,0,1]=4 11006 B14R0.394 C=CCCCCCCCCOCC(C)Br 34a_100012180447_100011933949 [1,1,0,0,0,0|1,0,1]=4 11007 B14R0.394 C=CCCCCCCCCOCC(C)C 34a_100000210257_100011933949 [1,1,0,0,0,0|1,0,1]=4 11008 B14R0.394 C=CCCCCCCCCOCC(C)C 34a_100011215194_100000210624 [1,1,0,0,0,0|1,0,1]=4 11009 B14R0.394 C=CCCCCCCCCOCC(C)C 7a_100011215194_100000210760 [1,1,0,0,0,0|1,0,1]=4 11010 B14R0.394 C=CCCCCCCCCOCC(C)F 34a_100015925927_100011933949 [1,1,0,0,0,0|1,0,1]=4 11011 B14R0.394 C=CCCCCCCCCOCC(C)O 34a_100011215194_100011218427 [1,1,0,0,0,0|1,0,1]=4 11012 B14R0.394 C=CCCCCCCCCOCC(C)O 7a_100011215194_100011218427 [1,1,0,0,0,0|1,0,1]=4 11013 B14R0.394 C=CCCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100011933949 [1,1,0,0,0,0|1,0,1]=4 11014 B14R0.394 C=CCCCCCCCCOC[C@@H](C)N 34a_100000737577_100011933949 [1,1,0,0,0,0|1,0,1]=4 11015 B14R0.394 C=CCCCCCCCCOC[C@@H](C)O 34a_100011215194_100009817552 [1,1,0,0,0,0|1,0,1]=4 11016 B14R0.394 C=CCCCCCCCCOC[C@@H](C)O 7a_100011215194_100009817552 [1,1,0,0,0,0|1,0,1]=4 11017 B14R0.394 C=CCCCCCCCCSCC(C)C 62a_100000210624_100011933949 [1,1,0,0,0,0|1,0,1]=4 11018 B14R0.394 C=CCCCCCCCCSCC(C)C 62a_100011933949_100000210760 [1,1,0,0,0,0|1,0,1]=4 11019 B14R0.394 C=CCCCCCCCCSCC(C)O 62a_100011218427_100011933949 [1,1,0,0,0,0|1,0,1]=4 11020 B14R0.394 C=CCCCCCCCCSCC(C)O 62a_100011933949_100011218427 [1,1,0,0,0,0|1,0,1]=4 11021 B14R0.394 C=CCCCCCCCCSC[C@@H](C)O 62a_100009817552_100011933949 [1,1,0,0,0,0|1,0,1]=4 11022 B14R0.394 C=CCCCCCCCCSC[C@@H](C)O 62a_100011933949_100009817552 [1,1,0,0,0,0|1,0,1]=4 11023 B14R0.394 C=CCCCCCCCNCCC(C)O 2230a_200000755665_100012355270 [1,1,0,0,0,0|1,0,1]=4 11024 B14R0.394 C=CCCCCCCCOCCC(C)Br 34a_100009893172_100012355270 [1,1,0,0,0,0|1,0,1]=4 11025 B14R0.394 C=CCCCCCCCOCCC(C)C 34a_100000210254_100012355270 [1,1,0,0,0,0|1,0,1]=4 11026 B14R0.394 C=CCCCCCCCOCCC(C)C 34a_100000730831_100000210312 [1,1,0,0,0,0|1,0,1]=4 11027 B14R0.394 C=CCCCCCCCOCCC(C)C 7a_100000210254_100012355270 [1,1,0,0,0,0|1,0,1]=4 11028 B14R0.394 C=CCCCCCCCOCCC(C)C 7a_100000730831_100000210626 [1,1,0,0,0,0|1,0,1]=4 11029 B14R0.394 C=CCCCCCCCOCCC(C)O 34a_100000730831_100012276601 [1,1,0,0,0,0|1,0,1]=4 11030 B14R0.394 C=CCCCCCCCOCCC(C)O 7a_100000730831_100012276601 [1,1,0,0,0,0|1,0,1]=4 11031 B14R0.394 C=CCCCCCCCOCC[C@@H](C)N 34a_100000706166_100012355270 [1,1,0,0,0,0|1,0,1]=4 11032 B14R0.394 C=CCCCCCCCSCCC(C)C 62a_100000210312_100012355270 [1,1,0,0,0,0|1,0,1]=4 11033 B14R0.394 C=CCCCCCCCSCCC(C)C 62a_100012355270_100000210312 [1,1,0,0,0,0|1,0,1]=4 11034 B14R0.394 C=CCCCCCCCSCCC(C)O 62a_100012276601_100012355270 [1,1,0,0,0,0|1,0,1]=4 11035 B14R0.394 C=CCCCCCCCSCCC(C)O 62a_100012355270_100012276601 [1,1,0,0,0,0|1,0,1]=4 11036 B14R0.394 C=CCCCCCCNCCCC(C)C 2230a_200000737386_100011215473 [1,1,0,0,0,0|1,0,1]=4 11037 B14R0.394 C=CCCCCCCNCCCC(C)C 34a_200000737386_100011215473 [1,1,0,0,0,0|1,0,1]=4 11038 B14R0.394 C=CCCCCCCOCCCC(C)C 34a_100000210774_100011215473 [1,1,0,0,0,0|1,0,1]=4 11039 B14R0.394 C=CCCCCCCOCCCC(C)C 34a_200011216477_100011214892 [1,1,0,0,0,0|1,0,1]=4 11040 B14R0.394 C=CCCCCCCOCCCC(C)C 7a_100000210774_100011215473 [1,1,0,0,0,0|1,0,1]=4 11041 B14R0.394 C=CCCCCCCOCCCC(C)C 7a_200011216477_100011214892 [1,1,0,0,0,0|1,0,1]=4 11042 B14R0.394 C=CCCCCCCOCCCC(C)O 34a_200011216477_200000718107 [1,1,0,0,0,0|1,0,1]=4 11043 B14R0.394 C=CCCCCCCOCCCC(C)O 7a_200011216477_200000718107 [1,1,0,0,0,0|1,0,1]=4 11044 B14R0.394 C=CCCCCCCSCCCC(C)C 62a_100011214892_100011215473 [1,1,0,0,0,0|1,0,1]=4 11045 B14R0.394 C=CCCCCCCSCCCC(C)C 62a_100011215473_100011214892 [1,1,0,0,0,0|1,0,1]=4 11046 B14R0.394 C=CCCCCCCSCCCC(C)O 62a_100011215473_200000718107 [1,1,0,0,0,0|1,0,1]=4 11047 B14R0.394 C=CCCCCCCSCCCC(C)O 62a_200000718107_100011215473 [1,1,0,0,0,0|1,0,1]=4 11048 B14R0.394 C=CCCCCCOCCCCC(C)C 34a_100011214890_100000700193 [1,1,0,0,0,0|1,0,1]=4 11049 B14R0.394 C=CCCCCCOCCCCC(C)C 34a_100011216702_100011216152 [1,1,0,0,0,0|1,0,1]=4 11050 B14R0.394 C=CCCCCCOCCCCC(C)C 7a_100011214890_100000700193 [1,1,0,0,0,0|1,0,1]=4 11051 B14R0.394 C=CCCCCCOCCCCC(C)C 7a_100011216702_100011216152 [1,1,0,0,0,0|1,0,1]=4 11052 B14R0.394 C=CCCCCCSCCCCC(C)C 62a_100000700193_100011216152 [1,1,0,0,0,0|1,0,1]=4 11053 B14R0.394 C=CCCCCCSCCCCC(C)C 62a_100011216152_100000700193 [1,1,0,0,0,0|1,0,1]=4 11054 B14R0.394 C=CCCCCNCCCCCC(C)C 2230a_100000703577_100000210682 [1,1,0,0,0,0|1,0,1]=4 11055 B14R0.394 C=CCCCCNCCCCCC(C)C 2230a_100011290863_100011215482 [1,1,0,0,0,0|1,0,1]=4 11056 B14R0.394 C=CCCCCNCCCCCC(C)C 34a_100000703577_100000210682 [1,1,0,0,0,0|1,0,1]=4 11057 B14R0.394 C=CCCCCNCCCCCC(C)C 34a_100011290863_100011215482 [1,1,0,0,0,0|1,0,1]=4 11058 B14R0.394 C=CCCCCOCCCCCC(C)C 34a_100000766645_100000210682 [1,1,0,0,0,0|1,0,1]=4 11059 B14R0.394 C=CCCCCOCCCCCC(C)C 34a_100011995859_100011215482 [1,1,0,0,0,0|1,0,1]=4 11060 B14R0.394 C=CCCCCOCCCCCC(C)C 7a_100000766645_100000210682 [1,1,0,0,0,0|1,0,1]=4 11061 B14R0.394 C=CCCCCOCCCCCC(C)C 7a_100011995859_100011215482 [1,1,0,0,0,0|1,0,1]=4 11062 B14R0.394 C=CCCCCSCCCCCC(C)C 62a_100000210682_100011215482 [1,1,0,0,0,0|1,0,1]=4 11063 B14R0.394 C=CCCCCSCCCCCC(C)C 62a_100011215482_100000210682 [1,1,0,0,0,0|1,0,1]=4 11064 B14R0.394 C=CCCCNCCCCCCC(C)C 2230a_100000211014_100011713584 [1,1,0,0,0,0|1,0,1]=4 11065 B14R0.394 C=CCCCNCCCCCCC(C)C 34a_100000211014_100000757094 [1,1,0,0,0,0|1,0,1]=4 11066 B14R0.394 C=CCCOCCCCCCCC(C)C 34a_200000210741_100000754431 [1,1,0,0,0,0|1,0,1]=4 11067 B14R0.394 C=CCCOCCCCCCCC(C)C 7a_200000210741_100000754431 [1,1,0,0,0,0|1,0,1]=4 11068 B14R0.394 CC(=O)CCCCCCCCCCCO 1458a_100000070787_100009812471 [1,1,0,0,0,0|1,0,0]=3 11069 B14R0.394 CC(=O)CCCCNCCCCCCO 34a_100000686447_100009817362 [1,1,0,0,0,0|2,0,0]=4 11070 B14R0.394 CC(=O)CCCCOCCCCCCBr 34a_100011215345_100009817362 [1,1,0,0,0,0|2,0,0]=4 11071 B14R0.394 CC(=O)CCCCOCCCCCCBr 7a_100011215345_100000735457 [1,1,0,0,0,0|2,0,0]=4 11072 B14R0.394 CC(=O)CCCCOCCCCCCCl 34a_100000766143_100009817362 [1,1,0,0,0,0|2,0,0]=4 11073 B14R0.394 CC(=O)CCCCOCCCCCCCl 7a_100000766143_100000735457 [1,1,0,0,0,0|2,0,0]=4 11074 B14R0.394 CC(=O)CCCCOCCCCCCF 34a_100000732779_100009817362 [1,1,0,0,0,0|2,0,0]=4 11075 B14R0.394 CC(=O)CCCCOCCCCCCF 7a_100000732779_100000735457 [1,1,0,0,0,0|2,0,0]=4 11076 B14R0.394 CC(=O)CCCCOCCCCCCN 34a_100000686447_100009817362 [1,1,0,0,0,0|2,0,0]=4 11077 B14R0.394 CC(=O)CCCCSCCCCCC=O 62a_100000139337_100000735457 [1,1,0,0,0,0|1,0,1]=4 11078 B14R0.394 CC(=O)CCCCSCCCCCC=O 62a_100000735457_100000139337 [1,1,0,0,0,0|1,0,1]=4 11079 B14R0.394 CC(=O)CCCCSCCCCCCF 62a_100000735457_100015922095 [1,1,0,0,0,0|2,0,0]=4 11080 B14R0.394 CC(=O)CCCCSCCCCCCF 62a_100015922095_100000735457 [1,1,0,0,0,0|2,0,0]=4 11081 B14R0.394 CC(=O)CCCCSCCCCCCO 62a_100000735457_100000766143 [1,1,0,0,0,0|2,0,0]=4 11082 B14R0.394 CC(=O)CCCCSCCCCCCO 62a_100000766143_100000735457 [1,1,0,0,0,0|2,0,0]=4 11083 B14R0.394 CC(=O)CCCNCCCCCCCO 34a_100011996573_100000685027 [1,1,0,0,0,0|2,0,0]=4 11084 B14R0.394 CC(=O)CCCOCCCCCCCBr 34a_100000760002_100000685027 [1,1,0,0,0,0|2,0,0]=4 11085 B14R0.394 CC(=O)CCCOCCCCCCCBr 7a_100000760002_100011215641 [1,1,0,0,0,0|2,0,0]=4 11086 B14R0.394 CC(=O)CCCOCCCCCCCN 34a_100011996573_100000685027 [1,1,0,0,0,0|2,0,0]=4 11087 B14R0.394 CC(=O)CCCOCCCCCCCO 34a_100000759063_100000760002 [1,1,0,0,0,0|2,0,0]=4 11088 B14R0.394 CC(=O)CCCOCCCCCCCO 7a_100000759063_100000760002 [1,1,0,0,0,0|2,0,0]=4 11089 B14R0.394 CC(=O)CCCSCCCCCCCO 62a_100000760002_100011215641 [1,1,0,0,0,0|2,0,0]=4 11090 B14R0.394 CC(=O)CCCSCCCCCCCO 62a_100011215641_100000760002 [1,1,0,0,0,0|2,0,0]=4 11091 B14R0.394 CC(=O)CCOCCCCCCCCBr 7a_100009813846_100000053229 [1,1,0,0,0,0|2,0,0]=4 11092 B14R0.394 CC(=O)CCOCCCCCCCCCl 7a_100000033203_100000053229 [1,1,0,0,0,0|2,0,0]=4 11093 B14R0.394 CC(=O)CCOCCCCCCCCO 34a_100000759926_100000033203 [1,1,0,0,0,0|2,0,0]=4 11094 B14R0.394 CC(=O)CCOCCCCCCCCO 7a_100000759926_100000033203 [1,1,0,0,0,0|2,0,0]=4 11095 B14R0.394 CC(=O)CCSCCCCCCCCO 62a_100000033203_100000053229 [1,1,0,0,0,0|2,0,0]=4 11096 B14R0.394 CC(=O)CCSCCCCCCCCO 62a_100000053229_100000033203 [1,1,0,0,0,0|2,0,0]=4 11097 B14R0.394 CC(=O)COCCCCCCCCCO 34a_100000211253_100009813782 [1,1,0,0,0,0|2,0,0]=4 11098 B14R0.394 CC(=O)NCCCCCCCCCCO 240690a_100000066964_100015343762 [1,1,0,0,0,0|2,0,0]=4 11099 B14R0.394 CC(Br)CCOCCCCCCCCO 34a_100009893172_100000033203 [1,1,0,0,0,0|1,0,1]=4 11100 B14R0.394 CC(Br)COCCCCCCCCCO 34a_100012180447_100009813782 [1,1,0,0,0,0|1,0,1]=4 11101 B14R0.394 CC(C)CCCCCCCOCCCF 34a_200000210741_100011934791 [1,1,0,0,0,0|2,0,0]=4 11102 B14R0.394 CC(C)CCCCCCCOCCCF 7a_200000210741_100011934791 [1,1,0,0,0,0|2,0,0]=4 11103 B14R0.394 CC(C)CCCCCCCOCCCO 34a_200000210741_100000230001 [1,1,0,0,0,0|1,0,1]=4 11104 B14R0.394 CC(C)CCCCCCCOCCCO 7a_200000210741_100011215043 [1,1,0,0,0,0|1,0,1]=4 11105 B14R0.394 CC(C)CCCCCCNCCCC=O 2230a_100000211014_200011292268 [1,1,0,0,0,0|1,0,0]=3 11106 B14R0.394 CC(C)CCCCCCNCCCCF 2230a_100000211014_100000729493 [1,1,0,0,0,0|2,0,0]=4 11107 B14R0.394 CC(C)CCCCCCNCCCCF 34a_100000211014_100000729493 [1,1,0,0,0,0|2,0,0]=4 11108 B14R0.394 CC(C)CCCCCCNCCCCO 2230a_100000211014_100000210776 [1,1,0,0,0,0|1,0,1]=4 11109 B14R0.394 CC(C)CCCCCCNCCCCO 34a_100000211014_100011216708 [1,1,0,0,0,0|1,0,1]=4 11110 B14R0.394 CC(C)CCCCCNCCCCC=O 2230a_100011290863_100000139335 [1,1,0,0,0,0|1,0,0]=3 11111 B14R0.394 CC(C)CCCCCNCCCCCF 2230a_100011290863_100000729378 [1,1,0,0,0,0|2,0,0]=4 11112 B14R0.394 CC(C)CCCCCNCCCCCF 34a_100011290863_100000729378 [1,1,0,0,0,0|2,0,0]=4 11113 B14R0.394 CC(C)CCCCCNCCCCCO 2230a_100000762737_100000210682 [1,1,0,0,0,0|1,0,1]=4 11114 B14R0.394 CC(C)CCCCCNCCCCCO 2230a_100011290863_100000746330 [1,1,0,0,0,0|1,0,1]=4 11115 B14R0.394 CC(C)CCCCCNCCCCCO 34a_100000762737_100000210682 [1,1,0,0,0,0|1,0,1]=4 11116 B14R0.394 CC(C)CCCCCNCCCCCO 34a_100011290863_100000746330 [1,1,0,0,0,0|1,0,1]=4 11117 B14R0.394 CC(C)CCCCCOCCCCC=O 7a_100011995859_100000139335 [1,1,0,0,0,0|1,0,0]=3 11118 B14R0.394 CC(C)CCCCCOCCCCCBr 34a_100000746331_100000210682 [1,1,0,0,0,0|2,0,0]=4 11119 B14R0.394 CC(C)CCCCCOCCCCCBr 7a_100000746331_100000210682 [1,1,0,0,0,0|2,0,0]=4 11120 B14R0.394 CC(C)CCCCCOCCCCCCl 34a_100000746330_100000210682 [1,1,0,0,0,0|2,0,0]=4 11121 B14R0.394 CC(C)CCCCCOCCCCCCl 7a_100000746330_100000210682 [1,1,0,0,0,0|2,0,0]=4 11122 B14R0.394 CC(C)CCCCCOCCCCCF 34a_100011995859_100000729378 [1,1,0,0,0,0|2,0,0]=4 11123 B14R0.394 CC(C)CCCCCOCCCCCF 7a_100011995859_100000729378 [1,1,0,0,0,0|2,0,0]=4 11124 B14R0.394 CC(C)CCCCCOCCCCCI 34a_200012148887_100000210682 [1,1,0,0,0,0|2,0,0]=4 11125 B14R0.394 CC(C)CCCCCOCCCCCI 7a_200012148887_100000210682 [1,1,0,0,0,0|2,0,0]=4 11126 B14R0.394 CC(C)CCCCCOCCCCCN 34a_100000762737_100000210682 [1,1,0,0,0,0|2,0,0]=4 11127 B14R0.394 CC(C)CCCCCOCCCCCO 34a_100011995859_100000746330 [1,1,0,0,0,0|1,0,1]=4 11128 B14R0.394 CC(C)CCCCCOCCCCCO 7a_100011995859_100000746330 [1,1,0,0,0,0|1,0,1]=4 11129 B14R0.394 CC(C)CCCCCSCCCCC=O 62a_100000139335_100000210682 [1,1,0,0,0,0|1,0,0]=3 11130 B14R0.394 CC(C)CCCCCSCCCCC=O 62a_100000210682_100000139335 [1,1,0,0,0,0|1,0,0]=3 11131 B14R0.394 CC(C)CCCCCSCCCCCF 62a_100000210682_100000729378 [1,1,0,0,0,0|2,0,0]=4 11132 B14R0.394 CC(C)CCCCCSCCCCCF 62a_100000729378_100000210682 [1,1,0,0,0,0|2,0,0]=4 11133 B14R0.394 CC(C)CCCCCSCCCCCO 62a_100000210682_100000746330 [1,1,0,0,0,0|1,0,1]=4 11134 B14R0.394 CC(C)CCCCCSCCCCCO 62a_100000746330_100000210682 [1,1,0,0,0,0|1,0,1]=4 11135 B14R0.394 CC(C)CCCCNCCCCCCO 2230a_100000686447_100011216152 [1,1,0,0,0,0|1,0,1]=4 11136 B14R0.394 CC(C)CCCCNCCCCCCO 34a_100000686447_100011216152 [1,1,0,0,0,0|1,0,1]=4 11137 B14R0.394 CC(C)CCCCOCCCCCC=O 7a_100011214890_100000139337 [1,1,0,0,0,0|1,0,0]=3 11138 B14R0.394 CC(C)CCCCOCCCCCCBr 34a_100011215345_100011216152 [1,1,0,0,0,0|2,0,0]=4 11139 B14R0.394 CC(C)CCCCOCCCCCCBr 7a_100011215345_100011216152 [1,1,0,0,0,0|2,0,0]=4 11140 B14R0.394 CC(C)CCCCOCCCCCCCl 34a_100000766143_100011216152 [1,1,0,0,0,0|2,0,0]=4 11141 B14R0.394 CC(C)CCCCOCCCCCCCl 7a_100000766143_100011216152 [1,1,0,0,0,0|2,0,0]=4 11142 B14R0.394 CC(C)CCCCOCCCCCCF 34a_100000732779_100011216152 [1,1,0,0,0,0|2,0,0]=4 11143 B14R0.394 CC(C)CCCCOCCCCCCF 34a_100011214890_100015922095 [1,1,0,0,0,0|2,0,0]=4 11144 B14R0.394 CC(C)CCCCOCCCCCCF 7a_100000732779_100011216152 [1,1,0,0,0,0|2,0,0]=4 11145 B14R0.394 CC(C)CCCCOCCCCCCF 7a_100011214890_100015922095 [1,1,0,0,0,0|2,0,0]=4 11146 B14R0.394 CC(C)CCCCOCCCCCCN 34a_100000686447_100011216152 [1,1,0,0,0,0|2,0,0]=4 11147 B14R0.394 CC(C)CCCCOCCCCCCO 34a_100011214890_100000766143 [1,1,0,0,0,0|1,0,1]=4 11148 B14R0.394 CC(C)CCCCOCCCCCCO 7a_100011214890_100000766143 [1,1,0,0,0,0|1,0,1]=4 11149 B14R0.394 CC(C)CCCCSCCCCCC=O 62a_100000139337_100011216152 [1,1,0,0,0,0|1,0,0]=3 11150 B14R0.394 CC(C)CCCCSCCCCCC=O 62a_100011216152_100000139337 [1,1,0,0,0,0|1,0,0]=3 11151 B14R0.394 CC(C)CCCCSCCCCCCF 62a_100011216152_100015922095 [1,1,0,0,0,0|2,0,0]=4 11152 B14R0.394 CC(C)CCCCSCCCCCCF 62a_100015922095_100011216152 [1,1,0,0,0,0|2,0,0]=4 11153 B14R0.394 CC(C)CCCCSCCCCCCO 62a_100000766143_100011216152 [1,1,0,0,0,0|1,0,1]=4 11154 B14R0.394 CC(C)CCCCSCCCCCCO 62a_100011216152_100000766143 [1,1,0,0,0,0|1,0,1]=4 11155 B14R0.394 CC(C)CCCNCCCCCCCO 2230a_100011996573_100011214892 [1,1,0,0,0,0|1,0,1]=4 11156 B14R0.394 CC(C)CCCNCCCCCCCO 2230a_200000737386_100000760002 [1,1,0,0,0,0|1,0,1]=4 11157 B14R0.394 CC(C)CCCNCCCCCCCO 34a_100011996573_100011214892 [1,1,0,0,0,0|1,0,1]=4 11158 B14R0.394 CC(C)CCCNCCCCCCCO 34a_200000737386_100000760002 [1,1,0,0,0,0|1,0,1]=4 11159 B14R0.394 CC(C)CCCOCCCCCCCBr 34a_100000760002_100011214892 [1,1,0,0,0,0|2,0,0]=4 11160 B14R0.394 CC(C)CCCOCCCCCCCBr 7a_100000760002_100011214892 [1,1,0,0,0,0|2,0,0]=4 11161 B14R0.394 CC(C)CCCOCCCCCCCN 34a_100011996573_100011214892 [1,1,0,0,0,0|2,0,0]=4 11162 B14R0.394 CC(C)CCCOCCCCCCCO 34a_100000210774_100000760002 [1,1,0,0,0,0|1,0,1]=4 11163 B14R0.394 CC(C)CCCOCCCCCCCO 7a_100000210774_100000760002 [1,1,0,0,0,0|1,0,1]=4 11164 B14R0.394 CC(C)CCCSCCCCCCCO 62a_100000760002_100011214892 [1,1,0,0,0,0|1,0,1]=4 11165 B14R0.394 CC(C)CCCSCCCCCCCO 62a_100011214892_100000760002 [1,1,0,0,0,0|1,0,1]=4 11166 B14R0.394 CC(C)CCNCCCCCCCCO 2230a_102515433106_100000210312 [1,1,0,0,0,0|1,0,1]=4 11167 B14R0.394 CC(C)CCNCCCCCCCCO 269862a_102515433106_100000185833 [1,1,0,0,0,0|1,0,1]=4 11168 B14R0.394 CC(C)CCNCCCCCCCCO 34a_102515433106_100000210312 [1,1,0,0,0,0|1,0,1]=4 11169 B14R0.394 CC(C)CCOCCCCCCCCBr 34a_100009813846_100000210312 [1,1,0,0,0,0|2,0,0]=4 11170 B14R0.394 CC(C)CCOCCCCCCCCBr 7a_100009813846_100000210626 [1,1,0,0,0,0|2,0,0]=4 11171 B14R0.394 CC(C)CCOCCCCCCCCCl 34a_100000033203_100000210312 [1,1,0,0,0,0|2,0,0]=4 11172 B14R0.394 CC(C)CCOCCCCCCCCCl 7a_100000033203_100000210626 [1,1,0,0,0,0|2,0,0]=4 11173 B14R0.394 CC(C)CCOCCCCCCCCN 34a_102515433106_100000210312 [1,1,0,0,0,0|2,0,0]=4 11174 B14R0.394 CC(C)CCOCCCCCCCCO 34a_100000210254_100000033203 [1,1,0,0,0,0|1,0,1]=4 11175 B14R0.394 CC(C)CCOCCCCCCCCO 7a_100000210254_100000033203 [1,1,0,0,0,0|1,0,1]=4 11176 B14R0.394 CC(C)CCSCCCCCCCCO 62a_100000033203_100000210312 [1,1,0,0,0,0|1,0,1]=4 11177 B14R0.394 CC(C)CCSCCCCCCCCO 62a_100000210312_100000033203 [1,1,0,0,0,0|1,0,1]=4 11178 B14R0.394 CC(C)CNCCCCCCCCCO 2230a_100000078944_100000210760 [1,1,0,0,0,0|1,0,1]=4 11179 B14R0.394 CC(C)CNCCCCCCCCCO 2230a_100000210953_100009813782 [1,1,0,0,0,0|1,0,1]=4 11180 B14R0.394 CC(C)CNCCCCCCCCCO 270004a_100000078944_100000210432 [1,1,0,0,0,0|1,0,1]=4 11181 B14R0.394 CC(C)CNCCCCCCCCCO 34a_100000078944_100000210624 [1,1,0,0,0,0|1,0,1]=4 11182 B14R0.394 CC(C)CNCCCCCCCCCO 34a_100000210953_100009813782 [1,1,0,0,0,0|1,0,1]=4 11183 B14R0.394 CC(C)COCCCCCCCCCBr 34a_100009813782_100000210624 [1,1,0,0,0,0|2,0,0]=4 11184 B14R0.394 CC(C)COCCCCCCCCCBr 7a_100009813782_100000210760 [1,1,0,0,0,0|2,0,0]=4 11185 B14R0.394 CC(C)COCCCCCCCCCCl 34a_100009868337_100000210624 [1,1,0,0,0,0|2,0,0]=4 11186 B14R0.394 CC(C)COCCCCCCCCCCl 7a_100009868337_100000210760 [1,1,0,0,0,0|2,0,0]=4 11187 B14R0.394 CC(C)COCCCCCCCCCN 34a_100000078944_100000210624 [1,1,0,0,0,0|2,0,0]=4 11188 B14R0.394 CC(C)COCCCCCCCCCO 34a_100000210257_100009813782 [1,1,0,0,0,0|1,0,1]=4 11189 B14R0.394 CC(C)COCCCNCCCCC=O 2230a_100000205972_100000139335 [1,1,0,0,0,0|2,0,0]=4 11190 B14R0.394 CC(C)COCCOCCCCCC=O 7a_100000703358_100000139337 [1,1,0,0,0,0|2,0,0]=4 11191 B14R0.394 CC(C)CSCCCCCCCCCO 62a_100000210624_100009813782 [1,1,0,0,0,0|1,0,1]=4 11192 B14R0.394 CC(C)CSCCCCCCCCCO 62a_100009813782_100000210760 [1,1,0,0,0,0|1,0,1]=4 11193 B14R0.394 CC(C)CSCCOCCCCCC=O 7a_200000230437_100000139337 [1,1,0,0,0,0|2,0,0]=4 11194 B14R0.394 CC(C)NCCCCCCCCCCO 2230a_100000066964_100000210206 [1,1,0,0,0,0|1,0,1]=4 11195 B14R0.394 CC(C)NCCCCCCCCCCO 2230a_100138425928_100009813290 [1,1,0,0,0,0|1,0,1]=4 11196 B14R0.394 CC(C)NCCCCCCCCCCO 34a_100000066964_100000210206 [1,1,0,0,0,0|1,0,1]=4 11197 B14R0.394 CC(C)NCCCCCCCCCCO 34a_100138425928_100009813290 [1,1,0,0,0,0|1,0,1]=4 11198 B14R0.394 CC(C)OCCCCCCCCCCBr 34a_100009813290_100000210206 [1,1,0,0,0,0|2,0,0]=4 11199 B14R0.394 CC(C)OCCCCCCCCCCBr 7a_100009813290_100000210206 [1,1,0,0,0,0|2,0,0]=4 11200 B14R0.394 CC(C)OCCCCCCCCCCCl 34a_200000033068_100000210206 [1,1,0,0,0,0|2,0,0]=4 11201 B14R0.394 CC(C)OCCCCCCCCCCCl 7a_200000033068_100000210206 [1,1,0,0,0,0|2,0,0]=4 11202 B14R0.394 CC(C)OCCCCCCCCCCN 34a_100000066964_100000210206 [1,1,0,0,0,0|2,0,0]=4 11203 B14R0.394 CC(C)OCCCCCCCCCCO 34a_100000212225_100009813290 [1,1,0,0,0,0|1,0,1]=4 11204 B14R0.394 CC(C)OCCCNCCCCCC=O 2230a_100000737246_100000139337 [1,1,0,0,0,0|2,0,0]=4 11205 B14R0.394 CC(C)SCCCCCCCCCCO 62a_100000210206_200000033068 [1,1,0,0,0,0|1,0,1]=4 11206 B14R0.394 CC(C)SCCCCCCCCCCO 62a_100009813290_100000210206 [1,1,0,0,0,0|1,0,1]=4 11207 B14R0.394 CC(F)COCCCCCCCCCO 34a_100015925927_100009813782 [1,1,0,0,0,0|1,0,1]=4 11208 B14R0.394 CC(O)CCCNCCCCCCCO 2230a_100011996573_200000718107 [1,1,0,0,0,0|1,0,1]=4 11209 B14R0.394 CC(O)CCCNCCCCCCCO 34a_100011996573_200000718107 [1,1,0,0,0,0|1,0,1]=4 11210 B14R0.394 CC(O)CCCOCCCCCCCBr 34a_100000760002_200000718107 [1,1,0,0,0,0|2,0,0]=4 11211 B14R0.394 CC(O)CCCOCCCCCCCBr 7a_100000760002_200000718107 [1,1,0,0,0,0|2,0,0]=4 11212 B14R0.394 CC(O)CCCOCCCCCCCN 34a_100011996573_200000718107 [1,1,0,0,0,0|2,0,0]=4 11213 B14R0.394 CC(O)CCCSCCCCCCCO 62a_100000760002_200000718107 [1,1,0,0,0,0|1,0,1]=4 11214 B14R0.394 CC(O)CCCSCCCCCCCO 62a_200000718107_100000760002 [1,1,0,0,0,0|1,0,1]=4 11215 B14R0.394 CC(O)CCNCCCCCCCCO 2230a_102515433106_100012276601 [1,1,0,0,0,0|1,0,1]=4 11216 B14R0.394 CC(O)CCNCCCCCCCCO 2230a_200000755665_100000033203 [1,1,0,0,0,0|1,0,1]=4 11217 B14R0.394 CC(O)CCNCCCCCCCCO 34a_102515433106_100012276601 [1,1,0,0,0,0|1,0,1]=4 11218 B14R0.394 CC(O)CCOCCCCCCCCBr 34a_100009813846_100012276601 [1,1,0,0,0,0|2,0,0]=4 11219 B14R0.394 CC(O)CCOCCCCCCCCBr 7a_100009813846_100012276601 [1,1,0,0,0,0|2,0,0]=4 11220 B14R0.394 CC(O)CCOCCCCCCCCCl 34a_100000033203_100012276601 [1,1,0,0,0,0|2,0,0]=4 11221 B14R0.394 CC(O)CCOCCCCCCCCCl 7a_100000033203_100012276601 [1,1,0,0,0,0|2,0,0]=4 11222 B14R0.394 CC(O)CCOCCCCCCCCN 34a_102515433106_100012276601 [1,1,0,0,0,0|2,0,0]=4 11223 B14R0.394 CC(O)CCSCCCCCCCCO 62a_100000033203_100012276601 [1,1,0,0,0,0|1,0,1]=4 11224 B14R0.394 CC(O)CCSCCCCCCCCO 62a_100012276601_100000033203 [1,1,0,0,0,0|1,0,1]=4 11225 B14R0.394 CC(O)CNCCCCCCCCCO 2230a_100000078944_100011218427 [1,1,0,0,0,0|1,0,1]=4 11226 B14R0.394 CC(O)CNCCCCCCCCCO 2230a_100000210904_100009813782 [1,1,0,0,0,0|1,0,1]=4 11227 B14R0.394 CC(O)CNCCCCCCCCCO 34a_100000078944_100011218427 [1,1,0,0,0,0|1,0,1]=4 11228 B14R0.394 CC(O)CNCCCCCCCCCO 34a_100000210904_100009813782 [1,1,0,0,0,0|1,0,1]=4 11229 B14R0.394 CC(O)COCCCCCCCCCBr 34a_100009813782_100011218427 [1,1,0,0,0,0|2,0,0]=4 11230 B14R0.394 CC(O)COCCCCCCCCCBr 7a_100009813782_100011218427 [1,1,0,0,0,0|2,0,0]=4 11231 B14R0.394 CC(O)COCCCCCCCCCCl 34a_100009868337_100011218427 [1,1,0,0,0,0|2,0,0]=4 11232 B14R0.394 CC(O)COCCCCCCCCCCl 7a_100009868337_100011218427 [1,1,0,0,0,0|2,0,0]=4 11233 B14R0.394 CC(O)COCCCCCCCCCN 34a_100000078944_100011218427 [1,1,0,0,0,0|2,0,0]=4 11234 B14R0.394 CC(O)CSCCCCCCCCCO 62a_100009813782_100011218427 [1,1,0,0,0,0|1,0,1]=4 11235 B14R0.394 CC(O)CSCCCCCCCCCO 62a_100011218427_100009813782 [1,1,0,0,0,0|1,0,1]=4 11236 B14R0.394 CCCCC#CCCCCCCC(=O)C 1458a_100000070787_200000043322 [1,1,0,0,0,0|0,0,2]=4 11237 B14R0.394 CCCCCCCCCCCCC(=O)C 1458a_100000070787_100000759014 [1,1,0,0,0,0|0,0,0]=2 11238 B14R0.394 CCCCCCCCCCCCC(=O)C 1458a_100011215791_200000210301 [1,1,0,0,0,0|0,0,0]=2 11239 B14R0.394 CCCCCCCCCCCCC(=O)[13CH3] 1458a_100011215791_200025704644 [1,1,0,0,0,0|0,0,0]=2 11240 B14R0.394 CCCCCCCCCCCCN(C)C 2230a_100000227908_200000210301 [1,1,0,0,0,0|1,0,1]=4 11241 B14R0.394 CCCCCCCCCCCCN(C)C 2230a_100102631434_100011215052 [1,1,0,0,0,0|1,0,1]=4 11242 B14R0.394 CCCCCCCCCCCCN(C)C 269982a_100000227908_200000210301 [1,1,0,0,0,0|1,0,1]=4 11243 B14R0.394 CCCCCCCCCCCCN(C)C 269982a_100102631434_100000759014 [1,1,0,0,0,0|1,0,1]=4 11244 B14R0.394 CCCCCCCCCCCCN(C)C 270004a_100102631434_100011218549 [1,1,0,0,0,0|1,0,1]=4 11245 B14R0.394 CCCCCCCCCCCCN(C)[13CH3] 2230a_100000227908_200025704644 [1,1,0,0,0,0|1,0,1]=4 11246 B14R0.394 CCCCCCCCCCCCN(C)[13CH3] 269982a_100000227908_200025704644 [1,1,0,0,0,0|1,0,1]=4 11247 B14R0.394 CCCCCCCCCCCNC(=O)C 11a_200011215754_100015343762 [1,1,0,0,0,0|1,0,0]=3 11248 B14R0.394 CCCCCCCCCCCNC(=O)C 1626a_200011215754_100015343762 [1,1,0,0,0,0|1,0,0]=3 11249 B14R0.394 CCCCCCCCCCCNC(=O)C 240690a_200011215754_100015343762 [1,1,0,0,0,0|1,0,0]=3 11250 B14R0.394 CCCCCCCCCCCNC(=O)C 527a_200011215754_100103153847 [1,1,0,0,0,0|1,0,0]=3 11251 B14R0.394 CCCCCCCCCCCNC(C)C 2230a_100138425928_100011215454 [1,1,0,0,0,0|1,0,1]=4 11252 B14R0.394 CCCCCCCCCCCNC(C)C 2230a_200011215754_100000210206 [1,1,0,0,0,0|1,0,1]=4 11253 B14R0.394 CCCCCCCCCCCNC(C)C 34a_100138425928_100011215454 [1,1,0,0,0,0|1,0,1]=4 11254 B14R0.394 CCCCCCCCCCCNC(C)C 34a_200011215754_100000210206 [1,1,0,0,0,0|1,0,1]=4 11255 B14R0.394 CCCCCCCCCCCOC(C)C 34a_100000210809_100000210206 [1,1,0,0,0,0|1,0,1]=4 11256 B14R0.394 CCCCCCCCCCCOC(C)C 34a_100000212225_100011215454 [1,1,0,0,0,0|1,0,1]=4 11257 B14R0.394 CCCCCCCCCCCOC(C)C 7a_100000210809_100000210206 [1,1,0,0,0,0|1,0,1]=4 11258 B14R0.394 CCCCCCCCCCCSC(C)C 62a_100000210206_100011215454 [1,1,0,0,0,0|1,0,1]=4 11259 B14R0.394 CCCCCCCCCCNCC(=O)N 2230a_100000684558_100000747473 [1,1,0,0,0,0|1,0,0]=3 11260 B14R0.394 CCCCCCCCCCNCC(=O)N 2230a_100000711301_100000210320 [1,1,0,0,0,0|1,0,0]=3 11261 B14R0.394 CCCCCCCCCCNCC(=O)N 34a_100000684558_100000187820 [1,1,0,0,0,0|1,0,0]=3 11262 B14R0.394 CCCCCCCCCCNCC(=O)O 269956a_100016091260_100000210320 [1,1,0,0,0,0|1,0,0]=3 11263 B14R0.394 CCCCCCCCCCNCC(=O)[O-] 34a_100000684558_100020667443 [1,1,0,0,0,0|1,0,0]=3 11264 B14R0.394 CCCCCCCCCCNCC(C)C 2230a_100000210953_100000210320 [1,1,0,0,0,0|1,0,1]=4 11265 B14R0.394 CCCCCCCCCCNCC(C)C 2230a_100000684558_100000210760 [1,1,0,0,0,0|1,0,1]=4 11266 B14R0.394 CCCCCCCCCCNCC(C)C 270004a_100000684558_100000210432 [1,1,0,0,0,0|1,0,1]=4 11267 B14R0.394 CCCCCCCCCCNCC(C)C 34a_100000210953_100000210320 [1,1,0,0,0,0|1,0,1]=4 11268 B14R0.394 CCCCCCCCCCNCC(C)C 34a_100000684558_100000210624 [1,1,0,0,0,0|1,0,1]=4 11269 B14R0.394 CCCCCCCCCCNCC(C)O 2230a_100000210904_100000210320 [1,1,0,0,0,0|1,0,1]=4 11270 B14R0.394 CCCCCCCCCCNCC(C)O 2230a_100000684558_100011218427 [1,1,0,0,0,0|1,0,1]=4 11271 B14R0.394 CCCCCCCCCCNCC(C)O 34a_100000210904_100000210320 [1,1,0,0,0,0|1,0,1]=4 11272 B14R0.394 CCCCCCCCCCNCC(C)O 34a_100000684558_100011218427 [1,1,0,0,0,0|1,0,1]=4 11273 B14R0.394 CCCCCCCCCCNCC(F)F 2230a_100000684558_100011934356 [1,1,0,0,0,0|2,0,0]=4 11274 B14R0.394 CCCCCCCCCCNCC(F)F 34a_100000684558_100011934356 [1,1,0,0,0,0|2,0,0]=4 11275 B14R0.394 CCCCCCCCCCNCC(F)F 34a_100000765723_100000210320 [1,1,0,0,0,0|2,0,0]=4 11276 B14R0.394 CCCCCCCCCCNC[C@@H](C)O 2230a_100000684558_100009817552 [1,1,0,0,0,0|1,0,1]=4 11277 B14R0.394 CCCCCCCCCCNC[C@@H](C)O 34a_100000684558_100009817552 [1,1,0,0,0,0|1,0,1]=4 11278 B14R0.394 CCCCCCCCCCNC[N+](=O)[O-] 34a_100000684558_100000761209 [1,1,0,0,0,0|2,0,0]=4 11279 B14R0.394 CCCCCCCCCCOCC(=O)C 34a_100000211253_100000210320 [1,1,0,0,0,0|1,0,0]=3 11280 B14R0.394 CCCCCCCCCCOCC(=O)N 34a_100000210711_100000187820 [1,1,0,0,0,0|1,0,0]=3 11281 B14R0.394 CCCCCCCCCCOCC(=O)N 7a_100000210711_100000187820 [1,1,0,0,0,0|1,0,0]=3 11282 B14R0.394 CCCCCCCCCCOCC(=O)[O-] 34a_100000210711_100020667443 [1,1,0,0,0,0|1,0,0]=3 11283 B14R0.394 CCCCCCCCCCOCC(C)Br 34a_100012180447_100000210320 [1,1,0,0,0,0|1,0,1]=4 11284 B14R0.394 CCCCCCCCCCOCC(C)C 34a_100000210257_100000210320 [1,1,0,0,0,0|1,0,1]=4 11285 B14R0.394 CCCCCCCCCCOCC(C)C 34a_100000210711_100000210624 [1,1,0,0,0,0|1,0,1]=4 11286 B14R0.394 CCCCCCCCCCOCC(C)C 7a_100000210711_100000210760 [1,1,0,0,0,0|1,0,1]=4 11287 B14R0.394 CCCCCCCCCCOCC(C)F 34a_100015925927_100000210320 [1,1,0,0,0,0|1,0,1]=4 11288 B14R0.394 CCCCCCCCCCOCC(C)O 34a_100000210711_100011218427 [1,1,0,0,0,0|1,0,1]=4 11289 B14R0.394 CCCCCCCCCCOCC(C)O 7a_100000210711_100011218427 [1,1,0,0,0,0|1,0,1]=4 11290 B14R0.394 CCCCCCCCCCOCC(F)F 34a_100000210711_100011934356 [1,1,0,0,0,0|2,0,0]=4 11291 B14R0.394 CCCCCCCCCCOCC(F)F 34a_100000743014_100000210320 [1,1,0,0,0,0|2,0,0]=4 11292 B14R0.394 CCCCCCCCCCOCC(F)F 7a_100000210711_100011934356 [1,1,0,0,0,0|2,0,0]=4 11293 B14R0.394 CCCCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100000210320 [1,1,0,0,0,0|1,0,1]=4 11294 B14R0.394 CCCCCCCCCCOC[C@@H](C)N 34a_100000737577_100000210320 [1,1,0,0,0,0|1,0,1]=4 11295 B14R0.394 CCCCCCCCCCOC[C@@H](C)O 34a_100000210711_100009817552 [1,1,0,0,0,0|1,0,1]=4 11296 B14R0.394 CCCCCCCCCCOC[C@@H](C)O 7a_100000210711_100009817552 [1,1,0,0,0,0|1,0,1]=4 11297 B14R0.394 CCCCCCCCCCOC[N+](=O)[O-] 34a_100000210711_100000761209 [1,1,0,0,0,0|2,0,0]=4 11298 B14R0.394 CCCCCCCCCCSCC(=O)N 62a_100000747473_100000210320 [1,1,0,0,0,0|1,0,0]=3 11299 B14R0.394 CCCCCCCCCCSCC(=O)[O-] 62a_100020667443_100000210320 [1,1,0,0,0,0|1,0,0]=3 11300 B14R0.394 CCCCCCCCCCSCC(C)C 62a_100000210624_100000210320 [1,1,0,0,0,0|1,0,1]=4 11301 B14R0.394 CCCCCCCCCCSCC(C)O 62a_100011218427_100000210320 [1,1,0,0,0,0|1,0,1]=4 11302 B14R0.394 CCCCCCCCCCSCC(F)F 62a_100011934356_100000210320 [1,1,0,0,0,0|2,0,0]=4 11303 B14R0.394 CCCCCCCCCCSC[C@@H](C)O 62a_100009817552_100000210320 [1,1,0,0,0,0|1,0,1]=4 11304 B14R0.394 CCCCCCCCCNCCC(=O)N 2230a_100000212291_100000744528 [1,1,0,0,0,0|1,0,0]=3 11305 B14R0.394 CCCCCCCCCNCCC(=O)N 34a_100000212291_100000731001 [1,1,0,0,0,0|1,0,0]=3 11306 B14R0.394 CCCCCCCCCNCCC(C)C 2230a_100000212291_100000210312 [1,1,0,0,0,0|1,0,1]=4 11307 B14R0.394 CCCCCCCCCNCCC(C)C 269862a_100000212291_100000185833 [1,1,0,0,0,0|1,0,1]=4 11308 B14R0.394 CCCCCCCCCNCCC(C)C 34a_100000212291_100000210312 [1,1,0,0,0,0|1,0,1]=4 11309 B14R0.394 CCCCCCCCCNCCC(C)O 2230a_100000212291_100012276601 [1,1,0,0,0,0|1,0,1]=4 11310 B14R0.394 CCCCCCCCCNCCC(C)O 2230a_200000755665_100011214924 [1,1,0,0,0,0|1,0,1]=4 11311 B14R0.394 CCCCCCCCCNCCC(C)O 34a_100000212291_100012276601 [1,1,0,0,0,0|1,0,1]=4 11312 B14R0.394 CCCCCCCCCNCOC(=O)C 34a_100000212291_100009813279 [1,1,0,0,0,0|2,0,0]=4 11313 B14R0.394 CCCCCCCCCNOCC(=O)O 269956a_100000106656_100000210670 [1,1,0,0,0,0|2,0,0]=4 11314 B14R0.394 CCCCCCCCCOCCC(=O)C 34a_100000759926_100011214924 [1,1,0,0,0,0|1,0,0]=3 11315 B14R0.394 CCCCCCCCCOCCC(=O)C 7a_100000210712_100000053229 [1,1,0,0,0,0|1,0,0]=3 11316 B14R0.394 CCCCCCCCCOCCC(=O)C 7a_100000759926_100000210328 [1,1,0,0,0,0|1,0,0]=3 11317 B14R0.394 CCCCCCCCCOCCC(=O)N 34a_100000210712_100000731001 [1,1,0,0,0,0|1,0,0]=3 11318 B14R0.394 CCCCCCCCCOCCC(=O)N 34a_100000757172_100011214924 [1,1,0,0,0,0|1,0,0]=3 11319 B14R0.394 CCCCCCCCCOCCC(=O)N 7a_100000210712_100000744528 [1,1,0,0,0,0|1,0,0]=3 11320 B14R0.394 CCCCCCCCCOCCC(=O)N 7a_100000757172_100000210328 [1,1,0,0,0,0|1,0,0]=3 11321 B14R0.394 CCCCCCCCCOCCC(C)Br 34a_100009893172_100011214924 [1,1,0,0,0,0|1,0,1]=4 11322 B14R0.394 CCCCCCCCCOCCC(C)C 34a_100000210254_100011214924 [1,1,0,0,0,0|1,0,1]=4 11323 B14R0.394 CCCCCCCCCOCCC(C)C 34a_100000210712_100000210312 [1,1,0,0,0,0|1,0,1]=4 11324 B14R0.394 CCCCCCCCCOCCC(C)C 7a_100000210254_100000210328 [1,1,0,0,0,0|1,0,1]=4 11325 B14R0.394 CCCCCCCCCOCCC(C)C 7a_100000210712_100000210626 [1,1,0,0,0,0|1,0,1]=4 11326 B14R0.394 CCCCCCCCCOCCC(C)O 34a_100000210712_100012276601 [1,1,0,0,0,0|1,0,1]=4 11327 B14R0.394 CCCCCCCCCOCCC(C)O 7a_100000210712_100012276601 [1,1,0,0,0,0|1,0,1]=4 11328 B14R0.394 CCCCCCCCCOCCC(F)F 34a_100103093639_100011214924 [1,1,0,0,0,0|2,0,0]=4 11329 B14R0.394 CCCCCCCCCOCC[C@@H](C)N 34a_100000706166_100011214924 [1,1,0,0,0,0|1,0,1]=4 11330 B14R0.394 CCCCCCCCCOCOC(=O)C 34a_100000210712_100009813279 [1,1,0,0,0,0|2,0,0]=4 11331 B14R0.394 CCCCCCCCCSCCC(=O)C 62a_100000053229_100000210670 [1,1,0,0,0,0|1,0,0]=3 11332 B14R0.394 CCCCCCCCCSCCC(=O)N 62a_100000744528_100000210670 [1,1,0,0,0,0|1,0,0]=3 11333 B14R0.394 CCCCCCCCCSCCC(C)C 62a_100000210312_100000210670 [1,1,0,0,0,0|1,0,1]=4 11334 B14R0.394 CCCCCCCCCSCCC(C)O 62a_100012276601_100000210670 [1,1,0,0,0,0|1,0,1]=4 11335 B14R0.394 CCCCCCCCCSCOC(=O)C 62a_100000076356_100000210670 [1,1,0,0,0,0|2,0,0]=4 11336 B14R0.394 CCCCCCCCNCCCC(=O)C 34a_100000229939_100000685027 [1,1,0,0,0,0|1,0,0]=3 11337 B14R0.394 CCCCCCCCNCCCC(=O)N 34a_100000229939_100102525003 [1,1,0,0,0,0|1,0,0]=3 11338 B14R0.394 CCCCCCCCNCCCC(=O)N 34a_100000739312_100000210759 [1,1,0,0,0,0|1,0,0]=3 11339 B14R0.394 CCCCCCCCNCCCC(C)C 2230a_100000229939_100011214892 [1,1,0,0,0,0|1,0,1]=4 11340 B14R0.394 CCCCCCCCNCCCC(C)C 2230a_200000737386_100000210759 [1,1,0,0,0,0|1,0,1]=4 11341 B14R0.394 CCCCCCCCNCCCC(C)C 34a_100000229939_100011214892 [1,1,0,0,0,0|1,0,1]=4 11342 B14R0.394 CCCCCCCCNCCCC(C)C 34a_200000737386_100000210759 [1,1,0,0,0,0|1,0,1]=4 11343 B14R0.394 CCCCCCCCNCCCC(C)O 2230a_100000229939_200000718107 [1,1,0,0,0,0|1,0,1]=4 11344 B14R0.394 CCCCCCCCNCCCC(C)O 34a_100000229939_200000718107 [1,1,0,0,0,0|1,0,1]=4 11345 B14R0.394 CCCCCCCCNCCCS(=O)C 2230a_200000753449_100000210759 [1,1,0,0,0,0|2,0,0]=4 11346 B14R0.394 CCCCCCCCNCCNC(=O)C 2230a_100000209853_100000210759 [1,1,0,0,0,0|2,0,0]=4 11347 B14R0.394 CCCCCCCCNCCNC(=O)C 2230a_100000229939_100000189650 [1,1,0,0,0,0|2,0,0]=4 11348 B14R0.394 CCCCCCCCNCCNC(=O)N 2230a_100000229939_200000034859 [1,1,0,0,0,0|2,0,0]=4 11349 B14R0.394 CCCCCCCCNCCNC(=O)N 34a_100020590234_100000210759 [1,1,0,0,0,0|2,0,0]=4 11350 B14R0.394 CCCCCCCCNCCOC(=O)C 34a_100000229939_100009814007 [1,1,0,0,0,0|2,0,0]=4 11351 B14R0.394 CCCCCCCCNCCOC(=O)N 34a_100000229939_200011214921 [1,1,0,0,0,0|2,0,0]=4 11352 B14R0.394 CCCCCCCCOCCCC(=O)C 34a_100000210232_100000685027 [1,1,0,0,0,0|1,0,0]=3 11353 B14R0.394 CCCCCCCCOCCCC(=O)C 34a_100000759063_100000210759 [1,1,0,0,0,0|1,0,0]=3 11354 B14R0.394 CCCCCCCCOCCCC(=O)C 7a_100000210232_100011215641 [1,1,0,0,0,0|1,0,0]=3 11355 B14R0.394 CCCCCCCCOCCCC(=O)C 7a_100000759063_100000210759 [1,1,0,0,0,0|1,0,0]=3 11356 B14R0.394 CCCCCCCCOCCCC(=O)N 34a_100000210232_100102525003 [1,1,0,0,0,0|1,0,0]=3 11357 B14R0.394 CCCCCCCCOCCCC(=O)N 7a_100000210232_100102525003 [1,1,0,0,0,0|1,0,0]=3 11358 B14R0.394 CCCCCCCCOCCCC(C)C 34a_100000210232_100011214892 [1,1,0,0,0,0|1,0,1]=4 11359 B14R0.394 CCCCCCCCOCCCC(C)C 34a_100000210774_100000210759 [1,1,0,0,0,0|1,0,1]=4 11360 B14R0.394 CCCCCCCCOCCCC(C)C 7a_100000210232_100011214892 [1,1,0,0,0,0|1,0,1]=4 11361 B14R0.394 CCCCCCCCOCCCC(C)C 7a_100000210774_100000210759 [1,1,0,0,0,0|1,0,1]=4 11362 B14R0.394 CCCCCCCCOCCCC(C)O 34a_100000210232_200000718107 [1,1,0,0,0,0|1,0,1]=4 11363 B14R0.394 CCCCCCCCOCCCC(C)O 7a_100000210232_200000718107 [1,1,0,0,0,0|1,0,1]=4 11364 B14R0.394 CCCCCCCCOCCC[N+](=O)[O-] 34a_200000037920_100000210759 [1,1,0,0,0,0|2,0,0]=4 11365 B14R0.394 CCCCCCCCOCCNC(=O)C 34a_100000158858_100000210759 [1,1,0,0,0,0|2,0,0]=4 11366 B14R0.394 CCCCCCCCOCCNC(=O)C 7a_100000210232_100000189650 [1,1,0,0,0,0|2,0,0]=4 11367 B14R0.394 CCCCCCCCOCCNC(=O)N 34a_100000181757_100000210759 [1,1,0,0,0,0|2,0,0]=4 11368 B14R0.394 CCCCCCCCOCCNC(=O)N 7a_100000210232_200000034859 [1,1,0,0,0,0|2,0,0]=4 11369 B14R0.394 CCCCCCCCOCCOC(=O)C 34a_100000210232_100009814007 [1,1,0,0,0,0|2,0,0]=4 11370 B14R0.394 CCCCCCCCOCCOC(=O)C 7a_100000210232_100009814007 [1,1,0,0,0,0|2,0,0]=4 11371 B14R0.394 CCCCCCCCOCCOC(=O)N 34a_100000210232_200011214921 [1,1,0,0,0,0|2,0,0]=4 11372 B14R0.394 CCCCCCCCOCCOC(=O)N 7a_100000210232_200011214921 [1,1,0,0,0,0|2,0,0]=4 11373 B14R0.394 CCCCCCCCOCCOC(=O)N 7a_100000766696_100000210759 [1,1,0,0,0,0|2,0,0]=4 11374 B14R0.394 CCCCCCCCSCCCC(=O)C 62a_100000210759_100011215641 [1,1,0,0,0,0|1,0,0]=3 11375 B14R0.394 CCCCCCCCSCCCC(=O)C 62a_100011215641_100000210317 [1,1,0,0,0,0|1,0,0]=3 11376 B14R0.394 CCCCCCCCSCCCC(=O)N 62a_100000210759_100102525003 [1,1,0,0,0,0|1,0,0]=3 11377 B14R0.394 CCCCCCCCSCCCC(=O)N 62a_100102525003_100000210317 [1,1,0,0,0,0|1,0,0]=3 11378 B14R0.394 CCCCCCCCSCCCC(C)C 62a_100000210759_100011214892 [1,1,0,0,0,0|1,0,1]=4 11379 B14R0.394 CCCCCCCCSCCCC(C)C 62a_100011214892_100000210317 [1,1,0,0,0,0|1,0,1]=4 11380 B14R0.394 CCCCCCCCSCCCC(C)O 62a_100000210759_200000718107 [1,1,0,0,0,0|1,0,1]=4 11381 B14R0.394 CCCCCCCCSCCCC(C)O 62a_200000718107_100000210317 [1,1,0,0,0,0|1,0,1]=4 11382 B14R0.394 CCCCCCCCSCCNC(=O)C 62a_100000189650_100000210317 [1,1,0,0,0,0|2,0,0]=4 11383 B14R0.394 CCCCCCCCSCCNC(=O)C 62a_100000210759_100000189650 [1,1,0,0,0,0|2,0,0]=4 11384 B14R0.394 CCCCCCCCSCCNC(=O)N 62a_100000210759_200000034859 [1,1,0,0,0,0|2,0,0]=4 11385 B14R0.394 CCCCCCCCSCCNC(=O)N 62a_200000034859_100000210317 [1,1,0,0,0,0|2,0,0]=4 11386 B14R0.394 CCCCCCCCSCCOC(=O)C 62a_100000210759_100009814007 [1,1,0,0,0,0|2,0,0]=4 11387 B14R0.394 CCCCCCCCSCCOC(=O)C 62a_100009814007_100000210317 [1,1,0,0,0,0|2,0,0]=4 11388 B14R0.394 CCCCCCCCSCCOC(=O)N 62a_100000210759_200011214921 [1,1,0,0,0,0|2,0,0]=4 11389 B14R0.394 CCCCCCCCSCCOC(=O)N 62a_200011214921_100000210317 [1,1,0,0,0,0|2,0,0]=4 11390 B14R0.394 CCCCCCCNCCCCC(=O)N 34a_100000696515_100000210614 [1,1,0,0,0,0|1,0,0]=3 11391 B14R0.394 CCCCCCCNCCCCC(C)C 2230a_100000229938_100011216152 [1,1,0,0,0,0|1,0,1]=4 11392 B14R0.394 CCCCCCCNCCCNC(=O)C 34a_100000736810_100000210614 [1,1,0,0,0,0|2,0,0]=4 11393 B14R0.394 CCCCCCCNCCCSC(=O)C 2230a_100000229938_100000038929 [1,1,0,0,0,0|2,0,0]=4 11394 B14R0.394 CCCCCCCNCCOCC(=O)N 2230a_100000229938_100000076697 [1,1,0,0,0,0|2,0,0]=4 11395 B14R0.394 CCCCCCCNCCOCC(=O)O 269956a_100000700818_100000210614 [1,1,0,0,0,0|2,0,0]=4 11396 B14R0.394 CCCCCCCOCCCCC(=O)C 34a_100000210272_100009817362 [1,1,0,0,0,0|1,0,0]=3 11397 B14R0.394 CCCCCCCOCCCCC(=O)C 7a_100000210272_100000735457 [1,1,0,0,0,0|1,0,0]=3 11398 B14R0.394 CCCCCCCOCCCCC(=O)N 34a_100012022536_100000210614 [1,1,0,0,0,0|1,0,0]=3 11399 B14R0.394 CCCCCCCOCCCCC(=O)N 7a_100012022536_100000210614 [1,1,0,0,0,0|1,0,0]=3 11400 B14R0.394 CCCCCCCOCCCCC(C)C 34a_100000210272_100011216152 [1,1,0,0,0,0|1,0,1]=4 11401 B14R0.394 CCCCCCCOCCCCC(C)C 34a_100011214890_100000210614 [1,1,0,0,0,0|1,0,1]=4 11402 B14R0.394 CCCCCCCOCCCCC(C)C 7a_100000210272_100011216152 [1,1,0,0,0,0|1,0,1]=4 11403 B14R0.394 CCCCCCCOCCCCC(C)C 7a_100011214890_100000210614 [1,1,0,0,0,0|1,0,1]=4 11404 B14R0.394 CCCCCCCOCCCC[N+](=O)[O-] 34a_200015379883_100000210614 [1,1,0,0,0,0|2,0,0]=4 11405 B14R0.394 CCCCCCCOCCCC[N+](=O)[O-] 7a_200015379883_100000210614 [1,1,0,0,0,0|2,0,0]=4 11406 B14R0.394 CCCCCCCOCCCNC(=O)C 34a_100000752032_100000210614 [1,1,0,0,0,0|2,0,0]=4 11407 B14R0.394 CCCCCCCOCCCOC(=O)C 34a_100000210272_100000042594 [1,1,0,0,0,0|2,0,0]=4 11408 B14R0.394 CCCCCCCOCCCOC(=O)C 7a_100000210272_100000042594 [1,1,0,0,0,0|2,0,0]=4 11409 B14R0.394 CCCCCCCOCCCSC(=O)C 34a_100000210272_100000038929 [1,1,0,0,0,0|2,0,0]=4 11410 B14R0.394 CCCCCCCOCCCSC(=O)C 7a_100000210272_100000038929 [1,1,0,0,0,0|2,0,0]=4 11411 B14R0.394 CCCCCCCOCCOCC(=O)N 34a_100000210272_100000076697 [1,1,0,0,0,0|2,0,0]=4 11412 B14R0.394 CCCCCCCOCCOCC(=O)N 7a_100000210272_100000076697 [1,1,0,0,0,0|2,0,0]=4 11413 B14R0.394 CCCCCCCSCCCCC(=O)C 62a_100000210614_100000735457 [1,1,0,0,0,0|1,0,0]=3 11414 B14R0.394 CCCCCCCSCCCCC(=O)C 62a_100000735457_100000210316 [1,1,0,0,0,0|1,0,0]=3 11415 B14R0.394 CCCCCCCSCCCCC(C)C 62a_100000210614_100011216152 [1,1,0,0,0,0|1,0,1]=4 11416 B14R0.394 CCCCCCCSCCCCC(C)C 62a_100011216152_100000210316 [1,1,0,0,0,0|1,0,1]=4 11417 B14R0.394 CCCCCCCSCCCOC(=O)C 62a_100000042594_100000210316 [1,1,0,0,0,0|2,0,0]=4 11418 B14R0.394 CCCCCCCSCCCOC(=O)C 62a_100000210614_100000042594 [1,1,0,0,0,0|2,0,0]=4 11419 B14R0.394 CCCCCCCSCCCSC(=O)C 62a_100000038929_100000210316 [1,1,0,0,0,0|2,0,0]=4 11420 B14R0.394 CCCCCCCSCCCSC(=O)C 62a_100000210614_100000038929 [1,1,0,0,0,0|2,0,0]=4 11421 B14R0.394 CCCCCCCSCCOCC(=O)N 62a_100000076697_100000210316 [1,1,0,0,0,0|2,0,0]=4 11422 B14R0.394 CCCCCCCSCCOCC(=O)N 62a_100000210614_100000076697 [1,1,0,0,0,0|2,0,0]=4 11423 B14R0.394 CCCCCCNCCCCCC(=O)N 2230a_100000210581_100009817443 [1,1,0,0,0,0|1,0,0]=3 11424 B14R0.394 CCCCCCNCCCCCC(C)C 2230a_100000210581_100000210682 [1,1,0,0,0,0|1,0,1]=4 11425 B14R0.394 CCCCCCNCCCCCC(C)C 2230a_100011290863_100000210314 [1,1,0,0,0,0|1,0,1]=4 11426 B14R0.394 CCCCCCNCCCCCC(C)C 34a_100011290863_100000210314 [1,1,0,0,0,0|1,0,1]=4 11427 B14R0.394 CCCCCCNCCCCNC(=O)C 2230a_200011368371_100000210314 [1,1,0,0,0,0|2,0,0]=4 11428 B14R0.394 CCCCCCNCCCCNC(=O)C 34a_200011368371_100000210314 [1,1,0,0,0,0|2,0,0]=4 11429 B14R0.394 CCCCCCNCCCCSC(=O)C 2230a_100000210581_200010402107 [1,1,0,0,0,0|2,0,0]=4 11430 B14R0.394 CCCCCCOCCCCCC(=O)N 34a_100000123541_100000210314 [1,1,0,0,0,0|1,0,0]=3 11431 B14R0.394 CCCCCCOCCCCCC(=O)N 34a_100000210259_100009817443 [1,1,0,0,0,0|1,0,0]=3 11432 B14R0.394 CCCCCCOCCCCCC(=O)N 7a_100000123541_100000210314 [1,1,0,0,0,0|1,0,0]=3 11433 B14R0.394 CCCCCCOCCCCCC(=O)N 7a_100000210259_100009817443 [1,1,0,0,0,0|1,0,0]=3 11434 B14R0.394 CCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210314 [1,1,0,0,0,0|1,0,0]=3 11435 B14R0.394 CCCCCCOCCCCCC(C)C 34a_100000210259_100000210682 [1,1,0,0,0,0|1,0,1]=4 11436 B14R0.394 CCCCCCOCCCCCC(C)C 34a_100011995859_100000210314 [1,1,0,0,0,0|1,0,1]=4 11437 B14R0.394 CCCCCCOCCCCCC(C)C 7a_100000210259_100000210682 [1,1,0,0,0,0|1,0,1]=4 11438 B14R0.394 CCCCCCOCCCCCC(C)C 7a_100011995859_100000210314 [1,1,0,0,0,0|1,0,1]=4 11439 B14R0.394 CCCCCCOCCCCOC(=O)C 34a_100000073216_100000210314 [1,1,0,0,0,0|2,0,0]=4 11440 B14R0.394 CCCCCCOCCCCOC(=O)C 34a_100000210259_100000033659 [1,1,0,0,0,0|2,0,0]=4 11441 B14R0.394 CCCCCCOCCCCOC(=O)C 7a_100000073216_100000210314 [1,1,0,0,0,0|2,0,0]=4 11442 B14R0.394 CCCCCCOCCCCOC(=O)C 7a_100000210259_100000033659 [1,1,0,0,0,0|2,0,0]=4 11443 B14R0.394 CCCCCCOCCCCSC(=O)C 34a_100000210259_200010402107 [1,1,0,0,0,0|2,0,0]=4 11444 B14R0.394 CCCCCCOCCCCSC(=O)C 7a_100000210259_200010402107 [1,1,0,0,0,0|2,0,0]=4 11445 B14R0.394 CCCCCCOCCOCCC(=O)C 7a_100000691444_100000053229 [1,1,0,0,0,0|2,0,0]=4 11446 B14R0.394 CCCCCCOCCOCCC(=O)N 34a_100000691444_100000731001 [1,1,0,0,0,0|2,0,0]=4 11447 B14R0.394 CCCCCCOCCOCCC(=O)N 7a_100000691444_100000744528 [1,1,0,0,0,0|2,0,0]=4 11448 B14R0.394 CCCCCCSCCCCCC(=O)N 62a_100000210314_100009817443 [1,1,0,0,0,0|1,0,0]=3 11449 B14R0.394 CCCCCCSCCCCCC(=O)N 62a_100009817443_100000210757 [1,1,0,0,0,0|1,0,0]=3 11450 B14R0.394 CCCCCCSCCCCCC(C)C 62a_100000210314_100000210682 [1,1,0,0,0,0|1,0,1]=4 11451 B14R0.394 CCCCCCSCCCCCC(C)C 62a_100000210682_100000210757 [1,1,0,0,0,0|1,0,1]=4 11452 B14R0.394 CCCCCCSCCCCOC(=O)C 62a_100000033659_100000210757 [1,1,0,0,0,0|2,0,0]=4 11453 B14R0.394 CCCCCCSCCCCOC(=O)C 62a_100000210314_100000033659 [1,1,0,0,0,0|2,0,0]=4 11454 B14R0.394 CCCCCCSCCCCSC(=O)C 62a_100000210314_200010402107 [1,1,0,0,0,0|2,0,0]=4 11455 B14R0.394 CCCCCCSCCCCSC(=O)C 62a_200010402107_100000210757 [1,1,0,0,0,0|2,0,0]=4 11456 B14R0.394 CCCCCNCCCCCCC(C)C 2230a_100000211014_100000210326 [1,1,0,0,0,0|1,0,1]=4 11457 B14R0.394 CCCCCNCCCCCCC(C)C 34a_100000211014_100000718602 [1,1,0,0,0,0|1,0,1]=4 11458 B14R0.394 CCCCCNCCCCCNC(=O)C 2230a_200012022750_100000210326 [1,1,0,0,0,0|2,0,0]=4 11459 B14R0.394 CCCCCNCCCCCNC(=O)C 34a_200012022750_100000718602 [1,1,0,0,0,0|2,0,0]=4 11460 B14R0.394 CCCCCNCCCCCOC(=O)C 2230a_100000209983_100009813381 [1,1,0,0,0,0|2,0,0]=4 11461 B14R0.394 CCCCCNCCOCCCC(=O)C 34a_100000224656_100000685027 [1,1,0,0,0,0|2,0,0]=4 11462 B14R0.394 CCCCCNCCOCCCC(=O)N 34a_100000224656_100102525003 [1,1,0,0,0,0|2,0,0]=4 11463 B14R0.394 CCCCCOCCCCCOC(=O)C 34a_100000210253_100000033007 [1,1,0,0,0,0|2,0,0]=4 11464 B14R0.394 CCCCCOCCCCCOC(=O)C 7a_100000210253_100000033007 [1,1,0,0,0,0|2,0,0]=4 11465 B14R0.394 CCCCCOCCOCCCC(=O)C 34a_100011215259_100000685027 [1,1,0,0,0,0|2,0,0]=4 11466 B14R0.394 CCCCCOCCOCCCC(=O)C 7a_100011215259_100011215641 [1,1,0,0,0,0|2,0,0]=4 11467 B14R0.394 CCCCCOCCOCCCC(=O)N 34a_100011215259_100102525003 [1,1,0,0,0,0|2,0,0]=4 11468 B14R0.394 CCCCCOCCOCCCC(=O)N 7a_100011215259_100102525003 [1,1,0,0,0,0|2,0,0]=4 11469 B14R0.394 CCCCCSCCCCCOC(=O)C 62a_100000033007_100000210326 [1,1,0,0,0,0|2,0,0]=4 11470 B14R0.394 CCCCCSCCCCCOC(=O)C 62a_100000210326_100000033007 [1,1,0,0,0,0|2,0,0]=4 11471 B14R0.394 CCCCNCCCCCCNC(=O)C 2230a_200011996284_100000210211 [1,1,0,0,0,0|2,0,0]=4 11472 B14R0.394 CCCCNCCCCCCNC(=O)C 34a_200011996284_100000210210 [1,1,0,0,0,0|2,0,0]=4 11473 B14R0.394 CCCCNCCCCOCCC(=O)N 34a_200011216965_100000731001 [1,1,0,0,0,0|2,0,0]=4 11474 B14R0.394 CCCCOCCCCCCCC(C)C 34a_200000210741_100000210210 [1,1,0,0,0,0|1,0,1]=4 11475 B14R0.394 CCCCOCCCCCCCC(C)C 7a_200000210741_100000210211 [1,1,0,0,0,0|1,0,1]=4 11476 B14R0.394 CCCCOCCCCOCCC(=O)C 7a_200000760531_100000053229 [1,1,0,0,0,0|2,0,0]=4 11477 B14R0.394 CCCCOCCCCOCCC(=O)N 34a_200000760531_100000731001 [1,1,0,0,0,0|2,0,0]=4 11478 B14R0.394 CCCCOCCCCOCCC(=O)N 7a_200000760531_100000744528 [1,1,0,0,0,0|2,0,0]=4 11479 B14R0.394 CCCCOCCCNCCCC(=O)C 34a_200000211371_100000685027 [1,1,0,0,0,0|2,0,0]=4 11480 B14R0.394 CCCCOCCCNCCCC(=O)N 34a_200000211371_100102525003 [1,1,0,0,0,0|2,0,0]=4 11481 B14R0.394 CCCCOCCCOCCCC(=O)C 34a_200011215613_100000685027 [1,1,0,0,0,0|2,0,0]=4 11482 B14R0.394 CCCCOCCCOCCCC(=O)C 7a_200011215613_100011215641 [1,1,0,0,0,0|2,0,0]=4 11483 B14R0.394 CCCCOCCCOCCCC(=O)N 34a_200011215613_100102525003 [1,1,0,0,0,0|2,0,0]=4 11484 B14R0.394 CCCCOCCCOCCCC(=O)N 7a_200011215613_100102525003 [1,1,0,0,0,0|2,0,0]=4 11485 B14R0.394 CCCCOCCNCCCCC(=O)N 34a_100000696515_100000743108 [1,1,0,0,0,0|2,0,0]=4 11486 B14R0.394 CCCCOCCOCCCCC(=O)C 34a_100000210238_100009817362 [1,1,0,0,0,0|2,0,0]=4 11487 B14R0.394 CCCCOCCOCCCCC(=O)C 7a_100000210238_100000735457 [1,1,0,0,0,0|2,0,0]=4 11488 B14R0.394 CCCCOCCOCCCCC(=O)N 34a_100012022536_100000743108 [1,1,0,0,0,0|2,0,0]=4 11489 B14R0.394 CCCCOCCOCCCCC(=O)N 7a_100012022536_100000743108 [1,1,0,0,0,0|2,0,0]=4 11490 B14R0.394 CCCCOCCSCCCCC(=O)C 62a_100000735457_100000743108 [1,1,0,0,0,0|2,0,0]=4 11491 B14R0.394 CCCCOCCSCCCCC(=O)C 62a_100000743108_100000735457 [1,1,0,0,0,0|2,0,0]=4 11492 B14R0.394 CCCCOCOCCCCCC(=O)N 34a_100000123541_100011995733 [1,1,0,0,0,0|2,0,0]=4 11493 B14R0.394 CCCCOCSCCCCCC(=O)N 62a_100009817443_100011995733 [1,1,0,0,0,0|2,0,0]=4 11494 B14R0.394 CCCCOCSCCCCCC(=O)N 62a_100011995733_100009817443 [1,1,0,0,0,0|2,0,0]=4 11495 B14R0.394 CCCCSCCOCCCCC(=O)C 34a_200000230436_100009817362 [1,1,0,0,0,0|2,0,0]=4 11496 B14R0.394 CCCCSCCOCCCCC(=O)C 7a_200000230436_100000735457 [1,1,0,0,0,0|2,0,0]=4 11497 B14R0.394 CCCOCCCNCCCCC(=O)C 34a_100011217757_100009817362 [1,1,0,0,0,0|2,0,0]=4 11498 B14R0.394 CCCOCCNCCCCCC(=O)N 2230a_100161115042_100009817443 [1,1,0,0,0,0|2,0,0]=4 11499 B14R0.394 CCCOCCNCCCCCC(=O)N 34a_100161115042_100009817443 [1,1,0,0,0,0|2,0,0]=4 11500 B14R0.394 CCCOCCOCCCCCC(=O)N 34a_100000123541_100011215938 [1,1,0,0,0,0|2,0,0]=4 11501 B14R0.394 CCCOCCOCCCCCC(=O)N 34a_100000752267_100009817443 [1,1,0,0,0,0|2,0,0]=4 11502 B14R0.394 CCCOCCOCCCCCC(=O)N 7a_100000123541_100011215938 [1,1,0,0,0,0|2,0,0]=4 11503 B14R0.394 CCCOCCOCCCCCC(=O)N 7a_100000752267_100009817443 [1,1,0,0,0,0|2,0,0]=4 11504 B14R0.394 CCCOCCOCCCCCC(=O)[O-] 7a_100102619762_100011215938 [1,1,0,0,0,0|2,0,0]=4 11505 B14R0.394 CCCOCCSCCCCCC(=O)N 62a_100009817443_100011215938 [1,1,0,0,0,0|2,0,0]=4 11506 B14R0.394 CCCOCCSCCCCCC(=O)N 62a_100011215938_100009817443 [1,1,0,0,0,0|2,0,0]=4 11507 B14R0.394 CCCSCCNCCCCCC(=O)N 2230a_100020603323_100009817443 [1,1,0,0,0,0|2,0,0]=4 11508 B14R0.394 CCCSCCOCCCCCC(=O)N 34a_200000230433_100009817443 [1,1,0,0,0,0|2,0,0]=4 11509 B14R0.394 CCCSCCOCCCCCC(=O)N 7a_200000230433_100009817443 [1,1,0,0,0,0|2,0,0]=4 11510 B14R0.394 CCOCCCNCCCCCC(=O)N 2230a_100000210961_100009817443 [1,1,0,0,0,0|2,0,0]=4 11511 B14R0.394 CCOCCCNCCCCCC(=O)N 34a_100000210961_100009817443 [1,1,0,0,0,0|2,0,0]=4 11512 B14R0.394 CCOCCCOCCCCCC(=O)N 34a_100000123541_100012232248 [1,1,0,0,0,0|2,0,0]=4 11513 B14R0.394 CCOCCCOCCCCCC(=O)N 34a_100000757476_100009817443 [1,1,0,0,0,0|2,0,0]=4 11514 B14R0.394 CCOCCCOCCCCCC(=O)N 7a_100000123541_100012232248 [1,1,0,0,0,0|2,0,0]=4 11515 B14R0.394 CCOCCCOCCCCCC(=O)N 7a_100000757476_100009817443 [1,1,0,0,0,0|2,0,0]=4 11516 B14R0.394 CCOCCCOCCCCCC(=O)[O-] 7a_100102619762_100012232248 [1,1,0,0,0,0|2,0,0]=4 11517 B14R0.394 CCOCCCSCCCCCC(=O)N 62a_100009817443_100012232248 [1,1,0,0,0,0|2,0,0]=4 11518 B14R0.394 CCOCCCSCCCCCC(=O)N 62a_100012232248_100009817443 [1,1,0,0,0,0|2,0,0]=4 11519 B14R0.394 CCSCCCOCCCCCC(=O)N 34a_100011216438_100009817443 [1,1,0,0,0,0|2,0,0]=4 11520 B14R0.394 CCSCCCOCCCCCC(=O)N 7a_100011216438_100009817443 [1,1,0,0,0,0|2,0,0]=4 11521 B14R0.394 CN(C)CCCCCCCCCCCO 2230a_100102631434_100009812471 [1,1,0,0,0,0|1,0,1]=4 11522 B14R0.394 CN(C)CCCCCCCCCCCO 269982a_100102631434_100009812471 [1,1,0,0,0,0|1,0,1]=4 11523 B14R0.394 CN(C)CCCCSCCCCCC=O 62a_100000139337_100000690147 [1,1,0,0,0,0|2,0,0]=4 11524 B14R0.394 CNCCCCCCCCCCC(=O)N 2230a_106832991635_200010167045 [1,1,0,0,0,0|1,0,0]=3 11525 B14R0.394 CNCCCCCCCCCCC(=O)N 34a_100102657272_200010167045 [1,1,0,0,0,0|1,0,0]=3 11526 B14R0.394 CNCCCCCCCCCCC(=O)N 7a_106832991635_200010167045 [1,1,0,0,0,0|1,0,0]=3 11527 B14R0.394 CNCCCCCOCCCCC(=O)C 34a_100000722520_100009817362 [1,1,0,0,0,0|2,0,0]=4 11528 B14R0.394 COCCCCCCCCCCC(=O)N 34a_100138415774_200010167045 [1,1,0,0,0,0|1,0,0]=3 11529 B14R0.394 COCCCCCCNCCCC(=O)N 34a_100000739312_100011998445 [1,1,0,0,0,0|2,0,0]=4 11530 B14R0.394 COCCCCCCOCCCC(=O)C 34a_100000759063_100011998445 [1,1,0,0,0,0|2,0,0]=4 11531 B14R0.394 COCCCCCCOCCCC(=O)C 34a_200012092642_100000685027 [1,1,0,0,0,0|2,0,0]=4 11532 B14R0.394 COCCCCCCOCCCC(=O)C 7a_100000759063_100011998445 [1,1,0,0,0,0|2,0,0]=4 11533 B14R0.394 COCCCCCCOCCCC(=O)C 7a_200012092642_100011215641 [1,1,0,0,0,0|2,0,0]=4 11534 B14R0.394 COCCCCCCOCCCC(=O)N 34a_200012092642_100102525003 [1,1,0,0,0,0|2,0,0]=4 11535 B14R0.394 COCCCCCCOCCCC(=O)N 7a_200012092642_100102525003 [1,1,0,0,0,0|2,0,0]=4 11536 B14R0.394 COCCCCCCSCCCC(=O)C 62a_100011215641_100011998445 [1,1,0,0,0,0|2,0,0]=4 11537 B14R0.394 COCCCCCCSCCCC(=O)C 62a_100011998445_100011215641 [1,1,0,0,0,0|2,0,0]=4 11538 B14R0.394 COCCCCCCSCCCC(=O)N 62a_100011998445_100102525003 [1,1,0,0,0,0|2,0,0]=4 11539 B14R0.394 COCCCCCCSCCCC(=O)N 62a_100102525003_100011998445 [1,1,0,0,0,0|2,0,0]=4 11540 B14R0.394 COCCCCCNCCCCC(=O)C 34a_100000747528_100009817362 [1,1,0,0,0,0|2,0,0]=4 11541 B14R0.394 COCCCCOCCCCCC(=O)N 34a_100000123541_100000755781 [1,1,0,0,0,0|2,0,0]=4 11542 B14R0.394 COCCCCOCCCCCC(=O)N 34a_100000740925_100009817443 [1,1,0,0,0,0|2,0,0]=4 11543 B14R0.394 COCCCCOCCCCCC(=O)N 7a_100000123541_100000730899 [1,1,0,0,0,0|2,0,0]=4 11544 B14R0.394 COCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000730899 [1,1,0,0,0,0|2,0,0]=4 11545 B14R0.394 COCCCCSCCCCCC(=O)N 62a_100000730899_100009817443 [1,1,0,0,0,0|2,0,0]=4 11546 B14R0.394 COCCCCSCCCCCC(=O)N 62a_100009817443_100000730899 [1,1,0,0,0,0|2,0,0]=4 11547 B14R0.394 CSCCCCCCCCCCC(=O)N 62a_200000210301_200010167045 [1,1,0,0,0,0|1,0,0]=3 11548 B14R0.394 CSCCCCCCCCCCC(=O)N 62a_200010167045_200000210301 [1,1,0,0,0,0|1,0,0]=3 11549 B14R0.394 CSCCCCOCCCCCC(=O)N 34a_100011217163_100009817443 [1,1,0,0,0,0|2,0,0]=4 11550 B14R0.394 CSCCCCOCCCCCC(=O)N 7a_100011217163_100009817443 [1,1,0,0,0,0|2,0,0]=4 11551 B14R0.394 C[C@@H](Cl)COCCCCCCCCCO 34a_100016084084_100009813782 [1,1,0,0,0,0|1,0,1]=4 11552 B14R0.394 C[C@@H](N)CCOCCCCCCCCO 34a_100000706166_100000033203 [1,1,0,0,0,0|1,0,1]=4 11553 B14R0.394 C[C@@H](N)COCCCCCCCCCO 34a_100000737577_100009813782 [1,1,0,0,0,0|1,0,1]=4 11554 B14R0.394 C[C@@H](O)CNCCCCCCCCCO 2230a_100000078944_100009817552 [1,1,0,0,0,0|1,0,1]=4 11555 B14R0.394 C[C@@H](O)CNCCCCCCCCCO 34a_100000078944_100009817552 [1,1,0,0,0,0|1,0,1]=4 11556 B14R0.394 C[C@@H](O)COCCCCCCCCCBr 34a_100009813782_100009817552 [1,1,0,0,0,0|2,0,0]=4 11557 B14R0.394 C[C@@H](O)COCCCCCCCCCBr 7a_100009813782_100009817552 [1,1,0,0,0,0|2,0,0]=4 11558 B14R0.394 C[C@@H](O)COCCCCCCCCCCl 34a_100009868337_100009817552 [1,1,0,0,0,0|2,0,0]=4 11559 B14R0.394 C[C@@H](O)COCCCCCCCCCCl 7a_100009868337_100009817552 [1,1,0,0,0,0|2,0,0]=4 11560 B14R0.394 C[C@@H](O)COCCCCCCCCCN 34a_100000078944_100009817552 [1,1,0,0,0,0|2,0,0]=4 11561 B14R0.394 C[C@@H](O)CSCCCCCCCCCO 62a_100009813782_100009817552 [1,1,0,0,0,0|1,0,1]=4 11562 B14R0.394 C[C@@H](O)CSCCCCCCCCCO 62a_100009817552_100009813782 [1,1,0,0,0,0|1,0,1]=4 11563 B14R0.394 NC(=O)CCCCCNCCCCCO 2230a_100000762737_100009817443 [1,1,0,0,0,0|2,0,0]=4 11564 B14R0.394 NC(=O)CCCCCNCCCCCO 34a_100000762737_100009817443 [1,1,0,0,0,0|2,0,0]=4 11565 B14R0.394 NC(=O)CCCCCOCCCCCBr 34a_100000746331_100009817443 [1,1,0,0,0,0|2,0,0]=4 11566 B14R0.394 NC(=O)CCCCCOCCCCCBr 7a_100000746331_100009817443 [1,1,0,0,0,0|2,0,0]=4 11567 B14R0.394 NC(=O)CCCCCOCCCCCCl 34a_100000746330_100009817443 [1,1,0,0,0,0|2,0,0]=4 11568 B14R0.394 NC(=O)CCCCCOCCCCCCl 7a_100000746330_100009817443 [1,1,0,0,0,0|2,0,0]=4 11569 B14R0.394 NC(=O)CCCCCOCCCCCF 34a_100000123541_100000729378 [1,1,0,0,0,0|2,0,0]=4 11570 B14R0.394 NC(=O)CCCCCOCCCCCF 7a_100000123541_100000729378 [1,1,0,0,0,0|2,0,0]=4 11571 B14R0.394 NC(=O)CCCCCOCCCCCI 34a_200012148887_100009817443 [1,1,0,0,0,0|2,0,0]=4 11572 B14R0.394 NC(=O)CCCCCOCCCCCI 7a_200012148887_100009817443 [1,1,0,0,0,0|2,0,0]=4 11573 B14R0.394 NC(=O)CCCCCOCCCCCO 34a_100000123541_100000746330 [1,1,0,0,0,0|2,0,0]=4 11574 B14R0.394 NC(=O)CCCCCOCCCCCO 7a_100000123541_100000746330 [1,1,0,0,0,0|2,0,0]=4 11575 B14R0.394 NC(=O)CCCCCSCCCCCF 62a_100000729378_100009817443 [1,1,0,0,0,0|2,0,0]=4 11576 B14R0.394 NC(=O)CCCCCSCCCCCF 62a_100009817443_100000729378 [1,1,0,0,0,0|2,0,0]=4 11577 B14R0.394 NC(=O)CCCCCSCCCCCO 62a_100000746330_100009817443 [1,1,0,0,0,0|2,0,0]=4 11578 B14R0.394 NC(=O)CCCCCSCCCCCO 62a_100009817443_100000746330 [1,1,0,0,0,0|2,0,0]=4 11579 B14R0.394 NC(=O)CCCCNCCCCCCF 34a_100000696515_100015922095 [1,1,0,0,0,0|2,0,0]=4 11580 B14R0.394 NC(=O)CCCCNCCCCCCO 34a_100000696515_100000766143 [1,1,0,0,0,0|2,0,0]=4 11581 B14R0.394 NC(=O)CCCCOCCCCCCF 34a_100012022536_100015922095 [1,1,0,0,0,0|2,0,0]=4 11582 B14R0.394 NC(=O)CCCCOCCCCCCF 7a_100012022536_100015922095 [1,1,0,0,0,0|2,0,0]=4 11583 B14R0.394 NC(=O)CCCCOCCCCCCO 34a_100012022536_100000766143 [1,1,0,0,0,0|2,0,0]=4 11584 B14R0.394 NC(=O)CCCCOCCCCCCO 7a_100012022536_100000766143 [1,1,0,0,0,0|2,0,0]=4 11585 B14R0.394 NC(=O)CCCNCCCCCCCO 34a_100000739312_100000760002 [1,1,0,0,0,0|2,0,0]=4 11586 B14R0.394 NC(=O)CCCNCCCCCCCO 34a_100011996573_100102525003 [1,1,0,0,0,0|2,0,0]=4 11587 B14R0.394 NC(=O)CCCOCCCCCCCBr 34a_100000760002_100102525003 [1,1,0,0,0,0|2,0,0]=4 11588 B14R0.394 NC(=O)CCCOCCCCCCCBr 7a_100000760002_100102525003 [1,1,0,0,0,0|2,0,0]=4 11589 B14R0.394 NC(=O)CCCSCCCCCCCO 62a_100000760002_100102525003 [1,1,0,0,0,0|2,0,0]=4 11590 B14R0.394 NC(=O)CCCSCCCCCCCO 62a_100102525003_100000760002 [1,1,0,0,0,0|2,0,0]=4 11591 B14R0.394 NC(=O)CCNCCCCCCCCO 2230a_102515433106_100000744528 [1,1,0,0,0,0|2,0,0]=4 11592 B14R0.394 NC(=O)CCNCCCCCCCCO 34a_102515433106_100000731001 [1,1,0,0,0,0|2,0,0]=4 11593 B14R0.394 NC(=O)CCOCCCCCCCCBr 34a_100009813846_100000731001 [1,1,0,0,0,0|2,0,0]=4 11594 B14R0.394 NC(=O)CCOCCCCCCCCBr 7a_100009813846_100000744528 [1,1,0,0,0,0|2,0,0]=4 11595 B14R0.394 NC(=O)CCOCCCCCCCCCl 34a_100000033203_100000731001 [1,1,0,0,0,0|2,0,0]=4 11596 B14R0.394 NC(=O)CCOCCCCCCCCCl 7a_100000033203_100000744528 [1,1,0,0,0,0|2,0,0]=4 11597 B14R0.394 NC(=O)CCOCCCCCCCCO 34a_100000757172_100000033203 [1,1,0,0,0,0|2,0,0]=4 11598 B14R0.394 NC(=O)CCOCCCCCCCCO 7a_100000757172_100000033203 [1,1,0,0,0,0|2,0,0]=4 11599 B14R0.394 NC(=O)CCSCCCCCCCCO 62a_100000033203_100000744528 [1,1,0,0,0,0|2,0,0]=4 11600 B14R0.394 NC(=O)CCSCCCCCCCCO 62a_100000744528_100000033203 [1,1,0,0,0,0|2,0,0]=4 11601 B14R0.394 NC(=O)CNCCCCCCCCCO 2230a_100000078944_100000747473 [1,1,0,0,0,0|2,0,0]=4 11602 B14R0.394 NC(=O)CNCCCCCCCCCO 2230a_100000711301_100009813782 [1,1,0,0,0,0|2,0,0]=4 11603 B14R0.394 NC(=O)CNCCCCCCCCCO 34a_100000078944_100000187820 [1,1,0,0,0,0|2,0,0]=4 11604 B14R0.394 NC(=O)COCCCCCCCCCBr 34a_100009813782_100000187820 [1,1,0,0,0,0|2,0,0]=4 11605 B14R0.394 NC(=O)COCCCCCCCCCBr 7a_100009813782_100000187820 [1,1,0,0,0,0|2,0,0]=4 11606 B14R0.394 NC(=O)COCCCCCCCCCCl 34a_100009868337_100000187820 [1,1,0,0,0,0|2,0,0]=4 11607 B14R0.394 NC(=O)COCCCCCCCCCCl 7a_100009868337_100000187820 [1,1,0,0,0,0|2,0,0]=4 11608 B14R0.394 NC(=O)CSCCCCCCCCCO 62a_100000747473_100009813782 [1,1,0,0,0,0|2,0,0]=4 11609 B14R0.394 NC(=O)CSCCCCCCCCCO 62a_100009813782_100000747473 [1,1,0,0,0,0|2,0,0]=4 11610 B14R0.394 NCCCCCCCCCOCC(=O)N 34a_100000078944_100000187820 [1,1,0,0,0,0|2,0,0]=4 11611 B14R0.394 NCCCCCCCCCOCC(=O)[O-] 34a_100000078944_100020667443 [1,1,0,0,0,0|2,0,0]=4 11612 B14R0.394 NCCCCCCCCOCCC(=O)N 34a_102515433106_100000731001 [1,1,0,0,0,0|2,0,0]=4 11613 B14R0.394 NCCCCCCCOCCCC(=O)N 34a_100011996573_100102525003 [1,1,0,0,0,0|2,0,0]=4 11614 B14R0.394 NCCCCCOCCCCCC(=O)N 34a_100000762737_100009817443 [1,1,0,0,0,0|2,0,0]=4 11615 B14R0.394 O=C(O)CNCCCCCCCCCO 269956a_100016091260_100009813782 [1,1,0,0,0,0|2,0,0]=4 11616 B14R0.394 O=C([O-])CCCCCOCCCCCF 7a_100102619762_100000729378 [1,1,0,0,0,0|2,0,0]=4 11617 B14R0.394 O=C([O-])CCCCCOCCCCCO 7a_100102619762_100000746330 [1,1,0,0,0,0|2,0,0]=4 11618 B14R0.394 O=C([O-])CNCCCCCCCCCO 34a_100000078944_100020667443 [1,1,0,0,0,0|2,0,0]=4 11619 B14R0.394 O=C([O-])COCCCCCCCCCBr 34a_100009813782_100020667443 [1,1,0,0,0,0|2,0,0]=4 11620 B14R0.394 O=C([O-])COCCCCCCCCCCl 34a_100009868337_100020667443 [1,1,0,0,0,0|2,0,0]=4 11621 B14R0.394 O=C([O-])CSCCCCCCCCCO 62a_100009813782_100020667443 [1,1,0,0,0,0|2,0,0]=4 11622 B14R0.394 O=C([O-])CSCCCCCCCCCO 62a_100020667443_100009813782 [1,1,0,0,0,0|2,0,0]=4 11623 B14R0.394 [13CH3]SCCCCCCCCCCC(=O)N 62a_200010167045_200025704644 [1,1,0,0,0,0|1,0,0]=3 11624 B14R0.394 [13CH3]SCCCCCCCCCCC(=O)N 62a_200025704644_200010167045 [1,1,0,0,0,0|1,0,0]=3 11625 B14R0.493 C=CCCC(=O)CCCCCCCCC 1458a_100000210558_100000754431 [1,1,0,0,0,0|0,0,2]=4 11626 B14R0.493 C=CCCC(=O)CCCCCCCCC 1458a_100000749702_100000210670 [1,1,0,0,0,0|0,0,2]=4 11627 B14R0.493 C=CCCC(C)NCCCCCCCC 270004a_100000229939_100000762624 [1,1,0,0,0,0|1,0,1]=4 11628 B14R0.493 C=CCCC(C)OCCCCCCCC 34a_100000765329_100000210759 [1,1,0,0,0,0|1,0,1]=4 11629 B14R0.493 C=CCCC(C)OCCCCCCCC 7a_100000765329_100000210759 [1,1,0,0,0,0|1,0,1]=4 11630 B14R0.493 C=CCCCCCCCC(=O)CCCC 1458a_100000210183_100012355270 [1,1,0,0,0,0|0,0,2]=4 11631 B14R0.493 C=CCCCCCCCC(=O)CCCC 1458a_100011216160_100000210211 [1,1,0,0,0,0|0,0,2]=4 11632 B14R0.493 C=CCCCCCCCN(C)CCCC 2230a_100000207549_100012355270 [1,1,0,0,0,0|1,0,1]=4 11633 B14R0.493 C=CCCCCCCCN(C)CCCC 269982a_100000207549_100012355270 [1,1,0,0,0,0|1,0,1]=4 11634 B14R0.493 C=CCCCCCCNC(C)CCCC 2230a_100000126638_100011215473 [1,1,0,0,0,0|1,0,1]=4 11635 B14R0.493 C=CCCCCCCOC(C)CCCC 34a_100000687866_100011215473 [1,1,0,0,0,0|1,0,1]=4 11636 B14R0.493 C=CCCCCCCOC(C)CCCC 34a_200011216477_200011215066 [1,1,0,0,0,0|1,0,1]=4 11637 B14R0.493 C=CCCCCCCOC(C)CCCC 7a_100000687866_100011215473 [1,1,0,0,0,0|1,0,1]=4 11638 B14R0.493 C=CCCCCCCOC(C)CCCC 7a_200011216477_200011215066 [1,1,0,0,0,0|1,0,1]=4 11639 B14R0.493 C=CCCCCCCSC(C)CCCC 62a_100011215473_200011215066 [1,1,0,0,0,0|1,0,1]=4 11640 B14R0.493 C=CCCCCCCSC(C)CCCC 62a_200011215066_100011215473 [1,1,0,0,0,0|1,0,1]=4 11641 B14R0.493 C=CCCCCCOCC(C)CCCC 34a_100011995851_100000700193 [1,1,0,0,0,0|1,0,1]=4 11642 B14R0.493 C=CCCCCCOCC(C)CCCC 7a_100011995851_100000700193 [1,1,0,0,0,0|1,0,1]=4 11643 B14R0.493 C=CCCCCCOC[C@@H](N)CCCC 34a_100011934283_100000700193 [1,1,0,0,0,0|1,0,1]=4 11644 B14R0.493 C=CCCN(C)CCCCCCCCC 2230a_100000232482_100000754431 [1,1,0,0,0,0|1,0,1]=4 11645 B14R0.493 C=CCCN(C)CCCCCCCCC 2230a_100020639649_100011214924 [1,1,0,0,0,0|1,0,1]=4 11646 B14R0.493 C=CCCN(C)CCCCCCCCC 269982a_100000232482_100000754431 [1,1,0,0,0,0|1,0,1]=4 11647 B14R0.493 C=CCCN(C)CCCCCCCCC 269982a_100020639649_100000210670 [1,1,0,0,0,0|1,0,1]=4 11648 B14R0.493 C=CCCOCCCCC(C)CCCC 34a_200011021034_100000754431 [1,1,0,0,0,0|1,0,1]=4 11649 B14R0.493 C=CCCOCCCCC(C)CCCC 7a_200011021034_100000754431 [1,1,0,0,0,0|1,0,1]=4 11650 B14R0.493 C=CCNC(C)CCCCCCCCC 270004a_100020586998_100011215753 [1,1,0,0,0,0|1,0,1]=4 11651 B14R0.493 C=CCOC(C)CCCCCCCCC 34a_100011218016_100015514636 [1,1,0,0,0,0|1,0,1]=4 11652 B14R0.493 C=CCOC(C)CCCCCCCCC 7a_100011218016_100015514636 [1,1,0,0,0,0|1,0,1]=4 11653 B14R0.493 CCCCC(=O)CCCCCCCCO 1458a_100000210183_100000033203 [1,1,0,0,0,0|0,0,2]=4 11654 B14R0.493 CCCCC(C)CCCCOCCCF 34a_200011021034_100011934791 [1,1,0,0,0,0|2,0,0]=4 11655 B14R0.493 CCCCC(C)CCCCOCCCF 7a_200011021034_100011934791 [1,1,0,0,0,0|2,0,0]=4 11656 B14R0.493 CCCCC(C)CCCCOCCCO 34a_200011021034_100000230001 [1,1,0,0,0,0|1,0,1]=4 11657 B14R0.493 CCCCC(C)CCCCOCCCO 7a_200011021034_100011215043 [1,1,0,0,0,0|1,0,1]=4 11658 B14R0.493 CCCCC(C)COCCCCCC=O 7a_100011995851_100000139337 [1,1,0,0,0,0|1,0,0]=3 11659 B14R0.493 CCCCC(C)COCCCCCCF 34a_100011995851_100015922095 [1,1,0,0,0,0|2,0,0]=4 11660 B14R0.493 CCCCC(C)COCCCCCCF 7a_100011995851_100015922095 [1,1,0,0,0,0|2,0,0]=4 11661 B14R0.493 CCCCC(C)COCCCCCCO 34a_100011995851_100000766143 [1,1,0,0,0,0|1,0,1]=4 11662 B14R0.493 CCCCC(C)COCCCCCCO 7a_100011995851_100000766143 [1,1,0,0,0,0|1,0,1]=4 11663 B14R0.493 CCCCC(C)NCCCCCCCO 2230a_100000126638_100000760002 [1,1,0,0,0,0|1,0,1]=4 11664 B14R0.493 CCCCC(C)NCCCCCCCO 2230a_100011996573_200011215066 [1,1,0,0,0,0|1,0,1]=4 11665 B14R0.493 CCCCC(C)NCCCCCCCO 270004a_100011996573_100000210087 [1,1,0,0,0,0|1,0,1]=4 11666 B14R0.493 CCCCC(C)NCCCCCCCO 34a_100011996573_200011215066 [1,1,0,0,0,0|1,0,1]=4 11667 B14R0.493 CCCCC(C)OCCCCCCCBr 34a_100000760002_200011215066 [1,1,0,0,0,0|2,0,0]=4 11668 B14R0.493 CCCCC(C)OCCCCCCCBr 7a_100000760002_200011215066 [1,1,0,0,0,0|2,0,0]=4 11669 B14R0.493 CCCCC(C)OCCCCCCCN 34a_100011996573_200011215066 [1,1,0,0,0,0|2,0,0]=4 11670 B14R0.493 CCCCC(C)OCCCCCCCO 34a_100000687866_100000760002 [1,1,0,0,0,0|1,0,1]=4 11671 B14R0.493 CCCCC(C)OCCCCCCCO 7a_100000687866_100000760002 [1,1,0,0,0,0|1,0,1]=4 11672 B14R0.493 CCCCC(C)SCCCCCCCO 62a_100000760002_200011215066 [1,1,0,0,0,0|1,0,1]=4 11673 B14R0.493 CCCCC(C)SCCCCCCCO 62a_200011215066_100000760002 [1,1,0,0,0,0|1,0,1]=4 11674 B14R0.493 CCCCCCCCCC(=O)CCCC 1458a_100000210183_100000210670 [1,1,0,0,0,0|0,0,2]=4 11675 B14R0.493 CCCCCCCCCC(=O)CCCC 1458a_100000210558_100000210211 [1,1,0,0,0,0|0,0,2]=4 11676 B14R0.493 CCCCCCCCCC(=O)CCCF 1458a_100000210558_100011934791 [1,1,0,0,0,0|1,0,1]=4 11677 B14R0.493 CCCCCCCCCC(=O)CCCO 1458a_100000210558_100011215043 [1,1,0,0,0,0|0,0,2]=4 11678 B14R0.493 CCCCCCCCCC(C)CNCC 270004a_100015525214_200011218516 [1,1,0,0,0,0|1,0,1]=4 11679 B14R0.493 CCCCCCCCCC(C)NCCC 270004a_100020643023_100011215753 [1,1,0,0,0,0|1,0,1]=4 11680 B14R0.493 CCCCCCCCCC(C)NCCO 270004a_100000210304_100011215753 [1,1,0,0,0,0|1,0,1]=4 11681 B14R0.493 CCCCCCCCCC(C)OCC=O 34a_100011218016_200009817547 [1,1,0,0,0,0|1,0,0]=3 11682 B14R0.493 CCCCCCCCCC(C)OCC=O 7a_100011218016_200015260668 [1,1,0,0,0,0|1,0,0]=3 11683 B14R0.493 CCCCCCCCCC(C)OCCC 34a_100011218016_100000210303 [1,1,0,0,0,0|1,0,1]=4 11684 B14R0.493 CCCCCCCCCC(C)OCCC 7a_100011218016_100000210303 [1,1,0,0,0,0|1,0,1]=4 11685 B14R0.493 CCCCCCCCCC(C)OCCF 34a_100011218016_100011217306 [1,1,0,0,0,0|2,0,0]=4 11686 B14R0.493 CCCCCCCCCC(C)OCCF 7a_100011218016_100011217306 [1,1,0,0,0,0|2,0,0]=4 11687 B14R0.493 CCCCCCCCCC(C)OCCO 34a_100011218016_100000211926 [1,1,0,0,0,0|1,0,1]=4 11688 B14R0.493 CCCCCCCCCC(C)OCCO 7a_100011218016_100000211926 [1,1,0,0,0,0|1,0,1]=4 11689 B14R0.493 CCCCCCCCCN(C)CCCC 2230a_100000207549_100011214924 [1,1,0,0,0,0|1,0,1]=4 11690 B14R0.493 CCCCCCCCCN(C)CCCC 2230a_100000232482_100000210211 [1,1,0,0,0,0|1,0,1]=4 11691 B14R0.493 CCCCCCCCCN(C)CCCC 269982a_100000207549_100000210670 [1,1,0,0,0,0|1,0,1]=4 11692 B14R0.493 CCCCCCCCCN(C)CCCC 269982a_100000232482_100000210211 [1,1,0,0,0,0|1,0,1]=4 11693 B14R0.493 CCCCCCCCCN(C)CCCF 2230a_100000232482_100011934791 [1,1,0,0,0,0|2,0,0]=4 11694 B14R0.493 CCCCCCCCCN(C)CCCF 269982a_100000232482_100011934791 [1,1,0,0,0,0|2,0,0]=4 11695 B14R0.493 CCCCCCCCCN(C)CCCO 2230a_100000213112_100011214924 [1,1,0,0,0,0|1,0,1]=4 11696 B14R0.493 CCCCCCCCCN(C)CCCO 2230a_100000232482_100000230001 [1,1,0,0,0,0|1,0,1]=4 11697 B14R0.493 CCCCCCCCCN(C)CCCO 269982a_100000213112_100000210670 [1,1,0,0,0,0|1,0,1]=4 11698 B14R0.493 CCCCCCCCCN(C)CCCO 269982a_100000232482_100011215043 [1,1,0,0,0,0|1,0,1]=4 11699 B14R0.493 CCCCCCCCNC(C)CCCC 2230a_100000126638_100000210759 [1,1,0,0,0,0|1,0,1]=4 11700 B14R0.493 CCCCCCCCNC(C)CCCC 2230a_100000229939_200011215066 [1,1,0,0,0,0|1,0,1]=4 11701 B14R0.493 CCCCCCCCNC(C)CCCC 270004a_100000229939_100000210087 [1,1,0,0,0,0|1,0,1]=4 11702 B14R0.493 CCCCCCCCNC(C)CCCC 34a_100000229939_200011215066 [1,1,0,0,0,0|1,0,1]=4 11703 B14R0.493 CCCCCCCCOC(C)CCCC 34a_100000210232_200011215066 [1,1,0,0,0,0|1,0,1]=4 11704 B14R0.493 CCCCCCCCOC(C)CCCC 34a_100000687866_100000210759 [1,1,0,0,0,0|1,0,1]=4 11705 B14R0.493 CCCCCCCCOC(C)CCCC 7a_100000210232_200011215066 [1,1,0,0,0,0|1,0,1]=4 11706 B14R0.493 CCCCCCCCOC(C)CCCC 7a_100000687866_100000210759 [1,1,0,0,0,0|1,0,1]=4 11707 B14R0.493 CCCCCCCCOC(C)CCCCl 34a_200000718107_100000210759 [1,1,0,0,0,0|2,0,0]=4 11708 B14R0.493 CCCCCCCCOC(C)CCCCl 7a_200000718107_100000210759 [1,1,0,0,0,0|2,0,0]=4 11709 B14R0.493 CCCCCCCCSC(C)CCCC 62a_100000210759_200011215066 [1,1,0,0,0,0|1,0,1]=4 11710 B14R0.493 CCCCCCCCSC(C)CCCC 62a_200011215066_100000210317 [1,1,0,0,0,0|1,0,1]=4 11711 B14R0.493 CCCCCCCNC[C@H](C)CCCO 2230a_100160569302_100000210681 [1,1,0,0,0,0|1,0,1]=4 11712 B14R0.493 CCCCCCCNC[C@H](C)CCCO 34a_100160569302_100000210614 [1,1,0,0,0,0|1,0,1]=4 11713 B14R0.493 CCCCCCCOCC(C)CCCC 34a_100011995851_100000210614 [1,1,0,0,0,0|1,0,1]=4 11714 B14R0.493 CCCCCCCOCC(C)CCCC 7a_100011995851_100000210614 [1,1,0,0,0,0|1,0,1]=4 11715 B14R0.493 CCCCCCCOC[C@@H](N)CCCC 34a_100011934283_100000210614 [1,1,0,0,0,0|1,0,1]=4 11716 B14R0.493 CCCCN(C)CCCCCCCCO 2230a_100000207549_100000033203 [1,1,0,0,0,0|1,0,1]=4 11717 B14R0.493 CCCCN(C)CCCCCCCCO 269982a_100000207549_100000033203 [1,1,0,0,0,0|1,0,1]=4 11718 B14R0.493 CCCCOCCCCC(C)CCCC 34a_200011021034_100000210210 [1,1,0,0,0,0|1,0,1]=4 11719 B14R0.493 CCCCOCCCCC(C)CCCC 7a_200011021034_100000210211 [1,1,0,0,0,0|1,0,1]=4 11720 B14R0.493 CCCC[C@H](N)COCCCCCCF 34a_100011934283_100015922095 [1,1,0,0,0,0|2,0,0]=4 11721 B14R0.493 CCCC[C@H](N)COCCCCCCO 34a_100011934283_100000766143 [1,1,0,0,0,0|1,0,1]=4 11722 B14R0.493 CCCOC(C)CNCCCCCC=O 2230a_100015185124_100000139337 [1,1,0,0,0,0|2,0,0]=4 11723 B14R0.493 CCOCC(O)CNCCCCCC=O 2230a_102515437182_100000139337 [1,1,0,0,0,0|2,0,0]=4 11724 B14R0.493 C[C@H](CCCO)CNCCCCCC=O 2230a_100160569302_100000139337 [1,1,0,0,0,0|2,0,0]=4 11725 B16R0.61 C#CCC(=O)CCCCCCCCCCCC 1458a_100011215791_100000184674 [0,2,0,0,0,0|1,0,1]=4 11726 B16R0.61 C#CCC(=O)CCCCCCCCCCCC 1458a_100011220946_100000759014 [0,2,0,0,0,0|1,0,1]=4 11727 B16R0.61 C#CCC(C)OCCCCCCCCCCC 34a_100000685586_100011215454 [0,2,0,0,0,0|1,0,1]=4 11728 B16R0.61 C#CCC(C)OCCCCCCCCCCC 7a_100000685586_100011215454 [0,2,0,0,0,0|1,0,1]=4 11729 B16R0.61 C#CCCCCCCCCCOC(C)CCC 34a_100000034437_100000766640 [0,2,0,0,0,0|1,0,1]=4 11730 B16R0.61 C#CCCCCCCCCCOC(C)CCC 7a_100000034437_100000766640 [0,2,0,0,0,0|1,0,1]=4 11731 B16R0.61 C#CCCCCCCCCOCC(C)CCC 34a_100000065265_100011216630 [0,2,0,0,0,0|1,0,1]=4 11732 B16R0.61 C#CCCCCCCCCOCC(C)CCC 7a_100000065265_100011216630 [0,2,0,0,0,0|1,0,1]=4 11733 B16R0.61 C#CCCCCCCCOCCC(C)CCC 34a_100011217855_100153394163 [0,2,0,0,0,0|1,0,1]=4 11734 B16R0.61 C#CCCCCCCCOCCC(C)CCC 7a_100011217855_100153394163 [0,2,0,0,0,0|1,0,1]=4 11735 B16R0.61 C#CCCCCCCCOCC[C@@H](N)CCC 34a_100015193777_100153394163 [0,2,0,0,0,0|1,0,1]=4 11736 B16R0.61 C#CCCCCCCOCCCC(C)CCC 34a_100011713154_100012276617 [0,2,0,0,0,0|1,0,1]=4 11737 B16R0.61 C#CCCCCCCOCCCC(C)CCC 7a_100011713154_100012276617 [0,2,0,0,0,0|1,0,1]=4 11738 B16R0.61 C#CCN(C)CCCCCCCCCCCC 2230a_100000225692_100011215052 [0,2,0,0,0,0|1,0,1]=4 11739 B16R0.61 C#CCN(C)CCCCCCCCCCCC 2230a_100000227908_100000038162 [0,2,0,0,0,0|1,0,1]=4 11740 B16R0.61 C#CCN(C)CCCCCCCCCCCC 270004a_100000225692_100011218549 [0,2,0,0,0,0|1,0,1]=4 11741 B16R0.61 C#CCN(C)CCCCCCCCCCCC 34a_100000225692_100000759014 [0,2,0,0,0,0|1,0,1]=4 11742 B16R0.61 C/C=C/C(C)OCCCCCCCCCCC 34a_200102604097_100011215454 [0,2,0,0,0,0|1,0,1]=4 11743 B16R0.61 C=CCC(=O)CCCCCCCCCCCC 1458a_100000210193_100000759014 [0,2,0,0,0,0|1,0,0]=3 11744 B16R0.61 C=CCC(=O)CCCCCCCCCCCC 1458a_100011215791_100000210623 [0,2,0,0,0,0|1,0,0]=3 11745 B16R0.61 C=CCC(=O)CCCCCCCCCCCO 1458a_100000210193_100009812471 [0,2,0,0,0,0|1,0,1]=4 11746 B16R0.61 C=CCC(=O)NCCCCCCCCCCC 11a_200011215754_100000210193 [0,2,0,0,0,0|1,0,1]=4 11747 B16R0.61 C=CCC(=O)NCCCCCCCCCCC 1626a_200011215754_100000210193 [0,2,0,0,0,0|1,0,1]=4 11748 B16R0.61 C=CCC(=O)NCCCCCCCCCCC 240690a_200011215754_100000210193 [0,2,0,0,0,0|1,0,1]=4 11749 B16R0.61 C=CCC(=O)NCCCCCCCCCCC 527a_200011215754_100000210193 [0,2,0,0,0,0|1,0,1]=4 11750 B16R0.61 C=CCC(C)COCCCCCCCCCC 34a_100009832082_100000210320 [0,2,0,0,0,0|1,0,0]=3 11751 B16R0.61 C=CCC(C)COCCCCCCCCCC 7a_100009832082_100000210320 [0,2,0,0,0,0|1,0,0]=3 11752 B16R0.61 C=CCC(C)COCCCCCCCCCO 34a_100009832082_100009813782 [0,2,0,0,0,0|2,0,0]=4 11753 B16R0.61 C=CCC(C)COCCCCCCCCCO 7a_100009832082_100009813782 [0,2,0,0,0,0|2,0,0]=4 11754 B16R0.61 C=CCCCCCCCCCCC(=O)CCC 1458a_100000211992_100011093070 [0,2,0,0,0,0|1,0,0]=3 11755 B16R0.61 C=CCCCCCCCCCCC(=O)CCO 1458a_100011216618_100011093070 [0,2,0,0,0,0|1,0,1]=4 11756 B16R0.61 C=CCCCCCCCCCCC(=O)COC 1458a_100000210968_100011093070 [0,2,0,0,0,0|1,0,1]=4 11757 B16R0.61 C=CCCCCCCCCCCC(=O)CSC 1458a_100000184570_100011093070 [0,2,0,0,0,0|1,0,1]=4 11758 B16R0.61 C=CCCCCCCCCCCN(C)CCC 2230a_100000747261_100011093070 [0,2,0,0,0,0|1,0,0]=3 11759 B16R0.61 C=CCCCCCCCCCCN(C)CCC 269982a_100000747261_100011093070 [0,2,0,0,0,0|1,0,0]=3 11760 B16R0.61 C=CCCCCCCCCCCN(C)CCO 2230a_100000210263_100011093070 [0,2,0,0,0,0|2,0,0]=4 11761 B16R0.61 C=CCCCCCCCCCCN(C)CCO 269982a_100000210263_100011093070 [0,2,0,0,0,0|2,0,0]=4 11762 B16R0.61 C=CCCCCCCCCCNC(=O)CCC 11a_100000081888_100000211992 [0,2,0,0,0,0|1,0,1]=4 11763 B16R0.61 C=CCCCCCCCCCNC(=O)CCC 1626a_100000081888_100000211992 [0,2,0,0,0,0|1,0,1]=4 11764 B16R0.61 C=CCCCCCCCCCNC(=O)CCC 240690a_100000081888_100000211992 [0,2,0,0,0,0|1,0,1]=4 11765 B16R0.61 C=CCCCCCCCCCNC(=O)CCC 527a_100000081888_100000211992 [0,2,0,0,0,0|1,0,1]=4 11766 B16R0.61 C=CCCCCCCCCCNC(C)CCC 2230a_100000081888_100000766640 [0,2,0,0,0,0|1,0,0]=3 11767 B16R0.61 C=CCCCCCCCCCNC(C)CCC 2230a_100000741246_100009814027 [0,2,0,0,0,0|1,0,0]=3 11768 B16R0.61 C=CCCCCCCCCCNC(C)CCC 270004a_100000081888_100000211909 [0,2,0,0,0,0|1,0,0]=3 11769 B16R0.61 C=CCCCCCCCCCNC(C)CCC 34a_100000081888_100000766640 [0,2,0,0,0,0|1,0,0]=3 11770 B16R0.61 C=CCCCCCCCCCNC(C)CCO 2230a_100000081888_100009893172 [0,2,0,0,0,0|2,0,0]=4 11771 B16R0.61 C=CCCCCCCCCCNC(C)CCO 34a_100000081888_100009893172 [0,2,0,0,0,0|2,0,0]=4 11772 B16R0.61 C=CCCCCCCCCCNC(C)COC 2230a_100000081888_100000765312 [0,2,0,0,0,0|2,0,0]=4 11773 B16R0.61 C=CCCCCCCCCCNC(C)COC 270004a_100000081888_100000749346 [0,2,0,0,0,0|2,0,0]=4 11774 B16R0.61 C=CCCCCCCCCCNC(C)COC 34a_100000081888_100000765312 [0,2,0,0,0,0|2,0,0]=4 11775 B16R0.61 C=CCCCCCCCCCNC(C)CSC 270004a_100000081888_100011216314 [0,2,0,0,0,0|2,0,0]=4 11776 B16R0.61 C=CCCCCCCCCCN[C@H](C)CCO 2230a_100000706166_100009814027 [0,2,0,0,0,0|2,0,0]=4 11777 B16R0.61 C=CCCCCCCCCCN[C@H](C)CCO 34a_100000706166_100009814027 [0,2,0,0,0,0|2,0,0]=4 11778 B16R0.61 C=CCCCCCCCCCN[C@H](C)COC 2230a_100000764878_100009814027 [0,2,0,0,0,0|2,0,0]=4 11779 B16R0.61 C=CCCCCCCCCCOC(C)CCBr 34a_100012276601_100009814027 [0,2,0,0,0,0|2,0,0]=4 11780 B16R0.61 C=CCCCCCCCCCOC(C)CCC 34a_100000038209_100000766640 [0,2,0,0,0,0|1,0,0]=3 11781 B16R0.61 C=CCCCCCCCCCOC(C)CCC 34a_100000764384_100009814027 [0,2,0,0,0,0|1,0,0]=3 11782 B16R0.61 C=CCCCCCCCCCOC(C)CCC 7a_100000038209_100000766640 [0,2,0,0,0,0|1,0,0]=3 11783 B16R0.61 C=CCCCCCCCCCOC(C)CCC 7a_100000764384_100009814027 [0,2,0,0,0,0|1,0,0]=3 11784 B16R0.61 C=CCCCCCCCCCOC(C)CCO 34a_100000038209_100009893172 [0,2,0,0,0,0|2,0,0]=4 11785 B16R0.61 C=CCCCCCCCCCOC(C)CCO 7a_100000038209_100009893172 [0,2,0,0,0,0|2,0,0]=4 11786 B16R0.61 C=CCCCCCCCCCOC(C)COC 34a_100000038209_100000765312 [0,2,0,0,0,0|2,0,0]=4 11787 B16R0.61 C=CCCCCCCCCCOC(C)COC 7a_100000038209_100000765312 [0,2,0,0,0,0|2,0,0]=4 11788 B16R0.61 C=CCCCCCCCCCO[C@H](C)COC 34a_100011934205_100009814027 [0,2,0,0,0,0|2,0,0]=4 11789 B16R0.61 C=CCCCCCCCCCSC(C)CCO 62a_100009814027_100009893172 [0,2,0,0,0,0|2,0,0]=4 11790 B16R0.61 C=CCCCCCCCCCSC(C)CCO 62a_100009893172_100009814027 [0,2,0,0,0,0|2,0,0]=4 11791 B16R0.61 C=CCCCCCCCCCSC(C)COC 62a_100000765312_100009814027 [0,2,0,0,0,0|2,0,0]=4 11792 B16R0.61 C=CCCCCCCCCCSC(C)COC 62a_100009814027_100000765312 [0,2,0,0,0,0|2,0,0]=4 11793 B16R0.61 C=CCCCCCCCCNCC(O)COC 2230a_100000756049_100011933949 [0,2,0,0,0,0|2,0,0]=4 11794 B16R0.61 C=CCCCCCCCCNCC(O)COC 34a_100000756049_100011933949 [0,2,0,0,0,0|2,0,0]=4 11795 B16R0.61 C=CCCCCCCCCOCC(=O)CCC 7a_100011215194_100000747444 [0,2,0,0,0,0|1,0,1]=4 11796 B16R0.61 C=CCCCCCCCCOCC(C)CCC 34a_100000688023_100011933949 [0,2,0,0,0,0|1,0,0]=3 11797 B16R0.61 C=CCCCCCCCCOCC(C)CCC 34a_100011215194_100011216630 [0,2,0,0,0,0|1,0,0]=3 11798 B16R0.61 C=CCCCCCCCCOCC(C)CCC 7a_100000688023_100011933949 [0,2,0,0,0,0|1,0,0]=3 11799 B16R0.61 C=CCCCCCCCCOCC(C)CCC 7a_100011215194_100011216630 [0,2,0,0,0,0|1,0,0]=3 11800 B16R0.61 C=CCCCCCCCCOCC(C)CCN 34a_106354213184_100011933949 [0,2,0,0,0,0|2,0,0]=4 11801 B16R0.61 C=CCCCCCCCCOCC(N)COC 34a_100000724102_100011933949 [0,2,0,0,0,0|2,0,0]=4 11802 B16R0.61 C=CCCCCCCCCOCC(O)COC 34a_100011215194_100011215053 [0,2,0,0,0,0|2,0,0]=4 11803 B16R0.61 C=CCCCCCCCCOCC(O)COC 7a_100011215194_100011215053 [0,2,0,0,0,0|2,0,0]=4 11804 B16R0.61 C=CCCCCCCCCOC[C@@H](N)CCC 34a_100000732646_100011933949 [0,2,0,0,0,0|1,0,0]=3 11805 B16R0.61 C=CCCCCCCCCSCC(=O)CCC 62a_100000747444_100011933949 [0,2,0,0,0,0|1,0,1]=4 11806 B16R0.61 C=CCCCCCCCCSCC(=O)CCC 62a_100011933949_100000747444 [0,2,0,0,0,0|1,0,1]=4 11807 B16R0.61 C=CCCCCCCCCSCC(O)COC 62a_100011215053_100011933949 [0,2,0,0,0,0|2,0,0]=4 11808 B16R0.61 C=CCCCCCCCCSCC(O)COC 62a_100011933949_100011215053 [0,2,0,0,0,0|2,0,0]=4 11809 B16R0.61 C=CCCCCCCCOCCC(C)CCC 34a_100011217855_100012355270 [0,2,0,0,0,0|1,0,0]=3 11810 B16R0.61 C=CCCCCCCCOCCC(C)CCC 7a_100011217855_100012355270 [0,2,0,0,0,0|1,0,0]=3 11811 B16R0.61 C=CCCCCCCCOCC[C@@H](N)CCC 34a_100015193777_100012355270 [0,2,0,0,0,0|1,0,0]=3 11812 B16R0.61 C=CCCCCCCOCCCC(C)CCC 34a_100011713154_100011215473 [0,2,0,0,0,0|1,0,0]=3 11813 B16R0.61 C=CCCCCCCOCCCC(C)CCC 7a_100011713154_100011215473 [0,2,0,0,0,0|1,0,0]=3 11814 B16R0.61 C=CCN(C)CCCCCCCCCCCC 2230a_100000225617_100011215052 [0,2,0,0,0,0|1,0,0]=3 11815 B16R0.61 C=CCN(C)CCCCCCCCCCCC 2230a_100000227908_100000210623 [0,2,0,0,0,0|1,0,0]=3 11816 B16R0.61 C=CCN(C)CCCCCCCCCCCC 269982a_100000225617_100000759014 [0,2,0,0,0,0|1,0,0]=3 11817 B16R0.61 C=CCN(C)CCCCCCCCCCCC 269982a_100000227908_100000210623 [0,2,0,0,0,0|1,0,0]=3 11818 B16R0.61 C=CCN(C)CCCCCCCCCCCC 270004a_100000225617_100011218549 [0,2,0,0,0,0|1,0,0]=3 11819 B16R0.61 C=CCN(C)CCCCCCCCCCCO 2230a_100000225617_100009812471 [0,2,0,0,0,0|2,0,0]=4 11820 B16R0.61 C=CCN(C)CCCCCCCCCCCO 269982a_100000225617_100009812471 [0,2,0,0,0,0|2,0,0]=4 11821 B16R0.61 C=CC[C@@H](C)OCCCCCCCCCCC 34a_100000731007_100011215454 [0,2,0,0,0,0|1,0,0]=3 11822 B16R0.61 C=CC[C@@H](C)OCCCCCCCCCCC 7a_100000731007_100011215454 [0,2,0,0,0,0|1,0,0]=3 11823 B16R0.61 C=CC[C@@H](C)OCCCCCCCCCCO 34a_100000731007_100009813290 [0,2,0,0,0,0|2,0,0]=4 11824 B16R0.61 C=CC[C@@H](C)OCCCCCCCCCCO 7a_100000731007_100009813290 [0,2,0,0,0,0|2,0,0]=4 11825 B16R0.61 C=CC[C@@H](N)COCCCCCCCCCC 34a_100020615467_100000210320 [0,2,0,0,0,0|1,0,0]=3 11826 B16R0.61 C=CC[C@@H](N)COCCCCCCCCCO 34a_100020615467_100009813782 [0,2,0,0,0,0|2,0,0]=4 11827 B16R0.61 CC=CC(=O)CCCCCCCCCCCC 1458a_100000210699_100000759014 [0,2,0,0,0,0|1,0,1]=4 11828 B16R0.61 CCCC(=O)CCCCCCCCCCCO 1458a_100000211992_100009812471 [0,2,0,0,0,0|0,0,2]=4 11829 B16R0.61 CCCC(C)CCCOCCCCCCC#N 7a_100011713154_100009813337 [0,2,0,0,0,0|1,0,1]=4 11830 B16R0.61 CCCC(C)CCCOCCCCCCCO 34a_100011713154_100000760002 [0,2,0,0,0,0|0,0,2]=4 11831 B16R0.61 CCCC(C)CCCOCCCCCCCO 7a_100011713154_100000760002 [0,2,0,0,0,0|0,0,2]=4 11832 B16R0.61 CCCC(C)CCCOCCCCCCOC 34a_100011713154_100011998445 [0,2,0,0,0,0|2,0,0]=4 11833 B16R0.61 CCCC(C)CCCOCCCCCCOC 7a_100011713154_100011998445 [0,2,0,0,0,0|2,0,0]=4 11834 B16R0.61 CCCC(C)CCOCCCCCCCCO 34a_100011217855_100000033203 [0,2,0,0,0,0|0,0,2]=4 11835 B16R0.61 CCCC(C)CCOCCCCCCCCO 7a_100011217855_100000033203 [0,2,0,0,0,0|0,0,2]=4 11836 B16R0.61 CCCC(C)CNCCCCCCCCCO 2230a_100000078944_100011216630 [0,2,0,0,0,0|0,0,2]=4 11837 B16R0.61 CCCC(C)CNCCCCCCCCCO 270004a_100000078944_100000243154 [0,2,0,0,0,0|0,0,2]=4 11838 B16R0.61 CCCC(C)CNCCCCCCCCCO 34a_100000078944_100011216630 [0,2,0,0,0,0|0,0,2]=4 11839 B16R0.61 CCCC(C)COCCCCCCCCCBr 34a_100009813782_100011216630 [0,2,0,0,0,0|1,0,1]=4 11840 B16R0.61 CCCC(C)COCCCCCCCCCBr 7a_100009813782_100011216630 [0,2,0,0,0,0|1,0,1]=4 11841 B16R0.61 CCCC(C)COCCCCCCCCCCl 34a_100009868337_100011216630 [0,2,0,0,0,0|1,0,1]=4 11842 B16R0.61 CCCC(C)COCCCCCCCCCCl 7a_100009868337_100011216630 [0,2,0,0,0,0|1,0,1]=4 11843 B16R0.61 CCCC(C)COCCCCCCCCCN 34a_100000078944_100011216630 [0,2,0,0,0,0|1,0,1]=4 11844 B16R0.61 CCCC(C)COCCCCCCCCCO 34a_100000688023_100009813782 [0,2,0,0,0,0|0,0,2]=4 11845 B16R0.61 CCCC(C)COCCCCCCCCCO 7a_100000688023_100009813782 [0,2,0,0,0,0|0,0,2]=4 11846 B16R0.61 CCCC(C)CSCCCCCCCCCO 62a_100009813782_100011216630 [0,2,0,0,0,0|0,0,2]=4 11847 B16R0.61 CCCC(C)CSCCCCCCCCCO 62a_100011216630_100009813782 [0,2,0,0,0,0|0,0,2]=4 11848 B16R0.61 CCCC(C)NCCCCCCCCCCO 2230a_100000066964_100000766640 [0,2,0,0,0,0|0,0,2]=4 11849 B16R0.61 CCCC(C)NCCCCCCCCCCO 2230a_100000741246_100009813290 [0,2,0,0,0,0|0,0,2]=4 11850 B16R0.61 CCCC(C)NCCCCCCCCCCO 270004a_100000066964_100000211909 [0,2,0,0,0,0|0,0,2]=4 11851 B16R0.61 CCCC(C)NCCCCCCCCCCO 34a_100000066964_100000766640 [0,2,0,0,0,0|0,0,2]=4 11852 B16R0.61 CCCC(C)OCCCCCCCCCCBr 34a_100009813290_100000766640 [0,2,0,0,0,0|1,0,1]=4 11853 B16R0.61 CCCC(C)OCCCCCCCCCCBr 7a_100009813290_100000766640 [0,2,0,0,0,0|1,0,1]=4 11854 B16R0.61 CCCC(C)OCCCCCCCCCCCl 34a_200000033068_100000766640 [0,2,0,0,0,0|1,0,1]=4 11855 B16R0.61 CCCC(C)OCCCCCCCCCCCl 7a_200000033068_100000766640 [0,2,0,0,0,0|1,0,1]=4 11856 B16R0.61 CCCC(C)OCCCCCCCCCCN 34a_100000066964_100000766640 [0,2,0,0,0,0|1,0,1]=4 11857 B16R0.61 CCCC(C)OCCCCCCCCCCO 34a_100000764384_100009813290 [0,2,0,0,0,0|0,0,2]=4 11858 B16R0.61 CCCC(C)OCCCCCCCCCCO 7a_100000764384_100009813290 [0,2,0,0,0,0|0,0,2]=4 11859 B16R0.61 CCCC(C)SCCCCCCCCCCO 62a_100000766640_200000033068 [0,2,0,0,0,0|0,0,2]=4 11860 B16R0.61 CCCC(C)SCCCCCCCCCCO 62a_100009813290_100000766640 [0,2,0,0,0,0|0,0,2]=4 11861 B16R0.61 CCCCCCCCCCCCC(=O)C=CBr 1458a_100016273825_100000759014 [0,2,0,0,0,0|1,0,1]=4 11862 B16R0.61 CCCCCCCCCCCCC(=O)C=CCl 1458a_200016279998_100000759014 [0,2,0,0,0,0|1,0,1]=4 11863 B16R0.61 CCCCCCCCCCCCC(=O)C=CI 1458a_100016256311_100000759014 [0,2,0,0,0,0|1,0,1]=4 11864 B16R0.61 CCCCCCCCCCCCC(=O)CC#N 1458a_100011215791_100011214920 [0,2,0,0,0,0|1,0,1]=4 11865 B16R0.61 CCCCCCCCCCCCC(=O)CC#N 1458a_100051588842_100000759014 [0,2,0,0,0,0|1,0,1]=4 11866 B16R0.61 CCCCCCCCCCCCC(=O)CCC 1458a_100000211992_100000759014 [0,2,0,0,0,0|1,0,1]=4 11867 B16R0.61 CCCCCCCCCCCCC(=O)CCC 1458a_100011215791_100000210303 [0,2,0,0,0,0|1,0,1]=4 11868 B16R0.61 CCCCCCCCCCCCC(=O)CCF 1458a_100011215791_100011217306 [0,2,0,0,0,0|1,0,1]=4 11869 B16R0.61 CCCCCCCCCCCCC(=O)CCO 1458a_100011215791_100000211926 [0,2,0,0,0,0|0,0,2]=4 11870 B16R0.61 CCCCCCCCCCCCC(=O)CCO 1458a_100011216618_100000759014 [0,2,0,0,0,0|0,0,2]=4 11871 B16R0.61 CCCCCCCCCCCCC(=O)COC 1458a_100000210968_100000759014 [0,2,0,0,0,0|2,0,0]=4 11872 B16R0.61 CCCCCCCCCCCCC(=O)CSC 1458a_100000184570_100000759014 [0,2,0,0,0,0|2,0,0]=4 11873 B16R0.61 CCCCCCCCCCCCC(C)COC 34a_100000724949_200000210301 [0,2,0,0,0,0|0,0,2]=4 11874 B16R0.61 CCCCCCCCCCCCC(C)COC 7a_100000724949_200000210301 [0,2,0,0,0,0|0,0,2]=4 11875 B16R0.61 CCCCCCCCCCCCC(C)CO[13CH3] 34a_100000724949_200025704644 [0,2,0,0,0,0|0,0,2]=4 11876 B16R0.61 CCCCCCCCCCCCC(C)CO[13CH3] 7a_100000724949_200025704644 [0,2,0,0,0,0|0,0,2]=4 11877 B16R0.61 CCCCCCCCCCCCC(C)NCC 2230a_100015525214_200011217028 [0,2,0,0,0,0|1,0,1]=4 11878 B16R0.61 CCCCCCCCCCCCC(C)NCC 270004a_100015525214_100011219199 [0,2,0,0,0,0|1,0,1]=4 11879 B16R0.61 CCCCCCCCCCCCC(C)OCC 34a_100121572206_200011217028 [0,2,0,0,0,0|1,0,1]=4 11880 B16R0.61 CCCCCCCCCCCCC(C)OCC 34a_200011215752_100000210202 [0,2,0,0,0,0|1,0,1]=4 11881 B16R0.61 CCCCCCCCCCCCC(C)OCC 7a_200011215752_100000210202 [0,2,0,0,0,0|1,0,1]=4 11882 B16R0.61 CCCCCCCCCCCCC(C)OCF 34a_200011215752_100015361967 [0,2,0,0,0,0|1,0,1]=4 11883 B16R0.61 CCCCCCCCCCCCC(C)OCF 7a_200011215752_100015361967 [0,2,0,0,0,0|1,0,1]=4 11884 B16R0.61 CCCCCCCCCCCCN(C)CC#N 2230a_100000227908_100011215382 [0,2,0,0,0,0|1,0,1]=4 11885 B16R0.61 CCCCCCCCCCCCN(C)CC#N 2230a_100000748184_100011215052 [0,2,0,0,0,0|1,0,1]=4 11886 B16R0.61 CCCCCCCCCCCCN(C)CC#N 269982a_100000227908_100011214920 [0,2,0,0,0,0|1,0,1]=4 11887 B16R0.61 CCCCCCCCCCCCN(C)CC=O 2230a_100000227908_200015260668 [0,2,0,0,0,0|0,0,0]=2 11888 B16R0.61 CCCCCCCCCCCCN(C)CC=O 269982a_100000227908_200015260668 [0,2,0,0,0,0|0,0,0]=2 11889 B16R0.61 CCCCCCCCCCCCN(C)CCC 2230a_100000227908_100000210303 [0,2,0,0,0,0|1,0,1]=4 11890 B16R0.61 CCCCCCCCCCCCN(C)CCC 2230a_100000747261_100011215052 [0,2,0,0,0,0|1,0,1]=4 11891 B16R0.61 CCCCCCCCCCCCN(C)CCC 269982a_100000227908_100000210303 [0,2,0,0,0,0|1,0,1]=4 11892 B16R0.61 CCCCCCCCCCCCN(C)CCC 269982a_100000747261_100000759014 [0,2,0,0,0,0|1,0,1]=4 11893 B16R0.61 CCCCCCCCCCCCN(C)CCC 270004a_100000747261_100011218549 [0,2,0,0,0,0|1,0,1]=4 11894 B16R0.61 CCCCCCCCCCCCN(C)CCF 2230a_100000227908_100011217306 [0,2,0,0,0,0|1,0,1]=4 11895 B16R0.61 CCCCCCCCCCCCN(C)CCF 269982a_100000227908_100011217306 [0,2,0,0,0,0|1,0,1]=4 11896 B16R0.61 CCCCCCCCCCCCN(C)CCO 2230a_100000210263_100011215052 [0,2,0,0,0,0|0,0,2]=4 11897 B16R0.61 CCCCCCCCCCCCN(C)CCO 2230a_100000227908_100000211926 [0,2,0,0,0,0|0,0,2]=4 11898 B16R0.61 CCCCCCCCCCCCN(C)CCO 269982a_100000210263_100000759014 [0,2,0,0,0,0|0,0,2]=4 11899 B16R0.61 CCCCCCCCCCCCN(C)CCO 269982a_100000227908_100000211926 [0,2,0,0,0,0|0,0,2]=4 11900 B16R0.61 CCCCCCCCCCCCN(C)CCO 270004a_100000210263_100011218549 [0,2,0,0,0,0|0,0,2]=4 11901 B16R0.61 CCCCCCCCCCCCN(C)COC 2230a_100000227908_100000766300 [0,2,0,0,0,0|2,0,0]=4 11902 B16R0.61 CCCCCCCCCCCCN(C)COC 269982a_100000227908_100000766300 [0,2,0,0,0,0|2,0,0]=4 11903 B16R0.61 CCCCCCCCCCCCN(C)CSC 2230a_100000227908_100011218213 [0,2,0,0,0,0|2,0,0]=4 11904 B16R0.61 CCCCCCCCCCCCN(C)CSC 269982a_100000227908_100011218213 [0,2,0,0,0,0|2,0,0]=4 11905 B16R0.61 CCCCCCCCCCCNC(C)CC#N 2230a_200011215754_100009813641 [0,2,0,0,0,0|1,0,1]=4 11906 B16R0.61 CCCCCCCCCCCNC(C)CCC 2230a_100000741246_100011215454 [0,2,0,0,0,0|1,0,1]=4 11907 B16R0.61 CCCCCCCCCCCNC(C)CCC 2230a_200011215754_100000766640 [0,2,0,0,0,0|1,0,1]=4 11908 B16R0.61 CCCCCCCCCCCNC(C)CCC 270004a_200011215754_100000211909 [0,2,0,0,0,0|1,0,1]=4 11909 B16R0.61 CCCCCCCCCCCNC(C)CCC 34a_200011215754_100000766640 [0,2,0,0,0,0|1,0,1]=4 11910 B16R0.61 CCCCCCCCCCCNC(C)CCO 2230a_200011215754_100009893172 [0,2,0,0,0,0|0,0,2]=4 11911 B16R0.61 CCCCCCCCCCCNC(C)CCO 34a_200011215754_100009893172 [0,2,0,0,0,0|0,0,2]=4 11912 B16R0.61 CCCCCCCCCCCNC(C)COC 2230a_200011215754_100000765312 [0,2,0,0,0,0|2,0,0]=4 11913 B16R0.61 CCCCCCCCCCCNC(C)COC 270004a_200011215754_100000749346 [0,2,0,0,0,0|2,0,0]=4 11914 B16R0.61 CCCCCCCCCCCNC(C)COC 34a_200011215754_100000765312 [0,2,0,0,0,0|2,0,0]=4 11915 B16R0.61 CCCCCCCCCCCNC(C)CSC 270004a_200011215754_100011216314 [0,2,0,0,0,0|2,0,0]=4 11916 B16R0.61 CCCCCCCCCCCN[C@@H](C)CC#N 2230a_100016994482_100011215454 [0,2,0,0,0,0|1,0,1]=4 11917 B16R0.61 CCCCCCCCCCCN[C@H](C)CCO 2230a_100000706166_100011215454 [0,2,0,0,0,0|0,0,2]=4 11918 B16R0.61 CCCCCCCCCCCN[C@H](C)CCO 34a_100000706166_100011215454 [0,2,0,0,0,0|0,0,2]=4 11919 B16R0.61 CCCCCCCCCCCN[C@H](C)COC 2230a_100000764878_100011215454 [0,2,0,0,0,0|2,0,0]=4 11920 B16R0.61 CCCCCCCCCCCOC(C)CC#N 7a_100000210809_100009813641 [0,2,0,0,0,0|1,0,1]=4 11921 B16R0.61 CCCCCCCCCCCOC(C)CCBr 34a_100012276601_100011215454 [0,2,0,0,0,0|1,0,1]=4 11922 B16R0.61 CCCCCCCCCCCOC(C)CCC 34a_100000210809_100000766640 [0,2,0,0,0,0|1,0,1]=4 11923 B16R0.61 CCCCCCCCCCCOC(C)CCC 34a_100000764384_100011215454 [0,2,0,0,0,0|1,0,1]=4 11924 B16R0.61 CCCCCCCCCCCOC(C)CCC 7a_100000210809_100000766640 [0,2,0,0,0,0|1,0,1]=4 11925 B16R0.61 CCCCCCCCCCCOC(C)CCC 7a_100000764384_100011215454 [0,2,0,0,0,0|1,0,1]=4 11926 B16R0.61 CCCCCCCCCCCOC(C)CCO 34a_100000210809_100009893172 [0,2,0,0,0,0|0,0,2]=4 11927 B16R0.61 CCCCCCCCCCCOC(C)CCO 7a_100000210809_100009893172 [0,2,0,0,0,0|0,0,2]=4 11928 B16R0.61 CCCCCCCCCCCOC(C)COC 34a_100000210809_100000765312 [0,2,0,0,0,0|2,0,0]=4 11929 B16R0.61 CCCCCCCCCCCOC(C)COC 7a_100000210809_100000765312 [0,2,0,0,0,0|2,0,0]=4 11930 B16R0.61 CCCCCCCCCCCO[C@H](C)COC 34a_100011934205_100011215454 [0,2,0,0,0,0|2,0,0]=4 11931 B16R0.61 CCCCCCCCCCCSC(C)CC#N 62a_100009813641_100011215454 [0,2,0,0,0,0|1,0,1]=4 11932 B16R0.61 CCCCCCCCCCCSC(C)CCO 62a_100009893172_100011215454 [0,2,0,0,0,0|0,0,2]=4 11933 B16R0.61 CCCCCCCCCCCSC(C)COC 62a_100000765312_100011215454 [0,2,0,0,0,0|2,0,0]=4 11934 B16R0.61 CCCCCCCCCCNCC(C)CCC 2230a_100000684558_100011216630 [0,2,0,0,0,0|1,0,1]=4 11935 B16R0.61 CCCCCCCCCCNCC(C)CCC 270004a_100000684558_100000243154 [0,2,0,0,0,0|1,0,1]=4 11936 B16R0.61 CCCCCCCCCCNCC(C)CCC 34a_100000684558_100011216630 [0,2,0,0,0,0|1,0,1]=4 11937 B16R0.61 CCCCCCCCCCNCC(O)COC 2230a_100000756049_100000210320 [0,2,0,0,0,0|2,0,0]=4 11938 B16R0.61 CCCCCCCCCCNCC(O)COC 34a_100000684558_100011215053 [0,2,0,0,0,0|2,0,0]=4 11939 B16R0.61 CCCCCCCCCCNCC(O)COC 34a_100000756049_100000210320 [0,2,0,0,0,0|2,0,0]=4 11940 B16R0.61 CCCCCCCCCCNC[C@@H](O)CC#N 2230a_100000684558_100000001066 [0,2,0,0,0,0|1,0,1]=4 11941 B16R0.61 CCCCCCCCCCOCC(C)CCC 34a_100000210711_100011216630 [0,2,0,0,0,0|1,0,1]=4 11942 B16R0.61 CCCCCCCCCCOCC(C)CCC 34a_100000688023_100000210320 [0,2,0,0,0,0|1,0,1]=4 11943 B16R0.61 CCCCCCCCCCOCC(C)CCC 7a_100000210711_100011216630 [0,2,0,0,0,0|1,0,1]=4 11944 B16R0.61 CCCCCCCCCCOCC(C)CCC 7a_100000688023_100000210320 [0,2,0,0,0,0|1,0,1]=4 11945 B16R0.61 CCCCCCCCCCOCC(C)CCN 34a_106354213184_100000210320 [0,2,0,0,0,0|1,0,1]=4 11946 B16R0.61 CCCCCCCCCCOCC(N)COC 34a_100000724102_100000210320 [0,2,0,0,0,0|2,0,0]=4 11947 B16R0.61 CCCCCCCCCCOCC(O)COC 34a_100000210711_100011215053 [0,2,0,0,0,0|2,0,0]=4 11948 B16R0.61 CCCCCCCCCCOCC(O)COC 7a_100000210711_100011215053 [0,2,0,0,0,0|2,0,0]=4 11949 B16R0.61 CCCCCCCCCCOC[C@@H](N)CCC 34a_100000732646_100000210320 [0,2,0,0,0,0|1,0,1]=4 11950 B16R0.61 CCCCCCCCCCOC[C@@H](O)CC#N 7a_100000210711_100000001066 [0,2,0,0,0,0|1,0,1]=4 11951 B16R0.61 CCCCCCCCCCSCC(O)COC 62a_100011215053_100000210320 [0,2,0,0,0,0|2,0,0]=4 11952 B16R0.61 CCCCCCCCCCSC[C@@H](O)CC#N 62a_100000001066_100000210320 [0,2,0,0,0,0|1,0,1]=4 11953 B16R0.61 CCCCCCCCCOCCC(C)CCC 34a_100011217855_100011214924 [0,2,0,0,0,0|1,0,1]=4 11954 B16R0.61 CCCCCCCCCOCCC(C)CCC 7a_100011217855_100000210328 [0,2,0,0,0,0|1,0,1]=4 11955 B16R0.61 CCCCCCCCCOCC[C@@H](N)CCC 34a_100015193777_100011214924 [0,2,0,0,0,0|1,0,1]=4 11956 B16R0.61 CCCCCCCCOCCCC(C)CCC 34a_100011713154_100000210759 [0,2,0,0,0,0|1,0,1]=4 11957 B16R0.61 CCCCCCCCOCCCC(C)CCC 7a_100011713154_100000210759 [0,2,0,0,0,0|1,0,1]=4 11958 B16R0.61 CCCN(C)CCCCCCCCCCCO 2230a_100000747261_100009812471 [0,2,0,0,0,0|0,0,2]=4 11959 B16R0.61 CCCN(C)CCCCCCCCCCCO 269982a_100000747261_100009812471 [0,2,0,0,0,0|0,0,2]=4 11960 B16R0.61 CCC[C@H](N)CCOCCCCCCCCO 34a_100015193777_100000033203 [0,2,0,0,0,0|0,0,2]=4 11961 B16R0.61 CCC[C@H](N)COCCCCCCCCCO 34a_100000732646_100009813782 [0,2,0,0,0,0|0,0,2]=4 11962 B16R0.61 CCOC(=O)CCCCCCCCSCC=O 62a_200015260668_100010175975 [0,2,0,0,0,0|1,0,1]=4 11963 B16R0.61 CCOC(=O)CCCCCCSCCCC=O 62a_200011292268_100009814379 [0,2,0,0,0,0|1,0,1]=4 11964 B16R0.61 CCOC(=O)CCCCCOCCCCC=O 7a_100011214988_100000139335 [0,2,0,0,0,0|1,0,1]=4 11965 B16R0.61 CCOC(=O)CCCCCSCCCCC=O 62a_100000139335_100000755133 [0,2,0,0,0,0|1,0,1]=4 11966 B16R0.61 CCOC(=O)CCCCCSCCCCC=O 62a_100000755133_100000139335 [0,2,0,0,0,0|1,0,1]=4 11967 B16R0.61 CCOC(=O)CCCCSCCCCCC=O 62a_100000139337_100000750268 [0,2,0,0,0,0|1,0,1]=4 11968 B16R0.61 CCOC(=O)CCCCSCCCCCC=O 62a_100000750268_100000139337 [0,2,0,0,0,0|1,0,1]=4 11969 B16R0.68 C#CCCCC(=O)CCCCCCCCCC 1458a_100000210375_100000731252 [0,2,0,0,0,0|1,0,1]=4 11970 B16R0.68 C#CCCCC(=O)CCCCCCCCCC 1458a_100000690238_100000210319 [0,2,0,0,0,0|1,0,1]=4 11971 B16R0.68 C#CCCCCCCCCC(=O)CCCCC 1458a_100000029693_100000210326 [0,2,0,0,0,0|1,0,1]=4 11972 B16R0.68 C#CCCCCCCCNC(C)CCCCC 2230a_100000211957_100153394163 [0,2,0,0,0,0|1,0,1]=4 11973 B16R0.68 C#CCCCCCCCOC(C)CCCCC 34a_100000054614_200011218191 [0,2,0,0,0,0|1,0,1]=4 11974 B16R0.68 C#CCCCCCCCOC(C)CCCCC 34a_100011215632_100153394163 [0,2,0,0,0,0|1,0,1]=4 11975 B16R0.68 C#CCCCCCCCOC(C)CCCCC 7a_100000054614_200011218191 [0,2,0,0,0,0|1,0,1]=4 11976 B16R0.68 C#CCCCCCCCOC(C)CCCCC 7a_100011215632_100153394163 [0,2,0,0,0,0|1,0,1]=4 11977 B16R0.68 C#CCCCCCCCSC(C)CCCCC 62a_100153394163_200011218191 [0,2,0,0,0,0|1,0,1]=4 11978 B16R0.68 C#CCCCCCCCSC(C)CCCCC 62a_200011218191_100153394163 [0,2,0,0,0,0|1,0,1]=4 11979 B16R0.68 C#CCCCN(C)CCCCCCCCCC 2230a_100000207566_100000731252 [0,2,0,0,0,0|1,0,1]=4 11980 B16R0.68 C#CCCCN(C)CCCCCCCCCC 269982a_100000207566_100011215417 [0,2,0,0,0,0|1,0,1]=4 11981 B16R0.68 C#CCCOC(C)CCCCCCCCCC 34a_100011215000_100000688953 [0,2,0,0,0,0|1,0,1]=4 11982 B16R0.68 C#CCCOC(C)CCCCCCCCCC 7a_100011215000_100000688953 [0,2,0,0,0,0|1,0,1]=4 11983 B16R0.68 C/C=C/COC(C)CCCCCCCCCC 34a_100011215000_100102629194 [0,2,0,0,0,0|1,0,1]=4 11984 B16R0.68 C/C=C/COC(C)CCCCCCCCCC 7a_100011215000_100102629194 [0,2,0,0,0,0|1,0,1]=4 11985 B16R0.68 C=CCCCC(=O)CCCCCCCCCC 1458a_100000210375_100000757094 [0,2,0,0,0,0|1,0,0]=3 11986 B16R0.68 C=CCCCC(=O)CCCCCCCCCC 1458a_100000766728_100000210319 [0,2,0,0,0,0|1,0,0]=3 11987 B16R0.68 C=CCCCC(=O)CCCCCCCCCF 1458a_200009909015_100000757094 [0,2,0,0,0,0|1,0,1]=4 11988 B16R0.68 C=CCCCC(=O)CCCCCCCCCO 1458a_100000766728_100009813782 [0,2,0,0,0,0|1,0,1]=4 11989 B16R0.68 C=CCCCC(=O)COCCCCCCCC 1458a_100000759886_100000757094 [0,2,0,0,0,0|1,0,1]=4 11990 B16R0.68 C=CCCCC(=O)NCCCCCCCCC 11a_100000212291_100000766728 [0,2,0,0,0,0|1,0,1]=4 11991 B16R0.68 C=CCCCC(=O)NCCCCCCCCC 1626a_100000212291_100000766728 [0,2,0,0,0,0|1,0,1]=4 11992 B16R0.68 C=CCCCC(=O)NCCCCCCCCC 240690a_100000212291_100000766728 [0,2,0,0,0,0|1,0,1]=4 11993 B16R0.68 C=CCCCC(=O)NCCCCCCCCC 527a_100000212291_100000766728 [0,2,0,0,0,0|1,0,1]=4 11994 B16R0.68 C=CCCCCCCCCC(=O)CCCCC 1458a_100000211349_100000210326 [0,2,0,0,0,0|1,0,0]=3 11995 B16R0.68 C=CCCCCCCCCC(=O)CCCCC 1458a_100000212188_100011933949 [0,2,0,0,0,0|1,0,0]=3 11996 B16R0.68 C=CCCCCCCCCC(=O)CCCCF 1458a_100000211349_100000729493 [0,2,0,0,0,0|1,0,1]=4 11997 B16R0.68 C=CCCCCCCCCC(=O)CCCCO 1458a_100000211349_100000210776 [0,2,0,0,0,0|1,0,1]=4 11998 B16R0.68 C=CCCCCCCCCC(=O)CCCCO 1458a_100000695505_100011933949 [0,2,0,0,0,0|1,0,1]=4 11999 B16R0.68 C=CCCCCCCCCC(=O)CCCOC 1458a_100000211349_100000740836 [0,2,0,0,0,0|1,0,1]=4 12000 B16R0.68 C=CCCCCCCCCC(=O)CCCOC 1458a_100000741012_100011933949 [0,2,0,0,0,0|1,0,1]=4 12001 B16R0.68 C=CCCCCCCCCC(=O)CCCSC 1458a_100000173376_100011933949 [0,2,0,0,0,0|1,0,1]=4 12002 B16R0.68 C=CCCCCCCCCC(=O)CCOCC 1458a_100000211349_100011215890 [0,2,0,0,0,0|1,0,1]=4 12003 B16R0.68 C=CCCCCCCCCC(=O)CCOCC 1458a_100000749530_100011933949 [0,2,0,0,0,0|1,0,1]=4 12004 B16R0.68 C=CCCCCCCCCC(=O)CCSCC 1458a_100000211349_100000757381 [0,2,0,0,0,0|1,0,1]=4 12005 B16R0.68 C=CCCCCCCCCC(=O)CCSCC 1458a_100000230768_100011933949 [0,2,0,0,0,0|1,0,1]=4 12006 B16R0.68 C=CCCCCCCCCC(=O)COCCC 1458a_100000745993_100011933949 [0,2,0,0,0,0|1,0,1]=4 12007 B16R0.68 C=CCCCCCCCCC(=O)CSCCC 1458a_100000217233_100011933949 [0,2,0,0,0,0|1,0,1]=4 12008 B16R0.68 C=CCCCCCCCCC(=O)NCCCC 11a_100000102301_100000211349 [0,2,0,0,0,0|1,0,1]=4 12009 B16R0.68 C=CCCCCCCCCC(=O)NCCCC 1626a_100000102301_100000211349 [0,2,0,0,0,0|1,0,1]=4 12010 B16R0.68 C=CCCCCCCCCC(=O)NCCCC 240690a_100000102301_100000211349 [0,2,0,0,0,0|1,0,1]=4 12011 B16R0.68 C=CCCCCCCCCC(=O)NCCCC 527a_100000102301_100000211349 [0,2,0,0,0,0|1,0,1]=4 12012 B16R0.68 C=CCCCCCCCCN(C)CCCCC 2230a_100000223495_100011933949 [0,2,0,0,0,0|1,0,0]=3 12013 B16R0.68 C=CCCCCCCCCN(C)CCCCC 269982a_100000223495_100011933949 [0,2,0,0,0,0|1,0,0]=3 12014 B16R0.68 C=CCCCCCCCCN(C)CCCCO 2230a_100000717598_100011933949 [0,2,0,0,0,0|2,0,0]=4 12015 B16R0.68 C=CCCCCCCCCN(C)CCCCO 269982a_100000717598_100011933949 [0,2,0,0,0,0|2,0,0]=4 12016 B16R0.68 C=CCCCCCCCCN(C)CCCOC 2230a_100000224831_100011933949 [0,2,0,0,0,0|2,0,0]=4 12017 B16R0.68 C=CCCCCCCCCN(C)CCCOC 269982a_100000224831_100011933949 [0,2,0,0,0,0|2,0,0]=4 12018 B16R0.68 C=CCCCCCCCNC(C)CCCCC 2230a_100000211957_100012355270 [0,2,0,0,0,0|1,0,0]=3 12019 B16R0.68 C=CCCCCCCCOC(C)CCCCC 34a_100000730831_200011218191 [0,2,0,0,0,0|1,0,0]=3 12020 B16R0.68 C=CCCCCCCCOC(C)CCCCC 34a_100011215632_100012355270 [0,2,0,0,0,0|1,0,0]=3 12021 B16R0.68 C=CCCCCCCCOC(C)CCCCC 7a_100000730831_200011218191 [0,2,0,0,0,0|1,0,0]=3 12022 B16R0.68 C=CCCCCCCCOC(C)CCCCC 7a_100011215632_100012355270 [0,2,0,0,0,0|1,0,0]=3 12023 B16R0.68 C=CCCCCCCCOC(C)CCCOC 34a_200011539412_100012355270 [0,2,0,0,0,0|2,0,0]=4 12024 B16R0.68 C=CCCCCCCCOC(C)CCCOC 7a_200011539412_100012355270 [0,2,0,0,0,0|2,0,0]=4 12025 B16R0.68 C=CCCCCCCOCC(=O)CCCCC 34a_200011216477_200012276598 [0,2,0,0,0,0|1,0,1]=4 12026 B16R0.68 C=CCCCCCCOCC(=O)CCCCC 7a_200011216477_200012276598 [0,2,0,0,0,0|1,0,1]=4 12027 B16R0.68 C=CCCCCCCOC[C@@H](N)CCCCN 34a_100016993712_100011215473 [0,2,0,0,0,0|2,0,0]=4 12028 B16R0.68 C=CCCCCCCSCC(=O)CCCCC 62a_100011215473_200012276598 [0,2,0,0,0,0|1,0,1]=4 12029 B16R0.68 C=CCCCCCCSCC(=O)CCCCC 62a_200012276598_100011215473 [0,2,0,0,0,0|1,0,1]=4 12030 B16R0.68 C=CCCCN(C)CCCCCCCCCC 2230a_100000207566_100011713584 [0,2,0,0,0,0|1,0,0]=3 12031 B16R0.68 C=CCCCN(C)CCCCCCCCCC 269982a_100000207566_100000757094 [0,2,0,0,0,0|1,0,0]=3 12032 B16R0.68 C=CCCNC(=O)CCCCCCCCCC 11a_100015191253_100000210375 [0,2,0,0,0,0|1,0,1]=4 12033 B16R0.68 C=CCCNC(=O)CCCCCCCCCC 1626a_100015191253_100000210375 [0,2,0,0,0,0|1,0,1]=4 12034 B16R0.68 C=CCCNC(=O)CCCCCCCCCC 240690a_100015191253_100000210375 [0,2,0,0,0,0|1,0,1]=4 12035 B16R0.68 C=CCCNC(C)CCCCCCCCCC 270004a_100015191253_200011219864 [0,2,0,0,0,0|1,0,0]=3 12036 B16R0.68 C=CCCOC(C)CCCCCCCCCC 34a_100011215000_100000754431 [0,2,0,0,0,0|1,0,0]=3 12037 B16R0.68 C=CCCOC(C)CCCCCCCCCC 7a_100011215000_100000754431 [0,2,0,0,0,0|1,0,0]=3 12038 B16R0.68 C=CCSCC(=O)CCCCCCCCCC 1458a_100000230395_100000210319 [0,2,0,0,0,0|1,0,1]=4 12039 B16R0.68 C=COCCC(=O)CCCCCCCCCC 1458a_100000210375_100000039644 [0,2,0,0,0,0|1,0,1]=4 12040 B16R0.68 C=COCCN(C)CCCCCCCCCC 2230a_100000207566_100000039644 [0,2,0,0,0,0|2,0,0]=4 12041 B16R0.68 C=COCCN(C)CCCCCCCCCC 269982a_100000207566_100000039644 [0,2,0,0,0,0|2,0,0]=4 12042 B16R0.68 CC=CCOC(C)CCCCCCCCCC 34a_100011215000_100000070051 [0,2,0,0,0,0|1,0,1]=4 12043 B16R0.68 CC=CCOC(C)CCCCCCCCCC 7a_100011215000_100000070051 [0,2,0,0,0,0|1,0,1]=4 12044 B16R0.68 CCCCCC(=O)CCCCCCCCCF 1458a_200009909015_100000210326 [0,2,0,0,0,0|1,0,1]=4 12045 B16R0.68 CCCCCC(=O)CCCCCCCCCO 1458a_100000212188_100009813782 [0,2,0,0,0,0|0,0,2]=4 12046 B16R0.68 CCCCCC(C)NCCCCCCCCO 2230a_100000211957_100000033203 [0,2,0,0,0,0|0,0,2]=4 12047 B16R0.68 CCCCCC(C)NCCCCCCCCO 2230a_102515433106_200011218191 [0,2,0,0,0,0|0,0,2]=4 12048 B16R0.68 CCCCCC(C)NCCCCCCCCO 270004a_102515433106_100000211708 [0,2,0,0,0,0|0,0,2]=4 12049 B16R0.68 CCCCCC(C)NCCCCCCCCO 34a_102515433106_200011218191 [0,2,0,0,0,0|0,0,2]=4 12050 B16R0.68 CCCCCC(C)OCCCCCCCCBr 34a_100009813846_200011218191 [0,2,0,0,0,0|1,0,1]=4 12051 B16R0.68 CCCCCC(C)OCCCCCCCCBr 7a_100009813846_200011218191 [0,2,0,0,0,0|1,0,1]=4 12052 B16R0.68 CCCCCC(C)OCCCCCCCCCl 34a_100000033203_200011218191 [0,2,0,0,0,0|1,0,1]=4 12053 B16R0.68 CCCCCC(C)OCCCCCCCCCl 7a_100000033203_200011218191 [0,2,0,0,0,0|1,0,1]=4 12054 B16R0.68 CCCCCC(C)OCCCCCCCCN 34a_102515433106_200011218191 [0,2,0,0,0,0|1,0,1]=4 12055 B16R0.68 CCCCCC(C)OCCCCCCCCO 34a_100011215632_100000033203 [0,2,0,0,0,0|0,0,2]=4 12056 B16R0.68 CCCCCC(C)OCCCCCCCCO 7a_100011215632_100000033203 [0,2,0,0,0,0|0,0,2]=4 12057 B16R0.68 CCCCCC(C)SCCCCCCCCO 62a_100000033203_200011218191 [0,2,0,0,0,0|0,0,2]=4 12058 B16R0.68 CCCCCC(C)SCCCCCCCCO 62a_200011218191_100000033203 [0,2,0,0,0,0|0,0,2]=4 12059 B16R0.68 CCCCCCCCCCC(=O)CCCC#N 1458a_100000075515_100000210319 [0,2,0,0,0,0|1,0,1]=4 12060 B16R0.68 CCCCCCCCCCC(=O)CCCC#N 1458a_100000210375_100000211468 [0,2,0,0,0,0|1,0,1]=4 12061 B16R0.68 CCCCCCCCCCC(=O)CCCCC 1458a_100000210375_100000210326 [0,2,0,0,0,0|1,0,1]=4 12062 B16R0.68 CCCCCCCCCCC(=O)CCCCC 1458a_100000212188_100000210319 [0,2,0,0,0,0|1,0,1]=4 12063 B16R0.68 CCCCCCCCCCC(=O)CCCCF 1458a_100000210375_100000729493 [0,2,0,0,0,0|1,0,1]=4 12064 B16R0.68 CCCCCCCCCCC(=O)CCCCO 1458a_100000210375_100000210776 [0,2,0,0,0,0|0,0,2]=4 12065 B16R0.68 CCCCCCCCCCC(=O)CCCCO 1458a_100000695505_100000210319 [0,2,0,0,0,0|0,0,2]=4 12066 B16R0.68 CCCCCCCCCCC(=O)CCCOC 1458a_100000210375_100000740836 [0,2,0,0,0,0|2,0,0]=4 12067 B16R0.68 CCCCCCCCCCC(=O)CCCOC 1458a_100000741012_100000210319 [0,2,0,0,0,0|2,0,0]=4 12068 B16R0.68 CCCCCCCCCCC(=O)CCCSC 1458a_100000173376_100000210319 [0,2,0,0,0,0|2,0,0]=4 12069 B16R0.68 CCCCCCCCCCC(C)NCCC#N 270004a_100000720768_200011219864 [0,2,0,0,0,0|1,0,1]=4 12070 B16R0.68 CCCCCCCCCCC(C)NCCCC 270004a_100000102301_200011219864 [0,2,0,0,0,0|1,0,1]=4 12071 B16R0.68 CCCCCCCCCCC(C)NCCCF 270004a_100015189416_200011219864 [0,2,0,0,0,0|1,0,1]=4 12072 B16R0.68 CCCCCCCCCCC(C)NCCCO 270004a_100000182051_200011219864 [0,2,0,0,0,0|0,0,2]=4 12073 B16R0.68 CCCCCCCCCCC(C)NCCOC 270004a_100000209980_200011219864 [0,2,0,0,0,0|2,0,0]=4 12074 B16R0.68 CCCCCCCCCCC(C)NCCSC 270004a_100020590264_200011219864 [0,2,0,0,0,0|2,0,0]=4 12075 B16R0.68 CCCCCCCCCCC(C)OCCC#N 7a_100011215000_100000184422 [0,2,0,0,0,0|1,0,1]=4 12076 B16R0.68 CCCCCCCCCCC(C)OCCCC 34a_100011215000_100000210210 [0,2,0,0,0,0|1,0,1]=4 12077 B16R0.68 CCCCCCCCCCC(C)OCCCC 7a_100011215000_100000210211 [0,2,0,0,0,0|1,0,1]=4 12078 B16R0.68 CCCCCCCCCCC(C)OCCCF 34a_100011215000_100011934791 [0,2,0,0,0,0|1,0,1]=4 12079 B16R0.68 CCCCCCCCCCC(C)OCCCF 7a_100011215000_100011934791 [0,2,0,0,0,0|1,0,1]=4 12080 B16R0.68 CCCCCCCCCCC(C)OCCCO 34a_100011215000_100000230001 [0,2,0,0,0,0|0,0,2]=4 12081 B16R0.68 CCCCCCCCCCC(C)OCCCO 7a_100011215000_100011215043 [0,2,0,0,0,0|0,0,2]=4 12082 B16R0.68 CCCCCCCCCCC(C)OCCOC 34a_100011215000_100011201679 [0,2,0,0,0,0|2,0,0]=4 12083 B16R0.68 CCCCCCCCCCC(C)OCCOC 7a_100011215000_100000233755 [0,2,0,0,0,0|2,0,0]=4 12084 B16R0.68 CCCCCCCCCCC(C)OCCSC 34a_100011215000_100000212216 [0,2,0,0,0,0|2,0,0]=4 12085 B16R0.68 CCCCCCCCCCC(C)OCCSC 7a_100011215000_100000212216 [0,2,0,0,0,0|2,0,0]=4 12086 B16R0.68 CCCCCCCCCCN(C)CCCC#N 2230a_100000207566_100000687738 [0,2,0,0,0,0|1,0,1]=4 12087 B16R0.68 CCCCCCCCCCN(C)CCCC#N 269982a_100000207566_100000687738 [0,2,0,0,0,0|1,0,1]=4 12088 B16R0.68 CCCCCCCCCCN(C)CCCC=O 2230a_100000207566_200011292268 [0,2,0,0,0,0|0,0,0]=2 12089 B16R0.68 CCCCCCCCCCN(C)CCCC=O 269982a_100000207566_200011292268 [0,2,0,0,0,0|0,0,0]=2 12090 B16R0.68 CCCCCCCCCCN(C)CCCCC 2230a_100000207566_100000210326 [0,2,0,0,0,0|1,0,1]=4 12091 B16R0.68 CCCCCCCCCCN(C)CCCCC 2230a_100000223495_100000210320 [0,2,0,0,0,0|1,0,1]=4 12092 B16R0.68 CCCCCCCCCCN(C)CCCCC 269982a_100000207566_100000210215 [0,2,0,0,0,0|1,0,1]=4 12093 B16R0.68 CCCCCCCCCCN(C)CCCCC 269982a_100000223495_100000210320 [0,2,0,0,0,0|1,0,1]=4 12094 B16R0.68 CCCCCCCCCCN(C)CCCCF 2230a_100000207566_100000729493 [0,2,0,0,0,0|1,0,1]=4 12095 B16R0.68 CCCCCCCCCCN(C)CCCCF 269982a_100000207566_100000729493 [0,2,0,0,0,0|1,0,1]=4 12096 B16R0.68 CCCCCCCCCCN(C)CCCCO 2230a_100000207566_100000210776 [0,2,0,0,0,0|0,0,2]=4 12097 B16R0.68 CCCCCCCCCCN(C)CCCCO 2230a_100000717598_100000210320 [0,2,0,0,0,0|0,0,2]=4 12098 B16R0.68 CCCCCCCCCCN(C)CCCCO 269982a_100000207566_100000210776 [0,2,0,0,0,0|0,0,2]=4 12099 B16R0.68 CCCCCCCCCCN(C)CCCCO 269982a_100000717598_100000210320 [0,2,0,0,0,0|0,0,2]=4 12100 B16R0.68 CCCCCCCCCCN(C)CCCOC 2230a_100000207566_100000740836 [0,2,0,0,0,0|2,0,0]=4 12101 B16R0.68 CCCCCCCCCCN(C)CCCOC 2230a_100000224831_100000210320 [0,2,0,0,0,0|2,0,0]=4 12102 B16R0.68 CCCCCCCCCCN(C)CCCOC 269982a_100000207566_100000740836 [0,2,0,0,0,0|2,0,0]=4 12103 B16R0.68 CCCCCCCCCCN(C)CCCOC 269982a_100000224831_100000210320 [0,2,0,0,0,0|2,0,0]=4 12104 B16R0.68 CCCCCCCCCNC(C)CCCC#N 270004a_100000212291_200000032708 [0,2,0,0,0,0|1,0,1]=4 12105 B16R0.68 CCCCCCCCCNC(C)CCCCC 2230a_100000211957_100011214924 [0,2,0,0,0,0|1,0,1]=4 12106 B16R0.68 CCCCCCCCCNC(C)CCCCC 2230a_100000212291_200011218191 [0,2,0,0,0,0|1,0,1]=4 12107 B16R0.68 CCCCCCCCCNC(C)CCCCC 270004a_100000212291_100000211708 [0,2,0,0,0,0|1,0,1]=4 12108 B16R0.68 CCCCCCCCCNC(C)CCCCC 34a_100000212291_200011218191 [0,2,0,0,0,0|1,0,1]=4 12109 B16R0.68 CCCCCCCCCNC(C)CCCSC 270004a_100000212291_100011399439 [0,2,0,0,0,0|2,0,0]=4 12110 B16R0.68 CCCCCCCCCOC(C)CCCCC 34a_100000210712_200011218191 [0,2,0,0,0,0|1,0,1]=4 12111 B16R0.68 CCCCCCCCCOC(C)CCCCC 34a_100011215632_100011214924 [0,2,0,0,0,0|1,0,1]=4 12112 B16R0.68 CCCCCCCCCOC(C)CCCCC 7a_100000210712_200011218191 [0,2,0,0,0,0|1,0,1]=4 12113 B16R0.68 CCCCCCCCCOC(C)CCCCC 7a_100011215632_100000210328 [0,2,0,0,0,0|1,0,1]=4 12114 B16R0.68 CCCCCCCCCOC(C)CCCOC 34a_200011539412_100011214924 [0,2,0,0,0,0|2,0,0]=4 12115 B16R0.68 CCCCCCCCCOC(C)CCCOC 7a_200011539412_100000210328 [0,2,0,0,0,0|2,0,0]=4 12116 B16R0.68 CCCCCCCCOC[C@@H](N)CCCCN 34a_100016993712_100000210759 [0,2,0,0,0,0|1,0,1]=4 12117 B16R0.68 CCCCCN(C)CCCCCCCCCO 2230a_100000223495_100009813782 [0,2,0,0,0,0|0,0,2]=4 12118 B16R0.68 CCCCCN(C)CCCCCCCCCO 269982a_100000223495_100009813782 [0,2,0,0,0,0|0,0,2]=4 12119 B16R0.136 C#CCCCCCC(=O)CCCCCCCC 1458a_100000210188_100012094781 [0,2,0,0,0,0|1,0,1]=4 12120 B16R0.136 C#CCCCCCC(=O)CCCCCCCC 1458a_100000694772_100000210759 [0,2,0,0,0,0|1,0,1]=4 12121 B16R0.136 C#CCCCCCCC(=O)CCCCCCC 1458a_100000034748_100000210614 [0,2,0,0,0,0|1,0,1]=4 12122 B16R0.136 C#CCCCCCCC(=O)CCCCCCC 1458a_100000211969_100012276617 [0,2,0,0,0,0|1,0,1]=4 12123 B16R0.136 C#CCCCCCCN(C)CCCCCCC 2230a_100000228206_100012276617 [0,2,0,0,0,0|1,0,1]=4 12124 B16R0.136 C#CCCCCCCN(C)CCCCCCC 269982a_100000228206_100012276617 [0,2,0,0,0,0|1,0,1]=4 12125 B16R0.136 C#CCCCCCN(C)CCCCCCCC 2230a_100000207567_100012094781 [0,2,0,0,0,0|1,0,1]=4 12126 B16R0.136 C#CCCCCCN(C)CCCCCCCC 269982a_100000207567_100012094781 [0,2,0,0,0,0|1,0,1]=4 12127 B16R0.136 C#CCCCCCOC(C)CCCCCCC 34a_100000766912_200011218727 [0,2,0,0,0,0|1,0,1]=4 12128 B16R0.136 C#CCCCCCOC(C)CCCCCCC 34a_200011215852_100012094781 [0,2,0,0,0,0|1,0,1]=4 12129 B16R0.136 C#CCCCCCOC(C)CCCCCCC 7a_100000766912_200011218727 [0,2,0,0,0,0|1,0,1]=4 12130 B16R0.136 C#CCCCCCOC(C)CCCCCCC 7a_200011215852_100012094781 [0,2,0,0,0,0|1,0,1]=4 12131 B16R0.136 C#CCCCCCSC(C)CCCCCCC 62a_100012094781_200011218727 [0,2,0,0,0,0|1,0,1]=4 12132 B16R0.136 C#CCCCCCSC(C)CCCCCCC 62a_200011218727_100012094781 [0,2,0,0,0,0|1,0,1]=4 12133 B16R0.136 C#CCCCCOC(C)CCCCCCCC 34a_100000210740_100010269958 [0,2,0,0,0,0|1,0,1]=4 12134 B16R0.136 C#CCCCCOC(C)CCCCCCCC 7a_100000210740_100010269958 [0,2,0,0,0,0|1,0,1]=4 12135 B16R0.136 C#CCCCNCC(C)CCCCCCCC 270004a_100000718082_100011995885 [0,2,0,0,0,0|1,0,1]=4 12136 B16R0.136 C#CCCCOCC(C)CCCCCCCC 34a_200012125181_100000695029 [0,2,0,0,0,0|1,0,1]=4 12137 B16R0.136 C#CCCCOCC(C)CCCCCCCC 7a_200012125181_100011215417 [0,2,0,0,0,0|1,0,1]=4 12138 B16R0.136 C=CCCCCCC(=O)CCCCCCCC 1458a_100000210188_100000700193 [0,2,0,0,0,0|1,0,0]=3 12139 B16R0.136 C=CCCCCCC(=O)CCCCCCCC 1458a_100011934241_100000210759 [0,2,0,0,0,0|1,0,0]=3 12140 B16R0.136 C=CCCCCCC(=O)CCCCCCCO 1458a_100011219782_100000700193 [0,2,0,0,0,0|1,0,1]=4 12141 B16R0.136 C=CCCCCCC(=O)CCCCCCCO 1458a_100011934241_100000760002 [0,2,0,0,0,0|1,0,1]=4 12142 B16R0.136 C=CCCCCCC(=O)CCCCCCOC 1458a_100011934241_100011998445 [0,2,0,0,0,0|1,0,1]=4 12143 B16R0.136 C=CCCCCCC(=O)NCCCCCCC 11a_100000229938_100011934241 [0,2,0,0,0,0|1,0,1]=4 12144 B16R0.136 C=CCCCCCC(=O)NCCCCCCC 1626a_100000229938_100011934241 [0,2,0,0,0,0|1,0,1]=4 12145 B16R0.136 C=CCCCCCC(=O)NCCCCCCC 240690a_100000229938_100011934241 [0,2,0,0,0,0|1,0,1]=4 12146 B16R0.136 C=CCCCCCC(=O)NCCCCCCC 527a_100000229938_100011934241 [0,2,0,0,0,0|1,0,1]=4 12147 B16R0.136 C=CCCCCCCC(=O)CCCCCCC 1458a_100000211969_100011215473 [0,2,0,0,0,0|1,0,0]=3 12148 B16R0.136 C=CCCCCCCC(=O)CCCCCCC 1458a_100011809334_100000210614 [0,2,0,0,0,0|1,0,0]=3 12149 B16R0.136 C=CCCCCCCC(=O)CCCCCCF 1458a_100011809334_100015922095 [0,2,0,0,0,0|1,0,1]=4 12150 B16R0.136 C=CCCCCCCC(=O)CCCCCCO 1458a_100011809334_100000766143 [0,2,0,0,0,0|1,0,1]=4 12151 B16R0.136 C=CCCCCCCC(=O)CCCCCCO 1458a_100011996774_100011215473 [0,2,0,0,0,0|1,0,1]=4 12152 B16R0.136 C=CCCCCCCC(=O)CCCCCOC 1458a_100011935119_100011215473 [0,2,0,0,0,0|1,0,1]=4 12153 B16R0.136 C=CCCCCCCC(=O)CCOCCCC 1458a_100011809334_100000743108 [0,2,0,0,0,0|1,0,1]=4 12154 B16R0.136 C=CCCCCCCC(=O)NCCCCCC 11a_100000210581_100011809334 [0,2,0,0,0,0|1,0,1]=4 12155 B16R0.136 C=CCCCCCCC(=O)NCCCCCC 1626a_100000210581_100011809334 [0,2,0,0,0,0|1,0,1]=4 12156 B16R0.136 C=CCCCCCCC(=O)NCCCCCC 240690a_100000210581_100011809334 [0,2,0,0,0,0|1,0,1]=4 12157 B16R0.136 C=CCCCCCCC(=O)NCCCCCC 527a_100000210581_100011809334 [0,2,0,0,0,0|1,0,1]=4 12158 B16R0.136 C=CCCCCCCN(C)CCCCCCC 2230a_100000228206_100011215473 [0,2,0,0,0,0|1,0,0]=3 12159 B16R0.136 C=CCCCCCCN(C)CCCCCCC 269982a_100000228206_100011215473 [0,2,0,0,0,0|1,0,0]=3 12160 B16R0.136 C=CCCCCCN(C)CCCCCCCC 2230a_100000207567_100000700193 [0,2,0,0,0,0|1,0,0]=3 12161 B16R0.136 C=CCCCCCN(C)CCCCCCCC 269982a_100000207567_100000700193 [0,2,0,0,0,0|1,0,0]=3 12162 B16R0.136 C=CCCCCCOC(C)CCCCCCC 34a_100011216702_200011218727 [0,2,0,0,0,0|1,0,0]=3 12163 B16R0.136 C=CCCCCCOC(C)CCCCCCC 34a_200011215852_100000700193 [0,2,0,0,0,0|1,0,0]=3 12164 B16R0.136 C=CCCCCCOC(C)CCCCCCC 7a_100011216702_200011218727 [0,2,0,0,0,0|1,0,0]=3 12165 B16R0.136 C=CCCCCCOC(C)CCCCCCC 7a_200011215852_100000700193 [0,2,0,0,0,0|1,0,0]=3 12166 B16R0.136 C=CCCCCNC(=O)CCCCCCCC 11a_100000703577_100000210188 [0,2,0,0,0,0|1,0,1]=4 12167 B16R0.136 C=CCCCCNC(=O)CCCCCCCC 1626a_100000703577_100000210188 [0,2,0,0,0,0|1,0,1]=4 12168 B16R0.136 C=CCCCCNC(=O)CCCCCCCC 240690a_100000703577_100000210188 [0,2,0,0,0,0|1,0,1]=4 12169 B16R0.136 C=CCCCCNC(=O)CCCCCCCC 527a_100000703577_100000210188 [0,2,0,0,0,0|1,0,1]=4 12170 B16R0.136 C=CCCCCNC(C)CCCCCCCC 270004a_100000703577_100011216694 [0,2,0,0,0,0|1,0,0]=3 12171 B16R0.136 C=CCCCCOC(C)CCCCCCCC 34a_100000210740_100011215482 [0,2,0,0,0,0|1,0,0]=3 12172 B16R0.136 C=CCCCCOC(C)CCCCCCCC 7a_100000210740_100011215482 [0,2,0,0,0,0|1,0,0]=3 12173 B16R0.136 C=CCCCNCC(C)CCCCCCCC 270004a_100000700776_100011995885 [0,2,0,0,0,0|1,0,0]=3 12174 B16R0.136 C=CCCCOCC(C)CCCCCCCC 34a_200012125181_100000757094 [0,2,0,0,0,0|1,0,0]=3 12175 B16R0.136 C=CCCCOCC(C)CCCCCCCC 7a_200012125181_100000757094 [0,2,0,0,0,0|1,0,0]=3 12176 B16R0.136 C=COCCCCOC(C)CCCCCCC 34a_100000031558_200011218727 [0,2,0,0,0,0|2,0,0]=4 12177 B16R0.136 C=COCCCCOC(C)CCCCCCC 7a_100000031558_200011218727 [0,2,0,0,0,0|2,0,0]=4 12178 B16R0.136 C=COCCCNC(C)CCCCCCCC 270004a_100000210767_100011216694 [0,2,0,0,0,0|2,0,0]=4 12179 B16R0.136 C=COCCOCC(C)CCCCCCCC 34a_200012125181_100000039644 [0,2,0,0,0,0|2,0,0]=4 12180 B16R0.136 C=COCCOCC(C)CCCCCCCC 7a_200012125181_100000039644 [0,2,0,0,0,0|2,0,0]=4 12181 B16R0.136 CCCCCCCC(=O)CCCCCCC#N 1458a_100000211969_100009813337 [0,2,0,0,0,0|1,0,1]=4 12182 B16R0.136 CCCCCCCC(=O)CCCCCCCO 1458a_100000211969_100000760002 [0,2,0,0,0,0|0,0,2]=4 12183 B16R0.136 CCCCCCCC(=O)CCCCCCCO 1458a_100011219782_100000210614 [0,2,0,0,0,0|0,0,2]=4 12184 B16R0.136 CCCCCCCC(=O)CCCCCCOC 1458a_100000211969_100011998445 [0,2,0,0,0,0|2,0,0]=4 12185 B16R0.136 CCCCCCCC(=O)OCSCCCC=O 62a_200011292268_100009852258 [0,2,0,0,0,0|1,0,1]=4 12186 B16R0.136 CCCCCCCC(C)NCCCCCC#N 270004a_100000061152_100000210596 [0,2,0,0,0,0|1,0,1]=4 12187 B16R0.136 CCCCCCCC(C)NCCCCCCO 2230a_100000686447_200011218727 [0,2,0,0,0,0|0,0,2]=4 12188 B16R0.136 CCCCCCCC(C)NCCCCCCO 270004a_100000686447_100000210596 [0,2,0,0,0,0|0,0,2]=4 12189 B16R0.136 CCCCCCCC(C)NCCCCCCO 34a_100000686447_200011218727 [0,2,0,0,0,0|0,0,2]=4 12190 B16R0.136 CCCCCCCC(C)NCCCCCOC 2230a_100000747528_200011218727 [0,2,0,0,0,0|2,0,0]=4 12191 B16R0.136 CCCCCCCC(C)NCCCCCOC 270004a_100000747528_100000210596 [0,2,0,0,0,0|2,0,0]=4 12192 B16R0.136 CCCCCCCC(C)NCCCCCOC 34a_100000747528_200011218727 [0,2,0,0,0,0|2,0,0]=4 12193 B16R0.136 CCCCCCCC(C)OCCCCCC#N 7a_200011215852_100009813376 [0,2,0,0,0,0|1,0,1]=4 12194 B16R0.136 CCCCCCCC(C)OCCCCCC=O 7a_200011215852_100000139337 [0,2,0,0,0,0|0,0,0]=2 12195 B16R0.136 CCCCCCCC(C)OCCCCCCBr 34a_100011215345_200011218727 [0,2,0,0,0,0|1,0,1]=4 12196 B16R0.136 CCCCCCCC(C)OCCCCCCBr 7a_100011215345_200011218727 [0,2,0,0,0,0|1,0,1]=4 12197 B16R0.136 CCCCCCCC(C)OCCCCCCCl 34a_100000766143_200011218727 [0,2,0,0,0,0|1,0,1]=4 12198 B16R0.136 CCCCCCCC(C)OCCCCCCCl 7a_100000766143_200011218727 [0,2,0,0,0,0|1,0,1]=4 12199 B16R0.136 CCCCCCCC(C)OCCCCCCF 34a_100000732779_200011218727 [0,2,0,0,0,0|1,0,1]=4 12200 B16R0.136 CCCCCCCC(C)OCCCCCCF 34a_200011215852_100015922095 [0,2,0,0,0,0|1,0,1]=4 12201 B16R0.136 CCCCCCCC(C)OCCCCCCF 7a_100000732779_200011218727 [0,2,0,0,0,0|1,0,1]=4 12202 B16R0.136 CCCCCCCC(C)OCCCCCCF 7a_200011215852_100015922095 [0,2,0,0,0,0|1,0,1]=4 12203 B16R0.136 CCCCCCCC(C)OCCCCCCN 34a_100000686447_200011218727 [0,2,0,0,0,0|1,0,1]=4 12204 B16R0.136 CCCCCCCC(C)OCCCCCCO 34a_200011215852_100000766143 [0,2,0,0,0,0|0,0,2]=4 12205 B16R0.136 CCCCCCCC(C)OCCCCCCO 7a_200011215852_100000766143 [0,2,0,0,0,0|0,0,2]=4 12206 B16R0.136 CCCCCCCC(C)OCCCCCNC 34a_100000722520_200011218727 [0,2,0,0,0,0|2,0,0]=4 12207 B16R0.136 CCCCCCCC(C)SCCCCCC#N 62a_100009813376_200011218727 [0,2,0,0,0,0|1,0,1]=4 12208 B16R0.136 CCCCCCCC(C)SCCCCCC#N 62a_200011218727_100009813376 [0,2,0,0,0,0|1,0,1]=4 12209 B16R0.136 CCCCCCCC(C)SCCCCCC=O 62a_100000139337_200011218727 [0,2,0,0,0,0|0,0,0]=2 12210 B16R0.136 CCCCCCCC(C)SCCCCCC=O 62a_200011218727_100000139337 [0,2,0,0,0,0|0,0,0]=2 12211 B16R0.136 CCCCCCCC(C)SCCCCCCO 62a_100000766143_200011218727 [0,2,0,0,0,0|0,0,2]=4 12212 B16R0.136 CCCCCCCC(C)SCCCCCCO 62a_200011218727_100000766143 [0,2,0,0,0,0|0,0,2]=4 12213 B16R0.136 CCCCCCCCC(=O)CCCCCC#N 1458a_100000210188_100009813376 [0,2,0,0,0,0|1,0,1]=4 12214 B16R0.136 CCCCCCCCC(=O)CCCCCCC 1458a_100000210188_100000210614 [0,2,0,0,0,0|1,0,1]=4 12215 B16R0.136 CCCCCCCCC(=O)CCCCCCC 1458a_100000211969_100000210759 [0,2,0,0,0,0|1,0,1]=4 12216 B16R0.136 CCCCCCCCC(=O)CCCCCCF 1458a_100000210188_100015922095 [0,2,0,0,0,0|1,0,1]=4 12217 B16R0.136 CCCCCCCCC(=O)CCCCCCO 1458a_100000210188_100000766143 [0,2,0,0,0,0|0,0,2]=4 12218 B16R0.136 CCCCCCCCC(=O)CCCCCCO 1458a_100011996774_100000210759 [0,2,0,0,0,0|0,0,2]=4 12219 B16R0.136 CCCCCCCCC(=O)CCCCCOC 1458a_100011935119_100000210759 [0,2,0,0,0,0|2,0,0]=4 12220 B16R0.136 CCCCCCCCC(C)CNCCCCC 270004a_100000209983_100011995885 [0,2,0,0,0,0|1,0,1]=4 12221 B16R0.136 CCCCCCCCC(C)CNCCCCO 270004a_100000750430_100011995885 [0,2,0,0,0,0|0,0,2]=4 12222 B16R0.136 CCCCCCCCC(C)CNCCCOC 270004a_100150723488_100011995885 [0,2,0,0,0,0|2,0,0]=4 12223 B16R0.136 CCCCCCCCC(C)CNCCCSC 270004a_100000749238_100011995885 [0,2,0,0,0,0|2,0,0]=4 12224 B16R0.136 CCCCCCCCC(C)COCCCC#N 7a_200012125181_100000687738 [0,2,0,0,0,0|1,0,1]=4 12225 B16R0.136 CCCCCCCCC(C)COCCCC=O 7a_200012125181_200011292268 [0,2,0,0,0,0|0,0,0]=2 12226 B16R0.136 CCCCCCCCC(C)COCCCCC 34a_200012125181_100000718602 [0,2,0,0,0,0|1,0,1]=4 12227 B16R0.136 CCCCCCCCC(C)COCCCCC 7a_200012125181_100000210326 [0,2,0,0,0,0|1,0,1]=4 12228 B16R0.136 CCCCCCCCC(C)COCCCCF 34a_200012125181_100000729493 [0,2,0,0,0,0|1,0,1]=4 12229 B16R0.136 CCCCCCCCC(C)COCCCCF 7a_200012125181_100000729493 [0,2,0,0,0,0|1,0,1]=4 12230 B16R0.136 CCCCCCCCC(C)COCCCCO 34a_200012125181_100011216708 [0,2,0,0,0,0|0,0,2]=4 12231 B16R0.136 CCCCCCCCC(C)COCCCCO 7a_200012125181_100000210776 [0,2,0,0,0,0|0,0,2]=4 12232 B16R0.136 CCCCCCCCC(C)COCCCOC 34a_200012125181_100000740836 [0,2,0,0,0,0|2,0,0]=4 12233 B16R0.136 CCCCCCCCC(C)COCCCOC 7a_200012125181_100000740836 [0,2,0,0,0,0|2,0,0]=4 12234 B16R0.136 CCCCCCCCC(C)NCCCCC#N 270004a_100000751965_100011216694 [0,2,0,0,0,0|1,0,1]=4 12235 B16R0.136 CCCCCCCCC(C)NCCCCCC 270004a_100000210581_100011216694 [0,2,0,0,0,0|1,0,1]=4 12236 B16R0.136 CCCCCCCCC(C)NCCCCCO 270004a_100000762737_100011216694 [0,2,0,0,0,0|0,0,2]=4 12237 B16R0.136 CCCCCCCCC(C)OCCCCC#N 7a_100000210740_100000211819 [0,2,0,0,0,0|1,0,1]=4 12238 B16R0.136 CCCCCCCCC(C)OCCCCC=O 7a_100000210740_100000139335 [0,2,0,0,0,0|0,0,0]=2 12239 B16R0.136 CCCCCCCCC(C)OCCCCCC 34a_100000210740_100000210314 [0,2,0,0,0,0|1,0,1]=4 12240 B16R0.136 CCCCCCCCC(C)OCCCCCC 7a_100000210740_100000210314 [0,2,0,0,0,0|1,0,1]=4 12241 B16R0.136 CCCCCCCCC(C)OCCCCCF 34a_100000210740_100000729378 [0,2,0,0,0,0|1,0,1]=4 12242 B16R0.136 CCCCCCCCC(C)OCCCCCF 7a_100000210740_100000729378 [0,2,0,0,0,0|1,0,1]=4 12243 B16R0.136 CCCCCCCCC(C)OCCCCCO 34a_100000210740_100000746330 [0,2,0,0,0,0|0,0,2]=4 12244 B16R0.136 CCCCCCCCC(C)OCCCCCO 7a_100000210740_100000746330 [0,2,0,0,0,0|0,0,2]=4 12245 B16R0.136 CCCCCCCCC(C)OCCCCOC 34a_100000210740_100000755781 [0,2,0,0,0,0|2,0,0]=4 12246 B16R0.136 CCCCCCCCC(C)OCCCCOC 7a_100000210740_100000730899 [0,2,0,0,0,0|2,0,0]=4 12247 B16R0.136 CCCCCCCCN(C)CCCCCC#N 2230a_100000207567_100009813376 [0,2,0,0,0,0|1,0,1]=4 12248 B16R0.136 CCCCCCCCN(C)CCCCCC#N 269982a_100000207567_100009813376 [0,2,0,0,0,0|1,0,1]=4 12249 B16R0.136 CCCCCCCCN(C)CCCCCC=O 2230a_100000207567_100000139337 [0,2,0,0,0,0|0,0,0]=2 12250 B16R0.136 CCCCCCCCN(C)CCCCCC=O 269982a_100000207567_100000139337 [0,2,0,0,0,0|0,0,0]=2 12251 B16R0.136 CCCCCCCCN(C)CCCCCCC 2230a_100000207567_100000210681 [0,2,0,0,0,0|1,0,1]=4 12252 B16R0.136 CCCCCCCCN(C)CCCCCCC 2230a_100000228206_100000210759 [0,2,0,0,0,0|1,0,1]=4 12253 B16R0.136 CCCCCCCCN(C)CCCCCCC 2230a_200000271651_200000210301 [0,2,0,0,0,0|1,0,1]=4 12254 B16R0.136 CCCCCCCCN(C)CCCCCCC 269982a_100000207567_100000210681 [0,2,0,0,0,0|1,0,1]=4 12255 B16R0.136 CCCCCCCCN(C)CCCCCCC 269982a_100000228206_100000210759 [0,2,0,0,0,0|1,0,1]=4 12256 B16R0.136 CCCCCCCCN(C)CCCCCCC 269982a_200000271651_200000210301 [0,2,0,0,0,0|1,0,1]=4 12257 B16R0.136 CCCCCCCCN(C)CCCCCCF 2230a_100000207567_100015922095 [0,2,0,0,0,0|1,0,1]=4 12258 B16R0.136 CCCCCCCCN(C)CCCCCCF 269982a_100000207567_100015922095 [0,2,0,0,0,0|1,0,1]=4 12259 B16R0.136 CCCCCCCCN(C)CCCCCCO 2230a_100000207567_100000766143 [0,2,0,0,0,0|0,0,2]=4 12260 B16R0.136 CCCCCCCCN(C)CCCCCCO 269982a_100000207567_100000766143 [0,2,0,0,0,0|0,0,2]=4 12261 B16R0.136 CCCCCCCCN([13CH3])CCCCCCC 2230a_200000271651_200025704644 [0,2,0,0,0,0|1,0,1]=4 12262 B16R0.136 CCCCCCCCN([13CH3])CCCCCCC 269982a_200000271651_200025704644 [0,2,0,0,0,0|1,0,1]=4 12263 B16R0.136 CCCCCCCN(C)CCCCCCC#N 2230a_100000228206_100009813337 [0,2,0,0,0,0|1,0,1]=4 12264 B16R0.136 CCCCCCCN(C)CCCCCCC#N 269982a_100000228206_100009813337 [0,2,0,0,0,0|1,0,1]=4 12265 B16R0.136 CCCCCCCN(C)CCCCCCCO 2230a_100000228206_100000760002 [0,2,0,0,0,0|0,0,2]=4 12266 B16R0.136 CCCCCCCN(C)CCCCCCCO 269982a_100000228206_100000760002 [0,2,0,0,0,0|0,0,2]=4 12267 B16R0.136 CCCCCCCN(C)CCCCCCOC 2230a_100000228206_100011998445 [0,2,0,0,0,0|2,0,0]=4 12268 B16R0.136 CCCCCCCN(C)CCCCCCOC 269982a_100000228206_100011998445 [0,2,0,0,0,0|2,0,0]=4 12269 B16R0.136 CCCCCCCNC(C)CCCCCCC 2230a_100000229938_200011218727 [0,2,0,0,0,0|1,0,1]=4 12270 B16R0.136 CCCCCCCNC(C)CCCCCCC 270004a_100000229938_100000210596 [0,2,0,0,0,0|1,0,1]=4 12271 B16R0.136 CCCCCCCOC(C)CCCCCCC 34a_100000210272_200011218727 [0,2,0,0,0,0|1,0,1]=4 12272 B16R0.136 CCCCCCCOC(C)CCCCCCC 34a_200011215852_100000210614 [0,2,0,0,0,0|1,0,1]=4 12273 B16R0.136 CCCCCCCOC(C)CCCCCCC 7a_100000210272_200011218727 [0,2,0,0,0,0|1,0,1]=4 12274 B16R0.136 CCCCCCCOC(C)CCCCCCC 7a_200011215852_100000210614 [0,2,0,0,0,0|1,0,1]=4 12275 B16R0.136 CCCCCCNC(=O)CSCCCCC=O 62a_100000230325_100000139335 [0,2,0,0,0,0|1,0,1]=4 12276 B16R0.221 C#CC(=O)CCCCCCCCCCCC=C 1458a_100000211873_102130925996 [0,2,0,0,0,0|0,0,2]=4 12277 B16R0.221 C#CC(=O)CCCCCCCCCCCCC 1458a_100000211873_100000210684 [0,2,0,0,0,0|0,0,0]=2 12278 B16R0.221 C#CC(=O)CCCCCCCCCCCCO 1458a_100000211873_100009813331 [0,2,0,0,0,0|1,0,0]=3 12279 B16R0.221 C#CC(=O)CCCCCCOCCCCCO 1458a_100000211873_200132310570 [0,2,0,0,0,0|2,0,0]=4 12280 B16R0.221 C#CC(C)NCCCCCCCCCCC=C 2230a_100000707721_100011093070 [0,2,0,0,0,0|2,0,0]=4 12281 B16R0.221 C#CC(C)NCCCCCCCCCCC=C 34a_100000707721_100011093070 [0,2,0,0,0,0|2,0,0]=4 12282 B16R0.221 C#CC(C)NCCCCCCCCCCCC 2230a_100000707721_100011215052 [0,2,0,0,0,0|1,0,1]=4 12283 B16R0.221 C#CC(C)NCCCCCCCCCCCC 270004a_100000707721_100011218549 [0,2,0,0,0,0|1,0,1]=4 12284 B16R0.221 C#CC(C)NCCCCCCCCCCCC 34a_100000210451_200000035995 [0,2,0,0,0,0|1,0,1]=4 12285 B16R0.221 C#CC(C)NCCCCCCCCCCCC 34a_100000707721_100000759014 [0,2,0,0,0,0|1,0,1]=4 12286 B16R0.221 C#CC(C)OCCCCCCCCCCCC 34a_100000210810_200000035995 [0,2,0,0,0,0|1,0,1]=4 12287 B16R0.221 C#CC(C)SCCCCCCCCCCC=C 62a_200000035995_100011093070 [0,2,0,0,0,0|2,0,0]=4 12288 B16R0.221 C#CC(C)SCCCCCCCCCCCC 62a_200000035995_100000759014 [0,2,0,0,0,0|1,0,1]=4 12289 B16R0.221 C#CC(O)CCCCCNCCCCCCC 2230a_100000229938_200010408556 [0,2,0,0,0,0|1,0,1]=4 12290 B16R0.221 C#CC(O)CCCCCOCCCCCCC 34a_100000210272_200010408556 [0,2,0,0,0,0|1,0,1]=4 12291 B16R0.221 C#CC(O)CCCCCOCCCCCCC 7a_100000210272_200010408556 [0,2,0,0,0,0|1,0,1]=4 12292 B16R0.221 C#CC(O)CCCCCSCCCCCC=O 62a_100000139337_200010408556 [0,2,0,0,0,0|0,0,2]=4 12293 B16R0.221 C#CC(O)CCCCCSCCCCCC=O 62a_200010408556_100000139337 [0,2,0,0,0,0|0,0,2]=4 12294 B16R0.221 C#CC(O)CCCCCSCCCCCCC 62a_100000210614_200010408556 [0,2,0,0,0,0|1,0,1]=4 12295 B16R0.221 C#CC(O)CCCCCSCCCCCCC 62a_200010408556_100000210316 [0,2,0,0,0,0|1,0,1]=4 12296 B16R0.221 C#CCCCCCCCCCCOC(C)CC 34a_100000054667_100011215416 [0,2,0,0,0,0|1,0,1]=4 12297 B16R0.221 C#CCCCCCCCCCCOC(C)CC 7a_100000054667_100000758301 [0,2,0,0,0,0|1,0,1]=4 12298 B16R0.221 C#CCCCCCCCCCOCC(C)CC 34a_100000034437_100000748023 [0,2,0,0,0,0|1,0,1]=4 12299 B16R0.221 C#CCCCCCCCCCOCC(C)CC 7a_100000034437_100000748023 [0,2,0,0,0,0|1,0,1]=4 12300 B16R0.221 C#CCCCCCCCCCOCC(O)CC 34a_100000034437_100011218378 [0,2,0,0,0,0|1,0,1]=4 12301 B16R0.221 C#CCCCCCCCCCOCC(O)CC 7a_100000034437_100011218378 [0,2,0,0,0,0|1,0,1]=4 12302 B16R0.221 C#CCCCCCCCCCOC[C@@H](C)CC 34a_100000034437_100009816398 [0,2,0,0,0,0|1,0,1]=4 12303 B16R0.221 C#CCCCCCCCCCOC[C@@H](C)CC 7a_100000034437_100009816398 [0,2,0,0,0,0|1,0,1]=4 12304 B16R0.221 C#CCCCCCCCOCCCC(C)CC 7a_100011216074_100153394163 [0,2,0,0,0,0|1,0,1]=4 12305 B16R0.221 C#CCCCCCOCCCCCC(C)CC 7a_200000035636_100012094781 [0,2,0,0,0,0|1,0,1]=4 12306 B16R0.221 C#C[C@@H](C)OCCCCCCCCCCC=C 34a_100009815206_100011093070 [0,2,0,0,0,0|2,0,0]=4 12307 B16R0.221 C#C[C@@H](C)OCCCCCCCCCCC=C 7a_100009815206_100011093070 [0,2,0,0,0,0|2,0,0]=4 12308 B16R0.221 C#C[C@@H](C)OCCCCCCCCCCCC 34a_100009815206_100000759014 [0,2,0,0,0,0|1,0,1]=4 12309 B16R0.221 C#C[C@@H](C)OCCCCCCCCCCCC 7a_100009815206_100000759014 [0,2,0,0,0,0|1,0,1]=4 12310 B16R0.221 C=C(C#N)CNCCCCCCCCCCC 2230a_200011215754_100000694840 [0,2,0,0,0,0|2,0,0]=4 12311 B16R0.221 C=C(C#N)CNCCCCCCCCCCC 34a_200011215754_100000694840 [0,2,0,0,0,0|2,0,0]=4 12312 B16R0.221 C=C(C#N)COCCCCCCCCCCC 34a_100000210809_100000694840 [0,2,0,0,0,0|2,0,0]=4 12313 B16R0.221 C=CC(=O)CCCCCCCCCCCCC 1458a_100000185746_100000210684 [0,2,0,0,0,0|0,0,0]=2 12314 B16R0.221 C=CC(=O)CCCCCCCCCCCCO 1458a_100000185746_100009813331 [0,2,0,0,0,0|1,0,0]=3 12315 B16R0.221 C=CC(=O)CCCCCCOCCCCCO 1458a_100000185746_200132310570 [0,2,0,0,0,0|2,0,0]=4 12316 B16R0.221 C=CC(=O)NCCCCCCCCCCCC 1626a_100000210451_100000185746 [0,2,0,0,0,0|1,0,0]=3 12317 B16R0.221 C=CC(=O)NCCCCCCCCCCCC 240690a_100000210451_200121576911 [0,2,0,0,0,0|1,0,0]=3 12318 B16R0.221 C=CC(=O)NCCCCOCCCCCCC 34a_100014118770_100000210614 [0,2,0,0,0,0|2,0,0]=4 12319 B16R0.221 C=CC(=O)NCCNCCCCCCCCC 2230a_114873766552_100011214924 [0,2,0,0,0,0|2,0,0]=4 12320 B16R0.221 C=CC(=O)NCCOCCCCCCCCC 34a_100011304386_100011214924 [0,2,0,0,0,0|2,0,0]=4 12321 B16R0.221 C=CC(=O)OCCCCCCNCCCCC 2230a_100000209983_100009894100 [0,2,0,0,0,0|2,0,0]=4 12322 B16R0.221 C=CC(=O)OCCCCCCOCCCCC 34a_100000210253_100009894100 [0,2,0,0,0,0|2,0,0]=4 12323 B16R0.221 C=CC(=O)OCCCCCCOCCCCC 7a_100000210253_100009894100 [0,2,0,0,0,0|2,0,0]=4 12324 B16R0.221 C=CC(=O)OCCCCCCSCCCCC 62a_100000210326_100009894100 [0,2,0,0,0,0|2,0,0]=4 12325 B16R0.221 C=CC(=O)OCCCCCCSCCCCC 62a_100009894100_100000210326 [0,2,0,0,0,0|2,0,0]=4 12326 B16R0.221 C=CC(=O)OCCCCCOCCCCCC 7a_200011023508_100000210314 [0,2,0,0,0,0|2,0,0]=4 12327 B16R0.221 C=CC(=O)OCCNCCCCCCCCC 2230a_100000212291_100009813456 [0,2,0,0,0,0|2,0,0]=4 12328 B16R0.221 C=CC(=O)OCCNCCCCCCCCC 34a_100000212291_100009813456 [0,2,0,0,0,0|2,0,0]=4 12329 B16R0.221 C=CC(=O)OCCOCCCCCCCCC 34a_100000210712_100009813456 [0,2,0,0,0,0|2,0,0]=4 12330 B16R0.221 C=CC(=O)OCCOCCCCCCCCC 7a_100000210712_100009813456 [0,2,0,0,0,0|2,0,0]=4 12331 B16R0.221 C=CC(=O)OCCSCCCCCCCCC 62a_100009813456_100000210670 [0,2,0,0,0,0|2,0,0]=4 12332 B16R0.221 C=CC(C)COCCCCCCCCCCC 34a_100011215527_100011215454 [0,2,0,0,0,0|1,0,0]=3 12333 B16R0.221 C=CC(C)COCCCCCCCCCCC 7a_100011215527_100011215454 [0,2,0,0,0,0|1,0,0]=3 12334 B16R0.221 C=CC(C)COCCCCCCCCCCO 34a_100011215527_100009813290 [0,2,0,0,0,0|2,0,0]=4 12335 B16R0.221 C=CC(C)COCCCCCCCCCCO 7a_100011215527_100009813290 [0,2,0,0,0,0|2,0,0]=4 12336 B16R0.221 C=CC(C)OCCCCCCCCCCCC 34a_100000695699_100000759014 [0,2,0,0,0,0|1,0,0]=3 12337 B16R0.221 C=CC(C)OCCCCCCCCCCCO 34a_100000695699_100009812471 [0,2,0,0,0,0|2,0,0]=4 12338 B16R0.221 C=CC(O)CNCCCCCCCCCCC 2230a_200011215754_100000730141 [0,2,0,0,0,0|1,0,0]=3 12339 B16R0.221 C=CC(O)CNCCCCCCCCCCC 34a_200011215754_100000730141 [0,2,0,0,0,0|1,0,0]=3 12340 B16R0.221 C=CC(O)CNCCCCCCCCCCO 2230a_100000066964_100000730141 [0,2,0,0,0,0|2,0,0]=4 12341 B16R0.221 C=CC(O)CNCCCCCCCCCCO 34a_100000066964_100000730141 [0,2,0,0,0,0|2,0,0]=4 12342 B16R0.221 C=CC(O)COCCCCCCCCCCBr 34a_100009813290_100000730141 [0,2,0,0,0,0|2,0,0]=4 12343 B16R0.221 C=CC(O)COCCCCCCCCCCBr 7a_100009813290_100000730141 [0,2,0,0,0,0|2,0,0]=4 12344 B16R0.221 C=CC(O)COCCCCCCCCCCC 34a_100000210809_100000730141 [0,2,0,0,0,0|1,0,0]=3 12345 B16R0.221 C=CC(O)COCCCCCCCCCCC 7a_100000210809_100000730141 [0,2,0,0,0,0|1,0,0]=3 12346 B16R0.221 C=CC(O)COCCCCCCCCCCCl 34a_200000033068_100000730141 [0,2,0,0,0,0|2,0,0]=4 12347 B16R0.221 C=CC(O)COCCCCCCCCCCCl 7a_200000033068_100000730141 [0,2,0,0,0,0|2,0,0]=4 12348 B16R0.221 C=CC(O)COCCCCCCCCCCN 34a_100000066964_100000730141 [0,2,0,0,0,0|2,0,0]=4 12349 B16R0.221 C=CC(O)CSCCCCCCCCCCC 62a_100000730141_100011215454 [0,2,0,0,0,0|1,0,0]=3 12350 B16R0.221 C=CC(O)CSCCCCCCCCCCO 62a_100000730141_200000033068 [0,2,0,0,0,0|2,0,0]=4 12351 B16R0.221 C=CC(O)CSCCCCCCCCCCO 62a_100009813290_100000730141 [0,2,0,0,0,0|2,0,0]=4 12352 B16R0.221 C=CCCCCCCCCCCCC(=O)C=C 1458a_100000185746_102130925996 [0,2,0,0,0,0|0,0,2]=4 12353 B16R0.221 C=CCCCCCCCCCCCC(=O)CC 1458a_100000210414_102130925996 [0,2,0,0,0,0|1,0,0]=3 12354 B16R0.221 C=CCCCCCCCCCCCC(=O)CO 1458a_100000210174_102130925996 [0,2,0,0,0,0|0,0,2]=4 12355 B16R0.221 C=CCCCCCCCCCCCN(C)CC 2230a_100000225621_102130925996 [0,2,0,0,0,0|1,0,0]=3 12356 B16R0.221 C=CCCCCCCCCCCCN(C)CC 269982a_100000225621_102130925996 [0,2,0,0,0,0|1,0,0]=3 12357 B16R0.221 C=CCCCCCCCCCCNC(C)C#N 2230a_100000737613_100011093070 [0,2,0,0,0,0|2,0,0]=4 12358 B16R0.221 C=CCCCCCCCCCCNC(C)CC 2230a_100000209981_100011093070 [0,2,0,0,0,0|1,0,0]=3 12359 B16R0.221 C=CCCCCCCCCCCN[C@H](C)CO 2230a_100000737577_100011093070 [0,2,0,0,0,0|2,0,0]=4 12360 B16R0.221 C=CCCCCCCCCCCOC(C)C#N 34a_100011218135_100011093070 [0,2,0,0,0,0|2,0,0]=4 12361 B16R0.221 C=CCCCCCCCCCCOC(C)C=C 34a_100000695699_100011093070 [0,2,0,0,0,0|2,0,0]=4 12362 B16R0.221 C=CCCCCCCCCCCOC(C)CC 7a_100000210228_100011093070 [0,2,0,0,0,0|1,0,0]=3 12363 B16R0.221 C=CCCCCCCCCCCOC(C)CF 34a_100016041109_100011093070 [0,2,0,0,0,0|2,0,0]=4 12364 B16R0.221 C=CCCCCCCCCCCOC(C)CF 7a_100016041109_100011093070 [0,2,0,0,0,0|2,0,0]=4 12365 B16R0.221 C=CCCCCCCCCCCOC(C)CN 34a_100000210904_100011093070 [0,2,0,0,0,0|2,0,0]=4 12366 B16R0.221 C=CCCCCCCCCCCSC(C)C#N 62a_100000703298_100011093070 [0,2,0,0,0,0|2,0,0]=4 12367 B16R0.221 C=CCCCCCCCCCCSC(C)C#N 62a_100011093070_100000703298 [0,2,0,0,0,0|2,0,0]=4 12368 B16R0.221 C=CCCCCCCCCCCSC(C)C=C 62a_100011215867_100011093070 [0,2,0,0,0,0|2,0,0]=4 12369 B16R0.221 C=CCCCCCCCCCCSC(C)CO 62a_100012180447_100011093070 [0,2,0,0,0,0|2,0,0]=4 12370 B16R0.221 C=CCCCCCCCCCCSC(C)OC 62a_100009879195_100011093070 [0,2,0,0,0,0|2,0,0]=4 12371 B16R0.221 C=CCCCCCCCCCCSC(C)OC 62a_100011093070_100009879195 [0,2,0,0,0,0|2,0,0]=4 12372 B16R0.221 C=CCCCCCCCCCCS[C@H](C)CO 62a_100011093070_100016084084 [0,2,0,0,0,0|2,0,0]=4 12373 B16R0.221 C=CCCCCCCCCCCS[C@H](C)CO 62a_100016084084_100011093070 [0,2,0,0,0,0|2,0,0]=4 12374 B16R0.221 C=CCCCCCCCCCNCC(C)CC 2230a_100000081888_100000748023 [0,2,0,0,0,0|1,0,0]=3 12375 B16R0.221 C=CCCCCCCCCCNCC(C)CC 2230a_100020588543_100009814027 [0,2,0,0,0,0|1,0,0]=3 12376 B16R0.221 C=CCCCCCCCCCNCC(C)CC 270004a_100000081888_100000243153 [0,2,0,0,0,0|1,0,0]=3 12377 B16R0.221 C=CCCCCCCCCCNCC(C)CC 34a_100000081888_100000748023 [0,2,0,0,0,0|1,0,0]=3 12378 B16R0.221 C=CCCCCCCCCCNCC(C)CO 34a_100000744482_100009814027 [0,2,0,0,0,0|2,0,0]=4 12379 B16R0.221 C=CCCCCCCCCCNCC(O)CC 2230a_100000081888_100011218378 [0,2,0,0,0,0|1,0,0]=3 12380 B16R0.221 C=CCCCCCCCCCNCC(O)CC 2230a_100011218483_100009814027 [0,2,0,0,0,0|1,0,0]=3 12381 B16R0.221 C=CCCCCCCCCCNCC(O)CC 34a_100000081888_100011218378 [0,2,0,0,0,0|1,0,0]=3 12382 B16R0.221 C=CCCCCCCCCCNCC(O)CO 2230a_100000081888_100011219619 [0,2,0,0,0,0|2,0,0]=4 12383 B16R0.221 C=CCCCCCCCCCNCC(O)CO 34a_100000081888_100011219619 [0,2,0,0,0,0|2,0,0]=4 12384 B16R0.221 C=CCCCCCCCCCNC[C@@H](C)CC 2230a_100000081888_100009816398 [0,2,0,0,0,0|1,0,0]=3 12385 B16R0.221 C=CCCCCCCCCCNC[C@@H](C)CC 34a_100000081888_100009816398 [0,2,0,0,0,0|1,0,0]=3 12386 B16R0.221 C=CCCCCCCCCCNC[C@@H](C)CO 2230a_100000081888_100000059175 [0,2,0,0,0,0|2,0,0]=4 12387 B16R0.221 C=CCCCCCCCCCNC[C@@H](C)CO 34a_100000081888_100000059175 [0,2,0,0,0,0|2,0,0]=4 12388 B16R0.221 C=CCCCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100009814027 [0,2,0,0,0,0|2,0,0]=4 12389 B16R0.221 C=CCCCCCCCCCNC[C@@H](F)CO 34a_100015665980_100009814027 [0,2,0,0,0,0|2,0,0]=4 12390 B16R0.221 C=CCCCCCCCCCNC[C@@H](O)CF 2230a_100000081888_100015614560 [0,2,0,0,0,0|2,0,0]=4 12391 B16R0.221 C=CCCCCCCCCCNC[C@@H](O)CF 34a_100000081888_100015614560 [0,2,0,0,0,0|2,0,0]=4 12392 B16R0.221 C=CCCCCCCCCCNC[C@@H](O)CO 2230a_100000081888_100009815848 [0,2,0,0,0,0|2,0,0]=4 12393 B16R0.221 C=CCCCCCCCCCNC[C@@H](O)CO 34a_100000081888_100009815848 [0,2,0,0,0,0|2,0,0]=4 12394 B16R0.221 C=CCCCCCCCCCNC[C@H](O)CO 2230a_100020644852_100009814027 [0,2,0,0,0,0|2,0,0]=4 12395 B16R0.221 C=CCCCCCCCCCOCC(=O)CC 34a_100000725409_100009814027 [0,2,0,0,0,0|1,0,1]=4 12396 B16R0.221 C=CCCCCCCCCCOCC(=O)CC 7a_100000038209_100000747405 [0,2,0,0,0,0|1,0,1]=4 12397 B16R0.221 C=CCCCCCCCCCOCC(C)C=C 34a_100011215527_100009814027 [0,2,0,0,0,0|2,0,0]=4 12398 B16R0.221 C=CCCCCCCCCCOCC(C)C=C 7a_100011215527_100009814027 [0,2,0,0,0,0|2,0,0]=4 12399 B16R0.221 C=CCCCCCCCCCOCC(C)CC 34a_100000038209_100000748023 [0,2,0,0,0,0|1,0,0]=3 12400 B16R0.221 C=CCCCCCCCCCOCC(C)CC 7a_100000038209_100000748023 [0,2,0,0,0,0|1,0,0]=3 12401 B16R0.221 C=CCCCCCCCCCOCC(C)CN 34a_100000744482_100009814027 [0,2,0,0,0,0|2,0,0]=4 12402 B16R0.221 C=CCCCCCCCCCOCC(C)OC 34a_100000690652_100009814027 [0,2,0,0,0,0|2,0,0]=4 12403 B16R0.221 C=CCCCCCCCCCOCC(Cl)CCl 34a_100000033668_100009814027 [0,2,0,0,0,0|2,0,0]=4 12404 B16R0.221 C=CCCCCCCCCCOCC(O)CC 34a_100000038209_100011218378 [0,2,0,0,0,0|1,0,0]=3 12405 B16R0.221 C=CCCCCCCCCCOCC(O)CC 7a_100000038209_100011218378 [0,2,0,0,0,0|1,0,0]=3 12406 B16R0.221 C=CCCCCCCCCCOCC(O)CO 34a_100000038209_100011219619 [0,2,0,0,0,0|2,0,0]=4 12407 B16R0.221 C=CCCCCCCCCCOCC(O)CO 7a_100000038209_100011219619 [0,2,0,0,0,0|2,0,0]=4 12408 B16R0.221 C=CCCCCCCCCCOC[C@@H](C)CC 34a_100000038209_100009816398 [0,2,0,0,0,0|1,0,0]=3 12409 B16R0.221 C=CCCCCCCCCCOC[C@@H](C)CC 7a_100000038209_100009816398 [0,2,0,0,0,0|1,0,0]=3 12410 B16R0.221 C=CCCCCCCCCCOC[C@@H](C)CC 7a_100009816381_100009814027 [0,2,0,0,0,0|1,0,0]=3 12411 B16R0.221 C=CCCCCCCCCCOC[C@@H](C)CO 34a_100000038209_100000059175 [0,2,0,0,0,0|2,0,0]=4 12412 B16R0.221 C=CCCCCCCCCCOC[C@@H](C)CO 7a_100000038209_100000059175 [0,2,0,0,0,0|2,0,0]=4 12413 B16R0.221 C=CCCCCCCCCCOC[C@@H](O)CF 34a_100000038209_100015614560 [0,2,0,0,0,0|2,0,0]=4 12414 B16R0.221 C=CCCCCCCCCCOC[C@@H](O)CF 7a_100000038209_100015614560 [0,2,0,0,0,0|2,0,0]=4 12415 B16R0.221 C=CCCCCCCCCCOC[C@@H](O)CO 34a_100000038209_100009815848 [0,2,0,0,0,0|2,0,0]=4 12416 B16R0.221 C=CCCCCCCCCCOC[C@@H](O)CO 7a_100000038209_100009815848 [0,2,0,0,0,0|2,0,0]=4 12417 B16R0.221 C=CCCCCCCCCCOC[C@H](F)CN 34a_100015665980_100009814027 [0,2,0,0,0,0|2,0,0]=4 12418 B16R0.221 C=CCCCCCCCCCSCC(=O)CC 62a_100000747405_100009814027 [0,2,0,0,0,0|1,0,1]=4 12419 B16R0.221 C=CCCCCCCCCCSCC(=O)CC 62a_100009814027_100000747405 [0,2,0,0,0,0|1,0,1]=4 12420 B16R0.221 C=CCCCCCCCCCSCC(O)CC 62a_100009814027_100011218378 [0,2,0,0,0,0|1,0,0]=3 12421 B16R0.221 C=CCCCCCCCCCSCC(O)CC 62a_100011218378_100009814027 [0,2,0,0,0,0|1,0,0]=3 12422 B16R0.221 C=CCCCCCCCCCSCC(O)CO 62a_100009814027_100011219619 [0,2,0,0,0,0|2,0,0]=4 12423 B16R0.221 C=CCCCCCCCCCSCC(O)CO 62a_100011219619_100009814027 [0,2,0,0,0,0|2,0,0]=4 12424 B16R0.221 C=CCCCCCCCCCSC[C@@H](C)CO 62a_100000059175_100009814027 [0,2,0,0,0,0|2,0,0]=4 12425 B16R0.221 C=CCCCCCCCCCSC[C@@H](C)CO 62a_100009814027_100000059175 [0,2,0,0,0,0|2,0,0]=4 12426 B16R0.221 C=CCCCCCCCCCSC[C@@H](O)CF 62a_100009814027_100015614560 [0,2,0,0,0,0|2,0,0]=4 12427 B16R0.221 C=CCCCCCCCCCSC[C@@H](O)CF 62a_100015614560_100009814027 [0,2,0,0,0,0|2,0,0]=4 12428 B16R0.221 C=CCCCCCCCCCSC[C@@H](O)CO 62a_100009814027_100009815848 [0,2,0,0,0,0|2,0,0]=4 12429 B16R0.221 C=CCCCCCCCCCSC[C@@H](O)CO 62a_100009815848_100009814027 [0,2,0,0,0,0|2,0,0]=4 12430 B16R0.221 C=CCCCCCCCCNCCC(C)CC 2230a_100020591266_100011933949 [0,2,0,0,0,0|1,0,0]=3 12431 B16R0.221 C=CCCCCCCCCNCCC(C)CO 2230a_106354213184_100011933949 [0,2,0,0,0,0|2,0,0]=4 12432 B16R0.221 C=CCCCCCCCCNCCC(C)CO 34a_106354213184_100011933949 [0,2,0,0,0,0|2,0,0]=4 12433 B16R0.221 C=CCCCCCCCCOCCC(C)CC 7a_100011215188_100011933949 [0,2,0,0,0,0|1,0,0]=3 12434 B16R0.221 C=CCCCCCCCCOCCC(C)OC 7a_100000764861_100011933949 [0,2,0,0,0,0|2,0,0]=4 12435 B16R0.221 C=CCCCCCCCOCCCC(C)CC 7a_100011216074_100012355270 [0,2,0,0,0,0|1,0,0]=3 12436 B16R0.221 C=CCCCCCCCOCCCN(C)CC 7a_100000730831_100015186262 [0,2,0,0,0,0|2,0,0]=4 12437 B16R0.221 C=CCCCCCCCOCCC[C@@H](C)CN 34a_100160569302_100012355270 [0,2,0,0,0,0|2,0,0]=4 12438 B16R0.221 C=CCCCCCCCSCCCN(C)CC 62a_100012355270_100015186262 [0,2,0,0,0,0|2,0,0]=4 12439 B16R0.221 C=CCCCCCOCCCCCC(C)CC 7a_200000035636_100000700193 [0,2,0,0,0,0|1,0,0]=3 12440 B16R0.221 C=C[C@H](N)COCCCCCCCCCCC 34a_100016989147_100011215454 [0,2,0,0,0,0|1,0,0]=3 12441 B16R0.221 C=C[C@H](N)COCCCCCCCCCCO 34a_100016989147_100009813290 [0,2,0,0,0,0|2,0,0]=4 12442 B16R0.221 CCC(=O)CCCCCCCCCCCCO 1458a_100000210414_100009813331 [0,2,0,0,0,0|1,0,0]=3 12443 B16R0.221 CCC(=O)CCCCCCOCCCCCO 1458a_100000210414_200132310570 [0,2,0,0,0,0|2,0,0]=4 12444 B16R0.221 CCC(=O)COCCCCCCCCCCBr 7a_100009813290_100000747405 [0,2,0,0,0,0|2,0,0]=4 12445 B16R0.221 CCC(=O)COCCCCCCCCCCCl 7a_200000033068_100000747405 [0,2,0,0,0,0|2,0,0]=4 12446 B16R0.221 CCC(=O)COCCCCCCCCCCO 34a_100000725409_100009813290 [0,2,0,0,0,0|2,0,0]=4 12447 B16R0.221 CCC(=O)CSCCCCCCCCCCO 62a_100000747405_200000033068 [0,2,0,0,0,0|2,0,0]=4 12448 B16R0.221 CCC(=O)CSCCCCCCCCCCO 62a_100009813290_100000747405 [0,2,0,0,0,0|2,0,0]=4 12449 B16R0.221 CCC(C)CCCCCOCCCCCC#N 7a_200000035636_100009813376 [0,2,0,0,0,0|1,0,1]=4 12450 B16R0.221 CCC(C)CCCCCOCCCCCC=O 7a_200000035636_100000139337 [0,2,0,0,0,0|0,0,0]=2 12451 B16R0.221 CCC(C)CCCCCOCCCCCCF 7a_200000035636_100015922095 [0,2,0,0,0,0|1,0,1]=4 12452 B16R0.221 CCC(C)CCCCCOCCCCCCO 7a_200000035636_100000766143 [0,2,0,0,0,0|0,0,2]=4 12453 B16R0.221 CCC(C)CCCOCCCCCCCCO 7a_100011216074_100000033203 [0,2,0,0,0,0|0,0,2]=4 12454 B16R0.221 CCC(C)CCNCCCCCCCCCO 2230a_100020591266_100009813782 [0,2,0,0,0,0|0,0,2]=4 12455 B16R0.221 CCC(C)CCOCCCCCCCCCO 7a_100011215188_100009813782 [0,2,0,0,0,0|0,0,2]=4 12456 B16R0.221 CCC(C)CNCCCCCCCCCCO 2230a_100000066964_100000748023 [0,2,0,0,0,0|0,0,2]=4 12457 B16R0.221 CCC(C)CNCCCCCCCCCCO 2230a_100020588543_100009813290 [0,2,0,0,0,0|0,0,2]=4 12458 B16R0.221 CCC(C)CNCCCCCCCCCCO 270004a_100000066964_100000243153 [0,2,0,0,0,0|0,0,2]=4 12459 B16R0.221 CCC(C)CNCCCCCCCCCCO 34a_100000066964_100000748023 [0,2,0,0,0,0|0,0,2]=4 12460 B16R0.221 CCC(C)COCCCCCCCCCCBr 34a_100009813290_100000748023 [0,2,0,0,0,0|1,0,1]=4 12461 B16R0.221 CCC(C)COCCCCCCCCCCBr 7a_100009813290_100000748023 [0,2,0,0,0,0|1,0,1]=4 12462 B16R0.221 CCC(C)COCCCCCCCCCCCl 34a_200000033068_100000748023 [0,2,0,0,0,0|1,0,1]=4 12463 B16R0.221 CCC(C)COCCCCCCCCCCCl 7a_200000033068_100000748023 [0,2,0,0,0,0|1,0,1]=4 12464 B16R0.221 CCC(C)COCCCCCCCCCCN 34a_100000066964_100000748023 [0,2,0,0,0,0|1,0,1]=4 12465 B16R0.221 CCC(C)CSCCCCCCCCCCO 62a_100000748023_200000033068 [0,2,0,0,0,0|0,0,2]=4 12466 B16R0.221 CCC(C)CSCCCCCCCCCCO 62a_100009813290_100000748023 [0,2,0,0,0,0|0,0,2]=4 12467 B16R0.221 CCC(C)NCCCCCCCCCCCO 2230a_100000209981_100009812471 [0,2,0,0,0,0|0,0,2]=4 12468 B16R0.221 CCC(C)OCCCCCCCCCCCBr 34a_100009812471_100011215416 [0,2,0,0,0,0|1,0,1]=4 12469 B16R0.221 CCC(C)OCCCCCCCCCCCBr 7a_100009812471_100000758301 [0,2,0,0,0,0|1,0,1]=4 12470 B16R0.221 CCC(C)OCCCCCCCCCCCO 7a_100000210228_100009812471 [0,2,0,0,0,0|0,0,2]=4 12471 B16R0.221 CCC(C)SCCCCCCCCCCCO 62a_100009812471_100000758301 [0,2,0,0,0,0|0,0,2]=4 12472 B16R0.221 CCC(O)CNCCCCCCCCCCO 2230a_100000066964_100011218378 [0,2,0,0,0,0|0,0,2]=4 12473 B16R0.221 CCC(O)CNCCCCCCCCCCO 2230a_100011218483_100009813290 [0,2,0,0,0,0|0,0,2]=4 12474 B16R0.221 CCC(O)CNCCCCCCCCCCO 34a_100000066964_100011218378 [0,2,0,0,0,0|0,0,2]=4 12475 B16R0.221 CCC(O)COCCCCCCCCCCBr 34a_100009813290_100011218378 [0,2,0,0,0,0|1,0,1]=4 12476 B16R0.221 CCC(O)COCCCCCCCCCCBr 7a_100009813290_100011218378 [0,2,0,0,0,0|1,0,1]=4 12477 B16R0.221 CCC(O)COCCCCCCCCCCCl 34a_200000033068_100011218378 [0,2,0,0,0,0|1,0,1]=4 12478 B16R0.221 CCC(O)COCCCCCCCCCCCl 7a_200000033068_100011218378 [0,2,0,0,0,0|1,0,1]=4 12479 B16R0.221 CCC(O)COCCCCCCCCCCN 34a_100000066964_100011218378 [0,2,0,0,0,0|1,0,1]=4 12480 B16R0.221 CCC(O)CSCCCCCCCCCCO 62a_100009813290_100011218378 [0,2,0,0,0,0|0,0,2]=4 12481 B16R0.221 CCC(O)CSCCCCCCCCCCO 62a_100011218378_200000033068 [0,2,0,0,0,0|0,0,2]=4 12482 B16R0.221 CCCCCCCCCCCCCC(=O)CC 1458a_100000210414_100000210684 [0,2,0,0,0,0|0,0,0]=2 12483 B16R0.221 CCCCCCCCCCCCCC(=O)CC 1458a_100000756256_100000210202 [0,2,0,0,0,0|0,0,0]=2 12484 B16R0.221 CCCCCCCCCCCCCC(=O)CF 1458a_100000756256_100015361967 [0,2,0,0,0,0|0,0,0]=2 12485 B16R0.221 CCCCCCCCCCCCCC(=O)CO 1458a_100000210174_100000210684 [0,2,0,0,0,0|0,0,0]=2 12486 B16R0.221 CCCCCCCCCCCCCC(=O)NC 11a_106832991635_100000756256 [0,2,0,0,0,0|0,0,0]=2 12487 B16R0.221 CCCCCCCCCCCCCC(=O)NC 1626a_100102657272_100000756256 [0,2,0,0,0,0|0,0,0]=2 12488 B16R0.221 CCCCCCCCCCCCCC(=O)NC 240690a_100102657272_100000756256 [0,2,0,0,0,0|0,0,0]=2 12489 B16R0.221 CCCCCCCCCCCCCC(C)NC 270004a_106832991635_100011216122 [0,2,0,0,0,0|1,0,1]=4 12490 B16R0.221 CCCCCCCCCCCCCN(C)CC 2230a_100000225621_100000210684 [0,2,0,0,0,0|1,0,1]=4 12491 B16R0.221 CCCCCCCCCCCCCN(C)CC 269982a_100000225621_100000210684 [0,2,0,0,0,0|1,0,1]=4 12492 B16R0.221 CCCCCCCCCCCCNC(=O)CC 11a_100000210451_100000210414 [0,2,0,0,0,0|1,0,0]=3 12493 B16R0.221 CCCCCCCCCCCCNC(=O)CC 1626a_100000210451_100000210414 [0,2,0,0,0,0|1,0,0]=3 12494 B16R0.221 CCCCCCCCCCCCNC(=O)CC 240690a_100000210451_100000210414 [0,2,0,0,0,0|1,0,0]=3 12495 B16R0.221 CCCCCCCCCCCCNC(=O)CC 527a_100000210451_100000210414 [0,2,0,0,0,0|1,0,0]=3 12496 B16R0.221 CCCCCCCCCCCCNC(=O)CO 240690a_100000210451_100000210174 [0,2,0,0,0,0|1,0,0]=3 12497 B16R0.221 CCCCCCCCCCCCNC(=O)CO 527a_100000210451_100000210174 [0,2,0,0,0,0|1,0,0]=3 12498 B16R0.221 CCCCCCCCCCCCNC(=O)NC 2708a_100000210451_106832991635 [0,2,0,0,0,0|1,0,0]=3 12499 B16R0.221 CCCCCCCCCCCCNC(=O)NC 2708a_100102657272_100000210451 [0,2,0,0,0,0|1,0,0]=3 12500 B16R0.221 CCCCCCCCCCCCNC(=O)NC 273464a_100000210451_100102657272 [0,2,0,0,0,0|1,0,0]=3 12501 B16R0.221 CCCCCCCCCCCCNC(=O)NC 273464a_100102657272_100000210451 [0,2,0,0,0,0|1,0,0]=3 12502 B16R0.221 CCCCCCCCCCCCNC(=O)NC 512a_100000210451_100102657272 [0,2,0,0,0,0|1,0,0]=3 12503 B16R0.221 CCCCCCCCCCCCNC(=O)NC 512a_106832991638_100000210451 [0,2,0,0,0,0|1,0,0]=3 12504 B16R0.221 CCCCCCCCCCCCNC(C)C#N 2230a_100000210451_100000184139 [0,2,0,0,0,0|1,0,1]=4 12505 B16R0.221 CCCCCCCCCCCCNC(C)C#N 2230a_100000737613_100011215052 [0,2,0,0,0,0|1,0,1]=4 12506 B16R0.221 CCCCCCCCCCCCNC(C)CC 2230a_100000209981_100011215052 [0,2,0,0,0,0|1,0,1]=4 12507 B16R0.221 CCCCCCCCCCCCNC(C)CC 2230a_100000210451_100000758301 [0,2,0,0,0,0|1,0,1]=4 12508 B16R0.221 CCCCCCCCCCCCNC(C)CC 270004a_100000209981_100011218549 [0,2,0,0,0,0|1,0,1]=4 12509 B16R0.221 CCCCCCCCCCCCNC(C)CC 34a_100000210451_100011215416 [0,2,0,0,0,0|1,0,1]=4 12510 B16R0.221 CCCCCCCCCCCCNC(C)CO 2230a_100000210451_100012180447 [0,2,0,0,0,0|0,0,2]=4 12511 B16R0.221 CCCCCCCCCCCCNC(C)CO 34a_100000210451_100012180447 [0,2,0,0,0,0|0,0,2]=4 12512 B16R0.221 CCCCCCCCCCCCN[C@H](C)CF 270004a_100102880703_100011218549 [0,2,0,0,0,0|1,0,1]=4 12513 B16R0.221 CCCCCCCCCCCCN[C@H](C)CO 2230a_100000737577_100011215052 [0,2,0,0,0,0|0,0,2]=4 12514 B16R0.221 CCCCCCCCCCCCN[C@H](C)CO 270004a_100000737577_100011218549 [0,2,0,0,0,0|0,0,2]=4 12515 B16R0.221 CCCCCCCCCCCCOC(C)C#N 34a_100011218135_100000759014 [0,2,0,0,0,0|1,0,1]=4 12516 B16R0.221 CCCCCCCCCCCCOC(C)C#N 7a_100000210810_100000703298 [0,2,0,0,0,0|1,0,1]=4 12517 B16R0.221 CCCCCCCCCCCCOC(C)CC 34a_100000210810_100011215416 [0,2,0,0,0,0|1,0,1]=4 12518 B16R0.221 CCCCCCCCCCCCOC(C)CC 7a_100000210228_100000759014 [0,2,0,0,0,0|1,0,1]=4 12519 B16R0.221 CCCCCCCCCCCCOC(C)CC 7a_100000210810_100000758301 [0,2,0,0,0,0|1,0,1]=4 12520 B16R0.221 CCCCCCCCCCCCOC(C)CF 34a_100016041109_100000759014 [0,2,0,0,0,0|1,0,1]=4 12521 B16R0.221 CCCCCCCCCCCCOC(C)CF 7a_100016041109_100000759014 [0,2,0,0,0,0|1,0,1]=4 12522 B16R0.221 CCCCCCCCCCCCOC(C)CN 34a_100000210904_100000759014 [0,2,0,0,0,0|1,0,1]=4 12523 B16R0.221 CCCCCCCCCCCCOC(C)CO 34a_100000210810_100012180447 [0,2,0,0,0,0|0,0,2]=4 12524 B16R0.221 CCCCCCCCCCCCOC(C)CO 7a_100000210810_100012180447 [0,2,0,0,0,0|0,0,2]=4 12525 B16R0.221 CCCCCCCCCCCCSC(C)C#N 62a_100000703298_100000759014 [0,2,0,0,0,0|1,0,1]=4 12526 B16R0.221 CCCCCCCCCCCCSC(C)CO 62a_100012180447_100000759014 [0,2,0,0,0,0|0,0,2]=4 12527 B16R0.221 CCCCCCCCCCCCSC(C)OC 62a_100009879195_100000759014 [0,2,0,0,0,0|2,0,0]=4 12528 B16R0.221 CCCCCCCCCCCCSC(F)C#N 62a_200000117898_100000759014 [0,2,0,0,0,0|1,0,1]=4 12529 B16R0.221 CCCCCCCCCCCCS[C@H](C)CO 62a_100016084084_100000759014 [0,2,0,0,0,0|0,0,2]=4 12530 B16R0.221 CCCCCCCCCCCNCC(=O)NC 2230a_100000693194_100011215454 [0,2,0,0,0,0|1,0,0]=3 12531 B16R0.221 CCCCCCCCCCCNCC(=O)NC 2230a_200011215754_100000183359 [0,2,0,0,0,0|1,0,0]=3 12532 B16R0.221 CCCCCCCCCCCNCC(=O)NC 34a_200011215754_100000183359 [0,2,0,0,0,0|1,0,0]=3 12533 B16R0.221 CCCCCCCCCCCNCC(=O)OC 2230a_200011215754_100000747449 [0,2,0,0,0,0|1,0,0]=3 12534 B16R0.221 CCCCCCCCCCCNCC(=O)OC 34a_200011215754_100000747449 [0,2,0,0,0,0|1,0,0]=3 12535 B16R0.221 CCCCCCCCCCCNCC(C)CC 2230a_100020588543_100011215454 [0,2,0,0,0,0|1,0,1]=4 12536 B16R0.221 CCCCCCCCCCCNCC(C)CC 2230a_200011215754_100000748023 [0,2,0,0,0,0|1,0,1]=4 12537 B16R0.221 CCCCCCCCCCCNCC(C)CC 270004a_200011215754_100000243153 [0,2,0,0,0,0|1,0,1]=4 12538 B16R0.221 CCCCCCCCCCCNCC(C)CC 34a_200011215754_100000748023 [0,2,0,0,0,0|1,0,1]=4 12539 B16R0.221 CCCCCCCCCCCNCC(C)CO 34a_100000744482_100011215454 [0,2,0,0,0,0|0,0,2]=4 12540 B16R0.221 CCCCCCCCCCCNCC(O)CC 2230a_100011218483_100011215454 [0,2,0,0,0,0|1,0,1]=4 12541 B16R0.221 CCCCCCCCCCCNCC(O)CC 2230a_200011215754_100011218378 [0,2,0,0,0,0|1,0,1]=4 12542 B16R0.221 CCCCCCCCCCCNCC(O)CC 34a_200011215754_100011218378 [0,2,0,0,0,0|1,0,1]=4 12543 B16R0.221 CCCCCCCCCCCNCC(O)CO 2230a_200011215754_100011219619 [0,2,0,0,0,0|0,0,2]=4 12544 B16R0.221 CCCCCCCCCCCNCC(O)CO 34a_200011215754_100011219619 [0,2,0,0,0,0|0,0,2]=4 12545 B16R0.221 CCCCCCCCCCCNC[C@@H](C)CC 2230a_200011215754_100009816398 [0,2,0,0,0,0|1,0,1]=4 12546 B16R0.221 CCCCCCCCCCCNC[C@@H](C)CC 34a_200011215754_100009816398 [0,2,0,0,0,0|1,0,1]=4 12547 B16R0.221 CCCCCCCCCCCNC[C@@H](C)CO 2230a_200011215754_100000059175 [0,2,0,0,0,0|0,0,2]=4 12548 B16R0.221 CCCCCCCCCCCNC[C@@H](C)CO 34a_200011215754_100000059175 [0,2,0,0,0,0|0,0,2]=4 12549 B16R0.221 CCCCCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100011215454 [0,2,0,0,0,0|2,0,0]=4 12550 B16R0.221 CCCCCCCCCCCNC[C@@H](F)CO 34a_100015665980_100011215454 [0,2,0,0,0,0|0,0,2]=4 12551 B16R0.221 CCCCCCCCCCCNC[C@@H](O)CF 2230a_200011215754_100015614560 [0,2,0,0,0,0|1,0,1]=4 12552 B16R0.221 CCCCCCCCCCCNC[C@@H](O)CF 34a_200011215754_100015614560 [0,2,0,0,0,0|1,0,1]=4 12553 B16R0.221 CCCCCCCCCCCNC[C@@H](O)CO 2230a_200011215754_100009815848 [0,2,0,0,0,0|0,0,2]=4 12554 B16R0.221 CCCCCCCCCCCNC[C@@H](O)CO 34a_200011215754_100009815848 [0,2,0,0,0,0|0,0,2]=4 12555 B16R0.221 CCCCCCCCCCCNC[C@H](O)CO 2230a_100020644852_100011215454 [0,2,0,0,0,0|0,0,2]=4 12556 B16R0.221 CCCCCCCCCCCOCC(=O)CC 34a_100000725409_100011215454 [0,2,0,0,0,0|1,0,0]=3 12557 B16R0.221 CCCCCCCCCCCOCC(=O)CC 7a_100000210809_100000747405 [0,2,0,0,0,0|1,0,0]=3 12558 B16R0.221 CCCCCCCCCCCOCC(=O)NC 34a_100000210809_100000183359 [0,2,0,0,0,0|1,0,0]=3 12559 B16R0.221 CCCCCCCCCCCOCC(=O)NC 34a_100000750040_100011215454 [0,2,0,0,0,0|1,0,0]=3 12560 B16R0.221 CCCCCCCCCCCOCC(=O)NC 7a_100000210809_100000183359 [0,2,0,0,0,0|1,0,0]=3 12561 B16R0.221 CCCCCCCCCCCOCC(=O)OC 34a_100000210809_100000747449 [0,2,0,0,0,0|1,0,0]=3 12562 B16R0.221 CCCCCCCCCCCOCC(=O)OC 7a_100000210809_100000747449 [0,2,0,0,0,0|1,0,0]=3 12563 B16R0.221 CCCCCCCCCCCOCC(C)CC 34a_100000210809_100000748023 [0,2,0,0,0,0|1,0,1]=4 12564 B16R0.221 CCCCCCCCCCCOCC(C)CC 7a_100000210809_100000748023 [0,2,0,0,0,0|1,0,1]=4 12565 B16R0.221 CCCCCCCCCCCOCC(C)CN 34a_100000744482_100011215454 [0,2,0,0,0,0|1,0,1]=4 12566 B16R0.221 CCCCCCCCCCCOCC(C)OC 34a_100000690652_100011215454 [0,2,0,0,0,0|2,0,0]=4 12567 B16R0.221 CCCCCCCCCCCOCC(Cl)CCl 34a_100000033668_100011215454 [0,2,0,0,0,0|1,0,1]=4 12568 B16R0.221 CCCCCCCCCCCOCC(O)CC 34a_100000210809_100011218378 [0,2,0,0,0,0|1,0,1]=4 12569 B16R0.221 CCCCCCCCCCCOCC(O)CC 7a_100000210809_100011218378 [0,2,0,0,0,0|1,0,1]=4 12570 B16R0.221 CCCCCCCCCCCOCC(O)CO 34a_100000210809_100011219619 [0,2,0,0,0,0|0,0,2]=4 12571 B16R0.221 CCCCCCCCCCCOCC(O)CO 7a_100000210809_100011219619 [0,2,0,0,0,0|0,0,2]=4 12572 B16R0.221 CCCCCCCCCCCOC[C@@H](C)CC 34a_100000210809_100009816398 [0,2,0,0,0,0|1,0,1]=4 12573 B16R0.221 CCCCCCCCCCCOC[C@@H](C)CC 7a_100000210809_100009816398 [0,2,0,0,0,0|1,0,1]=4 12574 B16R0.221 CCCCCCCCCCCOC[C@@H](C)CC 7a_100009816381_100011215454 [0,2,0,0,0,0|1,0,1]=4 12575 B16R0.221 CCCCCCCCCCCOC[C@@H](C)CO 34a_100000210809_100000059175 [0,2,0,0,0,0|0,0,2]=4 12576 B16R0.221 CCCCCCCCCCCOC[C@@H](C)CO 7a_100000210809_100000059175 [0,2,0,0,0,0|0,0,2]=4 12577 B16R0.221 CCCCCCCCCCCOC[C@@H](O)CF 34a_100000210809_100015614560 [0,2,0,0,0,0|1,0,1]=4 12578 B16R0.221 CCCCCCCCCCCOC[C@@H](O)CF 7a_100000210809_100015614560 [0,2,0,0,0,0|1,0,1]=4 12579 B16R0.221 CCCCCCCCCCCOC[C@@H](O)CO 34a_100000210809_100009815848 [0,2,0,0,0,0|0,0,2]=4 12580 B16R0.221 CCCCCCCCCCCOC[C@@H](O)CO 7a_100000210809_100009815848 [0,2,0,0,0,0|0,0,2]=4 12581 B16R0.221 CCCCCCCCCCCOC[C@H](F)CN 34a_100015665980_100011215454 [0,2,0,0,0,0|1,0,1]=4 12582 B16R0.221 CCCCCCCCCCCSCC(=O)CC 62a_100000747405_100011215454 [0,2,0,0,0,0|1,0,0]=3 12583 B16R0.221 CCCCCCCCCCCSCC(=O)NC 62a_100000183359_100011215454 [0,2,0,0,0,0|1,0,0]=3 12584 B16R0.221 CCCCCCCCCCCSCC(=O)OC 62a_100000747449_100011215454 [0,2,0,0,0,0|1,0,0]=3 12585 B16R0.221 CCCCCCCCCCCSCC(O)CC 62a_100011218378_100011215454 [0,2,0,0,0,0|1,0,1]=4 12586 B16R0.221 CCCCCCCCCCCSCC(O)CO 62a_100011219619_100011215454 [0,2,0,0,0,0|0,0,2]=4 12587 B16R0.221 CCCCCCCCCCCSC[C@@H](C)CO 62a_100000059175_100011215454 [0,2,0,0,0,0|0,0,2]=4 12588 B16R0.221 CCCCCCCCCCCSC[C@@H](O)CF 62a_100015614560_100011215454 [0,2,0,0,0,0|1,0,1]=4 12589 B16R0.221 CCCCCCCCCCCSC[C@@H](O)CO 62a_100009815848_100011215454 [0,2,0,0,0,0|0,0,2]=4 12590 B16R0.221 CCCCCCCCCCNCCC(=O)NC 2230a_100000684558_100000737683 [0,2,0,0,0,0|1,0,0]=3 12591 B16R0.221 CCCCCCCCCCNCCC(=O)NC 2230a_100000738227_100000210320 [0,2,0,0,0,0|1,0,0]=3 12592 B16R0.221 CCCCCCCCCCNCCC(=O)NC 34a_100000684558_100012179268 [0,2,0,0,0,0|1,0,0]=3 12593 B16R0.221 CCCCCCCCCCNCCC(=O)NC 34a_100000738227_100000210320 [0,2,0,0,0,0|1,0,0]=3 12594 B16R0.221 CCCCCCCCCCNCCC(=O)OC 2230a_100000684558_100000204255 [0,2,0,0,0,0|1,0,0]=3 12595 B16R0.221 CCCCCCCCCCNCCC(=O)OC 34a_100000684558_100000742370 [0,2,0,0,0,0|1,0,0]=3 12596 B16R0.221 CCCCCCCCCCNCCC(C)CC 2230a_100020591266_100000210320 [0,2,0,0,0,0|1,0,1]=4 12597 B16R0.221 CCCCCCCCCCNCCC(C)CO 2230a_106354213184_100000210320 [0,2,0,0,0,0|0,0,2]=4 12598 B16R0.221 CCCCCCCCCCNCCC(C)CO 34a_106354213184_100000210320 [0,2,0,0,0,0|0,0,2]=4 12599 B16R0.221 CCCCCCCCCCOCCC(=NO)N 34a_100000749954_100000210320 [0,2,0,0,0,0|1,0,1]=4 12600 B16R0.221 CCCCCCCCCCOCCC(=O)NC 34a_100000210711_100012179268 [0,2,0,0,0,0|1,0,0]=3 12601 B16R0.221 CCCCCCCCCCOCCC(=O)NC 34a_100000754576_100000210320 [0,2,0,0,0,0|1,0,0]=3 12602 B16R0.221 CCCCCCCCCCOCCC(=O)NC 7a_100000210711_100000737683 [0,2,0,0,0,0|1,0,0]=3 12603 B16R0.221 CCCCCCCCCCOCCC(=O)OC 34a_100000210711_100000742370 [0,2,0,0,0,0|1,0,0]=3 12604 B16R0.221 CCCCCCCCCCOCCC(=O)OC 7a_100000210711_100000204255 [0,2,0,0,0,0|1,0,0]=3 12605 B16R0.221 CCCCCCCCCCOCCC(C)CC 7a_100011215188_100000210320 [0,2,0,0,0,0|1,0,1]=4 12606 B16R0.221 CCCCCCCCCCOCCC(C)OC 7a_100000764861_100000210320 [0,2,0,0,0,0|2,0,0]=4 12607 B16R0.221 CCCCCCCCCCSCCC(=O)NC 62a_100000737683_100000210320 [0,2,0,0,0,0|1,0,0]=3 12608 B16R0.221 CCCCCCCCCCSCCC(=O)OC 62a_100000204255_100000210320 [0,2,0,0,0,0|1,0,0]=3 12609 B16R0.221 CCCCCCCCCNCCCC(=O)NC 2230a_100000212291_100000741757 [0,2,0,0,0,0|1,0,0]=3 12610 B16R0.221 CCCCCCCCCNCCCC(=O)NC 2230a_100000740002_100011214924 [0,2,0,0,0,0|1,0,0]=3 12611 B16R0.221 CCCCCCCCCNCCCC(=O)NC 34a_100000212291_100000741757 [0,2,0,0,0,0|1,0,0]=3 12612 B16R0.221 CCCCCCCCCNCCCC(=O)NC 34a_100000740002_100011214924 [0,2,0,0,0,0|1,0,0]=3 12613 B16R0.221 CCCCCCCCCNCCCC(=O)OC 2230a_100000212291_100011218270 [0,2,0,0,0,0|1,0,0]=3 12614 B16R0.221 CCCCCCCCCNCCCC(=O)OC 34a_100000212291_100000742333 [0,2,0,0,0,0|1,0,0]=3 12615 B16R0.221 CCCCCCCCCNCCNC(=O)CC 34a_100132302217_100011214924 [0,2,0,0,0,0|2,0,0]=4 12616 B16R0.221 CCCCCCCCCNCCNC(=O)NC 34a_100015205895_100011214924 [0,2,0,0,0,0|2,0,0]=4 12617 B16R0.221 CCCCCCCCCNCCOC(=O)NC 34a_100000212291_200011997002 [0,2,0,0,0,0|2,0,0]=4 12618 B16R0.221 CCCCCCCCCOCCCC(=O)NC 34a_100000210712_100000741757 [0,2,0,0,0,0|1,0,0]=3 12619 B16R0.221 CCCCCCCCCOCCCC(=O)NC 7a_100000210712_100000741757 [0,2,0,0,0,0|1,0,0]=3 12620 B16R0.221 CCCCCCCCCOCCCC(=O)NN 34a_100000211488_100011214924 [0,2,0,0,0,0|1,0,0]=3 12621 B16R0.221 CCCCCCCCCOCCCC(=O)OC 34a_100000210712_100000742333 [0,2,0,0,0,0|1,0,0]=3 12622 B16R0.221 CCCCCCCCCOCCCC(=O)OC 7a_100000210712_100011218270 [0,2,0,0,0,0|1,0,0]=3 12623 B16R0.221 CCCCCCCCCOCCCC(C)CC 7a_100011216074_100000210328 [0,2,0,0,0,0|1,0,1]=4 12624 B16R0.221 CCCCCCCCCOCCC[C@@H](C)CN 34a_100160569302_100011214924 [0,2,0,0,0,0|1,0,1]=4 12625 B16R0.221 CCCCCCCCCOCCNC(=O)CC 34a_200000158885_100011214924 [0,2,0,0,0,0|2,0,0]=4 12626 B16R0.221 CCCCCCCCCOCCNC(=O)CC 7a_200000158885_100000210328 [0,2,0,0,0,0|2,0,0]=4 12627 B16R0.221 CCCCCCCCCOCCNC(=O)OC 34a_100000757965_100011214924 [0,2,0,0,0,0|2,0,0]=4 12628 B16R0.221 CCCCCCCCCOCCOC(=O)CC 7a_200000031056_100000210328 [0,2,0,0,0,0|2,0,0]=4 12629 B16R0.221 CCCCCCCCCOCCOC(=O)NC 34a_100000210712_200011997002 [0,2,0,0,0,0|2,0,0]=4 12630 B16R0.221 CCCCCCCCCOCCOC(=O)NC 7a_100000210712_200011997002 [0,2,0,0,0,0|2,0,0]=4 12631 B16R0.221 CCCCCCCCCOCCOC(=O)OC 34a_100010262106_100011214924 [0,2,0,0,0,0|2,0,0]=4 12632 B16R0.221 CCCCCCCCCSCCCC(=O)NC 62a_100000741757_100000210670 [0,2,0,0,0,0|1,0,0]=3 12633 B16R0.221 CCCCCCCCCSCCCC(=O)OC 62a_100011218270_100000210670 [0,2,0,0,0,0|1,0,0]=3 12634 B16R0.221 CCCCCCCCCSCCOC(=O)NC 62a_200011997002_100000210670 [0,2,0,0,0,0|2,0,0]=4 12635 B16R0.221 CCCCCCCCNCCCCC(=O)OC 2230a_100000229939_100000204269 [0,2,0,0,0,0|1,0,0]=3 12636 B16R0.221 CCCCCCCCNCCCCC(=O)OC 34a_100000229939_100000204269 [0,2,0,0,0,0|1,0,0]=3 12637 B16R0.221 CCCCCCCCNCCOCC(=O)OC 2230a_100000229939_100000090808 [0,2,0,0,0,0|2,0,0]=4 12638 B16R0.221 CCCCCCCCNCCOCC(=O)OC 34a_100000229939_100000090808 [0,2,0,0,0,0|2,0,0]=4 12639 B16R0.221 CCCCCCCCOCCCCC(=O)OC 34a_100000059025_100000210759 [0,2,0,0,0,0|1,0,0]=3 12640 B16R0.221 CCCCCCCCOCCCCC(=O)OC 34a_100000210232_100000204269 [0,2,0,0,0,0|1,0,0]=3 12641 B16R0.221 CCCCCCCCOCCCCC(=O)OC 7a_100000059025_100000210759 [0,2,0,0,0,0|1,0,0]=3 12642 B16R0.221 CCCCCCCCOCCCCC(=O)OC 7a_100000210232_100000204269 [0,2,0,0,0,0|1,0,0]=3 12643 B16R0.221 CCCCCCCCOCCOCC(=O)OC 34a_100000210232_100000090808 [0,2,0,0,0,0|2,0,0]=4 12644 B16R0.221 CCCCCCCCOCCOCC(=O)OC 7a_100000210232_100000090808 [0,2,0,0,0,0|2,0,0]=4 12645 B16R0.221 CCCCCCCCSCCCCC(=O)OC 62a_100000204269_100000210317 [0,2,0,0,0,0|1,0,0]=3 12646 B16R0.221 CCCCCCCCSCCCCC(=O)OC 62a_100000210759_100000204269 [0,2,0,0,0,0|1,0,0]=3 12647 B16R0.221 CCCCCCCCSCCOCC(=O)OC 62a_100000090808_100000210317 [0,2,0,0,0,0|2,0,0]=4 12648 B16R0.221 CCCCCCCCSCCOCC(=O)OC 62a_100000210759_100000090808 [0,2,0,0,0,0|2,0,0]=4 12649 B16R0.221 CCCCCCCNCCCCCC(=O)OC 2230a_100000229938_100009816466 [0,2,0,0,0,0|1,0,0]=3 12650 B16R0.221 CCCCCCCOCCCCCC(=O)OC 34a_100000074720_100000210614 [0,2,0,0,0,0|1,0,0]=3 12651 B16R0.221 CCCCCCCOCCCCCC(=O)OC 34a_100000210272_100009816466 [0,2,0,0,0,0|1,0,0]=3 12652 B16R0.221 CCCCCCCOCCCCCC(=O)OC 7a_100000074720_100000210614 [0,2,0,0,0,0|1,0,0]=3 12653 B16R0.221 CCCCCCCOCCCCCC(=O)OC 7a_100000210272_100009816466 [0,2,0,0,0,0|1,0,0]=3 12654 B16R0.221 CCCCCCCOCCCCCC(C)CC 7a_200000035636_100000210614 [0,2,0,0,0,0|1,0,1]=4 12655 B16R0.221 CCCCCCCSCCCCCC(=O)OC 62a_100000210614_100009816466 [0,2,0,0,0,0|1,0,0]=3 12656 B16R0.221 CCCCCCCSCCCCCC(=O)OC 62a_100009816466_100000210316 [0,2,0,0,0,0|1,0,0]=3 12657 B16R0.221 CCCCCCNCCCCCCC(=O)OC 2230a_100000210581_100009815986 [0,2,0,0,0,0|1,0,0]=3 12658 B16R0.221 CCCCCCOCCCCCCC(=O)OC 34a_100000210259_100009815986 [0,2,0,0,0,0|1,0,0]=3 12659 B16R0.221 CCCCCCOCCCCCCC(=O)OC 34a_100009863599_100000210314 [0,2,0,0,0,0|1,0,0]=3 12660 B16R0.221 CCCCCCOCCCCCCC(=O)OC 7a_100000210259_100009815986 [0,2,0,0,0,0|1,0,0]=3 12661 B16R0.221 CCCCCCOCCCCCCC(=O)OC 7a_100009863599_100000210314 [0,2,0,0,0,0|1,0,0]=3 12662 B16R0.221 CCCCCCOCCOCCCC(=O)NC 34a_100000691444_100000741757 [0,2,0,0,0,0|2,0,0]=4 12663 B16R0.221 CCCCCCOCCOCCCC(=O)NC 7a_100000691444_100000741757 [0,2,0,0,0,0|2,0,0]=4 12664 B16R0.221 CCCCCCOCCOCCCC(=O)OC 34a_100000691444_100000742333 [0,2,0,0,0,0|2,0,0]=4 12665 B16R0.221 CCCCCCOCCOCCCC(=O)OC 7a_100000691444_100011218270 [0,2,0,0,0,0|2,0,0]=4 12666 B16R0.221 CCCCCCSCCCCCCC(=O)OC 62a_100000210314_100009815986 [0,2,0,0,0,0|1,0,0]=3 12667 B16R0.221 CCCCCCSCCCCCCC(=O)OC 62a_100009815986_100000210757 [0,2,0,0,0,0|1,0,0]=3 12668 B16R0.221 CCCCCNCCCCCCCC(=O)OC 2230a_100000209983_100010004213 [0,2,0,0,0,0|1,0,0]=3 12669 B16R0.221 CCCCCNCCOCCCCC(=O)OC 34a_100000224656_100000204269 [0,2,0,0,0,0|2,0,0]=4 12670 B16R0.221 CCCCCOCCCCCCCC(=O)OC 34a_100000210253_100010004213 [0,2,0,0,0,0|1,0,0]=3 12671 B16R0.221 CCCCCOCCCCCCCC(=O)OC 34a_100011022521_100000718602 [0,2,0,0,0,0|1,0,0]=3 12672 B16R0.221 CCCCCOCCCCCCCC(=O)OC 7a_100000210253_100010004213 [0,2,0,0,0,0|1,0,0]=3 12673 B16R0.221 CCCCCOCCCCCCCC(=O)OC 7a_100011022521_100000210326 [0,2,0,0,0,0|1,0,0]=3 12674 B16R0.221 CCCCCOCCOCCCCC(=O)OC 34a_100011215259_100000204269 [0,2,0,0,0,0|2,0,0]=4 12675 B16R0.221 CCCCCOCCOCCCCC(=O)OC 7a_100011215259_100000204269 [0,2,0,0,0,0|2,0,0]=4 12676 B16R0.221 CCCCCSCCCCCCCC(=O)OC 62a_100000210326_100010004213 [0,2,0,0,0,0|1,0,0]=3 12677 B16R0.221 CCCCCSCCCCCCCC(=O)OC 62a_100010004213_100000210326 [0,2,0,0,0,0|1,0,0]=3 12678 B16R0.221 CCCCNCCCCCCCCC(=O)OC 2230a_100000102301_100010282707 [0,2,0,0,0,0|1,0,0]=3 12679 B16R0.221 CCCCNCCCCCCCCC(=O)OC 7a_106832991798_100010282707 [0,2,0,0,0,0|1,0,0]=3 12680 B16R0.221 CCCCNCCCCOCCCC(=O)NC 34a_200011216965_100000741757 [0,2,0,0,0,0|2,0,0]=4 12681 B16R0.221 CCCCNCCCCOCCCC(=O)OC 34a_200011216965_100000742333 [0,2,0,0,0,0|2,0,0]=4 12682 B16R0.221 CCCCOCCCCCCCCC(=O)OC 34a_100000035544_100000210210 [0,2,0,0,0,0|1,0,0]=3 12683 B16R0.221 CCCCOCCCCCCCCC(=O)OC 34a_100000210227_100010282707 [0,2,0,0,0,0|1,0,0]=3 12684 B16R0.221 CCCCOCCCCCCCCC(=O)OC 7a_100000035544_100000210211 [0,2,0,0,0,0|1,0,0]=3 12685 B16R0.221 CCCCOCCCCCCCCC(=O)OC 7a_100000210227_100010282707 [0,2,0,0,0,0|1,0,0]=3 12686 B16R0.221 CCCCOCCCCOCCCC(=O)NC 34a_200000760531_100000741757 [0,2,0,0,0,0|2,0,0]=4 12687 B16R0.221 CCCCOCCCCOCCCC(=O)NC 7a_200000760531_100000741757 [0,2,0,0,0,0|2,0,0]=4 12688 B16R0.221 CCCCOCCCCOCCCC(=O)OC 34a_200000760531_100000742333 [0,2,0,0,0,0|2,0,0]=4 12689 B16R0.221 CCCCOCCCCOCCCC(=O)OC 7a_200000760531_100011218270 [0,2,0,0,0,0|2,0,0]=4 12690 B16R0.221 CCCCOCCCNCCCCC(=O)OC 2230a_200000211371_100000204269 [0,2,0,0,0,0|2,0,0]=4 12691 B16R0.221 CCCCOCCCNCCCCC(=O)OC 34a_200000211371_100000204269 [0,2,0,0,0,0|2,0,0]=4 12692 B16R0.221 CCCCOCCCOCCCCC(=O)OC 34a_200011215613_100000204269 [0,2,0,0,0,0|2,0,0]=4 12693 B16R0.221 CCCCOCCCOCCCCC(=O)OC 7a_200011215613_100000204269 [0,2,0,0,0,0|2,0,0]=4 12694 B16R0.221 CCCCOCCOCCCCCC(=O)OC 34a_100000074720_100000743108 [0,2,0,0,0,0|2,0,0]=4 12695 B16R0.221 CCCCOCCOCCCCCC(=O)OC 34a_100000210238_100009816466 [0,2,0,0,0,0|2,0,0]=4 12696 B16R0.221 CCCCOCCOCCCCCC(=O)OC 7a_100000074720_100000743108 [0,2,0,0,0,0|2,0,0]=4 12697 B16R0.221 CCCCOCCOCCCCCC(=O)OC 7a_100000210238_100009816466 [0,2,0,0,0,0|2,0,0]=4 12698 B16R0.221 CCCCOCCSCCCCCC(=O)OC 62a_100000743108_100009816466 [0,2,0,0,0,0|2,0,0]=4 12699 B16R0.221 CCCCOCCSCCCCCC(=O)OC 62a_100009816466_100000743108 [0,2,0,0,0,0|2,0,0]=4 12700 B16R0.221 CCCCOCOCCCCCCC(=O)OC 34a_100009863599_100011995733 [0,2,0,0,0,0|2,0,0]=4 12701 B16R0.221 CCCCOCSCCCCCCC(=O)OC 62a_100009815986_100011995733 [0,2,0,0,0,0|2,0,0]=4 12702 B16R0.221 CCCCOCSCCCCCCC(=O)OC 62a_100011995733_100009815986 [0,2,0,0,0,0|2,0,0]=4 12703 B16R0.221 CCCCSCCCCCCCCC(=O)OC 62a_100000210211_100010282707 [0,2,0,0,0,0|1,0,0]=3 12704 B16R0.221 CCCCSCCCCCCCCC(=O)OC 62a_100010282707_100000210210 [0,2,0,0,0,0|1,0,0]=3 12705 B16R0.221 CCCCSCCNCCCCCC(=O)OC 2230a_100025743550_100009816466 [0,2,0,0,0,0|2,0,0]=4 12706 B16R0.221 CCCCSCCOCCCCCC(=O)OC 34a_200000230436_100009816466 [0,2,0,0,0,0|2,0,0]=4 12707 B16R0.221 CCCCSCCOCCCCCC(=O)OC 7a_200000230436_100009816466 [0,2,0,0,0,0|2,0,0]=4 12708 B16R0.221 CCCOCCCCCCCCCC(=O)OC 34a_100000210258_100009813843 [0,2,0,0,0,0|1,0,0]=3 12709 B16R0.221 CCCOCCCNCCCCCC(=O)OC 2230a_100011217757_100009816466 [0,2,0,0,0,0|2,0,0]=4 12710 B16R0.221 CCCOCCCNCCCCCC(=O)OC 34a_100011217757_100009816466 [0,2,0,0,0,0|2,0,0]=4 12711 B16R0.221 CCCOCCNCCCCCCC(=O)OC 2230a_100161115042_100009815986 [0,2,0,0,0,0|2,0,0]=4 12712 B16R0.221 CCCOCCNCCCCCCC(=O)OC 34a_100161115042_100009815986 [0,2,0,0,0,0|2,0,0]=4 12713 B16R0.221 CCCOCCOCCCCCCC(=O)OC 34a_100000752267_100009815986 [0,2,0,0,0,0|2,0,0]=4 12714 B16R0.221 CCCOCCOCCCCCCC(=O)OC 34a_100009863599_100011215938 [0,2,0,0,0,0|2,0,0]=4 12715 B16R0.221 CCCOCCOCCCCCCC(=O)OC 7a_100000752267_100009815986 [0,2,0,0,0,0|2,0,0]=4 12716 B16R0.221 CCCOCCOCCCCCCC(=O)OC 7a_100009863599_100011215938 [0,2,0,0,0,0|2,0,0]=4 12717 B16R0.221 CCCOCCSCCCCCCC(=O)OC 62a_100009815986_100011215938 [0,2,0,0,0,0|2,0,0]=4 12718 B16R0.221 CCCOCCSCCCCCCC(=O)OC 62a_100011215938_100009815986 [0,2,0,0,0,0|2,0,0]=4 12719 B16R0.221 CCCSCCCCCCCCCC(=O)OC 62a_100000210303_100009813843 [0,2,0,0,0,0|1,0,0]=3 12720 B16R0.221 CCCSCCNCCCCCCC(=O)OC 2230a_100020603323_100009815986 [0,2,0,0,0,0|2,0,0]=4 12721 B16R0.221 CCCSCCOCCCCCCC(=O)OC 34a_200000230433_100009815986 [0,2,0,0,0,0|2,0,0]=4 12722 B16R0.221 CCCSCCOCCCCCCC(=O)OC 7a_200000230433_100009815986 [0,2,0,0,0,0|2,0,0]=4 12723 B16R0.221 CCN(C)CCCCCCCCCCCCO 2230a_100000225621_100009813331 [0,2,0,0,0,0|0,0,2]=4 12724 B16R0.221 CCN(C)CCCCCCCCCCCCO 269982a_100000225621_100009813331 [0,2,0,0,0,0|0,0,2]=4 12725 B16R0.221 CCNCCCCCCCCCCC(=O)OC 2230a_100015525214_100009812566 [0,2,0,0,0,0|1,0,0]=3 12726 B16R0.221 CCOCCCCCCCCCCC(=O)OC 34a_100011003013_100000210202 [0,2,0,0,0,0|1,0,0]=3 12727 B16R0.221 CCOCCCCCCCCCCC(=O)OC 34a_100121572206_100009812566 [0,2,0,0,0,0|1,0,0]=3 12728 B16R0.221 CCOCCCCCCCCCCC(=O)OC 7a_100011003013_100000210202 [0,2,0,0,0,0|1,0,0]=3 12729 B16R0.221 CCOCCCNCCCCCCC(=O)OC 2230a_100000210961_100009815986 [0,2,0,0,0,0|2,0,0]=4 12730 B16R0.221 CCOCCCNCCCCCCC(=O)OC 34a_100000210961_100009815986 [0,2,0,0,0,0|2,0,0]=4 12731 B16R0.221 CCOCCCOCCCCCCC(=O)OC 34a_100000757476_100009815986 [0,2,0,0,0,0|2,0,0]=4 12732 B16R0.221 CCOCCCOCCCCCCC(=O)OC 34a_100009863599_100012232248 [0,2,0,0,0,0|2,0,0]=4 12733 B16R0.221 CCOCCCOCCCCCCC(=O)OC 7a_100000757476_100009815986 [0,2,0,0,0,0|2,0,0]=4 12734 B16R0.221 CCOCCCOCCCCCCC(=O)OC 7a_100009863599_100012232248 [0,2,0,0,0,0|2,0,0]=4 12735 B16R0.221 CCOCCCSCCCCCCC(=O)OC 62a_100009815986_100012232248 [0,2,0,0,0,0|2,0,0]=4 12736 B16R0.221 CCOCCCSCCCCCCC(=O)OC 62a_100012232248_100009815986 [0,2,0,0,0,0|2,0,0]=4 12737 B16R0.221 CCOCCNCCCCCCCC(=O)OC 2230a_102516460346_100010004213 [0,2,0,0,0,0|2,0,0]=4 12738 B16R0.221 CCOCCNCCCCCCCC(=O)OC 34a_102516460346_100010004213 [0,2,0,0,0,0|2,0,0]=4 12739 B16R0.221 CCOCCOCCCCCCCC(=O)OC 34a_100000210136_100010004213 [0,2,0,0,0,0|2,0,0]=4 12740 B16R0.221 CCOCCOCCCCCCCC(=O)OC 34a_100011022521_100000210147 [0,2,0,0,0,0|2,0,0]=4 12741 B16R0.221 CCOCCOCCCCCCCC(=O)OC 7a_100000210136_100010004213 [0,2,0,0,0,0|2,0,0]=4 12742 B16R0.221 CCOCCOCCCCCCCC(=O)OC 7a_100011022521_100011215890 [0,2,0,0,0,0|2,0,0]=4 12743 B16R0.221 CCOCCSCCCCCCCC(=O)OC 62a_100000210147_100010004213 [0,2,0,0,0,0|2,0,0]=4 12744 B16R0.221 CCOCCSCCCCCCCC(=O)OC 62a_100010004213_100011215890 [0,2,0,0,0,0|2,0,0]=4 12745 B16R0.221 CCOCSCCCCCCCCC(=O)OC 62a_100000739092_100010282707 [0,2,0,0,0,0|2,0,0]=4 12746 B16R0.221 CCOCSCCCCCCCCC(=O)OC 62a_100010282707_100000739092 [0,2,0,0,0,0|2,0,0]=4 12747 B16R0.221 CCSCCCCCCCCCCC(=O)OC 62a_100000210202_100009812566 [0,2,0,0,0,0|1,0,0]=3 12748 B16R0.221 CCSCCCOCCCCCCC(=O)OC 34a_100011216438_100009815986 [0,2,0,0,0,0|2,0,0]=4 12749 B16R0.221 CCSCCCOCCCCCCC(=O)OC 7a_100011216438_100009815986 [0,2,0,0,0,0|2,0,0]=4 12750 B16R0.221 CCSCCNCCCCCCCC(=O)OC 2230a_100000106463_100010004213 [0,2,0,0,0,0|2,0,0]=4 12751 B16R0.221 CCSCCOCCCCCCCC(=O)OC 34a_100000212035_100010004213 [0,2,0,0,0,0|2,0,0]=4 12752 B16R0.221 CCSCCOCCCCCCCC(=O)OC 34a_100011022521_100000757381 [0,2,0,0,0,0|2,0,0]=4 12753 B16R0.221 CCSCCOCCCCCCCC(=O)OC 7a_100000212035_100010004213 [0,2,0,0,0,0|2,0,0]=4 12754 B16R0.221 CCSCCOCCCCCCCC(=O)OC 7a_100011022521_100000757381 [0,2,0,0,0,0|2,0,0]=4 12755 B16R0.221 CCSCCSCCCCCCCC(=O)OC 62a_100000757381_100010004213 [0,2,0,0,0,0|2,0,0]=4 12756 B16R0.221 CCSCCSCCCCCCCC(=O)OC 62a_100010004213_100000757381 [0,2,0,0,0,0|2,0,0]=4 12757 B16R0.221 CC[C@H](C)CNCCCCCCCCCCO 2230a_100000066964_100009816398 [0,2,0,0,0,0|0,0,2]=4 12758 B16R0.221 CC[C@H](C)CNCCCCCCCCCCO 34a_100000066964_100009816398 [0,2,0,0,0,0|0,0,2]=4 12759 B16R0.221 CC[C@H](C)COCCCCCCCCCCBr 34a_100009813290_100009816398 [0,2,0,0,0,0|1,0,1]=4 12760 B16R0.221 CC[C@H](C)COCCCCCCCCCCBr 7a_100009813290_100009816398 [0,2,0,0,0,0|1,0,1]=4 12761 B16R0.221 CC[C@H](C)COCCCCCCCCCCCl 34a_200000033068_100009816398 [0,2,0,0,0,0|1,0,1]=4 12762 B16R0.221 CC[C@H](C)COCCCCCCCCCCCl 7a_200000033068_100009816398 [0,2,0,0,0,0|1,0,1]=4 12763 B16R0.221 CC[C@H](C)COCCCCCCCCCCN 34a_100000066964_100009816398 [0,2,0,0,0,0|1,0,1]=4 12764 B16R0.221 CC[C@H](C)COCCCCCCCCCCO 7a_100009816381_100009813290 [0,2,0,0,0,0|0,0,2]=4 12765 B16R0.221 CC[C@H](C)CSCCCCCCCCCCO 62a_100009813290_100009816398 [0,2,0,0,0,0|0,0,2]=4 12766 B16R0.221 CC[C@H](C)CSCCCCCCCCCCO 62a_100009816398_200000033068 [0,2,0,0,0,0|0,0,2]=4 12767 B16R0.221 CNC(=O)CCCCCCCCCCCCO 240690a_100102657272_100102582631 [0,2,0,0,0,0|1,0,0]=3 12768 B16R0.221 CNC(=O)CCCNCCCCCCCCO 2230a_100000740002_100000033203 [0,2,0,0,0,0|2,0,0]=4 12769 B16R0.221 CNC(=O)CCCNCCCCCCCCO 2230a_102515433106_100000741757 [0,2,0,0,0,0|2,0,0]=4 12770 B16R0.221 CNC(=O)CCCNCCCCCCCCO 34a_100000740002_100000033203 [0,2,0,0,0,0|2,0,0]=4 12771 B16R0.221 CNC(=O)CCCNCCCCCCCCO 34a_102515433106_100000741757 [0,2,0,0,0,0|2,0,0]=4 12772 B16R0.221 CNC(=O)CCCOCCCCCCCCBr 34a_100009813846_100000741757 [0,2,0,0,0,0|2,0,0]=4 12773 B16R0.221 CNC(=O)CCCOCCCCCCCCBr 7a_100009813846_100000741757 [0,2,0,0,0,0|2,0,0]=4 12774 B16R0.221 CNC(=O)CCCOCCCCCCCCCl 34a_100000033203_100000741757 [0,2,0,0,0,0|2,0,0]=4 12775 B16R0.221 CNC(=O)CCCOCCCCCCCCCl 7a_100000033203_100000741757 [0,2,0,0,0,0|2,0,0]=4 12776 B16R0.221 CNC(=O)CCCOCCCCCCCCN 34a_102515433106_100000741757 [0,2,0,0,0,0|2,0,0]=4 12777 B16R0.221 CNC(=O)CCCSCCCCCCCCO 62a_100000033203_100000741757 [0,2,0,0,0,0|2,0,0]=4 12778 B16R0.221 CNC(=O)CCCSCCCCCCCCO 62a_100000741757_100000033203 [0,2,0,0,0,0|2,0,0]=4 12779 B16R0.221 CNC(=O)CCNCCCCCCCCCO 2230a_100000078944_100000737683 [0,2,0,0,0,0|2,0,0]=4 12780 B16R0.221 CNC(=O)CCNCCCCCCCCCO 2230a_100000738227_100009813782 [0,2,0,0,0,0|2,0,0]=4 12781 B16R0.221 CNC(=O)CCNCCCCCCCCCO 34a_100000078944_100012179268 [0,2,0,0,0,0|2,0,0]=4 12782 B16R0.221 CNC(=O)CCNCCCCCCCCCO 34a_100000738227_100009813782 [0,2,0,0,0,0|2,0,0]=4 12783 B16R0.221 CNC(=O)CCOCCCCCCCCCBr 34a_100009813782_100012179268 [0,2,0,0,0,0|2,0,0]=4 12784 B16R0.221 CNC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000737683 [0,2,0,0,0,0|2,0,0]=4 12785 B16R0.221 CNC(=O)CCOCCCCCCCCCCl 34a_100009868337_100012179268 [0,2,0,0,0,0|2,0,0]=4 12786 B16R0.221 CNC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000737683 [0,2,0,0,0,0|2,0,0]=4 12787 B16R0.221 CNC(=O)CCOCCCCCCCCCN 34a_100000078944_100012179268 [0,2,0,0,0,0|2,0,0]=4 12788 B16R0.221 CNC(=O)CCOCCCCCCCCCO 34a_100000754576_100009813782 [0,2,0,0,0,0|2,0,0]=4 12789 B16R0.221 CNC(=O)CCSCCCCCCCCCO 62a_100000737683_100009813782 [0,2,0,0,0,0|2,0,0]=4 12790 B16R0.221 CNC(=O)CCSCCCCCCCCCO 62a_100009813782_100000737683 [0,2,0,0,0,0|2,0,0]=4 12791 B16R0.221 CNC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000183359 [0,2,0,0,0,0|2,0,0]=4 12792 B16R0.221 CNC(=O)CNCCCCCCCCCCO 2230a_100000693194_100009813290 [0,2,0,0,0,0|2,0,0]=4 12793 B16R0.221 CNC(=O)CNCCCCCCCCCCO 34a_100000066964_100000183359 [0,2,0,0,0,0|2,0,0]=4 12794 B16R0.221 CNC(=O)COCCCCCCCCCCBr 34a_100009813290_100000183359 [0,2,0,0,0,0|2,0,0]=4 12795 B16R0.221 CNC(=O)COCCCCCCCCCCBr 7a_100009813290_100000183359 [0,2,0,0,0,0|2,0,0]=4 12796 B16R0.221 CNC(=O)COCCCCCCCCCCCl 34a_200000033068_100000183359 [0,2,0,0,0,0|2,0,0]=4 12797 B16R0.221 CNC(=O)COCCCCCCCCCCCl 7a_200000033068_100000183359 [0,2,0,0,0,0|2,0,0]=4 12798 B16R0.221 CNC(=O)COCCCCCCCCCCN 34a_100000066964_100000183359 [0,2,0,0,0,0|2,0,0]=4 12799 B16R0.221 CNC(=O)COCCCCCCCCCCO 34a_100000750040_100009813290 [0,2,0,0,0,0|2,0,0]=4 12800 B16R0.221 CNC(=O)CSCCCCCCCCCCO 62a_100000183359_200000033068 [0,2,0,0,0,0|2,0,0]=4 12801 B16R0.221 CNC(=O)CSCCCCCCCCCCO 62a_100009813290_100000183359 [0,2,0,0,0,0|2,0,0]=4 12802 B16R0.221 CNCCCCCCCCCCCC(=O)OC 2230a_106832991635_100010983606 [0,2,0,0,0,0|1,0,0]=3 12803 B16R0.221 CNCCCCCCCCCCCC(=O)OC 34a_100102657272_100010983606 [0,2,0,0,0,0|1,0,0]=3 12804 B16R0.221 CNCCCCCCCCCCCC(=O)OC 7a_106832991635_100010983606 [0,2,0,0,0,0|1,0,0]=3 12805 B16R0.221 CNCCCCCOCCCCCC(=O)OC 34a_100000722520_100009816466 [0,2,0,0,0,0|2,0,0]=4 12806 B16R0.221 CNCCCOCCCCCCCC(=O)OC 34a_100000213112_100010004213 [0,2,0,0,0,0|2,0,0]=4 12807 B16R0.221 COC(=O)CCCCCCCCCCCSC 62a_200000210301_100010983606 [0,2,0,0,0,0|1,0,0]=3 12808 B16R0.221 COC(=O)CCCCCCCCCCCS[13CH3] 62a_200025704644_100010983606 [0,2,0,0,0,0|1,0,0]=3 12809 B16R0.221 COC(=O)CCCCCCCCCCOCF 34a_100011003013_100015361967 [0,2,0,0,0,0|2,0,0]=4 12810 B16R0.221 COC(=O)CCCCCCCCCCOCF 7a_100011003013_100015361967 [0,2,0,0,0,0|2,0,0]=4 12811 B16R0.221 COC(=O)CCCCCCCCCCSCF 62a_100015361967_100009812566 [0,2,0,0,0,0|2,0,0]=4 12812 B16R0.221 COC(=O)CCCCCCCCCNCCF 34a_100000724931_100009813843 [0,2,0,0,0,0|2,0,0]=4 12813 B16R0.221 COC(=O)CCCCCCCCCNCCO 2230a_100016997473_100009813843 [0,2,0,0,0,0|2,0,0]=4 12814 B16R0.221 COC(=O)CCCCCCCCCNCCO 34a_100016990907_100009813843 [0,2,0,0,0,0|2,0,0]=4 12815 B16R0.221 COC(=O)CCCCCCCCCOCCBr 34a_100000211926_100009813843 [0,2,0,0,0,0|2,0,0]=4 12816 B16R0.221 COC(=O)CCCCCCCCCOCCN 34a_100000210304_100009813843 [0,2,0,0,0,0|2,0,0]=4 12817 B16R0.221 COC(=O)CCCCCCCCCSCC=O 62a_200015260668_100009813843 [0,2,0,0,0,0|1,0,1]=4 12818 B16R0.221 COC(=O)CCCCCCCCCSCCF 62a_100011217306_100009813843 [0,2,0,0,0,0|2,0,0]=4 12819 B16R0.221 COC(=O)CCCCCCCCCSCCO 62a_100000211926_100009813843 [0,2,0,0,0,0|2,0,0]=4 12820 B16R0.221 COC(=O)CCCCCCCCCSCSC 62a_100011218213_100009813843 [0,2,0,0,0,0|2,0,0]=4 12821 B16R0.221 COC(=O)CCCCCCCCNCCCF 2230a_100015189416_100010282707 [0,2,0,0,0,0|2,0,0]=4 12822 B16R0.221 COC(=O)CCCCCCCCNCCCF 34a_100015189416_100010282707 [0,2,0,0,0,0|2,0,0]=4 12823 B16R0.221 COC(=O)CCCCCCCCNCCSC 2230a_100020590264_100010282707 [0,2,0,0,0,0|2,0,0]=4 12824 B16R0.221 COC(=O)CCCCCCCCOCCCBr 34a_100011217188_100010282707 [0,2,0,0,0,0|2,0,0]=4 12825 B16R0.221 COC(=O)CCCCCCCCOCCCCl 34a_100000230001_100010282707 [0,2,0,0,0,0|2,0,0]=4 12826 B16R0.221 COC(=O)CCCCCCCCOCCCF 34a_100000035544_100011934791 [0,2,0,0,0,0|2,0,0]=4 12827 B16R0.221 COC(=O)CCCCCCCCOCCCF 34a_100000759539_100010282707 [0,2,0,0,0,0|2,0,0]=4 12828 B16R0.221 COC(=O)CCCCCCCCOCCCF 7a_100000035544_100011934791 [0,2,0,0,0,0|2,0,0]=4 12829 B16R0.221 COC(=O)CCCCCCCCOCCCN 34a_100000182051_100010282707 [0,2,0,0,0,0|2,0,0]=4 12830 B16R0.221 COC(=O)CCCCCCCCOCCCO 34a_100000035544_100000230001 [0,2,0,0,0,0|2,0,0]=4 12831 B16R0.221 COC(=O)CCCCCCCCOCCCO 7a_100000035544_100011215043 [0,2,0,0,0,0|2,0,0]=4 12832 B16R0.221 COC(=O)CCCCCCCCOCCSC 34a_100000035544_100000212216 [0,2,0,0,0,0|2,0,0]=4 12833 B16R0.221 COC(=O)CCCCCCCCOCCSC 34a_100000230434_100010282707 [0,2,0,0,0,0|2,0,0]=4 12834 B16R0.221 COC(=O)CCCCCCCCOCCSC 7a_100000035544_100000212216 [0,2,0,0,0,0|2,0,0]=4 12835 B16R0.221 COC(=O)CCCCCCCCOCCSC 7a_100000230434_100010282707 [0,2,0,0,0,0|2,0,0]=4 12836 B16R0.221 COC(=O)CCCCCCCCSCCCF 62a_100010282707_100011934791 [0,2,0,0,0,0|2,0,0]=4 12837 B16R0.221 COC(=O)CCCCCCCCSCCCF 62a_100011934791_100010282707 [0,2,0,0,0,0|2,0,0]=4 12838 B16R0.221 COC(=O)CCCCCCCCSCCCO 62a_100010282707_100011215043 [0,2,0,0,0,0|2,0,0]=4 12839 B16R0.221 COC(=O)CCCCCCCCSCCCO 62a_100011215043_100010282707 [0,2,0,0,0,0|2,0,0]=4 12840 B16R0.221 COC(=O)CCCCCCCCSCCSC 62a_100000212216_100010282707 [0,2,0,0,0,0|2,0,0]=4 12841 B16R0.221 COC(=O)CCCCCCCCSCCSC 62a_100010282707_100000751147 [0,2,0,0,0,0|2,0,0]=4 12842 B16R0.221 COC(=O)CCCCCCCNCCCCO 2230a_100000750430_100010004213 [0,2,0,0,0,0|2,0,0]=4 12843 B16R0.221 COC(=O)CCCCCCCNCCCCO 34a_100000750430_100010004213 [0,2,0,0,0,0|2,0,0]=4 12844 B16R0.221 COC(=O)CCCCCCCNCCCSC 2230a_100000749238_100010004213 [0,2,0,0,0,0|2,0,0]=4 12845 B16R0.221 COC(=O)CCCCCCCOCCCC=O 7a_100011022521_200011292268 [0,2,0,0,0,0|1,0,1]=4 12846 B16R0.221 COC(=O)CCCCCCCOCCCCBr 34a_100011216708_100010004213 [0,2,0,0,0,0|2,0,0]=4 12847 B16R0.221 COC(=O)CCCCCCCOCCCCCl 34a_100000210776_100010004213 [0,2,0,0,0,0|2,0,0]=4 12848 B16R0.221 COC(=O)CCCCCCCOCCCCCl 7a_100000210776_100010004213 [0,2,0,0,0,0|2,0,0]=4 12849 B16R0.221 COC(=O)CCCCCCCOCCCCF 34a_100011022521_100000729493 [0,2,0,0,0,0|2,0,0]=4 12850 B16R0.221 COC(=O)CCCCCCCOCCCCF 34a_100011995726_100010004213 [0,2,0,0,0,0|2,0,0]=4 12851 B16R0.221 COC(=O)CCCCCCCOCCCCF 7a_100011022521_100000729493 [0,2,0,0,0,0|2,0,0]=4 12852 B16R0.221 COC(=O)CCCCCCCOCCCCF 7a_100011995726_100010004213 [0,2,0,0,0,0|2,0,0]=4 12853 B16R0.221 COC(=O)CCCCCCCOCCCCI 34a_200012148704_100010004213 [0,2,0,0,0,0|2,0,0]=4 12854 B16R0.221 COC(=O)CCCCCCCOCCCCN 34a_100000750430_100010004213 [0,2,0,0,0,0|2,0,0]=4 12855 B16R0.221 COC(=O)CCCCCCCOCCCCO 34a_100011022521_100011216708 [0,2,0,0,0,0|2,0,0]=4 12856 B16R0.221 COC(=O)CCCCCCCOCCCCO 7a_100011022521_100000210776 [0,2,0,0,0,0|2,0,0]=4 12857 B16R0.221 COC(=O)CCCCCCCOCCCSC 34a_100000690336_100010004213 [0,2,0,0,0,0|2,0,0]=4 12858 B16R0.221 COC(=O)CCCCCCCOCCCSC 7a_100000690336_100010004213 [0,2,0,0,0,0|2,0,0]=4 12859 B16R0.221 COC(=O)CCCCCCCSCCCC=O 62a_100010004213_200011292268 [0,2,0,0,0,0|1,0,1]=4 12860 B16R0.221 COC(=O)CCCCCCCSCCCC=O 62a_200011292268_100010004213 [0,2,0,0,0,0|1,0,1]=4 12861 B16R0.221 COC(=O)CCCCCCCSCCCCF 62a_100000729493_100010004213 [0,2,0,0,0,0|2,0,0]=4 12862 B16R0.221 COC(=O)CCCCCCCSCCCCF 62a_100010004213_100000729493 [0,2,0,0,0,0|2,0,0]=4 12863 B16R0.221 COC(=O)CCCCCCCSCCCCO 62a_100000210776_100010004213 [0,2,0,0,0,0|2,0,0]=4 12864 B16R0.221 COC(=O)CCCCCCCSCCCCO 62a_100010004213_100000210776 [0,2,0,0,0,0|2,0,0]=4 12865 B16R0.221 COC(=O)CCCCCCNCCCCCO 2230a_100000762737_100009815986 [0,2,0,0,0,0|2,0,0]=4 12866 B16R0.221 COC(=O)CCCCCCNCCCCCO 34a_100000762737_100009815986 [0,2,0,0,0,0|2,0,0]=4 12867 B16R0.221 COC(=O)CCCCCCOCCCCC=O 7a_100009863599_100000139335 [0,2,0,0,0,0|1,0,1]=4 12868 B16R0.221 COC(=O)CCCCCCOCCCCCBr 34a_100000746331_100009815986 [0,2,0,0,0,0|2,0,0]=4 12869 B16R0.221 COC(=O)CCCCCCOCCCCCBr 7a_100000746331_100009815986 [0,2,0,0,0,0|2,0,0]=4 12870 B16R0.221 COC(=O)CCCCCCOCCCCCCl 34a_100000746330_100009815986 [0,2,0,0,0,0|2,0,0]=4 12871 B16R0.221 COC(=O)CCCCCCOCCCCCCl 7a_100000746330_100009815986 [0,2,0,0,0,0|2,0,0]=4 12872 B16R0.221 COC(=O)CCCCCCOCCCCCF 34a_100009863599_100000729378 [0,2,0,0,0,0|2,0,0]=4 12873 B16R0.221 COC(=O)CCCCCCOCCCCCF 7a_100009863599_100000729378 [0,2,0,0,0,0|2,0,0]=4 12874 B16R0.221 COC(=O)CCCCCCOCCCCCI 34a_200012148887_100009815986 [0,2,0,0,0,0|2,0,0]=4 12875 B16R0.221 COC(=O)CCCCCCOCCCCCI 7a_200012148887_100009815986 [0,2,0,0,0,0|2,0,0]=4 12876 B16R0.221 COC(=O)CCCCCCOCCCCCN 34a_100000762737_100009815986 [0,2,0,0,0,0|2,0,0]=4 12877 B16R0.221 COC(=O)CCCCCCOCCCCCO 34a_100009863599_100000746330 [0,2,0,0,0,0|2,0,0]=4 12878 B16R0.221 COC(=O)CCCCCCOCCCCCO 7a_100009863599_100000746330 [0,2,0,0,0,0|2,0,0]=4 12879 B16R0.221 COC(=O)CCCCCCOCCCCSC 34a_100011217163_100009815986 [0,2,0,0,0,0|2,0,0]=4 12880 B16R0.221 COC(=O)CCCCCCOCCCCSC 7a_100011217163_100009815986 [0,2,0,0,0,0|2,0,0]=4 12881 B16R0.221 COC(=O)CCCCCCSCCCCC=O 62a_100000139335_100009815986 [0,2,0,0,0,0|1,0,1]=4 12882 B16R0.221 COC(=O)CCCCCCSCCCCC=O 62a_100009815986_100000139335 [0,2,0,0,0,0|1,0,1]=4 12883 B16R0.221 COC(=O)CCCCCCSCCCCCF 62a_100000729378_100009815986 [0,2,0,0,0,0|2,0,0]=4 12884 B16R0.221 COC(=O)CCCCCCSCCCCCF 62a_100009815986_100000729378 [0,2,0,0,0,0|2,0,0]=4 12885 B16R0.221 COC(=O)CCCCCCSCCCCCO 62a_100000746330_100009815986 [0,2,0,0,0,0|2,0,0]=4 12886 B16R0.221 COC(=O)CCCCCCSCCCCCO 62a_100009815986_100000746330 [0,2,0,0,0,0|2,0,0]=4 12887 B16R0.221 COC(=O)CCCCCNCCCCCCO 2230a_100000686447_100009816466 [0,2,0,0,0,0|2,0,0]=4 12888 B16R0.221 COC(=O)CCCCCNCCCCCCO 34a_100000686447_100009816466 [0,2,0,0,0,0|2,0,0]=4 12889 B16R0.221 COC(=O)CCCCCOCCCCCC=O 7a_100000074720_100000139337 [0,2,0,0,0,0|1,0,1]=4 12890 B16R0.221 COC(=O)CCCCCOCCCCCCBr 34a_100011215345_100009816466 [0,2,0,0,0,0|2,0,0]=4 12891 B16R0.221 COC(=O)CCCCCOCCCCCCBr 7a_100011215345_100009816466 [0,2,0,0,0,0|2,0,0]=4 12892 B16R0.221 COC(=O)CCCCCOCCCCCCCl 34a_100000766143_100009816466 [0,2,0,0,0,0|2,0,0]=4 12893 B16R0.221 COC(=O)CCCCCOCCCCCCCl 7a_100000766143_100009816466 [0,2,0,0,0,0|2,0,0]=4 12894 B16R0.221 COC(=O)CCCCCOCCCCCCF 34a_100000074720_100015922095 [0,2,0,0,0,0|2,0,0]=4 12895 B16R0.221 COC(=O)CCCCCOCCCCCCF 34a_100000732779_100009816466 [0,2,0,0,0,0|2,0,0]=4 12896 B16R0.221 COC(=O)CCCCCOCCCCCCF 7a_100000074720_100015922095 [0,2,0,0,0,0|2,0,0]=4 12897 B16R0.221 COC(=O)CCCCCOCCCCCCF 7a_100000732779_100009816466 [0,2,0,0,0,0|2,0,0]=4 12898 B16R0.221 COC(=O)CCCCCOCCCCCCN 34a_100000686447_100009816466 [0,2,0,0,0,0|2,0,0]=4 12899 B16R0.221 COC(=O)CCCCCOCCCCCCO 34a_100000074720_100000766143 [0,2,0,0,0,0|2,0,0]=4 12900 B16R0.221 COC(=O)CCCCCOCCCCCCO 7a_100000074720_100000766143 [0,2,0,0,0,0|2,0,0]=4 12901 B16R0.221 COC(=O)CCCCCSCCCCCC=O 62a_100000139337_100009816466 [0,2,0,0,0,0|1,0,1]=4 12902 B16R0.221 COC(=O)CCCCCSCCCCCC=O 62a_100009816466_100000139337 [0,2,0,0,0,0|1,0,1]=4 12903 B16R0.221 COC(=O)CCCCCSCCCCCCF 62a_100009816466_100015922095 [0,2,0,0,0,0|2,0,0]=4 12904 B16R0.221 COC(=O)CCCCCSCCCCCCF 62a_100015922095_100009816466 [0,2,0,0,0,0|2,0,0]=4 12905 B16R0.221 COC(=O)CCCCCSCCCCCCO 62a_100000766143_100009816466 [0,2,0,0,0,0|2,0,0]=4 12906 B16R0.221 COC(=O)CCCCCSCCCCCCO 62a_100009816466_100000766143 [0,2,0,0,0,0|2,0,0]=4 12907 B16R0.221 COC(=O)CCCCNCCCCCCCO 2230a_100011996573_100000204269 [0,2,0,0,0,0|2,0,0]=4 12908 B16R0.221 COC(=O)CCCCNCCCCCCCO 34a_100011996573_100000204269 [0,2,0,0,0,0|2,0,0]=4 12909 B16R0.221 COC(=O)CCCCOCCCCCCCBr 34a_100000760002_100000204269 [0,2,0,0,0,0|2,0,0]=4 12910 B16R0.221 COC(=O)CCCCOCCCCCCCBr 7a_100000760002_100000204269 [0,2,0,0,0,0|2,0,0]=4 12911 B16R0.221 COC(=O)CCCCOCCCCCCCN 34a_100011996573_100000204269 [0,2,0,0,0,0|2,0,0]=4 12912 B16R0.221 COC(=O)CCCCOCCCCCCCO 34a_100000059025_100000760002 [0,2,0,0,0,0|2,0,0]=4 12913 B16R0.221 COC(=O)CCCCOCCCCCCCO 7a_100000059025_100000760002 [0,2,0,0,0,0|2,0,0]=4 12914 B16R0.221 COC(=O)CCCCSCCCCCCCO 62a_100000204269_100000760002 [0,2,0,0,0,0|2,0,0]=4 12915 B16R0.221 COC(=O)CCCCSCCCCCCCO 62a_100000760002_100000204269 [0,2,0,0,0,0|2,0,0]=4 12916 B16R0.221 COC(=O)CCCNCCCCCCCCO 2230a_102515433106_100011218270 [0,2,0,0,0,0|2,0,0]=4 12917 B16R0.221 COC(=O)CCCNCCCCCCCCO 34a_102515433106_100000742333 [0,2,0,0,0,0|2,0,0]=4 12918 B16R0.221 COC(=O)CCCOCCCCCCCCBr 34a_100009813846_100000742333 [0,2,0,0,0,0|2,0,0]=4 12919 B16R0.221 COC(=O)CCCOCCCCCCCCBr 7a_100009813846_100011218270 [0,2,0,0,0,0|2,0,0]=4 12920 B16R0.221 COC(=O)CCCOCCCCCCCCCl 34a_100000033203_100000742333 [0,2,0,0,0,0|2,0,0]=4 12921 B16R0.221 COC(=O)CCCOCCCCCCCCCl 7a_100000033203_100011218270 [0,2,0,0,0,0|2,0,0]=4 12922 B16R0.221 COC(=O)CCCOCCCCCCCCN 34a_102515433106_100000742333 [0,2,0,0,0,0|2,0,0]=4 12923 B16R0.221 COC(=O)CCCSCCCCCCCCO 62a_100000033203_100011218270 [0,2,0,0,0,0|2,0,0]=4 12924 B16R0.221 COC(=O)CCCSCCCCCCCCO 62a_100011218270_100000033203 [0,2,0,0,0,0|2,0,0]=4 12925 B16R0.221 COC(=O)CCNCCCCCCCCCO 2230a_100000078944_100000204255 [0,2,0,0,0,0|2,0,0]=4 12926 B16R0.221 COC(=O)CCNCCCCCCCCCO 34a_100000078944_100000742370 [0,2,0,0,0,0|2,0,0]=4 12927 B16R0.221 COC(=O)CCOCCCCCCCCCBr 34a_100009813782_100000742370 [0,2,0,0,0,0|2,0,0]=4 12928 B16R0.221 COC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000204255 [0,2,0,0,0,0|2,0,0]=4 12929 B16R0.221 COC(=O)CCOCCCCCCCCCCl 34a_100009868337_100000742370 [0,2,0,0,0,0|2,0,0]=4 12930 B16R0.221 COC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000204255 [0,2,0,0,0,0|2,0,0]=4 12931 B16R0.221 COC(=O)CCOCCCCCCCCCN 34a_100000078944_100000742370 [0,2,0,0,0,0|2,0,0]=4 12932 B16R0.221 COC(=O)CCSCCCCCCCCCO 62a_100000204255_100009813782 [0,2,0,0,0,0|2,0,0]=4 12933 B16R0.221 COC(=O)CCSCCCCCCCCCO 62a_100009813782_100000204255 [0,2,0,0,0,0|2,0,0]=4 12934 B16R0.221 COC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000747449 [0,2,0,0,0,0|2,0,0]=4 12935 B16R0.221 COC(=O)CNCCCCCCCCCCO 34a_100000066964_100000747449 [0,2,0,0,0,0|2,0,0]=4 12936 B16R0.221 COC(=O)COCCCCCCCCCCBr 34a_100009813290_100000747449 [0,2,0,0,0,0|2,0,0]=4 12937 B16R0.221 COC(=O)COCCCCCCCCCCBr 7a_100009813290_100000747449 [0,2,0,0,0,0|2,0,0]=4 12938 B16R0.221 COC(=O)COCCCCCCCCCCCl 34a_200000033068_100000747449 [0,2,0,0,0,0|2,0,0]=4 12939 B16R0.221 COC(=O)COCCCCCCCCCCCl 7a_200000033068_100000747449 [0,2,0,0,0,0|2,0,0]=4 12940 B16R0.221 COC(=O)COCCCCCCCCCCN 34a_100000066964_100000747449 [0,2,0,0,0,0|2,0,0]=4 12941 B16R0.221 COC(=O)CSCCCCCCCCCCO 62a_100000747449_200000033068 [0,2,0,0,0,0|2,0,0]=4 12942 B16R0.221 COC(=O)CSCCCCCCCCCCO 62a_100009813290_100000747449 [0,2,0,0,0,0|2,0,0]=4 12943 B16R0.221 COCCCCCCCCCCCC(=O)OC 34a_100138415774_100010983606 [0,2,0,0,0,0|1,0,0]=3 12944 B16R0.221 COCCCCCCOCCCCC(=O)OC 34a_100000059025_100011998445 [0,2,0,0,0,0|2,0,0]=4 12945 B16R0.221 COCCCCCCOCCCCC(=O)OC 34a_200012092642_100000204269 [0,2,0,0,0,0|2,0,0]=4 12946 B16R0.221 COCCCCCCOCCCCC(=O)OC 7a_100000059025_100011998445 [0,2,0,0,0,0|2,0,0]=4 12947 B16R0.221 COCCCCCCOCCCCC(=O)OC 7a_200012092642_100000204269 [0,2,0,0,0,0|2,0,0]=4 12948 B16R0.221 COCCCCCCSCCCCC(=O)OC 62a_100000204269_100011998445 [0,2,0,0,0,0|2,0,0]=4 12949 B16R0.221 COCCCCCCSCCCCC(=O)OC 62a_100011998445_100000204269 [0,2,0,0,0,0|2,0,0]=4 12950 B16R0.221 COCCCCCNCCCCCC(=O)OC 2230a_100000747528_100009816466 [0,2,0,0,0,0|2,0,0]=4 12951 B16R0.221 COCCCCCNCCCCCC(=O)OC 34a_100000747528_100009816466 [0,2,0,0,0,0|2,0,0]=4 12952 B16R0.221 COCCCCOCCCCCCC(=O)OC 34a_100000740925_100009815986 [0,2,0,0,0,0|2,0,0]=4 12953 B16R0.221 COCCCCOCCCCCCC(=O)OC 34a_100009863599_100000755781 [0,2,0,0,0,0|2,0,0]=4 12954 B16R0.221 COCCCCOCCCCCCC(=O)OC 7a_100009863599_100000730899 [0,2,0,0,0,0|2,0,0]=4 12955 B16R0.221 COCCCCSCCCCCCC(=O)OC 62a_100000730899_100009815986 [0,2,0,0,0,0|2,0,0]=4 12956 B16R0.221 COCCCCSCCCCCCC(=O)OC 62a_100009815986_100000730899 [0,2,0,0,0,0|2,0,0]=4 12957 B16R0.221 COCCCNCCCCCCCC(=O)OC 34a_100150723488_100010004213 [0,2,0,0,0,0|2,0,0]=4 12958 B16R0.221 COCCCOCCCCCCCC(=O)OC 34a_100000740835_100010004213 [0,2,0,0,0,0|2,0,0]=4 12959 B16R0.221 COCCCOCCCCCCCC(=O)OC 34a_100011022521_100000740836 [0,2,0,0,0,0|2,0,0]=4 12960 B16R0.221 COCCCOCCCCCCCC(=O)OC 7a_100011022521_100000740836 [0,2,0,0,0,0|2,0,0]=4 12961 B16R0.221 COCCCSCCCCCCCC(=O)OC 62a_100000709357_100010004213 [0,2,0,0,0,0|2,0,0]=4 12962 B16R0.221 COCCCSCCCCCCCC(=O)OC 62a_100010004213_100000709357 [0,2,0,0,0,0|2,0,0]=4 12963 B16R0.221 COCCNCCCCCCCCC(=O)OC 2230a_100000209980_100010282707 [0,2,0,0,0,0|2,0,0]=4 12964 B16R0.221 COCCOCCCCCCCCC(=O)OC 34a_100000035544_100011201679 [0,2,0,0,0,0|2,0,0]=4 12965 B16R0.221 COCCOCCCCCCCCC(=O)OC 34a_100000210237_100010282707 [0,2,0,0,0,0|2,0,0]=4 12966 B16R0.221 COCCOCCCCCCCCC(=O)OC 7a_100000035544_100000233755 [0,2,0,0,0,0|2,0,0]=4 12967 B16R0.221 COCCSCCCCCCCCC(=O)OC 62a_100000233755_100010282707 [0,2,0,0,0,0|2,0,0]=4 12968 B16R0.221 COCCSCCCCCCCCC(=O)OC 62a_100010282707_100000233755 [0,2,0,0,0,0|2,0,0]=4 12969 B16R0.221 COCSCCCCCCCCCC(=O)OC 62a_100000766300_100009813843 [0,2,0,0,0,0|2,0,0]=4 12970 B16R0.221 NNC(=O)CCCOCCCCCCCCO 34a_100000211488_100000033203 [0,2,0,0,0,0|2,0,0]=4 12971 B16R0.221 O=C(CO)CCCCCCCCCCCCO 1458a_100000210174_100009813331 [0,2,0,0,0,0|1,0,0]=3 12972 B16R0.221 O=C(CO)CCCCCCOCCCCCO 1458a_100000210174_200132310570 [0,2,0,0,0,0|2,0,0]=4 12973 B16R0.274 C#CCCCCCCCCCCOCC(=O)N 34a_100000054667_100000187820 [0,2,0,0,0,0|0,0,2]=4 12974 B16R0.274 C#CCCCCCCCCCCOCC(=O)N 7a_100000054667_100000187820 [0,2,0,0,0,0|0,0,2]=4 12975 B16R0.274 C#CCCCCCCCCCCOCC(=O)[O-] 34a_100000054667_100020667443 [0,2,0,0,0,0|0,0,2]=4 12976 B16R0.274 C#CCCCCCCCCCCOCC(C)C 34a_100000054667_100000210624 [0,2,0,0,0,0|1,0,1]=4 12977 B16R0.274 C#CCCCCCCCCCCOCC(C)C 7a_100000054667_100000210760 [0,2,0,0,0,0|1,0,1]=4 12978 B16R0.274 C#CCCCCCCCCCCOCC(C)O 34a_100000054667_100011218427 [0,2,0,0,0,0|1,0,1]=4 12979 B16R0.274 C#CCCCCCCCCCCOCC(C)O 7a_100000054667_100011218427 [0,2,0,0,0,0|1,0,1]=4 12980 B16R0.274 C#CCCCCCCCCCCOC[C@@H](C)O 34a_100000054667_100009817552 [0,2,0,0,0,0|1,0,1]=4 12981 B16R0.274 C#CCCCCCCCCCCOC[C@@H](C)O 7a_100000054667_100009817552 [0,2,0,0,0,0|1,0,1]=4 12982 B16R0.274 C#CCCCCCCCCCOCCC(=O)C 7a_100000034437_100000053229 [0,2,0,0,0,0|0,0,2]=4 12983 B16R0.274 C#CCCCCCCCCCOCCC(=O)N 34a_100000034437_100000731001 [0,2,0,0,0,0|0,0,2]=4 12984 B16R0.274 C#CCCCCCCCCCOCCC(=O)N 7a_100000034437_100000744528 [0,2,0,0,0,0|0,0,2]=4 12985 B16R0.274 C#CCCCCCCCCCOCCC(C)C 34a_100000034437_100000210312 [0,2,0,0,0,0|1,0,1]=4 12986 B16R0.274 C#CCCCCCCCCCOCCC(C)C 7a_100000034437_100000210626 [0,2,0,0,0,0|1,0,1]=4 12987 B16R0.274 C#CCCCCCCCCCOCCC(C)O 34a_100000034437_100012276601 [0,2,0,0,0,0|1,0,1]=4 12988 B16R0.274 C#CCCCCCCCCCOCCC(C)O 7a_100000034437_100012276601 [0,2,0,0,0,0|1,0,1]=4 12989 B16R0.274 C#CCCCCCCCCOCCCC(=O)C 34a_100000065265_100000685027 [0,2,0,0,0,0|0,0,2]=4 12990 B16R0.274 C#CCCCCCCCCOCCCC(=O)C 7a_100000065265_100011215641 [0,2,0,0,0,0|0,0,2]=4 12991 B16R0.274 C#CCCCCCCCCOCCCC(=O)N 34a_100000065265_100102525003 [0,2,0,0,0,0|0,0,2]=4 12992 B16R0.274 C#CCCCCCCCCOCCCC(=O)N 7a_100000065265_100102525003 [0,2,0,0,0,0|0,0,2]=4 12993 B16R0.274 C#CCCCCCCCCOCCCC(C)C 34a_100000065265_100011214892 [0,2,0,0,0,0|1,0,1]=4 12994 B16R0.274 C#CCCCCCCCCOCCCC(C)C 7a_100000065265_100011214892 [0,2,0,0,0,0|1,0,1]=4 12995 B16R0.274 C#CCCCCCCCCOCCCC(C)O 34a_100000065265_200000718107 [0,2,0,0,0,0|1,0,1]=4 12996 B16R0.274 C#CCCCCCCCCOCCCC(C)O 7a_100000065265_200000718107 [0,2,0,0,0,0|1,0,1]=4 12997 B16R0.274 C#CCCCCCCCNCCCCC(=O)N 34a_100000696515_100153394163 [0,2,0,0,0,0|0,0,2]=4 12998 B16R0.274 C#CCCCCCCCOCCCCC(=O)C 34a_100000054614_100009817362 [0,2,0,0,0,0|0,0,2]=4 12999 B16R0.274 C#CCCCCCCCOCCCCC(=O)C 7a_100000054614_100000735457 [0,2,0,0,0,0|0,0,2]=4 13000 B16R0.274 C#CCCCCCCCOCCCCC(=O)N 34a_100012022536_100153394163 [0,2,0,0,0,0|0,0,2]=4 13001 B16R0.274 C#CCCCCCCCOCCCCC(=O)N 7a_100012022536_100153394163 [0,2,0,0,0,0|0,0,2]=4 13002 B16R0.274 C#CCCCCCCCOCCCCC(C)C 34a_100000054614_100011216152 [0,2,0,0,0,0|1,0,1]=4 13003 B16R0.274 C#CCCCCCCCOCCCCC(C)C 34a_100011214890_100153394163 [0,2,0,0,0,0|1,0,1]=4 13004 B16R0.274 C#CCCCCCCCOCCCCC(C)C 7a_100000054614_100011216152 [0,2,0,0,0,0|1,0,1]=4 13005 B16R0.274 C#CCCCCCCCOCCCCC(C)C 7a_100011214890_100153394163 [0,2,0,0,0,0|1,0,1]=4 13006 B16R0.274 C#CCCCCCCCSCCCCC(=O)C 62a_100000735457_100153394163 [0,2,0,0,0,0|0,0,2]=4 13007 B16R0.274 C#CCCCCCCCSCCCCC(=O)C 62a_100153394163_100000735457 [0,2,0,0,0,0|0,0,2]=4 13008 B16R0.274 C#CCCCCCCCSCCCCC(C)C 62a_100011216152_100153394163 [0,2,0,0,0,0|1,0,1]=4 13009 B16R0.274 C#CCCCCCCCSCCCCC(C)C 62a_100153394163_100011216152 [0,2,0,0,0,0|1,0,1]=4 13010 B16R0.274 C#CCCCCCCNCCCCCC(C)C 2230a_100011290863_100012276617 [0,2,0,0,0,0|1,0,1]=4 13011 B16R0.274 C#CCCCCCCNCCCCCC(C)C 34a_100011290863_100012276617 [0,2,0,0,0,0|1,0,1]=4 13012 B16R0.274 C#CCCCCCCOCCCCCC(=O)N 34a_100000123541_100012276617 [0,2,0,0,0,0|0,0,2]=4 13013 B16R0.274 C#CCCCCCCOCCCCCC(=O)N 34a_100011217361_100009817443 [0,2,0,0,0,0|0,0,2]=4 13014 B16R0.274 C#CCCCCCCOCCCCCC(=O)N 7a_100000123541_100012276617 [0,2,0,0,0,0|0,0,2]=4 13015 B16R0.274 C#CCCCCCCOCCCCCC(=O)N 7a_100011217361_100009817443 [0,2,0,0,0,0|0,0,2]=4 13016 B16R0.274 C#CCCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100012276617 [0,2,0,0,0,0|0,0,2]=4 13017 B16R0.274 C#CCCCCCCOCCCCCC(C)C 34a_100011217361_100000210682 [0,2,0,0,0,0|1,0,1]=4 13018 B16R0.274 C#CCCCCCCOCCCCCC(C)C 34a_100011995859_100012276617 [0,2,0,0,0,0|1,0,1]=4 13019 B16R0.274 C#CCCCCCCOCCCCCC(C)C 7a_100011217361_100000210682 [0,2,0,0,0,0|1,0,1]=4 13020 B16R0.274 C#CCCCCCCOCCCCCC(C)C 7a_100011995859_100012276617 [0,2,0,0,0,0|1,0,1]=4 13021 B16R0.274 C#CCCCCCCSCCCCCC(=O)N 62a_100009817443_100012276617 [0,2,0,0,0,0|0,0,2]=4 13022 B16R0.274 C#CCCCCCCSCCCCCC(=O)N 62a_100012276617_100009817443 [0,2,0,0,0,0|0,0,2]=4 13023 B16R0.274 C#CCCCCCCSCCCCCC(C)C 62a_100000210682_100012276617 [0,2,0,0,0,0|1,0,1]=4 13024 B16R0.274 C#CCCCCCCSCCCCCC(C)C 62a_100012276617_100000210682 [0,2,0,0,0,0|1,0,1]=4 13025 B16R0.274 C#CCCCCCNCCCCCCC(C)C 2230a_100000211014_100012094781 [0,2,0,0,0,0|1,0,1]=4 13026 B16R0.274 C#CCCCCCNCCCCCCC(C)C 34a_100000211014_100012094781 [0,2,0,0,0,0|1,0,1]=4 13027 B16R0.274 C#CCCCCOCCCCCCCC(C)C 34a_200000210741_100010269958 [0,2,0,0,0,0|1,0,1]=4 13028 B16R0.274 C#CCCCCOCCCCCCCC(C)C 7a_200000210741_100010269958 [0,2,0,0,0,0|1,0,1]=4 13029 B16R0.274 C#CCNCCCCCCCCCCC(=O)N 34a_100000212058_200010167045 [0,2,0,0,0,0|0,0,2]=4 13030 B16R0.274 C#CCOCCCCCCCCCCC(=O)N 34a_100000210247_200010167045 [0,2,0,0,0,0|0,0,2]=4 13031 B16R0.274 C#CCSCCCCCCCCCCC(=O)N 62a_100000038162_200010167045 [0,2,0,0,0,0|0,0,2]=4 13032 B16R0.274 C=C(Br)CCOCCCCCCCCCCC 34a_100009813270_100011215454 [0,2,0,0,0,0|1,0,0]=3 13033 B16R0.274 C=C(Br)CCOCCCCCCCCCCO 34a_100009813270_100009813290 [0,2,0,0,0,0|2,0,0]=4 13034 B16R0.274 C=C(C)CCNCCCCCCCCCCC 2230a_200011215754_100000730704 [0,2,0,0,0,0|1,0,0]=3 13035 B16R0.274 C=C(C)CCNCCCCCCCCCCC 34a_200011215754_100000730704 [0,2,0,0,0,0|1,0,0]=3 13036 B16R0.274 C=C(C)CCNCCCCCCCCCCO 2230a_100000066964_100000730704 [0,2,0,0,0,0|2,0,0]=4 13037 B16R0.274 C=C(C)CCNCCCCCCCCCCO 34a_100000066964_100000730704 [0,2,0,0,0,0|2,0,0]=4 13038 B16R0.274 C=C(C)CCOCCCCCCCCCCBr 34a_100009813290_100000730704 [0,2,0,0,0,0|2,0,0]=4 13039 B16R0.274 C=C(C)CCOCCCCCCCCCCBr 7a_100009813290_100000730704 [0,2,0,0,0,0|2,0,0]=4 13040 B16R0.274 C=C(C)CCOCCCCCCCCCCC 34a_100000210809_100000730704 [0,2,0,0,0,0|1,0,0]=3 13041 B16R0.274 C=C(C)CCOCCCCCCCCCCC 34a_100000764851_100011215454 [0,2,0,0,0,0|1,0,0]=3 13042 B16R0.274 C=C(C)CCOCCCCCCCCCCC 7a_100000210809_100000730704 [0,2,0,0,0,0|1,0,0]=3 13043 B16R0.274 C=C(C)CCOCCCCCCCCCCCl 34a_200000033068_100000730704 [0,2,0,0,0,0|2,0,0]=4 13044 B16R0.274 C=C(C)CCOCCCCCCCCCCCl 7a_200000033068_100000730704 [0,2,0,0,0,0|2,0,0]=4 13045 B16R0.274 C=C(C)CCOCCCCCCCCCCN 34a_100000066964_100000730704 [0,2,0,0,0,0|2,0,0]=4 13046 B16R0.274 C=C(C)CCOCCCCCCCCCCO 34a_100000764851_100009813290 [0,2,0,0,0,0|2,0,0]=4 13047 B16R0.274 C=C(C)CCSCCCCCCCCCCO 62a_100000730704_200000033068 [0,2,0,0,0,0|2,0,0]=4 13048 B16R0.274 C=C(C)CCSCCCCCCCCCCO 62a_100009813290_100000730704 [0,2,0,0,0,0|2,0,0]=4 13049 B16R0.274 C=C(C)CNCCCCCCCCCCCC 2230a_100000210451_100000748629 [0,2,0,0,0,0|1,0,0]=3 13050 B16R0.274 C=C(C)CNCCCCCCCCCCCC 34a_100000210451_100000748629 [0,2,0,0,0,0|1,0,0]=3 13051 B16R0.274 C=C(C)COCCCCCCCCCCCBr 34a_100009812471_100000748629 [0,2,0,0,0,0|2,0,0]=4 13052 B16R0.274 C=C(C)COCCCCCCCCCCCBr 7a_100009812471_100000748629 [0,2,0,0,0,0|2,0,0]=4 13053 B16R0.274 C=C(C)COCCCCCCCCCCCC 34a_100000210245_100000759014 [0,2,0,0,0,0|1,0,0]=3 13054 B16R0.274 C=C(C)COCCCCCCCCCCCC 34a_100000210810_100000748629 [0,2,0,0,0,0|1,0,0]=3 13055 B16R0.274 C=C(C)COCCCCCCCCCCCC 7a_100000210810_100000748629 [0,2,0,0,0,0|1,0,0]=3 13056 B16R0.274 C=C(C)COCCCCCCCCCCCO 34a_100000210245_100009812471 [0,2,0,0,0,0|2,0,0]=4 13057 B16R0.274 C=C(C)COCCCCCCCCCOCC 34a_100009875440_100000748629 [0,2,0,0,0,0|2,0,0]=4 13058 B16R0.274 C=C(C)COCCCCCCCCCOCC 7a_100009875440_100000748629 [0,2,0,0,0,0|2,0,0]=4 13059 B16R0.274 C=C(C)CSCCCCCCCCCCCO 62a_100009812471_100000211660 [0,2,0,0,0,0|2,0,0]=4 13060 B16R0.274 C=C(F)CNCCCCCCCCCCCC 2230a_100000210451_100009893438 [0,2,0,0,0,0|1,0,0]=3 13061 B16R0.274 C=C(F)CNCCCCCCCCCCCC 34a_100000210451_100009893438 [0,2,0,0,0,0|1,0,0]=3 13062 B16R0.274 C=C(F)COCCCCCCCCCCCBr 34a_100009812471_100009893438 [0,2,0,0,0,0|2,0,0]=4 13063 B16R0.274 C=C(F)COCCCCCCCCCCCBr 7a_100009812471_100000042424 [0,2,0,0,0,0|2,0,0]=4 13064 B16R0.274 C=C(F)COCCCCCCCCCCCC 34a_100000210810_100009893438 [0,2,0,0,0,0|1,0,0]=3 13065 B16R0.274 C=C(F)COCCCCCCCCCCCC 34a_200010262243_100000759014 [0,2,0,0,0,0|1,0,0]=3 13066 B16R0.274 C=C(F)COCCCCCCCCCCCC 7a_100000210810_100000042424 [0,2,0,0,0,0|1,0,0]=3 13067 B16R0.274 C=C(F)COCCCCCCCCCCCO 34a_200010262243_100009812471 [0,2,0,0,0,0|2,0,0]=4 13068 B16R0.274 C=C(F)COCCCCCCCCCOCC 34a_100009875440_100009893438 [0,2,0,0,0,0|2,0,0]=4 13069 B16R0.274 C=C(F)COCCCCCCCCCOCC 7a_100009875440_100000042424 [0,2,0,0,0,0|2,0,0]=4 13070 B16R0.274 C=C(F)CSCCCCCCCCCCCO 62a_100009812471_100000042424 [0,2,0,0,0,0|2,0,0]=4 13071 B16R0.274 C=CCCCCCCCCCCCNC(C)C 2230a_100138425928_102130925996 [0,2,0,0,0,0|1,0,0]=3 13072 B16R0.274 C=CCCCCCCCCCCCNC(C)C 34a_100138425928_102130925996 [0,2,0,0,0,0|1,0,0]=3 13073 B16R0.274 C=CCCCCCCCCCCCOC(C)C 34a_100000212225_102130925996 [0,2,0,0,0,0|1,0,0]=3 13074 B16R0.274 C=CCCCCCCCCCCNCC(=O)N 2230a_100000711301_100011093070 [0,2,0,0,0,0|0,0,2]=4 13075 B16R0.274 C=CCCCCCCCCCCNCC(=O)O 269956a_100016091260_100011093070 [0,2,0,0,0,0|0,0,2]=4 13076 B16R0.274 C=CCCCCCCCCCCNCC(C)C 2230a_100000210953_100011093070 [0,2,0,0,0,0|1,0,0]=3 13077 B16R0.274 C=CCCCCCCCCCCNCC(C)C 34a_100000210953_100011093070 [0,2,0,0,0,0|1,0,0]=3 13078 B16R0.274 C=CCCCCCCCCCCNCC(C)O 2230a_100000210904_100011093070 [0,2,0,0,0,0|1,0,0]=3 13079 B16R0.274 C=CCCCCCCCCCCNCC(C)O 34a_100000210904_100011093070 [0,2,0,0,0,0|1,0,0]=3 13080 B16R0.274 C=CCCCCCCCCCCNCC(F)F 34a_100000765723_100011093070 [0,2,0,0,0,0|2,0,0]=4 13081 B16R0.274 C=CCCCCCCCCCCOCC(=C)C 34a_100000210245_100011093070 [0,2,0,0,0,0|1,0,1]=4 13082 B16R0.274 C=CCCCCCCCCCCOCC(=O)C 34a_100000211253_100011093070 [0,2,0,0,0,0|0,0,2]=4 13083 B16R0.274 C=CCCCCCCCCCCOCC(C)Br 34a_100012180447_100011093070 [0,2,0,0,0,0|1,0,0]=3 13084 B16R0.274 C=CCCCCCCCCCCOCC(C)C 34a_100000210257_100011093070 [0,2,0,0,0,0|1,0,0]=3 13085 B16R0.274 C=CCCCCCCCCCCOCC(C)F 34a_100015925927_100011093070 [0,2,0,0,0,0|1,0,0]=3 13086 B16R0.274 C=CCCCCCCCCCCOCC(F)F 34a_100000743014_100011093070 [0,2,0,0,0,0|2,0,0]=4 13087 B16R0.274 C=CCCCCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100011093070 [0,2,0,0,0,0|1,0,0]=3 13088 B16R0.274 C=CCCCCCCCCCCOC[C@@H](C)N 34a_100000737577_100011093070 [0,2,0,0,0,0|1,0,0]=3 13089 B16R0.274 C=CCCCCCCCCCCSCC(=C)C 62a_100000748629_100011093070 [0,2,0,0,0,0|1,0,1]=4 13090 B16R0.274 C=CCCCCCCCCCCSCC(=C)C 62a_100011093070_100000211660 [0,2,0,0,0,0|1,0,1]=4 13091 B16R0.274 C=CCCCCCCCCCCSCC(=O)N 62a_100000747473_100011093070 [0,2,0,0,0,0|0,0,2]=4 13092 B16R0.274 C=CCCCCCCCCCCSCC(=O)N 62a_100011093070_100000747473 [0,2,0,0,0,0|0,0,2]=4 13093 B16R0.274 C=CCCCCCCCCCCSCC(=O)[O-] 62a_100011093070_100020667443 [0,2,0,0,0,0|0,0,2]=4 13094 B16R0.274 C=CCCCCCCCCCCSCC(=O)[O-] 62a_100020667443_100011093070 [0,2,0,0,0,0|0,0,2]=4 13095 B16R0.274 C=CCCCCCCCCCCSCC(C)O 62a_100011093070_100011218427 [0,2,0,0,0,0|1,0,0]=3 13096 B16R0.274 C=CCCCCCCCCCCSCC(C)O 62a_100011218427_100011093070 [0,2,0,0,0,0|1,0,0]=3 13097 B16R0.274 C=CCCCCCCCCCCSCC(F)F 62a_100011093070_100011934356 [0,2,0,0,0,0|2,0,0]=4 13098 B16R0.274 C=CCCCCCCCCCCSCC(F)F 62a_100011934356_100011093070 [0,2,0,0,0,0|2,0,0]=4 13099 B16R0.274 C=CCCCCCCCCCCSC[C@@H](C)O 62a_100009817552_100011093070 [0,2,0,0,0,0|1,0,0]=3 13100 B16R0.274 C=CCCCCCCCCCCSC[C@@H](C)O 62a_100011093070_100009817552 [0,2,0,0,0,0|1,0,0]=3 13101 B16R0.274 C=CCCCCCCCCCNCCC(=C)C 2230a_100000081888_100000730704 [0,2,0,0,0,0|1,0,1]=4 13102 B16R0.274 C=CCCCCCCCCCNCCC(=C)C 34a_100000081888_100000730704 [0,2,0,0,0,0|1,0,1]=4 13103 B16R0.274 C=CCCCCCCCCCNCCC(=O)N 2230a_100000081888_100000744528 [0,2,0,0,0,0|0,0,2]=4 13104 B16R0.274 C=CCCCCCCCCCNCCC(=O)N 34a_100000081888_100000731001 [0,2,0,0,0,0|0,0,2]=4 13105 B16R0.274 C=CCCCCCCCCCNCCC(C)C 2230a_100000081888_100000210312 [0,2,0,0,0,0|1,0,0]=3 13106 B16R0.274 C=CCCCCCCCCCNCCC(C)C 269862a_100000081888_100000185833 [0,2,0,0,0,0|1,0,0]=3 13107 B16R0.274 C=CCCCCCCCCCNCCC(C)C 34a_100000081888_100000210312 [0,2,0,0,0,0|1,0,0]=3 13108 B16R0.274 C=CCCCCCCCCCNCCC(C)O 2230a_100000081888_100012276601 [0,2,0,0,0,0|1,0,0]=3 13109 B16R0.274 C=CCCCCCCCCCNCCC(C)O 2230a_200000755665_100009814027 [0,2,0,0,0,0|1,0,0]=3 13110 B16R0.274 C=CCCCCCCCCCNCCC(C)O 34a_100000081888_100012276601 [0,2,0,0,0,0|1,0,0]=3 13111 B16R0.274 C=CCCCCCCCCCNCOC(C)C 2230a_100000081888_100000709892 [0,2,0,0,0,0|2,0,0]=4 13112 B16R0.274 C=CCCCCCCCCCNCOC(C)C 34a_100000081888_100000709892 [0,2,0,0,0,0|2,0,0]=4 13113 B16R0.274 C=CCCCCCCCCCOCCC(=C)C 34a_100000038209_100000730704 [0,2,0,0,0,0|1,0,1]=4 13114 B16R0.274 C=CCCCCCCCCCOCCC(=C)C 34a_100000764851_100009814027 [0,2,0,0,0,0|1,0,1]=4 13115 B16R0.274 C=CCCCCCCCCCOCCC(=C)C 7a_100000038209_100000730704 [0,2,0,0,0,0|1,0,1]=4 13116 B16R0.274 C=CCCCCCCCCCOCCC(=O)C 34a_100000759926_100009814027 [0,2,0,0,0,0|0,0,2]=4 13117 B16R0.274 C=CCCCCCCCCCOCCC(=O)C 7a_100000038209_100000053229 [0,2,0,0,0,0|0,0,2]=4 13118 B16R0.274 C=CCCCCCCCCCOCCC(=O)C 7a_100000759926_100009814027 [0,2,0,0,0,0|0,0,2]=4 13119 B16R0.274 C=CCCCCCCCCCOCCC(=O)N 34a_100000038209_100000731001 [0,2,0,0,0,0|0,0,2]=4 13120 B16R0.274 C=CCCCCCCCCCOCCC(=O)N 34a_100000757172_100009814027 [0,2,0,0,0,0|0,0,2]=4 13121 B16R0.274 C=CCCCCCCCCCOCCC(=O)N 7a_100000038209_100000744528 [0,2,0,0,0,0|0,0,2]=4 13122 B16R0.274 C=CCCCCCCCCCOCCC(=O)N 7a_100000757172_100009814027 [0,2,0,0,0,0|0,0,2]=4 13123 B16R0.274 C=CCCCCCCCCCOCCC(C)Br 34a_100009893172_100009814027 [0,2,0,0,0,0|1,0,0]=3 13124 B16R0.274 C=CCCCCCCCCCOCCC(C)C 34a_100000038209_100000210312 [0,2,0,0,0,0|1,0,0]=3 13125 B16R0.274 C=CCCCCCCCCCOCCC(C)C 34a_100000210254_100009814027 [0,2,0,0,0,0|1,0,0]=3 13126 B16R0.274 C=CCCCCCCCCCOCCC(C)C 7a_100000038209_100000210626 [0,2,0,0,0,0|1,0,0]=3 13127 B16R0.274 C=CCCCCCCCCCOCCC(C)C 7a_100000210254_100009814027 [0,2,0,0,0,0|1,0,0]=3 13128 B16R0.274 C=CCCCCCCCCCOCCC(C)O 34a_100000038209_100012276601 [0,2,0,0,0,0|1,0,0]=3 13129 B16R0.274 C=CCCCCCCCCCOCCC(C)O 7a_100000038209_100012276601 [0,2,0,0,0,0|1,0,0]=3 13130 B16R0.274 C=CCCCCCCCCCOCCC(F)F 34a_100103093639_100009814027 [0,2,0,0,0,0|2,0,0]=4 13131 B16R0.274 C=CCCCCCCCCCOCCN(C)C 7a_100000038209_100000755713 [0,2,0,0,0,0|2,0,0]=4 13132 B16R0.274 C=CCCCCCCCCCOCC[C@@H](C)N 34a_100000706166_100009814027 [0,2,0,0,0,0|1,0,0]=3 13133 B16R0.274 C=CCCCCCCCCCOCOC(C)C 34a_100000038209_100000709892 [0,2,0,0,0,0|2,0,0]=4 13134 B16R0.274 C=CCCCCCCCCCSCCC(=C)C 62a_100000730704_100009814027 [0,2,0,0,0,0|1,0,1]=4 13135 B16R0.274 C=CCCCCCCCCCSCCC(=C)C 62a_100009814027_100000730704 [0,2,0,0,0,0|1,0,1]=4 13136 B16R0.274 C=CCCCCCCCCCSCCC(=O)C 62a_100000053229_100009814027 [0,2,0,0,0,0|0,0,2]=4 13137 B16R0.274 C=CCCCCCCCCCSCCC(=O)C 62a_100009814027_100000053229 [0,2,0,0,0,0|0,0,2]=4 13138 B16R0.274 C=CCCCCCCCCCSCCC(=O)N 62a_100000744528_100009814027 [0,2,0,0,0,0|0,0,2]=4 13139 B16R0.274 C=CCCCCCCCCCSCCC(=O)N 62a_100009814027_100000744528 [0,2,0,0,0,0|0,0,2]=4 13140 B16R0.274 C=CCCCCCCCCCSCCC(C)O 62a_100009814027_100012276601 [0,2,0,0,0,0|1,0,0]=3 13141 B16R0.274 C=CCCCCCCCCCSCCC(C)O 62a_100012276601_100009814027 [0,2,0,0,0,0|1,0,0]=3 13142 B16R0.274 C=CCCCCCCCCCSCCN(C)C 62a_100009814027_100000755713 [0,2,0,0,0,0|2,0,0]=4 13143 B16R0.274 C=CCCCCCCCCCSCOC(C)C 62a_100000709892_100009814027 [0,2,0,0,0,0|2,0,0]=4 13144 B16R0.274 C=CCCCCCCCCCSCOC(C)C 62a_100009814027_100000709892 [0,2,0,0,0,0|2,0,0]=4 13145 B16R0.274 C=CCCCCCCCCNCCCC(=O)N 34a_100000739312_100011933949 [0,2,0,0,0,0|0,0,2]=4 13146 B16R0.274 C=CCCCCCCCCNCCCC(C)C 2230a_200000737386_100011933949 [0,2,0,0,0,0|1,0,0]=3 13147 B16R0.274 C=CCCCCCCCCNCCCC(C)C 34a_200000737386_100011933949 [0,2,0,0,0,0|1,0,0]=3 13148 B16R0.274 C=CCCCCCCCCNCCCS(=O)C 2230a_200000753449_100011933949 [0,2,0,0,0,0|2,0,0]=4 13149 B16R0.274 C=CCCCCCCCCNCCOC(C)C 2230a_100000701111_100011933949 [0,2,0,0,0,0|2,0,0]=4 13150 B16R0.274 C=CCCCCCCCCNCCOC(C)C 34a_100000701111_100011933949 [0,2,0,0,0,0|2,0,0]=4 13151 B16R0.274 C=CCCCCCCCCNCCSC(C)C 2230a_100000731138_100011933949 [0,2,0,0,0,0|2,0,0]=4 13152 B16R0.274 C=CCCCCCCCCNCCSC(C)C 34a_100000731138_100011933949 [0,2,0,0,0,0|2,0,0]=4 13153 B16R0.274 C=CCCCCCCCCOCCCC(=O)C 34a_100000759063_100011933949 [0,2,0,0,0,0|0,0,2]=4 13154 B16R0.274 C=CCCCCCCCCOCCCC(=O)C 34a_100011215194_100000685027 [0,2,0,0,0,0|0,0,2]=4 13155 B16R0.274 C=CCCCCCCCCOCCCC(=O)C 7a_100000759063_100011933949 [0,2,0,0,0,0|0,0,2]=4 13156 B16R0.274 C=CCCCCCCCCOCCCC(=O)C 7a_100011215194_100011215641 [0,2,0,0,0,0|0,0,2]=4 13157 B16R0.274 C=CCCCCCCCCOCCCC(=O)N 34a_100011215194_100102525003 [0,2,0,0,0,0|0,0,2]=4 13158 B16R0.274 C=CCCCCCCCCOCCCC(=O)N 7a_100011215194_100102525003 [0,2,0,0,0,0|0,0,2]=4 13159 B16R0.274 C=CCCCCCCCCOCCCC(C)C 34a_100000210774_100011933949 [0,2,0,0,0,0|1,0,0]=3 13160 B16R0.274 C=CCCCCCCCCOCCCC(C)C 34a_100011215194_100011214892 [0,2,0,0,0,0|1,0,0]=3 13161 B16R0.274 C=CCCCCCCCCOCCCC(C)C 7a_100000210774_100011933949 [0,2,0,0,0,0|1,0,0]=3 13162 B16R0.274 C=CCCCCCCCCOCCCC(C)C 7a_100011215194_100011214892 [0,2,0,0,0,0|1,0,0]=3 13163 B16R0.274 C=CCCCCCCCCOCCCC(C)O 34a_100011215194_200000718107 [0,2,0,0,0,0|1,0,0]=3 13164 B16R0.274 C=CCCCCCCCCOCCCC(C)O 7a_100011215194_200000718107 [0,2,0,0,0,0|1,0,0]=3 13165 B16R0.274 C=CCCCCCCCCOCCCN(C)C 7a_100011215194_100000757444 [0,2,0,0,0,0|2,0,0]=4 13166 B16R0.274 C=CCCCCCCCCOCCNC(C)C 34a_100000224655_100011933949 [0,2,0,0,0,0|2,0,0]=4 13167 B16R0.274 C=CCCCCCCCCOCCOC(C)C 34a_100000211219_100011933949 [0,2,0,0,0,0|2,0,0]=4 13168 B16R0.274 C=CCCCCCCCCOCCOC(C)C 34a_100011215194_100000211751 [0,2,0,0,0,0|2,0,0]=4 13169 B16R0.274 C=CCCCCCCCCOCCOC(C)C 7a_100000211219_100011933949 [0,2,0,0,0,0|2,0,0]=4 13170 B16R0.274 C=CCCCCCCCCOCCOC(C)C 7a_100011215194_100000211751 [0,2,0,0,0,0|2,0,0]=4 13171 B16R0.274 C=CCCCCCCCCOCCSC(C)C 34a_100011215194_100000730970 [0,2,0,0,0,0|2,0,0]=4 13172 B16R0.274 C=CCCCCCCCCOCCSC(C)C 34a_200011212901_100011933949 [0,2,0,0,0,0|2,0,0]=4 13173 B16R0.274 C=CCCCCCCCCOCCSC(C)C 7a_100011215194_100000730970 [0,2,0,0,0,0|2,0,0]=4 13174 B16R0.274 C=CCCCCCCCCOCCSC(C)C 7a_200011212901_100011933949 [0,2,0,0,0,0|2,0,0]=4 13175 B16R0.274 C=CCCCCCCCCSCCCC(=O)C 62a_100011215641_100011933949 [0,2,0,0,0,0|0,0,2]=4 13176 B16R0.274 C=CCCCCCCCCSCCCC(=O)C 62a_100011933949_100011215641 [0,2,0,0,0,0|0,0,2]=4 13177 B16R0.274 C=CCCCCCCCCSCCCC(=O)N 62a_100011933949_100102525003 [0,2,0,0,0,0|0,0,2]=4 13178 B16R0.274 C=CCCCCCCCCSCCCC(=O)N 62a_100102525003_100011933949 [0,2,0,0,0,0|0,0,2]=4 13179 B16R0.274 C=CCCCCCCCCSCCCC(C)O 62a_100011933949_200000718107 [0,2,0,0,0,0|1,0,0]=3 13180 B16R0.274 C=CCCCCCCCCSCCCC(C)O 62a_200000718107_100011933949 [0,2,0,0,0,0|1,0,0]=3 13181 B16R0.274 C=CCCCCCCCCSCCCN(C)C 62a_100011933949_100000757444 [0,2,0,0,0,0|2,0,0]=4 13182 B16R0.274 C=CCCCCCCCCSCCOC(C)C 62a_100000211751_100011933949 [0,2,0,0,0,0|2,0,0]=4 13183 B16R0.274 C=CCCCCCCCCSCCOC(C)C 62a_100011933949_100000211751 [0,2,0,0,0,0|2,0,0]=4 13184 B16R0.274 C=CCCCCCCCCSCCSC(C)C 62a_100000730970_100011933949 [0,2,0,0,0,0|2,0,0]=4 13185 B16R0.274 C=CCCCCCCCCSCCSC(C)C 62a_100011933949_100000730970 [0,2,0,0,0,0|2,0,0]=4 13186 B16R0.274 C=CCCCCCCCNCCCCC(=O)N 34a_100000696515_100012355270 [0,2,0,0,0,0|0,0,2]=4 13187 B16R0.274 C=CCCCCCCCNCCCOC(C)C 2230a_100000737246_100012355270 [0,2,0,0,0,0|2,0,0]=4 13188 B16R0.274 C=CCCCCCCCNCCCOC(C)C 34a_100000737246_100012355270 [0,2,0,0,0,0|2,0,0]=4 13189 B16R0.274 C=CCCCCCCCOCCCCC(=O)C 34a_100000730831_100009817362 [0,2,0,0,0,0|0,0,2]=4 13190 B16R0.274 C=CCCCCCCCOCCCCC(=O)C 7a_100000730831_100000735457 [0,2,0,0,0,0|0,0,2]=4 13191 B16R0.274 C=CCCCCCCCOCCCCC(=O)N 34a_100012022536_100012355270 [0,2,0,0,0,0|0,0,2]=4 13192 B16R0.274 C=CCCCCCCCOCCCCC(=O)N 7a_100012022536_100012355270 [0,2,0,0,0,0|0,0,2]=4 13193 B16R0.274 C=CCCCCCCCOCCCCC(C)C 34a_100000730831_100011216152 [0,2,0,0,0,0|1,0,0]=3 13194 B16R0.274 C=CCCCCCCCOCCCCC(C)C 34a_100011214890_100012355270 [0,2,0,0,0,0|1,0,0]=3 13195 B16R0.274 C=CCCCCCCCOCCCCC(C)C 7a_100000730831_100011216152 [0,2,0,0,0,0|1,0,0]=3 13196 B16R0.274 C=CCCCCCCCOCCCCC(C)C 7a_100011214890_100012355270 [0,2,0,0,0,0|1,0,0]=3 13197 B16R0.274 C=CCCCCCCCOCCCNC(C)C 34a_100000182298_100012355270 [0,2,0,0,0,0|2,0,0]=4 13198 B16R0.274 C=CCCCCCCCOCCNCC(C)C 34a_100015185251_100012355270 [0,2,0,0,0,0|2,0,0]=4 13199 B16R0.274 C=CCCCCCCCOCCOCC(C)C 34a_100000703358_100012355270 [0,2,0,0,0,0|2,0,0]=4 13200 B16R0.274 C=CCCCCCCCOCCOCC(C)C 7a_100000703358_100012355270 [0,2,0,0,0,0|2,0,0]=4 13201 B16R0.274 C=CCCCCCCCOCCSCC(C)C 34a_200000230437_100012355270 [0,2,0,0,0,0|2,0,0]=4 13202 B16R0.274 C=CCCCCCCCOCCSCC(C)C 7a_200000230437_100012355270 [0,2,0,0,0,0|2,0,0]=4 13203 B16R0.274 C=CCCCCCCCSCCCCC(=O)C 62a_100000735457_100012355270 [0,2,0,0,0,0|0,0,2]=4 13204 B16R0.274 C=CCCCCCCCSCCCCC(=O)C 62a_100012355270_100000735457 [0,2,0,0,0,0|0,0,2]=4 13205 B16R0.274 C=CCCCCCCCSCCCCN(C)C 62a_100012355270_100000690147 [0,2,0,0,0,0|2,0,0]=4 13206 B16R0.274 C=CCCCCCCNCCCCCC(C)C 2230a_100011290863_100011215473 [0,2,0,0,0,0|1,0,0]=3 13207 B16R0.274 C=CCCCCCCNCCCCCC(C)C 34a_100011290863_100011215473 [0,2,0,0,0,0|1,0,0]=3 13208 B16R0.274 C=CCCCCCCNCCCOCC(C)C 2230a_100000205972_100011215473 [0,2,0,0,0,0|2,0,0]=4 13209 B16R0.274 C=CCCCCCCNCCCOCC(C)C 34a_100000205972_100011215473 [0,2,0,0,0,0|2,0,0]=4 13210 B16R0.274 C=CCCCCCCOCCCCCC(=O)N 34a_100000123541_100011215473 [0,2,0,0,0,0|0,0,2]=4 13211 B16R0.274 C=CCCCCCCOCCCCCC(=O)N 34a_200011216477_100009817443 [0,2,0,0,0,0|0,0,2]=4 13212 B16R0.274 C=CCCCCCCOCCCCCC(=O)N 7a_100000123541_100011215473 [0,2,0,0,0,0|0,0,2]=4 13213 B16R0.274 C=CCCCCCCOCCCCCC(=O)N 7a_200011216477_100009817443 [0,2,0,0,0,0|0,0,2]=4 13214 B16R0.274 C=CCCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100011215473 [0,2,0,0,0,0|0,0,2]=4 13215 B16R0.274 C=CCCCCCCOCCCCCC(C)C 34a_100011995859_100011215473 [0,2,0,0,0,0|1,0,0]=3 13216 B16R0.274 C=CCCCCCCOCCCCCC(C)C 34a_200011216477_100000210682 [0,2,0,0,0,0|1,0,0]=3 13217 B16R0.274 C=CCCCCCCOCCCCCC(C)C 7a_100011995859_100011215473 [0,2,0,0,0,0|1,0,0]=3 13218 B16R0.274 C=CCCCCCCOCCCCCC(C)C 7a_200011216477_100000210682 [0,2,0,0,0,0|1,0,0]=3 13219 B16R0.274 C=CCCCCCCOCCCCNC(C)C 34a_100011521146_100011215473 [0,2,0,0,0,0|2,0,0]=4 13220 B16R0.274 C=CCCCCCCSCCCCCC(=O)N 62a_100009817443_100011215473 [0,2,0,0,0,0|0,0,2]=4 13221 B16R0.274 C=CCCCCCCSCCCCCC(=O)N 62a_100011215473_100009817443 [0,2,0,0,0,0|0,0,2]=4 13222 B16R0.274 C=CCCCCCNCCCCCCC(C)C 2230a_100000211014_100000700193 [0,2,0,0,0,0|1,0,0]=3 13223 B16R0.274 C=CCCCCCNCCCCCCC(C)C 34a_100000211014_100000700193 [0,2,0,0,0,0|1,0,0]=3 13224 B16R0.274 C=CCCCCCOCCCCCNC(C)C 34a_100011629493_100000700193 [0,2,0,0,0,0|2,0,0]=4 13225 B16R0.274 C=CCCCCOCCCCCCCC(C)C 34a_200000210741_100011215482 [0,2,0,0,0,0|1,0,0]=3 13226 B16R0.274 C=CCCCCOCCCCCCCC(C)C 7a_200000210741_100011215482 [0,2,0,0,0,0|1,0,0]=3 13227 B16R0.274 C=CCNCCCCCCCCCCC(=O)N 2230a_100020586998_200010167045 [0,2,0,0,0,0|0,0,2]=4 13228 B16R0.274 C=CCOCCCCCCCCCCC(=O)N 34a_200000210373_200010167045 [0,2,0,0,0,0|0,0,2]=4 13229 B16R0.274 C=CCSCCCCCCCCCCC(=O)N 62a_100000210623_200010167045 [0,2,0,0,0,0|0,0,2]=4 13230 B16R0.274 C=CCSCCCCCCCCCCC(=O)N 62a_200010167045_100000210623 [0,2,0,0,0,0|0,0,2]=4 13231 B16R0.274 CC(=O)CCCCCCCCCCCCCO 1458a_100000070787_100009812470 [0,2,0,0,0,0|0,0,0]=2 13232 B16R0.274 CC(=O)CCCCNCCCCCCCCO 34a_102515433106_100009817362 [0,2,0,0,0,0|1,0,0]=3 13233 B16R0.274 CC(=O)CCCCOCCCCCCCCBr 34a_100009813846_100009817362 [0,2,0,0,0,0|1,0,0]=3 13234 B16R0.274 CC(=O)CCCCOCCCCCCCCBr 7a_100009813846_100000735457 [0,2,0,0,0,0|1,0,0]=3 13235 B16R0.274 CC(=O)CCCCOCCCCCCCCCl 34a_100000033203_100009817362 [0,2,0,0,0,0|1,0,0]=3 13236 B16R0.274 CC(=O)CCCCOCCCCCCCCCl 7a_100000033203_100000735457 [0,2,0,0,0,0|1,0,0]=3 13237 B16R0.274 CC(=O)CCCCOCCCCCCCCN 34a_102515433106_100009817362 [0,2,0,0,0,0|1,0,0]=3 13238 B16R0.274 CC(=O)CCCCOCCCCCNCCN 34a_103619048469_100009817362 [0,2,0,0,0,0|2,0,0]=4 13239 B16R0.274 CC(=O)CCCCSCCCCCCCCO 62a_100000033203_100000735457 [0,2,0,0,0,0|1,0,0]=3 13240 B16R0.274 CC(=O)CCCCSCCCCCCCCO 62a_100000735457_100000033203 [0,2,0,0,0,0|1,0,0]=3 13241 B16R0.274 CC(=O)CCCNCCCCCCCCCO 34a_100000078944_100000685027 [0,2,0,0,0,0|1,0,0]=3 13242 B16R0.274 CC(=O)CCCOCCCCCCCCCBr 34a_100009813782_100000685027 [0,2,0,0,0,0|1,0,0]=3 13243 B16R0.274 CC(=O)CCCOCCCCCCCCCBr 7a_100009813782_100011215641 [0,2,0,0,0,0|1,0,0]=3 13244 B16R0.274 CC(=O)CCCOCCCCCCCCCCl 34a_100009868337_100000685027 [0,2,0,0,0,0|1,0,0]=3 13245 B16R0.274 CC(=O)CCCOCCCCCCCCCCl 7a_100009868337_100011215641 [0,2,0,0,0,0|1,0,0]=3 13246 B16R0.274 CC(=O)CCCOCCCCCCCCCN 34a_100000078944_100000685027 [0,2,0,0,0,0|1,0,0]=3 13247 B16R0.274 CC(=O)CCCOCCCCCCCCCO 34a_100000759063_100009813782 [0,2,0,0,0,0|1,0,0]=3 13248 B16R0.274 CC(=O)CCCOCCCCCCCCCO 7a_100000759063_100009813782 [0,2,0,0,0,0|1,0,0]=3 13249 B16R0.274 CC(=O)CCCSCCCCCCCCCO 62a_100009813782_100011215641 [0,2,0,0,0,0|1,0,0]=3 13250 B16R0.274 CC(=O)CCCSCCCCCCCCCO 62a_100011215641_100009813782 [0,2,0,0,0,0|1,0,0]=3 13251 B16R0.274 CC(=O)CCOCCCCCCCCCCBr 7a_100009813290_100000053229 [0,2,0,0,0,0|1,0,0]=3 13252 B16R0.274 CC(=O)CCOCCCCCCCCCCCl 7a_200000033068_100000053229 [0,2,0,0,0,0|1,0,0]=3 13253 B16R0.274 CC(=O)CCOCCCCCCCCCCO 34a_100000759926_100009813290 [0,2,0,0,0,0|1,0,0]=3 13254 B16R0.274 CC(=O)CCOCCCCCCCCCCO 7a_100000759926_100009813290 [0,2,0,0,0,0|1,0,0]=3 13255 B16R0.274 CC(=O)CCSCCCCCCCCCCO 62a_100000053229_200000033068 [0,2,0,0,0,0|1,0,0]=3 13256 B16R0.274 CC(=O)CCSCCCCCCCCCCO 62a_100009813290_100000053229 [0,2,0,0,0,0|1,0,0]=3 13257 B16R0.274 CC(=O)COCCCCCCCCCCCO 34a_100000211253_100009812471 [0,2,0,0,0,0|1,0,0]=3 13258 B16R0.274 CC(=O)NCCCCCCCCCCCCO 240690a_100000066677_100015343762 [0,2,0,0,0,0|1,0,0]=3 13259 B16R0.274 CC(=O)NCCCCCCNCCCCC=O 2230a_200011996284_100000139335 [0,2,0,0,0,0|1,0,1]=4 13260 B16R0.274 CC(=O)NCCCCCCNCCCCCF 2230a_200011996284_100000729378 [0,2,0,0,0,0|2,0,0]=4 13261 B16R0.274 CC(=O)NCCCCCCNCCCCCF 34a_200011996284_100000729378 [0,2,0,0,0,0|2,0,0]=4 13262 B16R0.274 CC(=O)NCCCCCCNCCCCCO 2230a_200011996284_100000746330 [0,2,0,0,0,0|2,0,0]=4 13263 B16R0.274 CC(=O)NCCCCCCNCCCCCO 34a_200011996284_100000746330 [0,2,0,0,0,0|2,0,0]=4 13264 B16R0.274 CC(=O)NCCCCCNCCCCCC=O 2230a_200012022750_100000139337 [0,2,0,0,0,0|1,0,1]=4 13265 B16R0.274 CC(=O)NCCCCCNCCCCCCF 2230a_200012022750_100015922095 [0,2,0,0,0,0|2,0,0]=4 13266 B16R0.274 CC(=O)NCCCCCNCCCCCCF 34a_200012022750_100015922095 [0,2,0,0,0,0|2,0,0]=4 13267 B16R0.274 CC(=O)NCCCCCNCCCCCCO 2230a_200012022750_100000766143 [0,2,0,0,0,0|2,0,0]=4 13268 B16R0.274 CC(=O)NCCCCCNCCCCCCO 34a_200012022750_100000766143 [0,2,0,0,0,0|2,0,0]=4 13269 B16R0.274 CC(=O)NCCCCNCCCCCCCO 2230a_200011368371_100000760002 [0,2,0,0,0,0|2,0,0]=4 13270 B16R0.274 CC(=O)NCCCCNCCCCCCCO 34a_200011368371_100000760002 [0,2,0,0,0,0|2,0,0]=4 13271 B16R0.274 CC(=O)NCCCNCCCCCCCCO 34a_100000736810_100000033203 [0,2,0,0,0,0|2,0,0]=4 13272 B16R0.274 CC(=O)NCCCOCCCCCCCCO 34a_100000752032_100000033203 [0,2,0,0,0,0|2,0,0]=4 13273 B16R0.274 CC(=O)NCCNCCCCCCCCCO 2230a_100000078944_100000189650 [0,2,0,0,0,0|2,0,0]=4 13274 B16R0.274 CC(=O)NCCNCCCCCCCCCO 2230a_100000209853_100009813782 [0,2,0,0,0,0|2,0,0]=4 13275 B16R0.274 CC(=O)NCCOCCCCCCCCCBr 7a_100009813782_100000189650 [0,2,0,0,0,0|2,0,0]=4 13276 B16R0.274 CC(=O)NCCOCCCCCCCCCCl 7a_100009868337_100000189650 [0,2,0,0,0,0|2,0,0]=4 13277 B16R0.274 CC(=O)NCCOCCCCCCCCCO 34a_100000158858_100009813782 [0,2,0,0,0,0|2,0,0]=4 13278 B16R0.274 CC(=O)NCCSCCCCCCCCCO 62a_100000189650_100009813782 [0,2,0,0,0,0|2,0,0]=4 13279 B16R0.274 CC(=O)NCCSCCCCCCCCCO 62a_100009813782_100000189650 [0,2,0,0,0,0|2,0,0]=4 13280 B16R0.274 CC(=O)OCCCCCNCCCCCCO 2230a_100000686447_100009813381 [0,2,0,0,0,0|2,0,0]=4 13281 B16R0.274 CC(=O)OCCCCCNCCCCCCO 34a_100000686447_100000033007 [0,2,0,0,0,0|2,0,0]=4 13282 B16R0.274 CC(=O)OCCCCCOCCCCCCBr 34a_100011215345_100000033007 [0,2,0,0,0,0|2,0,0]=4 13283 B16R0.274 CC(=O)OCCCCCOCCCCCCBr 7a_100011215345_100000033007 [0,2,0,0,0,0|2,0,0]=4 13284 B16R0.274 CC(=O)OCCCCCOCCCCCCCl 34a_100000766143_100000033007 [0,2,0,0,0,0|2,0,0]=4 13285 B16R0.274 CC(=O)OCCCCCOCCCCCCCl 7a_100000766143_100000033007 [0,2,0,0,0,0|2,0,0]=4 13286 B16R0.274 CC(=O)OCCCCCOCCCCCCF 34a_100000732779_100000033007 [0,2,0,0,0,0|2,0,0]=4 13287 B16R0.274 CC(=O)OCCCCCOCCCCCCF 7a_100000732779_100000033007 [0,2,0,0,0,0|2,0,0]=4 13288 B16R0.274 CC(=O)OCCCCCOCCCCCCN 34a_100000686447_100000033007 [0,2,0,0,0,0|2,0,0]=4 13289 B16R0.274 CC(=O)OCCCCCSCCCCCC=O 62a_100000033007_100000139337 [0,2,0,0,0,0|1,0,1]=4 13290 B16R0.274 CC(=O)OCCCCCSCCCCCC=O 62a_100000139337_100000033007 [0,2,0,0,0,0|1,0,1]=4 13291 B16R0.274 CC(=O)OCCCCCSCCCCCCF 62a_100000033007_100015922095 [0,2,0,0,0,0|2,0,0]=4 13292 B16R0.274 CC(=O)OCCCCCSCCCCCCF 62a_100015922095_100000033007 [0,2,0,0,0,0|2,0,0]=4 13293 B16R0.274 CC(=O)OCCCCCSCCCCCCO 62a_100000033007_100000766143 [0,2,0,0,0,0|2,0,0]=4 13294 B16R0.274 CC(=O)OCCCCCSCCCCCCO 62a_100000766143_100000033007 [0,2,0,0,0,0|2,0,0]=4 13295 B16R0.274 CC(=O)OCCCCNCCCCCCCO 34a_100011996573_100000033659 [0,2,0,0,0,0|2,0,0]=4 13296 B16R0.274 CC(=O)OCCCCOCCCCCCCBr 34a_100000760002_100000033659 [0,2,0,0,0,0|2,0,0]=4 13297 B16R0.274 CC(=O)OCCCCOCCCCCCCBr 7a_100000760002_100000033659 [0,2,0,0,0,0|2,0,0]=4 13298 B16R0.274 CC(=O)OCCCCOCCCCCCCN 34a_100011996573_100000033659 [0,2,0,0,0,0|2,0,0]=4 13299 B16R0.274 CC(=O)OCCCCOCCCCCCCO 34a_100000073216_100000760002 [0,2,0,0,0,0|2,0,0]=4 13300 B16R0.274 CC(=O)OCCCCOCCCCCCCO 7a_100000073216_100000760002 [0,2,0,0,0,0|2,0,0]=4 13301 B16R0.274 CC(=O)OCCCCSCCCCCCCO 62a_100000033659_100000760002 [0,2,0,0,0,0|2,0,0]=4 13302 B16R0.274 CC(=O)OCCCCSCCCCCCCO 62a_100000760002_100000033659 [0,2,0,0,0,0|2,0,0]=4 13303 B16R0.274 CC(=O)OCCCNCCCCCCCCO 34a_102515433106_100000042594 [0,2,0,0,0,0|2,0,0]=4 13304 B16R0.274 CC(=O)OCCCOCCCCCCCCBr 34a_100009813846_100000042594 [0,2,0,0,0,0|2,0,0]=4 13305 B16R0.274 CC(=O)OCCCOCCCCCCCCBr 7a_100009813846_100000042594 [0,2,0,0,0,0|2,0,0]=4 13306 B16R0.274 CC(=O)OCCCOCCCCCCCCCl 34a_100000033203_100000042594 [0,2,0,0,0,0|2,0,0]=4 13307 B16R0.274 CC(=O)OCCCOCCCCCCCCCl 7a_100000033203_100000042594 [0,2,0,0,0,0|2,0,0]=4 13308 B16R0.274 CC(=O)OCCCOCCCCCCCCN 34a_102515433106_100000042594 [0,2,0,0,0,0|2,0,0]=4 13309 B16R0.274 CC(=O)OCCCSCCCCCCCCO 62a_100000033203_100000042594 [0,2,0,0,0,0|2,0,0]=4 13310 B16R0.274 CC(=O)OCCCSCCCCCCCCO 62a_100000042594_100000033203 [0,2,0,0,0,0|2,0,0]=4 13311 B16R0.274 CC(=O)OCCNCCCCCCCCCO 34a_100000078944_100009814007 [0,2,0,0,0,0|2,0,0]=4 13312 B16R0.274 CC(=O)OCCOCCCCCCCCCBr 34a_100009813782_100009814007 [0,2,0,0,0,0|2,0,0]=4 13313 B16R0.274 CC(=O)OCCOCCCCCCCCCBr 7a_100009813782_100009814007 [0,2,0,0,0,0|2,0,0]=4 13314 B16R0.274 CC(=O)OCCOCCCCCCCCCCl 34a_100009868337_100009814007 [0,2,0,0,0,0|2,0,0]=4 13315 B16R0.274 CC(=O)OCCOCCCCCCCCCCl 7a_100009868337_100009814007 [0,2,0,0,0,0|2,0,0]=4 13316 B16R0.274 CC(=O)OCCOCCCCCCCCCN 34a_100000078944_100009814007 [0,2,0,0,0,0|2,0,0]=4 13317 B16R0.274 CC(=O)OCCSCCCCCCCCCO 62a_100009813782_100009814007 [0,2,0,0,0,0|2,0,0]=4 13318 B16R0.274 CC(=O)OCCSCCCCCCCCCO 62a_100009814007_100009813782 [0,2,0,0,0,0|2,0,0]=4 13319 B16R0.274 CC(=O)OCNCCCCCCCCCCO 34a_100000066964_100009813279 [0,2,0,0,0,0|2,0,0]=4 13320 B16R0.274 CC(=O)OCOCCCCCCCCCCBr 34a_100009813290_100009813279 [0,2,0,0,0,0|2,0,0]=4 13321 B16R0.274 CC(=O)OCOCCCCCCCCCCCl 34a_200000033068_100009813279 [0,2,0,0,0,0|2,0,0]=4 13322 B16R0.274 CC(=O)OCOCCCCCCCCCCN 34a_100000066964_100009813279 [0,2,0,0,0,0|2,0,0]=4 13323 B16R0.274 CC(=O)OCSCCCCCCCCCCO 62a_100000076356_200000033068 [0,2,0,0,0,0|2,0,0]=4 13324 B16R0.274 CC(=O)OCSCCCCCCCCCCO 62a_100009813290_100000076356 [0,2,0,0,0,0|2,0,0]=4 13325 B16R0.274 CC(=O)SCCCCCCCCCCCS[13CH3] 62a_100010140907_200025704644 [0,2,0,0,0,0|1,0,0]=3 13326 B16R0.274 CC(=O)SCCCCCCCCCCCS[13CH3] 62a_200025704644_100010140907 [0,2,0,0,0,0|1,0,0]=3 13327 B16R0.274 CC(=O)SCCCCNCCCCCCCO 2230a_100011996573_200010402107 [0,2,0,0,0,0|2,0,0]=4 13328 B16R0.274 CC(=O)SCCCCNCCCCCCCO 34a_100011996573_200010402107 [0,2,0,0,0,0|2,0,0]=4 13329 B16R0.274 CC(=O)SCCCCOCCCCCCCBr 34a_100000760002_200010402107 [0,2,0,0,0,0|2,0,0]=4 13330 B16R0.274 CC(=O)SCCCCOCCCCCCCBr 7a_100000760002_200010402107 [0,2,0,0,0,0|2,0,0]=4 13331 B16R0.274 CC(=O)SCCCCOCCCCCCCN 34a_100011996573_200010402107 [0,2,0,0,0,0|2,0,0]=4 13332 B16R0.274 CC(=O)SCCCCSCCCCCCCO 62a_100000760002_200010402107 [0,2,0,0,0,0|2,0,0]=4 13333 B16R0.274 CC(=O)SCCCCSCCCCCCCO 62a_200010402107_100000760002 [0,2,0,0,0,0|2,0,0]=4 13334 B16R0.274 CC(=O)SCCCNCCCCCCCCO 2230a_102515433106_100000038929 [0,2,0,0,0,0|2,0,0]=4 13335 B16R0.274 CC(=O)SCCCNCCCCCCCCO 34a_102515433106_100000038929 [0,2,0,0,0,0|2,0,0]=4 13336 B16R0.274 CC(=O)SCCCOCCCCCCCCBr 34a_100009813846_100000038929 [0,2,0,0,0,0|2,0,0]=4 13337 B16R0.274 CC(=O)SCCCOCCCCCCCCBr 7a_100009813846_100000038929 [0,2,0,0,0,0|2,0,0]=4 13338 B16R0.274 CC(=O)SCCCOCCCCCCCCCl 34a_100000033203_100000038929 [0,2,0,0,0,0|2,0,0]=4 13339 B16R0.274 CC(=O)SCCCOCCCCCCCCCl 7a_100000033203_100000038929 [0,2,0,0,0,0|2,0,0]=4 13340 B16R0.274 CC(=O)SCCCOCCCCCCCCN 34a_102515433106_100000038929 [0,2,0,0,0,0|2,0,0]=4 13341 B16R0.274 CC(=O)SCCCSCCCCCCCCO 62a_100000033203_100000038929 [0,2,0,0,0,0|2,0,0]=4 13342 B16R0.274 CC(=O)SCCCSCCCCCCCCO 62a_100000038929_100000033203 [0,2,0,0,0,0|2,0,0]=4 13343 B16R0.274 CC(Br)CCOCCCCCCCCCCO 34a_100009893172_100009813290 [0,2,0,0,0,0|0,0,2]=4 13344 B16R0.274 CC(Br)COCCCCCCCCCCCO 34a_100012180447_100009812471 [0,2,0,0,0,0|0,0,2]=4 13345 B16R0.274 CC(C)CCCCCCCOCCCCC#N 7a_200000210741_100000211819 [0,2,0,0,0,0|1,0,1]=4 13346 B16R0.274 CC(C)CCCCCCCOCCCCC=O 7a_200000210741_100000139335 [0,2,0,0,0,0|0,0,0]=2 13347 B16R0.274 CC(C)CCCCCCCOCCCCCF 34a_200000210741_100000729378 [0,2,0,0,0,0|1,0,1]=4 13348 B16R0.274 CC(C)CCCCCCCOCCCCCF 7a_200000210741_100000729378 [0,2,0,0,0,0|1,0,1]=4 13349 B16R0.274 CC(C)CCCCCCCOCCCCCO 34a_200000210741_100000746330 [0,2,0,0,0,0|0,0,2]=4 13350 B16R0.274 CC(C)CCCCCCCOCCCCCO 7a_200000210741_100000746330 [0,2,0,0,0,0|0,0,2]=4 13351 B16R0.274 CC(C)CCCCCCNCCCCCC#N 2230a_100000211014_100009813376 [0,2,0,0,0,0|1,0,1]=4 13352 B16R0.274 CC(C)CCCCCCNCCCCCC=O 2230a_100000211014_100000139337 [0,2,0,0,0,0|0,0,0]=2 13353 B16R0.274 CC(C)CCCCCCNCCCCCCF 2230a_100000211014_100015922095 [0,2,0,0,0,0|1,0,1]=4 13354 B16R0.274 CC(C)CCCCCCNCCCCCCF 34a_100000211014_100015922095 [0,2,0,0,0,0|1,0,1]=4 13355 B16R0.274 CC(C)CCCCCCNCCCCCCO 2230a_100000211014_100000766143 [0,2,0,0,0,0|0,0,2]=4 13356 B16R0.274 CC(C)CCCCCCNCCCCCCO 34a_100000211014_100000766143 [0,2,0,0,0,0|0,0,2]=4 13357 B16R0.274 CC(C)CCCCCNCCCCCCC#N 2230a_100011290863_100009813337 [0,2,0,0,0,0|1,0,1]=4 13358 B16R0.274 CC(C)CCCCCNCCCCCCCO 2230a_100011290863_100000760002 [0,2,0,0,0,0|0,0,2]=4 13359 B16R0.274 CC(C)CCCCCNCCCCCCCO 2230a_100011996573_100000210682 [0,2,0,0,0,0|0,0,2]=4 13360 B16R0.274 CC(C)CCCCCNCCCCCCCO 34a_100011290863_100000760002 [0,2,0,0,0,0|0,0,2]=4 13361 B16R0.274 CC(C)CCCCCNCCCCCCCO 34a_100011996573_100000210682 [0,2,0,0,0,0|0,0,2]=4 13362 B16R0.274 CC(C)CCCCCOCCCCCCC#N 7a_100011995859_100009813337 [0,2,0,0,0,0|1,0,1]=4 13363 B16R0.274 CC(C)CCCCCOCCCCCCCBr 34a_100000760002_100000210682 [0,2,0,0,0,0|1,0,1]=4 13364 B16R0.274 CC(C)CCCCCOCCCCCCCBr 7a_100000760002_100000210682 [0,2,0,0,0,0|1,0,1]=4 13365 B16R0.274 CC(C)CCCCCOCCCCCCCN 34a_100011996573_100000210682 [0,2,0,0,0,0|1,0,1]=4 13366 B16R0.274 CC(C)CCCCCOCCCCCCCO 34a_100011995859_100000760002 [0,2,0,0,0,0|0,0,2]=4 13367 B16R0.274 CC(C)CCCCCOCCCCCCCO 7a_100011995859_100000760002 [0,2,0,0,0,0|0,0,2]=4 13368 B16R0.274 CC(C)CCCCCSCCCCCCC#N 62a_100000210682_100009813337 [0,2,0,0,0,0|1,0,1]=4 13369 B16R0.274 CC(C)CCCCCSCCCCCCC#N 62a_100009813337_100000210682 [0,2,0,0,0,0|1,0,1]=4 13370 B16R0.274 CC(C)CCCCCSCCCCCCCO 62a_100000210682_100000760002 [0,2,0,0,0,0|0,0,2]=4 13371 B16R0.274 CC(C)CCCCCSCCCCCCCO 62a_100000760002_100000210682 [0,2,0,0,0,0|0,0,2]=4 13372 B16R0.274 CC(C)CCCCNCCCCCCCCO 2230a_102515433106_100011216152 [0,2,0,0,0,0|0,0,2]=4 13373 B16R0.274 CC(C)CCCCNCCCCCCCCO 34a_102515433106_100011216152 [0,2,0,0,0,0|0,0,2]=4 13374 B16R0.274 CC(C)CCCCOCCCCCCCCBr 34a_100009813846_100011216152 [0,2,0,0,0,0|1,0,1]=4 13375 B16R0.274 CC(C)CCCCOCCCCCCCCBr 7a_100009813846_100011216152 [0,2,0,0,0,0|1,0,1]=4 13376 B16R0.274 CC(C)CCCCOCCCCCCCCCl 34a_100000033203_100011216152 [0,2,0,0,0,0|1,0,1]=4 13377 B16R0.274 CC(C)CCCCOCCCCCCCCCl 7a_100000033203_100011216152 [0,2,0,0,0,0|1,0,1]=4 13378 B16R0.274 CC(C)CCCCOCCCCCCCCN 34a_102515433106_100011216152 [0,2,0,0,0,0|1,0,1]=4 13379 B16R0.274 CC(C)CCCCOCCCCCCCCO 34a_100011214890_100000033203 [0,2,0,0,0,0|0,0,2]=4 13380 B16R0.274 CC(C)CCCCOCCCCCCCCO 7a_100011214890_100000033203 [0,2,0,0,0,0|0,0,2]=4 13381 B16R0.274 CC(C)CCCCSCCCCCCCCO 62a_100000033203_100011216152 [0,2,0,0,0,0|0,0,2]=4 13382 B16R0.274 CC(C)CCCCSCCCCCCCCO 62a_100011216152_100000033203 [0,2,0,0,0,0|0,0,2]=4 13383 B16R0.274 CC(C)CCCNCCCCCCCCCO 2230a_100000078944_100011214892 [0,2,0,0,0,0|0,0,2]=4 13384 B16R0.274 CC(C)CCCNCCCCCCCCCO 2230a_200000737386_100009813782 [0,2,0,0,0,0|0,0,2]=4 13385 B16R0.274 CC(C)CCCNCCCCCCCCCO 34a_100000078944_100011214892 [0,2,0,0,0,0|0,0,2]=4 13386 B16R0.274 CC(C)CCCNCCCCCCCCCO 34a_200000737386_100009813782 [0,2,0,0,0,0|0,0,2]=4 13387 B16R0.274 CC(C)CCCOCCCCCCCCCBr 34a_100009813782_100011214892 [0,2,0,0,0,0|1,0,1]=4 13388 B16R0.274 CC(C)CCCOCCCCCCCCCBr 7a_100009813782_100011214892 [0,2,0,0,0,0|1,0,1]=4 13389 B16R0.274 CC(C)CCCOCCCCCCCCCCl 34a_100009868337_100011214892 [0,2,0,0,0,0|1,0,1]=4 13390 B16R0.274 CC(C)CCCOCCCCCCCCCCl 7a_100009868337_100011214892 [0,2,0,0,0,0|1,0,1]=4 13391 B16R0.274 CC(C)CCCOCCCCCCCCCN 34a_100000078944_100011214892 [0,2,0,0,0,0|1,0,1]=4 13392 B16R0.274 CC(C)CCCOCCCCCCCCCO 34a_100000210774_100009813782 [0,2,0,0,0,0|0,0,2]=4 13393 B16R0.274 CC(C)CCCOCCCCCCCCCO 7a_100000210774_100009813782 [0,2,0,0,0,0|0,0,2]=4 13394 B16R0.274 CC(C)CCCSCCCCCCCCCO 62a_100009813782_100011214892 [0,2,0,0,0,0|0,0,2]=4 13395 B16R0.274 CC(C)CCCSCCCCCCCCCO 62a_100011214892_100009813782 [0,2,0,0,0,0|0,0,2]=4 13396 B16R0.274 CC(C)CCNCCCCCCCCCCO 2230a_100000066964_100000210312 [0,2,0,0,0,0|0,0,2]=4 13397 B16R0.274 CC(C)CCNCCCCCCCCCCO 269862a_100000066964_100000185833 [0,2,0,0,0,0|0,0,2]=4 13398 B16R0.274 CC(C)CCNCCCCCCCCCCO 34a_100000066964_100000210312 [0,2,0,0,0,0|0,0,2]=4 13399 B16R0.274 CC(C)CCOCCCCCCCCCCBr 34a_100009813290_100000210312 [0,2,0,0,0,0|1,0,1]=4 13400 B16R0.274 CC(C)CCOCCCCCCCCCCBr 7a_100009813290_100000210626 [0,2,0,0,0,0|1,0,1]=4 13401 B16R0.274 CC(C)CCOCCCCCCCCCCCl 34a_200000033068_100000210312 [0,2,0,0,0,0|1,0,1]=4 13402 B16R0.274 CC(C)CCOCCCCCCCCCCCl 7a_200000033068_100000210626 [0,2,0,0,0,0|1,0,1]=4 13403 B16R0.274 CC(C)CCOCCCCCCCCCCN 34a_100000066964_100000210312 [0,2,0,0,0,0|1,0,1]=4 13404 B16R0.274 CC(C)CCOCCCCCCCCCCO 34a_100000210254_100009813290 [0,2,0,0,0,0|0,0,2]=4 13405 B16R0.274 CC(C)CCOCCCCCCCCCCO 7a_100000210254_100009813290 [0,2,0,0,0,0|0,0,2]=4 13406 B16R0.274 CC(C)CCSCCCCCCCCCCO 62a_100000210312_200000033068 [0,2,0,0,0,0|0,0,2]=4 13407 B16R0.274 CC(C)CCSCCCCCCCCCCO 62a_100009813290_100000210312 [0,2,0,0,0,0|0,0,2]=4 13408 B16R0.274 CC(C)CNCCCCCCCCCCCO 2230a_100000210953_100009812471 [0,2,0,0,0,0|0,0,2]=4 13409 B16R0.274 CC(C)CNCCCCCCCCCCCO 34a_100000210953_100009812471 [0,2,0,0,0,0|0,0,2]=4 13410 B16R0.274 CC(C)COCCCCCCCCCCCBr 34a_100009812471_100000210624 [0,2,0,0,0,0|1,0,1]=4 13411 B16R0.274 CC(C)COCCCCCCCCCCCBr 7a_100009812471_100000210760 [0,2,0,0,0,0|1,0,1]=4 13412 B16R0.274 CC(C)COCCCCCCCCCCCO 34a_100000210257_100009812471 [0,2,0,0,0,0|0,0,2]=4 13413 B16R0.274 CC(C)CSCCCCCCCCCCCO 62a_100009812471_100000210760 [0,2,0,0,0,0|0,0,2]=4 13414 B16R0.274 CC(C)NCCCCCCCCCCCCO 2230a_100000066677_100000210206 [0,2,0,0,0,0|0,0,2]=4 13415 B16R0.274 CC(C)NCCCCCCCCCCCCO 2230a_100138425928_100009813331 [0,2,0,0,0,0|0,0,2]=4 13416 B16R0.274 CC(C)NCCCCCCCCCCCCO 34a_100000066677_100000210206 [0,2,0,0,0,0|0,0,2]=4 13417 B16R0.274 CC(C)NCCCCCCCCCCCCO 34a_100138425928_100009813331 [0,2,0,0,0,0|0,0,2]=4 13418 B16R0.274 CC(C)OCCCCCCCCCCCCBr 34a_100009813331_100000210206 [0,2,0,0,0,0|1,0,1]=4 13419 B16R0.274 CC(C)OCCCCCCCCCCCCBr 7a_100009813331_100000210206 [0,2,0,0,0,0|1,0,1]=4 13420 B16R0.274 CC(C)OCCCCCCCCCCCCN 34a_100000066677_100000210206 [0,2,0,0,0,0|1,0,1]=4 13421 B16R0.274 CC(C)OCCCCCCCCCCCCO 34a_100000212225_100009813331 [0,2,0,0,0,0|0,0,2]=4 13422 B16R0.274 CC(C)SCCCCCCCCCCCCO 62a_100009813331_100000210206 [0,2,0,0,0,0|0,0,2]=4 13423 B16R0.274 CC(F)COCCCCCCCCCCCO 34a_100015925927_100009812471 [0,2,0,0,0,0|0,0,2]=4 13424 B16R0.274 CC(O)CCCNCCCCCCCCCO 2230a_100000078944_200000718107 [0,2,0,0,0,0|0,0,2]=4 13425 B16R0.274 CC(O)CCCNCCCCCCCCCO 34a_100000078944_200000718107 [0,2,0,0,0,0|0,0,2]=4 13426 B16R0.274 CC(O)CCCOCCCCCCCCCBr 34a_100009813782_200000718107 [0,2,0,0,0,0|1,0,1]=4 13427 B16R0.274 CC(O)CCCOCCCCCCCCCBr 7a_100009813782_200000718107 [0,2,0,0,0,0|1,0,1]=4 13428 B16R0.274 CC(O)CCCOCCCCCCCCCCl 34a_100009868337_200000718107 [0,2,0,0,0,0|1,0,1]=4 13429 B16R0.274 CC(O)CCCOCCCCCCCCCCl 7a_100009868337_200000718107 [0,2,0,0,0,0|1,0,1]=4 13430 B16R0.274 CC(O)CCCOCCCCCCCCCN 34a_100000078944_200000718107 [0,2,0,0,0,0|1,0,1]=4 13431 B16R0.274 CC(O)CCCSCCCCCCCCCO 62a_100009813782_200000718107 [0,2,0,0,0,0|0,0,2]=4 13432 B16R0.274 CC(O)CCCSCCCCCCCCCO 62a_200000718107_100009813782 [0,2,0,0,0,0|0,0,2]=4 13433 B16R0.274 CC(O)CCNCCCCCCCCCCO 2230a_100000066964_100012276601 [0,2,0,0,0,0|0,0,2]=4 13434 B16R0.274 CC(O)CCNCCCCCCCCCCO 2230a_200000755665_100009813290 [0,2,0,0,0,0|0,0,2]=4 13435 B16R0.274 CC(O)CCNCCCCCCCCCCO 34a_100000066964_100012276601 [0,2,0,0,0,0|0,0,2]=4 13436 B16R0.274 CC(O)CCOCCCCCCCCCCBr 34a_100009813290_100012276601 [0,2,0,0,0,0|1,0,1]=4 13437 B16R0.274 CC(O)CCOCCCCCCCCCCBr 7a_100009813290_100012276601 [0,2,0,0,0,0|1,0,1]=4 13438 B16R0.274 CC(O)CCOCCCCCCCCCCCl 34a_200000033068_100012276601 [0,2,0,0,0,0|1,0,1]=4 13439 B16R0.274 CC(O)CCOCCCCCCCCCCCl 7a_200000033068_100012276601 [0,2,0,0,0,0|1,0,1]=4 13440 B16R0.274 CC(O)CCOCCCCCCCCCCN 34a_100000066964_100012276601 [0,2,0,0,0,0|1,0,1]=4 13441 B16R0.274 CC(O)CCSCCCCCCCCCCO 62a_100009813290_100012276601 [0,2,0,0,0,0|0,0,2]=4 13442 B16R0.274 CC(O)CCSCCCCCCCCCCO 62a_100012276601_200000033068 [0,2,0,0,0,0|0,0,2]=4 13443 B16R0.274 CC(O)CNCCCCCCCCCCCO 2230a_100000210904_100009812471 [0,2,0,0,0,0|0,0,2]=4 13444 B16R0.274 CC(O)CNCCCCCCCCCCCO 34a_100000210904_100009812471 [0,2,0,0,0,0|0,0,2]=4 13445 B16R0.274 CC(O)COCCCCCCCCCCCBr 34a_100009812471_100011218427 [0,2,0,0,0,0|1,0,1]=4 13446 B16R0.274 CC(O)COCCCCCCCCCCCBr 7a_100009812471_100011218427 [0,2,0,0,0,0|1,0,1]=4 13447 B16R0.274 CC(O)CSCCCCCCCCCCCO 62a_100009812471_100011218427 [0,2,0,0,0,0|0,0,2]=4 13448 B16R0.274 CC/C=C\CCCCCCCNCCC(=O)N 269862a_100000740010_200025770492 [0,2,0,0,0,0|0,0,2]=4 13449 B16R0.274 CC/C=C\CCCCCNCCCCC(=O)N 269862a_100000696515_100016288537 [0,2,0,0,0,0|0,0,2]=4 13450 B16R0.274 CC/C=C\CCCCCOCCCCC(=O)C 34a_100016268722_100009817362 [0,2,0,0,0,0|0,0,2]=4 13451 B16R0.274 CC/C=C\CCCCCOCCCCC(=O)C 7a_100016268722_100000735457 [0,2,0,0,0,0|0,0,2]=4 13452 B16R0.274 CC/C=C\CCCCOCCCCCC(=O)N 34a_100016287862_100009817443 [0,2,0,0,0,0|0,0,2]=4 13453 B16R0.274 CC/C=C\CCCCOCCCCCC(=O)N 7a_100016287862_100009817443 [0,2,0,0,0,0|0,0,2]=4 13454 B16R0.274 CCC#CCCCCCCCCOCC(=O)N 34a_200000031908_100000187820 [0,2,0,0,0,0|0,0,2]=4 13455 B16R0.274 CCC#CCCCCCCCCOCC(=O)N 7a_200000031908_100000187820 [0,2,0,0,0,0|0,0,2]=4 13456 B16R0.274 CCC#CCCCCCCCCOCC(=O)[O-] 34a_200000031908_100020667443 [0,2,0,0,0,0|0,0,2]=4 13457 B16R0.274 CCC#CCCCCCCNCCCC(=O)N 34a_100000739312_200000036426 [0,2,0,0,0,0|0,0,2]=4 13458 B16R0.274 CCC#CCCCCCCOCCCC(=O)C 34a_100000759063_200000036426 [0,2,0,0,0,0|0,0,2]=4 13459 B16R0.274 CCC#CCCCCCCOCCCC(=O)C 7a_100000759063_200000036426 [0,2,0,0,0,0|0,0,2]=4 13460 B16R0.274 CCC#CCCCCCCSCCCC(=O)C 62a_100011215641_200000036426 [0,2,0,0,0,0|0,0,2]=4 13461 B16R0.274 CCC#CCCCCCCSCCCC(=O)C 62a_200000036426_100011215641 [0,2,0,0,0,0|0,0,2]=4 13462 B16R0.274 CCC#CCCCCCCSCCCC(=O)N 62a_100102525003_200000036426 [0,2,0,0,0,0|0,0,2]=4 13463 B16R0.274 CCC#CCCCCCCSCCCC(=O)N 62a_200000036426_100102525003 [0,2,0,0,0,0|0,0,2]=4 13464 B16R0.274 CCCC/C=C/CCCCOCCCC(=O)C 34a_200020645093_100000685027 [0,2,0,0,0,0|0,0,2]=4 13465 B16R0.274 CCCC/C=C/CCCCOCCCC(=O)C 7a_200020645093_100011215641 [0,2,0,0,0,0|0,0,2]=4 13466 B16R0.274 CCCC/C=C/CCCCOCCCC(=O)N 34a_200020645093_100102525003 [0,2,0,0,0,0|0,0,2]=4 13467 B16R0.274 CCCC/C=C/CCCCOCCCC(=O)N 7a_200020645093_100102525003 [0,2,0,0,0,0|0,0,2]=4 13468 B16R0.274 CCCC/C=C\CCOCCCCCC(=O)N 34a_200016286491_100009817443 [0,2,0,0,0,0|0,0,2]=4 13469 B16R0.274 CCCC/C=C\CCOCCCCCC(=O)N 7a_200016286491_100009817443 [0,2,0,0,0,0|0,0,2]=4 13470 B16R0.274 CCCCC#CCCCCCCNCC(=O)N 2230a_100000711301_200000043322 [0,2,0,0,0,0|0,0,2]=4 13471 B16R0.274 CCCCC#CCCCCCCNCC(=O)O 269956a_100016091260_200000043322 [0,2,0,0,0,0|0,0,2]=4 13472 B16R0.274 CCCCC#CCCCCCCOCC(=O)C 34a_100000211253_200000043322 [0,2,0,0,0,0|0,0,2]=4 13473 B16R0.274 CCCCC#CCCCCCCSCC(=O)N 62a_100000747473_200000043322 [0,2,0,0,0,0|0,0,2]=4 13474 B16R0.274 CCCCC#CCCCCCCSCC(=O)N 62a_200000043322_100000747473 [0,2,0,0,0,0|0,0,2]=4 13475 B16R0.274 CCCCC#CCCCCCCSCC(=O)[O-] 62a_100020667443_200000043322 [0,2,0,0,0,0|0,0,2]=4 13476 B16R0.274 CCCCC#CCCCCCCSCC(=O)[O-] 62a_200000043322_100020667443 [0,2,0,0,0,0|0,0,2]=4 13477 B16R0.274 CCCCC#CCCCCOCCCC(=O)C 34a_200000066234_100000685027 [0,2,0,0,0,0|0,0,2]=4 13478 B16R0.274 CCCCC#CCCCCOCCCC(=O)C 7a_200000066234_100011215641 [0,2,0,0,0,0|0,0,2]=4 13479 B16R0.274 CCCCC#CCCCCOCCCC(=O)N 34a_200000066234_100102525003 [0,2,0,0,0,0|0,0,2]=4 13480 B16R0.274 CCCCC#CCCCCOCCCC(=O)N 7a_200000066234_100102525003 [0,2,0,0,0,0|0,0,2]=4 13481 B16R0.274 CCCCC#CCCCNCCCCC(=O)N 34a_100000696515_200000047210 [0,2,0,0,0,0|0,0,2]=4 13482 B16R0.274 CCCCC#CCCCOCCCCC(=O)N 34a_100012022536_200000047210 [0,2,0,0,0,0|0,0,2]=4 13483 B16R0.274 CCCCC#CCCCOCCCCC(=O)N 7a_100012022536_200000047210 [0,2,0,0,0,0|0,0,2]=4 13484 B16R0.274 CCCCC#CCCCSCCCCC(=O)C 62a_100000735457_200000047210 [0,2,0,0,0,0|0,0,2]=4 13485 B16R0.274 CCCCC#CCCCSCCCCC(=O)C 62a_200000047210_100000735457 [0,2,0,0,0,0|0,0,2]=4 13486 B16R0.274 CCCCC#CCCOCCCCCC(=O)N 34a_100000037610_100009817443 [0,2,0,0,0,0|0,0,2]=4 13487 B16R0.274 CCCCC#CCCOCCCCCC(=O)N 7a_100000037610_100009817443 [0,2,0,0,0,0|0,0,2]=4 13488 B16R0.274 CCCCC/C=C/COCCCCCC(=O)N 34a_100016258190_100009817443 [0,2,0,0,0,0|0,0,2]=4 13489 B16R0.274 CCCCC/C=C/COCCCCCC(=O)N 7a_100016258190_100009817443 [0,2,0,0,0,0|0,0,2]=4 13490 B16R0.274 CCCCC/C=C\CCCOCCCC(=O)C 34a_100020655193_100000685027 [0,2,0,0,0,0|0,0,2]=4 13491 B16R0.274 CCCCC/C=C\CCCOCCCC(=O)C 7a_100020655193_100011215641 [0,2,0,0,0,0|0,0,2]=4 13492 B16R0.274 CCCCC/C=C\CCCOCCCC(=O)N 34a_100020655193_100102525003 [0,2,0,0,0,0|0,0,2]=4 13493 B16R0.274 CCCCC/C=C\CCCOCCCC(=O)N 7a_100020655193_100102525003 [0,2,0,0,0,0|0,0,2]=4 13494 B16R0.274 CCCCC/C=C\CCOCCCCC(=O)C 34a_100016277358_100009817362 [0,2,0,0,0,0|0,0,2]=4 13495 B16R0.274 CCCCC/C=C\CCOCCCCC(=O)C 7a_100016277358_100000735457 [0,2,0,0,0,0|0,0,2]=4 13496 B16R0.274 CCCCCC#CCCOCCCCC(=O)C 34a_200000042877_100009817362 [0,2,0,0,0,0|0,0,2]=4 13497 B16R0.274 CCCCCC#CCCOCCCCC(=O)C 7a_200000042877_100000735457 [0,2,0,0,0,0|0,0,2]=4 13498 B16R0.274 CCCCCC#CCOCCCCCC(=O)N 34a_100000123541_100009816472 [0,2,0,0,0,0|0,0,2]=4 13499 B16R0.274 CCCCCC#CCOCCCCCC(=O)N 34a_200000033628_100009817443 [0,2,0,0,0,0|0,0,2]=4 13500 B16R0.274 CCCCCC#CCOCCCCCC(=O)N 7a_100000123541_100009816472 [0,2,0,0,0,0|0,0,2]=4 13501 B16R0.274 CCCCCC#CCOCCCCCC(=O)N 7a_200000033628_100009817443 [0,2,0,0,0,0|0,0,2]=4 13502 B16R0.274 CCCCCC#CCOCCCCCC(=O)[O-] 7a_100102619762_100009816472 [0,2,0,0,0,0|0,0,2]=4 13503 B16R0.274 CCCCCC#CCSCCCCCC(=O)N 62a_100009816472_100009817443 [0,2,0,0,0,0|0,0,2]=4 13504 B16R0.274 CCCCCC#CCSCCCCCC(=O)N 62a_100009817443_100009816472 [0,2,0,0,0,0|0,0,2]=4 13505 B16R0.274 CCCCCC/C=C/COCCCCC(=O)C 34a_200016276170_100009817362 [0,2,0,0,0,0|0,0,2]=4 13506 B16R0.274 CCCCCC/C=C/COCCCCC(=O)C 7a_200016276170_100000735457 [0,2,0,0,0,0|0,0,2]=4 13507 B16R0.274 CCCCCCC#CCCOCCCC(=O)C 34a_200000033163_100000685027 [0,2,0,0,0,0|0,0,2]=4 13508 B16R0.274 CCCCCCC#CCCOCCCC(=O)C 7a_200000033163_100011215641 [0,2,0,0,0,0|0,0,2]=4 13509 B16R0.274 CCCCCCC#CCCOCCCC(=O)N 34a_200000033163_100102525003 [0,2,0,0,0,0|0,0,2]=4 13510 B16R0.274 CCCCCCC#CCCOCCCC(=O)N 7a_200000033163_100102525003 [0,2,0,0,0,0|0,0,2]=4 13511 B16R0.274 CCCCCCC#CCOCCCCC(=O)C 34a_200000037284_100009817362 [0,2,0,0,0,0|0,0,2]=4 13512 B16R0.274 CCCCCCC#CCOCCCCC(=O)C 7a_200000037284_100000735457 [0,2,0,0,0,0|0,0,2]=4 13513 B16R0.274 CCCCCCCC#CCOCCCC(=O)C 34a_200000061759_100000685027 [0,2,0,0,0,0|0,0,2]=4 13514 B16R0.274 CCCCCCCC#CCOCCCC(=O)C 7a_200000061759_100011215641 [0,2,0,0,0,0|0,0,2]=4 13515 B16R0.274 CCCCCCCC#CCOCCCC(=O)N 34a_200000061759_100102525003 [0,2,0,0,0,0|0,0,2]=4 13516 B16R0.274 CCCCCCCC#CCOCCCC(=O)N 7a_200000061759_100102525003 [0,2,0,0,0,0|0,0,2]=4 13517 B16R0.274 CCCCCCCC/C=C/COCCC(=O)C 7a_200020667288_100000053229 [0,2,0,0,0,0|0,0,2]=4 13518 B16R0.274 CCCCCCCC/C=C/COCCC(=O)N 34a_200020667288_100000731001 [0,2,0,0,0,0|0,0,2]=4 13519 B16R0.274 CCCCCCCC/C=C/COCCC(=O)N 7a_200020667288_100000744528 [0,2,0,0,0,0|0,0,2]=4 13520 B16R0.274 CCCCCCCCC/C=C/COCC(=O)N 34a_100015232335_100000187820 [0,2,0,0,0,0|0,0,2]=4 13521 B16R0.274 CCCCCCCCC/C=C/COCC(=O)N 7a_100015232335_100000187820 [0,2,0,0,0,0|0,0,2]=4 13522 B16R0.274 CCCCCCCCC/C=C/COCC(=O)[O-] 34a_100015232335_100020667443 [0,2,0,0,0,0|0,0,2]=4 13523 B16R0.274 CCCCCCCCCCCC=NNC(=O)C 4a_100000189765_100011218549 [0,2,0,0,0,0|1,0,1]=4 13524 B16R0.274 CCCCCCCCCCCCCCC(=O)C 1458a_100000070787_100011215471 [0,2,0,0,0,0|0,0,0]=2 13525 B16R0.274 CCCCCCCCCCCCCCC(=O)C 1458a_100000297455_200000210301 [0,2,0,0,0,0|0,0,0]=2 13526 B16R0.274 CCCCCCCCCCCCCCC(=O)[13CH3] 1458a_100000297455_200025704644 [0,2,0,0,0,0|0,0,0]=2 13527 B16R0.274 CCCCCCCCCCCCCCN(C)C 2230a_100102631434_100011215471 [0,2,0,0,0,0|1,0,1]=4 13528 B16R0.274 CCCCCCCCCCCCCCN(C)C 269982a_100102631434_100011215471 [0,2,0,0,0,0|1,0,1]=4 13529 B16R0.274 CCCCCCCCCCCCCCN(C)C 270004a_100102631434_200011216147 [0,2,0,0,0,0|1,0,1]=4 13530 B16R0.274 CCCCCCCCCCCCCNC(=O)C 11a_100011215765_100015343762 [0,2,0,0,0,0|0,0,0]=2 13531 B16R0.274 CCCCCCCCCCCCCNC(=O)C 1626a_100011215765_100015343762 [0,2,0,0,0,0|0,0,0]=2 13532 B16R0.274 CCCCCCCCCCCCCNC(=O)C 240690a_100011215765_100015343762 [0,2,0,0,0,0|0,0,0]=2 13533 B16R0.274 CCCCCCCCCCCCCNC(=O)C 527a_100011215765_100103153847 [0,2,0,0,0,0|0,0,0]=2 13534 B16R0.274 CCCCCCCCCCCCCNC(C)C 2230a_100011215765_100000210206 [0,2,0,0,0,0|1,0,1]=4 13535 B16R0.274 CCCCCCCCCCCCCNC(C)C 2230a_100138425928_100000210684 [0,2,0,0,0,0|1,0,1]=4 13536 B16R0.274 CCCCCCCCCCCCCNC(C)C 34a_100011215765_100000210206 [0,2,0,0,0,0|1,0,1]=4 13537 B16R0.274 CCCCCCCCCCCCCNC(C)C 34a_100138425928_100000210684 [0,2,0,0,0,0|1,0,1]=4 13538 B16R0.274 CCCCCCCCCCCCCOC(C)C 34a_100000185773_100000210206 [0,2,0,0,0,0|1,0,1]=4 13539 B16R0.274 CCCCCCCCCCCCCOC(C)C 34a_100000212225_100000210684 [0,2,0,0,0,0|1,0,1]=4 13540 B16R0.274 CCCCCCCCCCCCCOC(C)C 7a_100000185773_100000210206 [0,2,0,0,0,0|1,0,1]=4 13541 B16R0.274 CCCCCCCCCCCCNCC(=O)N 2230a_100000210451_100000747473 [0,2,0,0,0,0|0,0,0]=2 13542 B16R0.274 CCCCCCCCCCCCNCC(=O)N 2230a_100000711301_100011215052 [0,2,0,0,0,0|0,0,0]=2 13543 B16R0.274 CCCCCCCCCCCCNCC(=O)N 34a_100000210451_100000187820 [0,2,0,0,0,0|0,0,0]=2 13544 B16R0.274 CCCCCCCCCCCCNCC(=O)O 269956a_100016091260_100000759014 [0,2,0,0,0,0|0,0,0]=2 13545 B16R0.274 CCCCCCCCCCCCNCC(=O)[O-] 34a_100000210451_100020667443 [0,2,0,0,0,0|0,0,0]=2 13546 B16R0.274 CCCCCCCCCCCCNCC(C)C 2230a_100000210451_100000210760 [0,2,0,0,0,0|1,0,1]=4 13547 B16R0.274 CCCCCCCCCCCCNCC(C)C 2230a_100000210953_100011215052 [0,2,0,0,0,0|1,0,1]=4 13548 B16R0.274 CCCCCCCCCCCCNCC(C)C 270004a_100000210451_100000210432 [0,2,0,0,0,0|1,0,1]=4 13549 B16R0.274 CCCCCCCCCCCCNCC(C)C 270004a_100000210953_100011218549 [0,2,0,0,0,0|1,0,1]=4 13550 B16R0.274 CCCCCCCCCCCCNCC(C)C 34a_100000210451_100000210624 [0,2,0,0,0,0|1,0,1]=4 13551 B16R0.274 CCCCCCCCCCCCNCC(C)C 34a_100000210953_100000759014 [0,2,0,0,0,0|1,0,1]=4 13552 B16R0.274 CCCCCCCCCCCCNCC(C)O 2230a_100000210451_100011218427 [0,2,0,0,0,0|0,0,2]=4 13553 B16R0.274 CCCCCCCCCCCCNCC(C)O 2230a_100000210904_100011215052 [0,2,0,0,0,0|0,0,2]=4 13554 B16R0.274 CCCCCCCCCCCCNCC(C)O 270004a_100000210904_100011218549 [0,2,0,0,0,0|0,0,2]=4 13555 B16R0.274 CCCCCCCCCCCCNCC(C)O 34a_100000210451_100011218427 [0,2,0,0,0,0|0,0,2]=4 13556 B16R0.274 CCCCCCCCCCCCNCC(C)O 34a_100000210904_100000759014 [0,2,0,0,0,0|0,0,2]=4 13557 B16R0.274 CCCCCCCCCCCCNCC(F)F 2230a_100000210451_100011934356 [0,2,0,0,0,0|1,0,1]=4 13558 B16R0.274 CCCCCCCCCCCCNCC(F)F 270004a_100000765723_100011218549 [0,2,0,0,0,0|1,0,1]=4 13559 B16R0.274 CCCCCCCCCCCCNCC(F)F 34a_100000210451_100011934356 [0,2,0,0,0,0|1,0,1]=4 13560 B16R0.274 CCCCCCCCCCCCNCC(F)F 34a_100000765723_100000759014 [0,2,0,0,0,0|1,0,1]=4 13561 B16R0.274 CCCCCCCCCCCCNC[C@@H](C)O 2230a_100000210451_100009817552 [0,2,0,0,0,0|0,0,2]=4 13562 B16R0.274 CCCCCCCCCCCCNC[C@@H](C)O 34a_100000210451_100009817552 [0,2,0,0,0,0|0,0,2]=4 13563 B16R0.274 CCCCCCCCCCCCNC[N+](=O)[O-] 34a_100000210451_100000761209 [0,2,0,0,0,0|1,0,0]=3 13564 B16R0.274 CCCCCCCCCCCCOCC(=O)C 34a_100000211253_100000759014 [0,2,0,0,0,0|0,0,0]=2 13565 B16R0.274 CCCCCCCCCCCCOCC(=O)N 34a_100000210810_100000187820 [0,2,0,0,0,0|0,0,0]=2 13566 B16R0.274 CCCCCCCCCCCCOCC(=O)N 7a_100000210810_100000187820 [0,2,0,0,0,0|0,0,0]=2 13567 B16R0.274 CCCCCCCCCCCCOCC(=O)[O-] 34a_100000210810_100020667443 [0,2,0,0,0,0|0,0,0]=2 13568 B16R0.274 CCCCCCCCCCCCOCC(C)Br 34a_100012180447_100000759014 [0,2,0,0,0,0|1,0,1]=4 13569 B16R0.274 CCCCCCCCCCCCOCC(C)C 34a_100000210257_100000759014 [0,2,0,0,0,0|1,0,1]=4 13570 B16R0.274 CCCCCCCCCCCCOCC(C)C 34a_100000210810_100000210624 [0,2,0,0,0,0|1,0,1]=4 13571 B16R0.274 CCCCCCCCCCCCOCC(C)C 7a_100000210810_100000210760 [0,2,0,0,0,0|1,0,1]=4 13572 B16R0.274 CCCCCCCCCCCCOCC(C)F 34a_100015925927_100000759014 [0,2,0,0,0,0|1,0,1]=4 13573 B16R0.274 CCCCCCCCCCCCOCC(C)O 34a_100000210810_100011218427 [0,2,0,0,0,0|0,0,2]=4 13574 B16R0.274 CCCCCCCCCCCCOCC(C)O 7a_100000210810_100011218427 [0,2,0,0,0,0|0,0,2]=4 13575 B16R0.274 CCCCCCCCCCCCOCC(F)F 34a_100000210810_100011934356 [0,2,0,0,0,0|1,0,1]=4 13576 B16R0.274 CCCCCCCCCCCCOCC(F)F 34a_100000743014_100000759014 [0,2,0,0,0,0|1,0,1]=4 13577 B16R0.274 CCCCCCCCCCCCOCC(F)F 7a_100000210810_100011934356 [0,2,0,0,0,0|1,0,1]=4 13578 B16R0.274 CCCCCCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100000759014 [0,2,0,0,0,0|1,0,1]=4 13579 B16R0.274 CCCCCCCCCCCCOC[C@@H](C)N 34a_100000737577_100000759014 [0,2,0,0,0,0|1,0,1]=4 13580 B16R0.274 CCCCCCCCCCCCOC[C@@H](C)O 34a_100000210810_100009817552 [0,2,0,0,0,0|0,0,2]=4 13581 B16R0.274 CCCCCCCCCCCCOC[C@@H](C)O 7a_100000210810_100009817552 [0,2,0,0,0,0|0,0,2]=4 13582 B16R0.274 CCCCCCCCCCCCOC[N+](=O)[O-] 34a_100000210810_100000761209 [0,2,0,0,0,0|1,0,0]=3 13583 B16R0.274 CCCCCCCCCCCCSCC(=O)N 62a_100000747473_100000759014 [0,2,0,0,0,0|0,0,0]=2 13584 B16R0.274 CCCCCCCCCCCCSCC(=O)[O-] 62a_100020667443_100000759014 [0,2,0,0,0,0|0,0,0]=2 13585 B16R0.274 CCCCCCCCCCCCSCC(C)O 62a_100011218427_100000759014 [0,2,0,0,0,0|0,0,2]=4 13586 B16R0.274 CCCCCCCCCCCCSCC(F)F 62a_100011934356_100000759014 [0,2,0,0,0,0|1,0,1]=4 13587 B16R0.274 CCCCCCCCCCCCSC[C@@H](C)O 62a_100009817552_100000759014 [0,2,0,0,0,0|0,0,2]=4 13588 B16R0.274 CCCCCCCCCCCNCC=C(C)C 2230a_200011215754_100000761012 [0,2,0,0,0,0|1,0,1]=4 13589 B16R0.274 CCCCCCCCCCCNCC=C(C)C 34a_100000718196_100011215454 [0,2,0,0,0,0|1,0,1]=4 13590 B16R0.274 CCCCCCCCCCCNCC=C(C)C 34a_200011215754_100000761012 [0,2,0,0,0,0|1,0,1]=4 13591 B16R0.274 CCCCCCCCCCCNCCC(=O)N 2230a_200011215754_100000744528 [0,2,0,0,0,0|0,0,0]=2 13592 B16R0.274 CCCCCCCCCCCNCCC(=O)N 34a_200011215754_100000731001 [0,2,0,0,0,0|0,0,0]=2 13593 B16R0.274 CCCCCCCCCCCNCCC(C)C 2230a_200011215754_100000210312 [0,2,0,0,0,0|1,0,1]=4 13594 B16R0.274 CCCCCCCCCCCNCCC(C)C 269862a_200011215754_100000185833 [0,2,0,0,0,0|1,0,1]=4 13595 B16R0.274 CCCCCCCCCCCNCCC(C)C 34a_200011215754_100000210312 [0,2,0,0,0,0|1,0,1]=4 13596 B16R0.274 CCCCCCCCCCCNCCC(C)O 2230a_200000755665_100011215454 [0,2,0,0,0,0|0,0,2]=4 13597 B16R0.274 CCCCCCCCCCCNCCC(C)O 2230a_200011215754_100012276601 [0,2,0,0,0,0|0,0,2]=4 13598 B16R0.274 CCCCCCCCCCCNCCC(C)O 34a_200011215754_100012276601 [0,2,0,0,0,0|0,0,2]=4 13599 B16R0.274 CCCCCCCCCCCNCOC(=O)C 34a_200011215754_100009813279 [0,2,0,0,0,0|1,0,0]=3 13600 B16R0.274 CCCCCCCCCCCNOCC(=O)O 269956a_100000106656_100011215454 [0,2,0,0,0,0|1,0,0]=3 13601 B16R0.274 CCCCCCCCCCCOCC=C(C)C 34a_100000210809_100000761012 [0,2,0,0,0,0|1,0,1]=4 13602 B16R0.274 CCCCCCCCCCCOCC=C(C)C 34a_100000753907_100011215454 [0,2,0,0,0,0|1,0,1]=4 13603 B16R0.274 CCCCCCCCCCCOCC=C(C)C 7a_100000210809_100000761012 [0,2,0,0,0,0|1,0,1]=4 13604 B16R0.274 CCCCCCCCCCCOCCC(=O)C 34a_100000759926_100011215454 [0,2,0,0,0,0|0,0,0]=2 13605 B16R0.274 CCCCCCCCCCCOCCC(=O)C 7a_100000210809_100000053229 [0,2,0,0,0,0|0,0,0]=2 13606 B16R0.274 CCCCCCCCCCCOCCC(=O)C 7a_100000759926_100011215454 [0,2,0,0,0,0|0,0,0]=2 13607 B16R0.274 CCCCCCCCCCCOCCC(=O)N 34a_100000210809_100000731001 [0,2,0,0,0,0|0,0,0]=2 13608 B16R0.274 CCCCCCCCCCCOCCC(=O)N 34a_100000757172_100011215454 [0,2,0,0,0,0|0,0,0]=2 13609 B16R0.274 CCCCCCCCCCCOCCC(=O)N 7a_100000210809_100000744528 [0,2,0,0,0,0|0,0,0]=2 13610 B16R0.274 CCCCCCCCCCCOCCC(=O)N 7a_100000757172_100011215454 [0,2,0,0,0,0|0,0,0]=2 13611 B16R0.274 CCCCCCCCCCCOCCC(C)Br 34a_100009893172_100011215454 [0,2,0,0,0,0|1,0,1]=4 13612 B16R0.274 CCCCCCCCCCCOCCC(C)C 34a_100000210254_100011215454 [0,2,0,0,0,0|1,0,1]=4 13613 B16R0.274 CCCCCCCCCCCOCCC(C)C 34a_100000210809_100000210312 [0,2,0,0,0,0|1,0,1]=4 13614 B16R0.274 CCCCCCCCCCCOCCC(C)C 7a_100000210254_100011215454 [0,2,0,0,0,0|1,0,1]=4 13615 B16R0.274 CCCCCCCCCCCOCCC(C)C 7a_100000210809_100000210626 [0,2,0,0,0,0|1,0,1]=4 13616 B16R0.274 CCCCCCCCCCCOCCC(C)O 34a_100000210809_100012276601 [0,2,0,0,0,0|0,0,2]=4 13617 B16R0.274 CCCCCCCCCCCOCCC(C)O 7a_100000210809_100012276601 [0,2,0,0,0,0|0,0,2]=4 13618 B16R0.274 CCCCCCCCCCCOCCC(F)F 34a_100103093639_100011215454 [0,2,0,0,0,0|1,0,1]=4 13619 B16R0.274 CCCCCCCCCCCOCCN(C)C 7a_100000210809_100000755713 [0,2,0,0,0,0|2,0,0]=4 13620 B16R0.274 CCCCCCCCCCCOCC[C@@H](C)N 34a_100000706166_100011215454 [0,2,0,0,0,0|1,0,1]=4 13621 B16R0.274 CCCCCCCCCCCOCOC(=O)C 34a_100000210809_100009813279 [0,2,0,0,0,0|1,0,0]=3 13622 B16R0.274 CCCCCCCCCCCSCCC(=O)C 62a_100000053229_100011215454 [0,2,0,0,0,0|0,0,0]=2 13623 B16R0.274 CCCCCCCCCCCSCCC(=O)N 62a_100000744528_100011215454 [0,2,0,0,0,0|0,0,0]=2 13624 B16R0.274 CCCCCCCCCCCSCCC(C)O 62a_100012276601_100011215454 [0,2,0,0,0,0|0,0,2]=4 13625 B16R0.274 CCCCCCCCCCCSCOC(=O)C 62a_100000076356_100011215454 [0,2,0,0,0,0|1,0,0]=3 13626 B16R0.274 CCCCCCCCCCNCCC=C(C)C 2230a_100000684558_100011217483 [0,2,0,0,0,0|1,0,1]=4 13627 B16R0.274 CCCCCCCCCCNCCC=C(C)C 34a_100000684558_100011217483 [0,2,0,0,0,0|1,0,1]=4 13628 B16R0.274 CCCCCCCCCCNCCC=C(F)F 2230a_100000684558_200009816681 [0,2,0,0,0,0|1,0,1]=4 13629 B16R0.274 CCCCCCCCCCNCCC=C(F)F 34a_100000684558_200009816681 [0,2,0,0,0,0|1,0,1]=4 13630 B16R0.274 CCCCCCCCCCNCCCC(=O)C 34a_100000684558_100000685027 [0,2,0,0,0,0|0,0,0]=2 13631 B16R0.274 CCCCCCCCCCNCCCC(=O)N 34a_100000684558_100102525003 [0,2,0,0,0,0|0,0,0]=2 13632 B16R0.274 CCCCCCCCCCNCCCC(=O)N 34a_100000739312_100000210320 [0,2,0,0,0,0|0,0,0]=2 13633 B16R0.274 CCCCCCCCCCNCCCC(C)C 2230a_100000684558_100011214892 [0,2,0,0,0,0|1,0,1]=4 13634 B16R0.274 CCCCCCCCCCNCCCC(C)C 2230a_200000737386_100000210320 [0,2,0,0,0,0|1,0,1]=4 13635 B16R0.274 CCCCCCCCCCNCCCC(C)C 34a_100000684558_100011214892 [0,2,0,0,0,0|1,0,1]=4 13636 B16R0.274 CCCCCCCCCCNCCCC(C)C 34a_200000737386_100000210320 [0,2,0,0,0,0|1,0,1]=4 13637 B16R0.274 CCCCCCCCCCNCCCC(C)O 2230a_100000684558_200000718107 [0,2,0,0,0,0|0,0,2]=4 13638 B16R0.274 CCCCCCCCCCNCCCC(C)O 34a_100000684558_200000718107 [0,2,0,0,0,0|0,0,2]=4 13639 B16R0.274 CCCCCCCCCCNCCCS(=O)C 2230a_200000753449_100000210320 [0,2,0,0,0,0|1,0,0]=3 13640 B16R0.274 CCCCCCCCCCNCCNC(=O)C 2230a_100000209853_100000210320 [0,2,0,0,0,0|1,0,0]=3 13641 B16R0.274 CCCCCCCCCCNCCNC(=O)C 2230a_100000684558_100000189650 [0,2,0,0,0,0|1,0,0]=3 13642 B16R0.274 CCCCCCCCCCNCCNC(=O)N 2230a_100000684558_200000034859 [0,2,0,0,0,0|1,0,0]=3 13643 B16R0.274 CCCCCCCCCCNCCNC(=O)N 34a_100020590234_100000210320 [0,2,0,0,0,0|1,0,0]=3 13644 B16R0.274 CCCCCCCCCCNCCOC(=O)C 34a_100000684558_100009814007 [0,2,0,0,0,0|1,0,0]=3 13645 B16R0.274 CCCCCCCCCCNCCOC(=O)N 34a_100000684558_200011214921 [0,2,0,0,0,0|1,0,0]=3 13646 B16R0.274 CCCCCCCCCCOCCC=C(C)C 34a_100000210711_100011217483 [0,2,0,0,0,0|1,0,1]=4 13647 B16R0.274 CCCCCCCCCCOCCC=C(C)C 7a_100000210711_100011217483 [0,2,0,0,0,0|1,0,1]=4 13648 B16R0.274 CCCCCCCCCCOCCC=C(F)F 34a_100000210711_200009816681 [0,2,0,0,0,0|1,0,1]=4 13649 B16R0.274 CCCCCCCCCCOCCC=C(F)F 7a_100000210711_200009816681 [0,2,0,0,0,0|1,0,1]=4 13650 B16R0.274 CCCCCCCCCCOCCCC(=O)C 34a_100000210711_100000685027 [0,2,0,0,0,0|0,0,0]=2 13651 B16R0.274 CCCCCCCCCCOCCCC(=O)C 34a_100000759063_100000210320 [0,2,0,0,0,0|0,0,0]=2 13652 B16R0.274 CCCCCCCCCCOCCCC(=O)C 7a_100000210711_100011215641 [0,2,0,0,0,0|0,0,0]=2 13653 B16R0.274 CCCCCCCCCCOCCCC(=O)C 7a_100000759063_100000210320 [0,2,0,0,0,0|0,0,0]=2 13654 B16R0.274 CCCCCCCCCCOCCCC(=O)N 34a_100000210711_100102525003 [0,2,0,0,0,0|0,0,0]=2 13655 B16R0.274 CCCCCCCCCCOCCCC(=O)N 7a_100000210711_100102525003 [0,2,0,0,0,0|0,0,0]=2 13656 B16R0.274 CCCCCCCCCCOCCCC(C)C 34a_100000210711_100011214892 [0,2,0,0,0,0|1,0,1]=4 13657 B16R0.274 CCCCCCCCCCOCCCC(C)C 34a_100000210774_100000210320 [0,2,0,0,0,0|1,0,1]=4 13658 B16R0.274 CCCCCCCCCCOCCCC(C)C 7a_100000210711_100011214892 [0,2,0,0,0,0|1,0,1]=4 13659 B16R0.274 CCCCCCCCCCOCCCC(C)C 7a_100000210774_100000210320 [0,2,0,0,0,0|1,0,1]=4 13660 B16R0.274 CCCCCCCCCCOCCCC(C)O 34a_100000210711_200000718107 [0,2,0,0,0,0|0,0,2]=4 13661 B16R0.274 CCCCCCCCCCOCCCC(C)O 7a_100000210711_200000718107 [0,2,0,0,0,0|0,0,2]=4 13662 B16R0.274 CCCCCCCCCCOCCCN(C)C 7a_100000210711_100000757444 [0,2,0,0,0,0|2,0,0]=4 13663 B16R0.274 CCCCCCCCCCOCCC[N+](=O)[O-] 34a_200000037920_100000210320 [0,2,0,0,0,0|1,0,0]=3 13664 B16R0.274 CCCCCCCCCCOCCNC(=O)C 34a_100000158858_100000210320 [0,2,0,0,0,0|1,0,0]=3 13665 B16R0.274 CCCCCCCCCCOCCNC(=O)C 7a_100000210711_100000189650 [0,2,0,0,0,0|1,0,0]=3 13666 B16R0.274 CCCCCCCCCCOCCNC(=O)N 34a_100000181757_100000210320 [0,2,0,0,0,0|1,0,0]=3 13667 B16R0.274 CCCCCCCCCCOCCNC(=O)N 7a_100000210711_200000034859 [0,2,0,0,0,0|1,0,0]=3 13668 B16R0.274 CCCCCCCCCCOCCOC(=O)C 34a_100000210711_100009814007 [0,2,0,0,0,0|1,0,0]=3 13669 B16R0.274 CCCCCCCCCCOCCOC(=O)C 7a_100000210711_100009814007 [0,2,0,0,0,0|1,0,0]=3 13670 B16R0.274 CCCCCCCCCCOCCOC(=O)N 34a_100000210711_200011214921 [0,2,0,0,0,0|1,0,0]=3 13671 B16R0.274 CCCCCCCCCCOCCOC(=O)N 7a_100000210711_200011214921 [0,2,0,0,0,0|1,0,0]=3 13672 B16R0.274 CCCCCCCCCCOCCOC(=O)N 7a_100000766696_100000210320 [0,2,0,0,0,0|1,0,0]=3 13673 B16R0.274 CCCCCCCCCCSCCCC(=O)C 62a_100011215641_100000210320 [0,2,0,0,0,0|0,0,0]=2 13674 B16R0.274 CCCCCCCCCCSCCCC(=O)N 62a_100102525003_100000210320 [0,2,0,0,0,0|0,0,0]=2 13675 B16R0.274 CCCCCCCCCCSCCCC(C)O 62a_200000718107_100000210320 [0,2,0,0,0,0|0,0,2]=4 13676 B16R0.274 CCCCCCCCCCSCCNC(=O)C 62a_100000189650_100000210320 [0,2,0,0,0,0|1,0,0]=3 13677 B16R0.274 CCCCCCCCCCSCCNC(=O)N 62a_200000034859_100000210320 [0,2,0,0,0,0|1,0,0]=3 13678 B16R0.274 CCCCCCCCCCSCCOC(=O)C 62a_100009814007_100000210320 [0,2,0,0,0,0|1,0,0]=3 13679 B16R0.274 CCCCCCCCCCSCCOC(=O)N 62a_200011214921_100000210320 [0,2,0,0,0,0|1,0,0]=3 13680 B16R0.274 CCCCCCCCCNCCCCB(O)O 2230a_100000212291_200009817182 [0,2,0,0,0,0|1,0,1]=4 13681 B16R0.274 CCCCCCCCCNCCCCB(O)O 34a_100000212291_200009817182 [0,2,0,0,0,0|1,0,1]=4 13682 B16R0.274 CCCCCCCCCNCCCCC(=O)C 34a_100000212291_100009817362 [0,2,0,0,0,0|0,0,0]=2 13683 B16R0.274 CCCCCCCCCNCCCCC(=O)N 34a_100000696515_100011214924 [0,2,0,0,0,0|0,0,0]=2 13684 B16R0.274 CCCCCCCCCNCCCCC(C)C 2230a_100000212291_100011216152 [0,2,0,0,0,0|1,0,1]=4 13685 B16R0.274 CCCCCCCCCNCCCCC(C)C 34a_100000212291_100011216152 [0,2,0,0,0,0|1,0,1]=4 13686 B16R0.274 CCCCCCCCCNCCCNC(=O)C 34a_100000736810_100011214924 [0,2,0,0,0,0|1,0,0]=3 13687 B16R0.274 CCCCCCCCCNCCCOC(=O)C 34a_100000212291_100000042594 [0,2,0,0,0,0|1,0,0]=3 13688 B16R0.274 CCCCCCCCCNCCCOC(=S)C 2230a_100000212291_200135323944 [0,2,0,0,0,0|1,1,0]=4 13689 B16R0.274 CCCCCCCCCNCCCOC(=S)C 34a_100000212291_200135323944 [0,2,0,0,0,0|1,1,0]=4 13690 B16R0.274 CCCCCCCCCNCCCSC(=O)C 2230a_100000212291_100000038929 [0,2,0,0,0,0|1,0,0]=3 13691 B16R0.274 CCCCCCCCCNCCCSC(=O)C 34a_100000212291_100000038929 [0,2,0,0,0,0|1,0,0]=3 13692 B16R0.274 CCCCCCCCCNCCOCC(=O)N 2230a_100000212291_100000076697 [0,2,0,0,0,0|1,0,0]=3 13693 B16R0.274 CCCCCCCCCNCCOCC(=O)N 34a_100000212291_100000076697 [0,2,0,0,0,0|1,0,0]=3 13694 B16R0.274 CCCCCCCCCNCCOCC(=O)O 269956a_100000700818_100000210670 [0,2,0,0,0,0|1,0,0]=3 13695 B16R0.274 CCCCCCCCCOCCCCB(O)O 34a_100000210712_200009817182 [0,2,0,0,0,0|1,0,1]=4 13696 B16R0.274 CCCCCCCCCOCCCCB(O)O 7a_100000210712_200009817182 [0,2,0,0,0,0|1,0,1]=4 13697 B16R0.274 CCCCCCCCCOCCCCC(=O)C 34a_100000210712_100009817362 [0,2,0,0,0,0|0,0,0]=2 13698 B16R0.274 CCCCCCCCCOCCCCC(=O)C 7a_100000210712_100000735457 [0,2,0,0,0,0|0,0,0]=2 13699 B16R0.274 CCCCCCCCCOCCCCC(=O)N 34a_100012022536_100011214924 [0,2,0,0,0,0|0,0,0]=2 13700 B16R0.274 CCCCCCCCCOCCCCC(=O)N 7a_100012022536_100000210328 [0,2,0,0,0,0|0,0,0]=2 13701 B16R0.274 CCCCCCCCCOCCCCC(C)C 34a_100000210712_100011216152 [0,2,0,0,0,0|1,0,1]=4 13702 B16R0.274 CCCCCCCCCOCCCCC(C)C 34a_100011214890_100011214924 [0,2,0,0,0,0|1,0,1]=4 13703 B16R0.274 CCCCCCCCCOCCCCC(C)C 7a_100000210712_100011216152 [0,2,0,0,0,0|1,0,1]=4 13704 B16R0.274 CCCCCCCCCOCCCCC(C)C 7a_100011214890_100000210328 [0,2,0,0,0,0|1,0,1]=4 13705 B16R0.274 CCCCCCCCCOCCCC[N+](=O)[O-] 34a_200015379883_100011214924 [0,2,0,0,0,0|1,0,0]=3 13706 B16R0.274 CCCCCCCCCOCCCC[N+](=O)[O-] 7a_200015379883_100000210328 [0,2,0,0,0,0|1,0,0]=3 13707 B16R0.274 CCCCCCCCCOCCCNC(=O)C 34a_100000752032_100011214924 [0,2,0,0,0,0|1,0,0]=3 13708 B16R0.274 CCCCCCCCCOCCCOC(=O)C 34a_100000210712_100000042594 [0,2,0,0,0,0|1,0,0]=3 13709 B16R0.274 CCCCCCCCCOCCCOC(=O)C 7a_100000210712_100000042594 [0,2,0,0,0,0|1,0,0]=3 13710 B16R0.274 CCCCCCCCCOCCCOC(=S)C 34a_100000210712_200135323944 [0,2,0,0,0,0|1,1,0]=4 13711 B16R0.274 CCCCCCCCCOCCCOC(=S)C 7a_100000210712_200135323944 [0,2,0,0,0,0|1,1,0]=4 13712 B16R0.274 CCCCCCCCCOCCCSC(=O)C 34a_100000210712_100000038929 [0,2,0,0,0,0|1,0,0]=3 13713 B16R0.274 CCCCCCCCCOCCCSC(=O)C 7a_100000210712_100000038929 [0,2,0,0,0,0|1,0,0]=3 13714 B16R0.274 CCCCCCCCCOCCOCC(=O)N 34a_100000210712_100000076697 [0,2,0,0,0,0|1,0,0]=3 13715 B16R0.274 CCCCCCCCCOCCOCC(=O)N 7a_100000210712_100000076697 [0,2,0,0,0,0|1,0,0]=3 13716 B16R0.274 CCCCCCCCCSCCCCB(O)O 62a_200009817182_100000210670 [0,2,0,0,0,0|1,0,1]=4 13717 B16R0.274 CCCCCCCCCSCCCCC(=O)C 62a_100000735457_100000210670 [0,2,0,0,0,0|0,0,0]=2 13718 B16R0.274 CCCCCCCCCSCCCOC(=O)C 62a_100000042594_100000210670 [0,2,0,0,0,0|1,0,0]=3 13719 B16R0.274 CCCCCCCCCSCCCOC(=S)C 62a_200135323944_100000210670 [0,2,0,0,0,0|1,1,0]=4 13720 B16R0.274 CCCCCCCCCSCCCSC(=O)C 62a_100000038929_100000210670 [0,2,0,0,0,0|1,0,0]=3 13721 B16R0.274 CCCCCCCCCSCCOCC(=O)N 62a_100000076697_100000210670 [0,2,0,0,0,0|1,0,0]=3 13722 B16R0.274 CCCCCCCCNCCCCCB(O)O 2230a_100000229939_200009817188 [0,2,0,0,0,0|1,0,1]=4 13723 B16R0.274 CCCCCCCCNCCCCCB(O)O 34a_100000229939_200009817188 [0,2,0,0,0,0|1,0,1]=4 13724 B16R0.274 CCCCCCCCNCCCCCC(=O)N 2230a_100000229939_100009817443 [0,2,0,0,0,0|0,0,0]=2 13725 B16R0.274 CCCCCCCCNCCCCCC(=O)N 34a_100000229939_100009817443 [0,2,0,0,0,0|0,0,0]=2 13726 B16R0.274 CCCCCCCCNCCCCCC(C)C 2230a_100000229939_100000210682 [0,2,0,0,0,0|1,0,1]=4 13727 B16R0.274 CCCCCCCCNCCCCCC(C)C 2230a_100011290863_100000210759 [0,2,0,0,0,0|1,0,1]=4 13728 B16R0.274 CCCCCCCCNCCCCCC(C)C 34a_100000229939_100000210682 [0,2,0,0,0,0|1,0,1]=4 13729 B16R0.274 CCCCCCCCNCCCCCC(C)C 34a_100011290863_100000210759 [0,2,0,0,0,0|1,0,1]=4 13730 B16R0.274 CCCCCCCCNCCCCNC(=O)C 2230a_200011368371_100000210759 [0,2,0,0,0,0|1,0,0]=3 13731 B16R0.274 CCCCCCCCNCCCCNC(=O)C 34a_200011368371_100000210759 [0,2,0,0,0,0|1,0,0]=3 13732 B16R0.274 CCCCCCCCNCCCCOC(=O)C 34a_100000229939_100000033659 [0,2,0,0,0,0|1,0,0]=3 13733 B16R0.274 CCCCCCCCNCCCCO[N+](=O)[O-] 34a_100000229939_100015694321 [0,2,0,0,0,0|2,0,0]=4 13734 B16R0.274 CCCCCCCCNCCCCSC(=O)C 2230a_100000229939_200010402107 [0,2,0,0,0,0|1,0,0]=3 13735 B16R0.274 CCCCCCCCNCCCCSC(=O)C 34a_100000229939_200010402107 [0,2,0,0,0,0|1,0,0]=3 13736 B16R0.274 CCCCCCCCNCOCCOC(=O)C 34a_100000229939_100000076355 [0,2,0,0,0,0|2,0,0]=4 13737 B16R0.274 CCCCCCCCOCCCCCB(O)O 34a_100000210232_200009817188 [0,2,0,0,0,0|1,0,1]=4 13738 B16R0.274 CCCCCCCCOCCCCCB(O)O 7a_100000210232_200009817188 [0,2,0,0,0,0|1,0,1]=4 13739 B16R0.274 CCCCCCCCOCCCCCC(=O)N 34a_100000123541_100000210759 [0,2,0,0,0,0|0,0,0]=2 13740 B16R0.274 CCCCCCCCOCCCCCC(=O)N 34a_100000210232_100009817443 [0,2,0,0,0,0|0,0,0]=2 13741 B16R0.274 CCCCCCCCOCCCCCC(=O)N 7a_100000123541_100000210759 [0,2,0,0,0,0|0,0,0]=2 13742 B16R0.274 CCCCCCCCOCCCCCC(=O)N 7a_100000210232_100009817443 [0,2,0,0,0,0|0,0,0]=2 13743 B16R0.274 CCCCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210759 [0,2,0,0,0,0|0,0,0]=2 13744 B16R0.274 CCCCCCCCOCCCCCC(C)C 34a_100000210232_100000210682 [0,2,0,0,0,0|1,0,1]=4 13745 B16R0.274 CCCCCCCCOCCCCCC(C)C 34a_100011995859_100000210759 [0,2,0,0,0,0|1,0,1]=4 13746 B16R0.274 CCCCCCCCOCCCCCC(C)C 7a_100000210232_100000210682 [0,2,0,0,0,0|1,0,1]=4 13747 B16R0.274 CCCCCCCCOCCCCCC(C)C 7a_100011995859_100000210759 [0,2,0,0,0,0|1,0,1]=4 13748 B16R0.274 CCCCCCCCOCCCCOC(=O)C 34a_100000073216_100000210759 [0,2,0,0,0,0|1,0,0]=3 13749 B16R0.274 CCCCCCCCOCCCCOC(=O)C 34a_100000210232_100000033659 [0,2,0,0,0,0|1,0,0]=3 13750 B16R0.274 CCCCCCCCOCCCCOC(=O)C 7a_100000073216_100000210759 [0,2,0,0,0,0|1,0,0]=3 13751 B16R0.274 CCCCCCCCOCCCCOC(=O)C 7a_100000210232_100000033659 [0,2,0,0,0,0|1,0,0]=3 13752 B16R0.274 CCCCCCCCOCCCCO[N+](=O)[O-] 34a_100000210232_100015694321 [0,2,0,0,0,0|2,0,0]=4 13753 B16R0.274 CCCCCCCCOCCCCO[N+](=O)[O-] 7a_100000210232_100015694321 [0,2,0,0,0,0|2,0,0]=4 13754 B16R0.274 CCCCCCCCOCCCCSC(=O)C 34a_100000210232_200010402107 [0,2,0,0,0,0|1,0,0]=3 13755 B16R0.274 CCCCCCCCOCCCCSC(=O)C 7a_100000210232_200010402107 [0,2,0,0,0,0|1,0,0]=3 13756 B16R0.274 CCCCCCCCOCOCCOC(=O)C 34a_100000210232_100000076355 [0,2,0,0,0,0|2,0,0]=4 13757 B16R0.274 CCCCCCCCSCCCCCB(O)O 62a_100000210759_200009817188 [0,2,0,0,0,0|1,0,1]=4 13758 B16R0.274 CCCCCCCCSCCCCCB(O)O 62a_200009817188_100000210317 [0,2,0,0,0,0|1,0,1]=4 13759 B16R0.274 CCCCCCCCSCCCCCC(=O)N 62a_100000210759_100009817443 [0,2,0,0,0,0|0,0,0]=2 13760 B16R0.274 CCCCCCCCSCCCCCC(=O)N 62a_100009817443_100000210317 [0,2,0,0,0,0|0,0,0]=2 13761 B16R0.274 CCCCCCCCSCCCCOC(=O)C 62a_100000033659_100000210317 [0,2,0,0,0,0|1,0,0]=3 13762 B16R0.274 CCCCCCCCSCCCCOC(=O)C 62a_100000210759_100000033659 [0,2,0,0,0,0|1,0,0]=3 13763 B16R0.274 CCCCCCCCSCCCCO[N+](=O)[O-] 62a_100000210759_100015694321 [0,2,0,0,0,0|2,0,0]=4 13764 B16R0.274 CCCCCCCCSCCCCSC(=O)C 62a_100000210759_200010402107 [0,2,0,0,0,0|1,0,0]=3 13765 B16R0.274 CCCCCCCCSCCCCSC(=O)C 62a_200010402107_100000210317 [0,2,0,0,0,0|1,0,0]=3 13766 B16R0.274 CCCCCCCCSCOCCOC(=O)C 62a_100000076355_100000210317 [0,2,0,0,0,0|2,0,0]=4 13767 B16R0.274 CCCCCCCCSCOCCOC(=O)C 62a_100000210759_100000076355 [0,2,0,0,0,0|2,0,0]=4 13768 B16R0.274 CCCCCCCNCCCCCCB(O)O 2230a_100000229938_100009817187 [0,2,0,0,0,0|1,0,1]=4 13769 B16R0.274 CCCCCCCNCCCCCCC(C)C 2230a_100000211014_100000210681 [0,2,0,0,0,0|1,0,1]=4 13770 B16R0.274 CCCCCCCNCCCCCCC(C)C 34a_100000211014_100000210614 [0,2,0,0,0,0|1,0,1]=4 13771 B16R0.274 CCCCCCCNCCCCCNC(=O)C 2230a_200012022750_100000210681 [0,2,0,0,0,0|1,0,0]=3 13772 B16R0.274 CCCCCCCNCCCCCNC(=O)C 34a_200012022750_100000210614 [0,2,0,0,0,0|1,0,0]=3 13773 B16R0.274 CCCCCCCNCCCCCOC(=O)C 2230a_100000229938_100009813381 [0,2,0,0,0,0|1,0,0]=3 13774 B16R0.274 CCCCCCCNCCOCCOC(=O)C 2230a_100000229938_200000083610 [0,2,0,0,0,0|2,0,0]=4 13775 B16R0.274 CCCCCCCOCCCCCCB(O)O 34a_100000210272_100009817187 [0,2,0,0,0,0|1,0,1]=4 13776 B16R0.274 CCCCCCCOCCCCCCB(O)O 7a_100000210272_100009817187 [0,2,0,0,0,0|1,0,1]=4 13777 B16R0.274 CCCCCCCOCCCCCOC(=O)C 34a_100000210272_100000033007 [0,2,0,0,0,0|1,0,0]=3 13778 B16R0.274 CCCCCCCOCCCCCOC(=O)C 7a_100000210272_100000033007 [0,2,0,0,0,0|1,0,0]=3 13779 B16R0.274 CCCCCCCOCCOCCOC(=O)C 34a_100000210272_200000083610 [0,2,0,0,0,0|2,0,0]=4 13780 B16R0.274 CCCCCCCOCCOCCOC(=O)C 7a_100000210272_200000083610 [0,2,0,0,0,0|2,0,0]=4 13781 B16R0.274 CCCCCCCSCCCCCCB(O)O 62a_100000210614_100009817187 [0,2,0,0,0,0|1,0,1]=4 13782 B16R0.274 CCCCCCCSCCCCCCB(O)O 62a_100009817187_100000210316 [0,2,0,0,0,0|1,0,1]=4 13783 B16R0.274 CCCCCCCSCCCCCOC(=O)C 62a_100000033007_100000210316 [0,2,0,0,0,0|1,0,0]=3 13784 B16R0.274 CCCCCCCSCCCCCOC(=O)C 62a_100000210614_100000033007 [0,2,0,0,0,0|1,0,0]=3 13785 B16R0.274 CCCCCCCSCCOCCOC(=O)C 62a_100000210614_200000083610 [0,2,0,0,0,0|2,0,0]=4 13786 B16R0.274 CCCCCCCSCCOCCOC(=O)C 62a_200000083610_100000210316 [0,2,0,0,0,0|2,0,0]=4 13787 B16R0.274 CCCCCCNCCCCCCNC(=O)C 2230a_200011996284_100000210314 [0,2,0,0,0,0|1,0,0]=3 13788 B16R0.274 CCCCCCNCCCCCCNC(=O)C 34a_200011996284_100000210314 [0,2,0,0,0,0|1,0,0]=3 13789 B16R0.274 CCCCCCNCCOCCOCC(=O)O 269956a_100009854275_100000210757 [0,2,0,0,0,0|2,0,0]=4 13790 B16R0.274 CCCCCCOCCCCCCCC(C)C 34a_200000210741_100000210314 [0,2,0,0,0,0|1,0,1]=4 13791 B16R0.274 CCCCCCOCCCCCCCC(C)C 7a_200000210741_100000210314 [0,2,0,0,0,0|1,0,1]=4 13792 B16R0.274 CCCCCCOCCOCCCCC(=O)C 34a_100000691444_100009817362 [0,2,0,0,0,0|1,0,0]=3 13793 B16R0.274 CCCCCCOCCOCCCCC(=O)C 7a_100000691444_100000735457 [0,2,0,0,0,0|1,0,0]=3 13794 B16R0.274 CCCCCCOCCOCCCOC(=O)C 34a_100000691444_100000042594 [0,2,0,0,0,0|2,0,0]=4 13795 B16R0.274 CCCCCCOCCOCCCOC(=O)C 7a_100000691444_100000042594 [0,2,0,0,0,0|2,0,0]=4 13796 B16R0.274 CCCCCCOCCOCCCSC(=O)C 34a_100000691444_100000038929 [0,2,0,0,0,0|2,0,0]=4 13797 B16R0.274 CCCCCCOCCOCCCSC(=O)C 7a_100000691444_100000038929 [0,2,0,0,0,0|2,0,0]=4 13798 B16R0.274 CCCCCCOCCOCCOCC(=O)N 34a_100000032842_100000187820 [0,2,0,0,0,0|2,0,0]=4 13799 B16R0.274 CCCCCCOCCOCCOCC(=O)N 34a_100000691444_100000076697 [0,2,0,0,0,0|2,0,0]=4 13800 B16R0.274 CCCCCCOCCOCCOCC(=O)N 7a_100000032842_100000187820 [0,2,0,0,0,0|2,0,0]=4 13801 B16R0.274 CCCCCCOCCOCCOCC(=O)N 7a_100000691444_100000076697 [0,2,0,0,0,0|2,0,0]=4 13802 B16R0.274 CCCCCCOCCOCCOCC(=O)[O-] 34a_100000032842_100020667443 [0,2,0,0,0,0|2,0,0]=4 13803 B16R0.274 CCCCCNCCOCCCCCC(=O)N 34a_100000224656_100009817443 [0,2,0,0,0,0|1,0,0]=3 13804 B16R0.274 CCCCCNCCOCCCCOC(=O)C 34a_100000224656_100000033659 [0,2,0,0,0,0|2,0,0]=4 13805 B16R0.274 CCCCCNCCOCCCCSC(=O)C 34a_100000224656_200010402107 [0,2,0,0,0,0|2,0,0]=4 13806 B16R0.274 CCCCCOCCOCCCCCC(=O)N 34a_100011215259_100009817443 [0,2,0,0,0,0|1,0,0]=3 13807 B16R0.274 CCCCCOCCOCCCCCC(=O)N 7a_100011215259_100009817443 [0,2,0,0,0,0|1,0,0]=3 13808 B16R0.274 CCCCCOCCOCCCCOC(=O)C 34a_100011215259_100000033659 [0,2,0,0,0,0|2,0,0]=4 13809 B16R0.274 CCCCCOCCOCCCCOC(=O)C 7a_100011215259_100000033659 [0,2,0,0,0,0|2,0,0]=4 13810 B16R0.274 CCCCCOCCOCCCCSC(=O)C 34a_100011215259_200010402107 [0,2,0,0,0,0|2,0,0]=4 13811 B16R0.274 CCCCCOCCOCCCCSC(=O)C 7a_100011215259_200010402107 [0,2,0,0,0,0|2,0,0]=4 13812 B16R0.274 CCCCNCCCCOCCCCC(=O)C 34a_200011216965_100009817362 [0,2,0,0,0,0|1,0,0]=3 13813 B16R0.274 CCCCNCCCCOCCCOC(=O)C 34a_200011216965_100000042594 [0,2,0,0,0,0|2,0,0]=4 13814 B16R0.274 CCCCNCCCCOCCCSC(=O)C 34a_200011216965_100000038929 [0,2,0,0,0,0|2,0,0]=4 13815 B16R0.274 CCCCNCCCCOCCOCC(=O)N 34a_200011216965_100000076697 [0,2,0,0,0,0|2,0,0]=4 13816 B16R0.274 CCCCOCCCCOCCCCC(=O)C 34a_200000760531_100009817362 [0,2,0,0,0,0|1,0,0]=3 13817 B16R0.274 CCCCOCCCCOCCCCC(=O)C 7a_200000760531_100000735457 [0,2,0,0,0,0|1,0,0]=3 13818 B16R0.274 CCCCOCCCCOCCCOC(=O)C 34a_200000760531_100000042594 [0,2,0,0,0,0|2,0,0]=4 13819 B16R0.274 CCCCOCCCCOCCCOC(=O)C 7a_200000760531_100000042594 [0,2,0,0,0,0|2,0,0]=4 13820 B16R0.274 CCCCOCCCCOCCCSC(=O)C 34a_200000760531_100000038929 [0,2,0,0,0,0|2,0,0]=4 13821 B16R0.274 CCCCOCCCCOCCCSC(=O)C 7a_200000760531_100000038929 [0,2,0,0,0,0|2,0,0]=4 13822 B16R0.274 CCCCOCCCCOCCOCC(=O)N 34a_200000760531_100000076697 [0,2,0,0,0,0|2,0,0]=4 13823 B16R0.274 CCCCOCCCCOCCOCC(=O)N 7a_200000760531_100000076697 [0,2,0,0,0,0|2,0,0]=4 13824 B16R0.274 CCCCOCCCNCCCCCC(=O)N 2230a_200000211371_100009817443 [0,2,0,0,0,0|1,0,0]=3 13825 B16R0.274 CCCCOCCCNCCCCCC(=O)N 34a_200000211371_100009817443 [0,2,0,0,0,0|1,0,0]=3 13826 B16R0.274 CCCCOCCCNCCCCOC(=O)C 34a_200000211371_100000033659 [0,2,0,0,0,0|2,0,0]=4 13827 B16R0.274 CCCCOCCCNCCCCSC(=O)C 2230a_200000211371_200010402107 [0,2,0,0,0,0|2,0,0]=4 13828 B16R0.274 CCCCOCCCNCCCCSC(=O)C 34a_200000211371_200010402107 [0,2,0,0,0,0|2,0,0]=4 13829 B16R0.274 CCCCOCCCOCCCCCC(=O)N 34a_200011215613_100009817443 [0,2,0,0,0,0|1,0,0]=3 13830 B16R0.274 CCCCOCCCOCCCCCC(=O)N 7a_200011215613_100009817443 [0,2,0,0,0,0|1,0,0]=3 13831 B16R0.274 CCCCOCCCOCCCCOC(=O)C 34a_200011215613_100000033659 [0,2,0,0,0,0|2,0,0]=4 13832 B16R0.274 CCCCOCCCOCCCCOC(=O)C 7a_200011215613_100000033659 [0,2,0,0,0,0|2,0,0]=4 13833 B16R0.274 CCCCOCCCOCCCCSC(=O)C 34a_200011215613_200010402107 [0,2,0,0,0,0|2,0,0]=4 13834 B16R0.274 CCCCOCCCOCCCCSC(=O)C 7a_200011215613_200010402107 [0,2,0,0,0,0|2,0,0]=4 13835 B16R0.274 CCCCOCCNCCCCCNC(=O)C 2230a_200012022750_100000743108 [0,2,0,0,0,0|2,0,0]=4 13836 B16R0.274 CCCCOCCNCCCCCNC(=O)C 34a_200012022750_100000743108 [0,2,0,0,0,0|2,0,0]=4 13837 B16R0.274 CCCCOCCOCCCCCOC(=O)C 34a_100000210238_100000033007 [0,2,0,0,0,0|2,0,0]=4 13838 B16R0.274 CCCCOCCOCCCCCOC(=O)C 7a_100000210238_100000033007 [0,2,0,0,0,0|2,0,0]=4 13839 B16R0.274 CCCCOCCOCCOCCCC(=O)C 34a_100011215186_100000685027 [0,2,0,0,0,0|2,0,0]=4 13840 B16R0.274 CCCCOCCOCCOCCCC(=O)C 7a_100011215186_100011215641 [0,2,0,0,0,0|2,0,0]=4 13841 B16R0.274 CCCCOCCOCCOCCCC(=O)N 34a_100011215186_100102525003 [0,2,0,0,0,0|2,0,0]=4 13842 B16R0.274 CCCCOCCOCCOCCCC(=O)N 7a_100011215186_100102525003 [0,2,0,0,0,0|2,0,0]=4 13843 B16R0.274 CCCCOCCSCCCCCOC(=O)C 62a_100000033007_100000743108 [0,2,0,0,0,0|2,0,0]=4 13844 B16R0.274 CCCCOCCSCCCCCOC(=O)C 62a_100000743108_100000033007 [0,2,0,0,0,0|2,0,0]=4 13845 B16R0.274 CCCCOCNCCCCCCNC(=O)C 2230a_200011996284_100011995733 [0,2,0,0,0,0|2,0,0]=4 13846 B16R0.274 CCCCOCNCCCCCCNC(=O)C 34a_200011996284_100011995733 [0,2,0,0,0,0|2,0,0]=4 13847 B16R0.274 CCCCSCCNCCCCCOC(=O)C 2230a_100025743550_100009813381 [0,2,0,0,0,0|2,0,0]=4 13848 B16R0.274 CCCCSCCOCCCCCOC(=O)C 34a_200000230436_100000033007 [0,2,0,0,0,0|2,0,0]=4 13849 B16R0.274 CCCCSCCOCCCCCOC(=O)C 7a_200000230436_100000033007 [0,2,0,0,0,0|2,0,0]=4 13850 B16R0.274 CCCOCCCCCCCCCCC(=O)N 34a_100000210258_200010167045 [0,2,0,0,0,0|0,0,0]=2 13851 B16R0.274 CCCOCCCNCCCCCOC(=O)C 2230a_100011217757_100009813381 [0,2,0,0,0,0|2,0,0]=4 13852 B16R0.274 CCCOCCCNCCCCCOC(=O)C 34a_100011217757_100000033007 [0,2,0,0,0,0|2,0,0]=4 13853 B16R0.274 CCCOCCNCCCCCCNC(=O)C 2230a_200011996284_100011215938 [0,2,0,0,0,0|2,0,0]=4 13854 B16R0.274 CCCOCCNCCCCCCNC(=O)C 34a_200011996284_100011215938 [0,2,0,0,0,0|2,0,0]=4 13855 B16R0.274 CCCOCCOCCNCCCCC(=O)C 34a_200011904461_100009817362 [0,2,0,0,0,0|2,0,0]=4 13856 B16R0.274 CCCSCCCCCCCCCCC(=O)N 62a_100000210303_200010167045 [0,2,0,0,0,0|0,0,0]=2 13857 B16R0.274 CCCSCCCCCCCCCCC(=O)N 62a_200010167045_100000210303 [0,2,0,0,0,0|0,0,0]=2 13858 B16R0.274 CCOCCCCCCCCCOCC(=O)N 34a_100009875440_100000187820 [0,2,0,0,0,0|1,0,0]=3 13859 B16R0.274 CCOCCCCCCCCCOCC(=O)N 7a_100009875440_100000187820 [0,2,0,0,0,0|1,0,0]=3 13860 B16R0.274 CCOCCCCCCCCCOCC(=O)[O-] 34a_100009875440_100020667443 [0,2,0,0,0,0|1,0,0]=3 13861 B16R0.274 CCOCCCCCCCCCOC[N+](=O)[O-] 34a_100009875440_100000761209 [0,2,0,0,0,0|2,0,0]=4 13862 B16R0.274 CCOCCCNCCCCCCNC(=O)C 2230a_200011996284_100012232248 [0,2,0,0,0,0|2,0,0]=4 13863 B16R0.274 CCOCCCNCCCCCCNC(=O)C 34a_200011996284_100012232248 [0,2,0,0,0,0|2,0,0]=4 13864 B16R0.274 CCOCCOCCNCCCCCC(=O)N 2230a_100102712874_100009817443 [0,2,0,0,0,0|2,0,0]=4 13865 B16R0.274 CCOCCOCCNCCCCCC(=O)N 34a_100102712874_100009817443 [0,2,0,0,0,0|2,0,0]=4 13866 B16R0.274 CCOCCOCCOCCCCCC(=O)N 34a_100000123541_100011211534 [0,2,0,0,0,0|2,0,0]=4 13867 B16R0.274 CCOCCOCCOCCCCCC(=O)N 34a_100000210240_100009817443 [0,2,0,0,0,0|2,0,0]=4 13868 B16R0.274 CCOCCOCCOCCCCCC(=O)N 7a_100000123541_100011211534 [0,2,0,0,0,0|2,0,0]=4 13869 B16R0.274 CCOCCOCCOCCCCCC(=O)N 7a_100000210240_100009817443 [0,2,0,0,0,0|2,0,0]=4 13870 B16R0.274 CCOCCOCCOCCCCCC(=O)[O-] 7a_100102619762_100011211534 [0,2,0,0,0,0|2,0,0]=4 13871 B16R0.274 CCOCCOCCSCCCCCC(=O)N 62a_100009817443_100011211534 [0,2,0,0,0,0|2,0,0]=4 13872 B16R0.274 CCOCCOCCSCCCCCC(=O)N 62a_100011211534_100009817443 [0,2,0,0,0,0|2,0,0]=4 13873 B16R0.274 CN(C)CCCCCCCCCCCCCO 2230a_100102631434_100009812470 [0,2,0,0,0,0|0,0,2]=4 13874 B16R0.274 CN(C)CCCCCCCCCCCCCO 269982a_100102631434_100009812470 [0,2,0,0,0,0|0,0,2]=4 13875 B16R0.274 CNCCCCCCCCCCCSC(=O)C 2230a_106832991635_100010140907 [0,2,0,0,0,0|1,0,0]=3 13876 B16R0.274 CNCCCCCCCCCCCSC(=O)C 34a_100102657272_100010140907 [0,2,0,0,0,0|1,0,0]=3 13877 B16R0.274 CNCCCCCCCCCCCSC(=O)C 7a_106832991635_100010140907 [0,2,0,0,0,0|1,0,0]=3 13878 B16R0.274 CNCCCCCOCCCCCOC(=O)C 34a_100000722520_100000033007 [0,2,0,0,0,0|2,0,0]=4 13879 B16R0.274 COCCCCCCCCCCCSC(=O)C 34a_100138415774_100010140907 [0,2,0,0,0,0|1,0,0]=3 13880 B16R0.274 COCCCCCCNCCCCCC(C)C 2230a_100011290863_100011998445 [0,2,0,0,0,0|2,0,0]=4 13881 B16R0.274 COCCCCCCNCCCCCC(C)C 34a_100011290863_100011998445 [0,2,0,0,0,0|2,0,0]=4 13882 B16R0.274 COCCCCCCNCCCCNC(=O)C 2230a_200011368371_100011998445 [0,2,0,0,0,0|2,0,0]=4 13883 B16R0.274 COCCCCCCNCCCCNC(=O)C 34a_200011368371_100011998445 [0,2,0,0,0,0|2,0,0]=4 13884 B16R0.274 COCCCCCCOCCCCCC(=O)N 34a_100000123541_100011998445 [0,2,0,0,0,0|1,0,0]=3 13885 B16R0.274 COCCCCCCOCCCCCC(=O)N 34a_200012092642_100009817443 [0,2,0,0,0,0|1,0,0]=3 13886 B16R0.274 COCCCCCCOCCCCCC(=O)N 7a_100000123541_100011998445 [0,2,0,0,0,0|1,0,0]=3 13887 B16R0.274 COCCCCCCOCCCCCC(=O)N 7a_200012092642_100009817443 [0,2,0,0,0,0|1,0,0]=3 13888 B16R0.274 COCCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100011998445 [0,2,0,0,0,0|1,0,0]=3 13889 B16R0.274 COCCCCCCOCCCCCC(C)C 34a_100011995859_100011998445 [0,2,0,0,0,0|2,0,0]=4 13890 B16R0.274 COCCCCCCOCCCCCC(C)C 34a_200012092642_100000210682 [0,2,0,0,0,0|2,0,0]=4 13891 B16R0.274 COCCCCCCOCCCCCC(C)C 7a_100011995859_100011998445 [0,2,0,0,0,0|2,0,0]=4 13892 B16R0.274 COCCCCCCOCCCCCC(C)C 7a_200012092642_100000210682 [0,2,0,0,0,0|2,0,0]=4 13893 B16R0.274 COCCCCCCOCCCCOC(=O)C 34a_100000073216_100011998445 [0,2,0,0,0,0|2,0,0]=4 13894 B16R0.274 COCCCCCCOCCCCOC(=O)C 34a_200012092642_100000033659 [0,2,0,0,0,0|2,0,0]=4 13895 B16R0.274 COCCCCCCOCCCCOC(=O)C 7a_100000073216_100011998445 [0,2,0,0,0,0|2,0,0]=4 13896 B16R0.274 COCCCCCCOCCCCOC(=O)C 7a_200012092642_100000033659 [0,2,0,0,0,0|2,0,0]=4 13897 B16R0.274 COCCCCCCOCCCCSC(=O)C 34a_200012092642_200010402107 [0,2,0,0,0,0|2,0,0]=4 13898 B16R0.274 COCCCCCCOCCCCSC(=O)C 7a_200012092642_200010402107 [0,2,0,0,0,0|2,0,0]=4 13899 B16R0.274 COCCCCCCSCCCCCC(=O)N 62a_100009817443_100011998445 [0,2,0,0,0,0|1,0,0]=3 13900 B16R0.274 COCCCCCCSCCCCCC(=O)N 62a_100011998445_100009817443 [0,2,0,0,0,0|1,0,0]=3 13901 B16R0.274 COCCCCCCSCCCCCC(C)C 62a_100000210682_100011998445 [0,2,0,0,0,0|2,0,0]=4 13902 B16R0.274 COCCCCCCSCCCCCC(C)C 62a_100011998445_100000210682 [0,2,0,0,0,0|2,0,0]=4 13903 B16R0.274 COCCCCCCSCCCCOC(=O)C 62a_100000033659_100011998445 [0,2,0,0,0,0|2,0,0]=4 13904 B16R0.274 COCCCCCCSCCCCOC(=O)C 62a_100011998445_100000033659 [0,2,0,0,0,0|2,0,0]=4 13905 B16R0.274 COCCCCCCSCCCCSC(=O)C 62a_100011998445_200010402107 [0,2,0,0,0,0|2,0,0]=4 13906 B16R0.274 COCCCCCCSCCCCSC(=O)C 62a_200010402107_100011998445 [0,2,0,0,0,0|2,0,0]=4 13907 B16R0.274 COCCCCCNCCCCCOC(=O)C 2230a_100000747528_100009813381 [0,2,0,0,0,0|2,0,0]=4 13908 B16R0.274 COCCCCCNCCCCCOC(=O)C 34a_100000747528_100000033007 [0,2,0,0,0,0|2,0,0]=4 13909 B16R0.274 COCCCCNCCCCCCNC(=O)C 2230a_200011996284_100000730899 [0,2,0,0,0,0|2,0,0]=4 13910 B16R0.274 COCCCCNCCCCCCNC(=O)C 34a_200011996284_100000755781 [0,2,0,0,0,0|2,0,0]=4 13911 B16R0.274 COCCCCOCCCCCCCC(C)C 34a_200000210741_100000755781 [0,2,0,0,0,0|2,0,0]=4 13912 B16R0.274 COCCCCOCCCCCCCC(C)C 7a_200000210741_100000730899 [0,2,0,0,0,0|2,0,0]=4 13913 B16R0.274 COCCCOCCCOCCCCC(=O)C 34a_200011215475_100009817362 [0,2,0,0,0,0|2,0,0]=4 13914 B16R0.274 COCCCOCCCOCCCCC(=O)C 7a_200011215475_100000735457 [0,2,0,0,0,0|2,0,0]=4 13915 B16R0.274 COCCOCCCNCCCCCC(=O)N 2230a_100000206027_100009817443 [0,2,0,0,0,0|2,0,0]=4 13916 B16R0.274 COCCOCCCNCCCCCC(=O)N 34a_100000206027_100009817443 [0,2,0,0,0,0|2,0,0]=4 13917 B16R0.274 COCCOCCCOCCCCCC(=O)N 34a_100000123541_100011216529 [0,2,0,0,0,0|2,0,0]=4 13918 B16R0.274 COCCOCCCOCCCCCC(=O)N 7a_100000123541_100011216529 [0,2,0,0,0,0|2,0,0]=4 13919 B16R0.274 COCCOCCCOCCCCCC(=O)[O-] 7a_100102619762_100011216529 [0,2,0,0,0,0|2,0,0]=4 13920 B16R0.274 COCCOCCCSCCCCCC(=O)N 62a_100009817443_100011216529 [0,2,0,0,0,0|2,0,0]=4 13921 B16R0.274 COCCOCCCSCCCCCC(=O)N 62a_100011216529_100009817443 [0,2,0,0,0,0|2,0,0]=4 13922 B16R0.274 COCSCCCCCCCCCCC(=O)N 62a_100000766300_200010167045 [0,2,0,0,0,0|1,0,0]=3 13923 B16R0.274 COCSCCCCCCCCCCC(=O)N 62a_200010167045_100000766300 [0,2,0,0,0,0|1,0,0]=3 13924 B16R0.274 CS(=O)CCCNCCCCCCCCCO 2230a_200000753449_100009813782 [0,2,0,0,0,0|2,0,0]=4 13925 B16R0.274 CSCCCCCCCCCCCSC(=O)C 62a_100010140907_200000210301 [0,2,0,0,0,0|1,0,0]=3 13926 B16R0.274 CSCCCCCCCCCCCSC(=O)C 62a_200000210301_100010140907 [0,2,0,0,0,0|1,0,0]=3 13927 B16R0.274 CSCSCCCCCCCCCCC(=O)N 62a_100011218213_200010167045 [0,2,0,0,0,0|1,0,0]=3 13928 B16R0.274 CSCSCCCCCCCCCCC(=O)N 62a_200010167045_100011218213 [0,2,0,0,0,0|1,0,0]=3 13929 B16R0.274 C[C@@H](Cl)COCCCCCCCCCCCO 34a_100016084084_100009812471 [0,2,0,0,0,0|0,0,2]=4 13930 B16R0.274 C[C@@H](N)CCOCCCCCCCCCCO 34a_100000706166_100009813290 [0,2,0,0,0,0|0,0,2]=4 13931 B16R0.274 C[C@@H](N)COCCCCCCCCCCCO 34a_100000737577_100009812471 [0,2,0,0,0,0|0,0,2]=4 13932 B16R0.274 C[C@@H](O)COCCCCCCCCCCCBr 34a_100009812471_100009817552 [0,2,0,0,0,0|1,0,1]=4 13933 B16R0.274 C[C@@H](O)COCCCCCCCCCCCBr 7a_100009812471_100009817552 [0,2,0,0,0,0|1,0,1]=4 13934 B16R0.274 C[C@@H](O)CSCCCCCCCCCCCO 62a_100009812471_100009817552 [0,2,0,0,0,0|0,0,2]=4 13935 B16R0.274 N#CCCCCCCOCCCCCC(=O)N 7a_100000123541_100009813337 [0,2,0,0,0,0|1,0,1]=4 13936 B16R0.274 N#CCCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100009813337 [0,2,0,0,0,0|1,0,1]=4 13937 B16R0.274 N#CCCCCCCSCCCCCC(=O)N 62a_100009813337_100009817443 [0,2,0,0,0,0|1,0,1]=4 13938 B16R0.274 N#CCCCCCCSCCCCCC(=O)N 62a_100009817443_100009813337 [0,2,0,0,0,0|1,0,1]=4 13939 B16R0.274 N#CCSCCCCCCCCCCC(=O)N 62a_100011215382_200010167045 [0,2,0,0,0,0|1,0,1]=4 13940 B16R0.274 N#CCSCCCCCCCCCCC(=O)N 62a_200010167045_100011215382 [0,2,0,0,0,0|1,0,1]=4 13941 B16R0.274 NC(=O)CCCCCCCCCCNCCF 34a_100000724931_200010167045 [0,2,0,0,0,0|1,0,0]=3 13942 B16R0.274 NC(=O)CCCCCCCCCCNCCO 2230a_100016997473_200010167045 [0,2,0,0,0,0|1,0,0]=3 13943 B16R0.274 NC(=O)CCCCCCCCCCNCCO 34a_100016990907_200010167045 [0,2,0,0,0,0|1,0,0]=3 13944 B16R0.274 NC(=O)CCCCCCCCCCOCCBr 34a_100000211926_200010167045 [0,2,0,0,0,0|1,0,0]=3 13945 B16R0.274 NC(=O)CCCCCCCCCCSCC=O 62a_200010167045_200015260668 [0,2,0,0,0,0|1,0,1]=4 13946 B16R0.274 NC(=O)CCCCCCCCCCSCC=O 62a_200015260668_200010167045 [0,2,0,0,0,0|1,0,1]=4 13947 B16R0.274 NC(=O)CCCCCCCCCCSCCF 62a_100011217306_200010167045 [0,2,0,0,0,0|1,0,0]=3 13948 B16R0.274 NC(=O)CCCCCCCCCCSCCF 62a_200010167045_100011217306 [0,2,0,0,0,0|1,0,0]=3 13949 B16R0.274 NC(=O)CCCCCCCCCCSCCO 62a_100000211926_200010167045 [0,2,0,0,0,0|1,0,0]=3 13950 B16R0.274 NC(=O)CCCCCCCCCCSCCO 62a_200010167045_100000211926 [0,2,0,0,0,0|1,0,0]=3 13951 B16R0.274 NC(=O)CCCCCNCCCCCCCO 2230a_100011996573_100009817443 [0,2,0,0,0,0|1,0,0]=3 13952 B16R0.274 NC(=O)CCCCCNCCCCCCCO 34a_100011996573_100009817443 [0,2,0,0,0,0|1,0,0]=3 13953 B16R0.274 NC(=O)CCCCCNCCCOCCCO 2230a_100011310245_100009817443 [0,2,0,0,0,0|2,0,0]=4 13954 B16R0.274 NC(=O)CCCCCNCCCOCCCO 34a_100011310245_100009817443 [0,2,0,0,0,0|2,0,0]=4 13955 B16R0.274 NC(=O)CCCCCOCCCCCCCBr 34a_100000760002_100009817443 [0,2,0,0,0,0|1,0,0]=3 13956 B16R0.274 NC(=O)CCCCCOCCCCCCCBr 7a_100000760002_100009817443 [0,2,0,0,0,0|1,0,0]=3 13957 B16R0.274 NC(=O)CCCCCOCCCCCCCO 34a_100000123541_100000760002 [0,2,0,0,0,0|1,0,0]=3 13958 B16R0.274 NC(=O)CCCCCOCCCCCCCO 7a_100000123541_100000760002 [0,2,0,0,0,0|1,0,0]=3 13959 B16R0.274 NC(=O)CCCCCSCCCCCCCO 62a_100000760002_100009817443 [0,2,0,0,0,0|1,0,0]=3 13960 B16R0.274 NC(=O)CCCCCSCCCCCCCO 62a_100009817443_100000760002 [0,2,0,0,0,0|1,0,0]=3 13961 B16R0.274 NC(=O)CCCCNCCCCCCCCO 34a_100000696515_100000033203 [0,2,0,0,0,0|1,0,0]=3 13962 B16R0.274 NC(=O)CCCCOCCCCCCCCO 34a_100012022536_100000033203 [0,2,0,0,0,0|1,0,0]=3 13963 B16R0.274 NC(=O)CCCCOCCCCCCCCO 7a_100012022536_100000033203 [0,2,0,0,0,0|1,0,0]=3 13964 B16R0.274 NC(=O)CCCNCCCCCCCCCO 34a_100000078944_100102525003 [0,2,0,0,0,0|1,0,0]=3 13965 B16R0.274 NC(=O)CCCNCCCCCCCCCO 34a_100000739312_100009813782 [0,2,0,0,0,0|1,0,0]=3 13966 B16R0.274 NC(=O)CCCOCCCCCCCCCBr 34a_100009813782_100102525003 [0,2,0,0,0,0|1,0,0]=3 13967 B16R0.274 NC(=O)CCCOCCCCCCCCCBr 7a_100009813782_100102525003 [0,2,0,0,0,0|1,0,0]=3 13968 B16R0.274 NC(=O)CCCOCCCCCCCCCCl 34a_100009868337_100102525003 [0,2,0,0,0,0|1,0,0]=3 13969 B16R0.274 NC(=O)CCCOCCCCCCCCCCl 7a_100009868337_100102525003 [0,2,0,0,0,0|1,0,0]=3 13970 B16R0.274 NC(=O)CCCSCCCCCCCCCO 62a_100009813782_100102525003 [0,2,0,0,0,0|1,0,0]=3 13971 B16R0.274 NC(=O)CCCSCCCCCCCCCO 62a_100102525003_100009813782 [0,2,0,0,0,0|1,0,0]=3 13972 B16R0.274 NC(=O)CCNCCCCCCCCCCO 2230a_100000066964_100000744528 [0,2,0,0,0,0|1,0,0]=3 13973 B16R0.274 NC(=O)CCNCCCCCCCCCCO 34a_100000066964_100000731001 [0,2,0,0,0,0|1,0,0]=3 13974 B16R0.274 NC(=O)CCOCCCCCCCCCCBr 34a_100009813290_100000731001 [0,2,0,0,0,0|1,0,0]=3 13975 B16R0.274 NC(=O)CCOCCCCCCCCCCBr 7a_100009813290_100000744528 [0,2,0,0,0,0|1,0,0]=3 13976 B16R0.274 NC(=O)CCOCCCCCCCCCCCl 34a_200000033068_100000731001 [0,2,0,0,0,0|1,0,0]=3 13977 B16R0.274 NC(=O)CCOCCCCCCCCCCCl 7a_200000033068_100000744528 [0,2,0,0,0,0|1,0,0]=3 13978 B16R0.274 NC(=O)CCOCCCCCCCCCCO 34a_100000757172_100009813290 [0,2,0,0,0,0|1,0,0]=3 13979 B16R0.274 NC(=O)CCOCCCCCCCCCCO 7a_100000757172_100009813290 [0,2,0,0,0,0|1,0,0]=3 13980 B16R0.274 NC(=O)CCSCCCCCCCCCCO 62a_100000744528_200000033068 [0,2,0,0,0,0|1,0,0]=3 13981 B16R0.274 NC(=O)CCSCCCCCCCCCCO 62a_100009813290_100000744528 [0,2,0,0,0,0|1,0,0]=3 13982 B16R0.274 NC(=O)CNCCCCCCCCCCCO 2230a_100000711301_100009812471 [0,2,0,0,0,0|1,0,0]=3 13983 B16R0.274 NC(=O)COCCCCCCCCCCCBr 34a_100009812471_100000187820 [0,2,0,0,0,0|1,0,0]=3 13984 B16R0.274 NC(=O)COCCCCCCCCCCCBr 7a_100009812471_100000187820 [0,2,0,0,0,0|1,0,0]=3 13985 B16R0.274 NC(=O)COCCNCCCCCCCCO 2230a_102515433106_100000076697 [0,2,0,0,0,0|2,0,0]=4 13986 B16R0.274 NC(=O)COCCNCCCCCCCCO 34a_102515433106_100000076697 [0,2,0,0,0,0|2,0,0]=4 13987 B16R0.274 NC(=O)COCCOCCCCCCCCBr 34a_100009813846_100000076697 [0,2,0,0,0,0|2,0,0]=4 13988 B16R0.274 NC(=O)COCCOCCCCCCCCBr 7a_100009813846_100000076697 [0,2,0,0,0,0|2,0,0]=4 13989 B16R0.274 NC(=O)COCCOCCCCCCCCCl 34a_100000033203_100000076697 [0,2,0,0,0,0|2,0,0]=4 13990 B16R0.274 NC(=O)COCCOCCCCCCCCCl 7a_100000033203_100000076697 [0,2,0,0,0,0|2,0,0]=4 13991 B16R0.274 NC(=O)COCCSCCCCCCCCO 62a_100000033203_100000076697 [0,2,0,0,0,0|2,0,0]=4 13992 B16R0.274 NC(=O)COCCSCCCCCCCCO 62a_100000076697_100000033203 [0,2,0,0,0,0|2,0,0]=4 13993 B16R0.274 NC(=O)CSCCCCCCCCCCCO 62a_100009812471_100000747473 [0,2,0,0,0,0|1,0,0]=3 13994 B16R0.274 NC(=O)NCCNCCCCCCCCCO 2230a_100000078944_200000034859 [0,2,0,0,0,0|2,0,0]=4 13995 B16R0.274 NC(=O)NCCNCCCCCCCCCO 34a_100020590234_100009813782 [0,2,0,0,0,0|2,0,0]=4 13996 B16R0.274 NC(=O)NCCOCCCCCCCCCBr 7a_100009813782_200000034859 [0,2,0,0,0,0|2,0,0]=4 13997 B16R0.274 NC(=O)NCCOCCCCCCCCCCl 7a_100009868337_200000034859 [0,2,0,0,0,0|2,0,0]=4 13998 B16R0.274 NC(=O)NCCOCCCCCCCCCO 34a_100000181757_100009813782 [0,2,0,0,0,0|2,0,0]=4 13999 B16R0.274 NC(=O)NCCSCCCCCCCCCO 62a_100009813782_200000034859 [0,2,0,0,0,0|2,0,0]=4 14000 B16R0.274 NC(=O)NCCSCCCCCCCCCO 62a_200000034859_100009813782 [0,2,0,0,0,0|2,0,0]=4 14001 B16R0.274 NC(=O)OCCNCCCCCCCCCO 34a_100000078944_200011214921 [0,2,0,0,0,0|2,0,0]=4 14002 B16R0.274 NC(=O)OCCOCCCCCCCCCBr 34a_100009813782_200011214921 [0,2,0,0,0,0|2,0,0]=4 14003 B16R0.274 NC(=O)OCCOCCCCCCCCCBr 7a_100009813782_200011214921 [0,2,0,0,0,0|2,0,0]=4 14004 B16R0.274 NC(=O)OCCOCCCCCCCCCCl 34a_100009868337_200011214921 [0,2,0,0,0,0|2,0,0]=4 14005 B16R0.274 NC(=O)OCCOCCCCCCCCCCl 7a_100009868337_200011214921 [0,2,0,0,0,0|2,0,0]=4 14006 B16R0.274 NC(=O)OCCOCCCCCCCCCO 7a_100000766696_100009813782 [0,2,0,0,0,0|2,0,0]=4 14007 B16R0.274 NC(=O)OCCSCCCCCCCCCO 62a_100009813782_200011214921 [0,2,0,0,0,0|2,0,0]=4 14008 B16R0.274 NC(=O)OCCSCCCCCCCCCO 62a_200011214921_100009813782 [0,2,0,0,0,0|2,0,0]=4 14009 B16R0.274 NCCCCCCCCCCOCCC(=O)N 34a_100000066964_100000731001 [0,2,0,0,0,0|1,0,0]=3 14010 B16R0.274 NCCCCCCCCCOCCCC(=O)N 34a_100000078944_100102525003 [0,2,0,0,0,0|1,0,0]=3 14011 B16R0.274 NCCCCCCCCCOCCOC(=O)N 34a_100000078944_200011214921 [0,2,0,0,0,0|2,0,0]=4 14012 B16R0.274 NCCCCCCCCOCCOCC(=O)N 34a_102515433106_100000076697 [0,2,0,0,0,0|2,0,0]=4 14013 B16R0.274 NCCCCCCCOCCCCCC(=O)N 34a_100011996573_100009817443 [0,2,0,0,0,0|1,0,0]=3 14014 B16R0.274 NCCCOCCCOCCCCCC(=O)N 34a_100011310245_100009817443 [0,2,0,0,0,0|2,0,0]=4 14015 B16R0.274 NCCOCCCCCCCCCCC(=O)N 34a_100000210304_200010167045 [0,2,0,0,0,0|1,0,0]=3 14016 B16R0.274 O=C(O)CNCCCCCCCCCCCO 269956a_100016091260_100009812471 [0,2,0,0,0,0|1,0,0]=3 14017 B16R0.274 O=C(O)COCCNCCCCCCCCO 269956a_100000700818_100000033203 [0,2,0,0,0,0|2,0,0]=4 14018 B16R0.274 O=C(O)CONCCCCCCCCCCO 269956a_100000106656_100009813290 [0,2,0,0,0,0|2,0,0]=4 14019 B16R0.274 O=C([O-])CCCCCOCCCCCCCO 7a_100102619762_100000760002 [0,2,0,0,0,0|1,0,0]=3 14020 B16R0.274 O=C([O-])COCCCCCCCCCCCBr 34a_100009812471_100020667443 [0,2,0,0,0,0|1,0,0]=3 14021 B16R0.274 O=C([O-])CSCCCCCCCCCCCO 62a_100009812471_100020667443 [0,2,0,0,0,0|1,0,0]=3 14022 B16R0.274 O=CCCCCCSCCCCCCB(O)O 62a_100000139337_100009817187 [0,2,0,0,0,0|2,0,0]=4 14023 B16R0.274 O=CCCCCCSCCCCCCB(O)O 62a_100009817187_100000139337 [0,2,0,0,0,0|2,0,0]=4 14024 B16R0.274 O=[N+]([O-])CCCCOCCCCCCCCO 34a_200015379883_100000033203 [0,2,0,0,0,0|2,0,0]=4 14025 B16R0.274 O=[N+]([O-])CCCCOCCCCCCCCO 7a_200015379883_100000033203 [0,2,0,0,0,0|2,0,0]=4 14026 B16R0.274 O=[N+]([O-])CCCOCCCCCCCCCO 34a_200000037920_100009813782 [0,2,0,0,0,0|2,0,0]=4 14027 B16R0.274 O=[N+]([O-])COCCCCCCCCCCCBr 34a_100009812471_100000761209 [0,2,0,0,0,0|2,0,0]=4 14028 B16R0.274 O=[N+]([O-])CSCCCCCCCCCCCO 62a_100009812471_100000761209 [0,2,0,0,0,0|2,0,0]=4 14029 B16R0.303 C#CCCCCCCCCCCOCCC=C 34a_100000054667_100000754431 [0,2,0,0,0,0|1,0,1]=4 14030 B16R0.303 C#CCCCCCCCCCCOCCC=C 7a_100000054667_100000754431 [0,2,0,0,0,0|1,0,1]=4 14031 B16R0.303 C#CCCCCCCCCCCOCCCC 34a_100000054667_100000210210 [0,2,0,0,0,0|1,0,1]=4 14032 B16R0.303 C#CCCCCCCCCCCOCCCC 7a_100000054667_100000210211 [0,2,0,0,0,0|1,0,1]=4 14033 B16R0.303 C#CCCCCCCCCCCOCCCF 34a_100000054667_100011934791 [0,2,0,0,0,0|1,0,1]=4 14034 B16R0.303 C#CCCCCCCCCCCOCCCF 7a_100000054667_100011934791 [0,2,0,0,0,0|1,0,1]=4 14035 B16R0.303 C#CCCCCCCCCCCOCCCO 34a_100000054667_100000230001 [0,2,0,0,0,0|1,0,1]=4 14036 B16R0.303 C#CCCCCCCCCCCOCCCO 7a_100000054667_100011215043 [0,2,0,0,0,0|1,0,1]=4 14037 B16R0.303 C#CCCCCCCCCCCOCCOC 34a_100000054667_100011201679 [0,2,0,0,0,0|1,0,1]=4 14038 B16R0.303 C#CCCCCCCCCCCOCCOC 7a_100000054667_100000233755 [0,2,0,0,0,0|1,0,1]=4 14039 B16R0.303 C#CCCCCCCCCCCOCCSC 34a_100000054667_100000212216 [0,2,0,0,0,0|1,0,1]=4 14040 B16R0.303 C#CCCCCCCCCCCOCCSC 7a_100000054667_100000212216 [0,2,0,0,0,0|1,0,1]=4 14041 B16R0.303 C#CCCCCCCCCCOCCCC=C 34a_100000034437_100000757094 [0,2,0,0,0,0|1,0,1]=4 14042 B16R0.303 C#CCCCCCCCCCOCCCC=C 7a_100000034437_100000757094 [0,2,0,0,0,0|1,0,1]=4 14043 B16R0.303 C#CCCCCCCCCCOCCCC=O 7a_100000034437_200011292268 [0,2,0,0,0,0|0,0,1]=3 14044 B16R0.303 C#CCCCCCCCCCOCCCCC 34a_100000034437_100000718602 [0,2,0,0,0,0|1,0,1]=4 14045 B16R0.303 C#CCCCCCCCCCOCCCCC 7a_100000034437_100000210326 [0,2,0,0,0,0|1,0,1]=4 14046 B16R0.303 C#CCCCCCCCCCOCCCCF 34a_100000034437_100000729493 [0,2,0,0,0,0|1,0,1]=4 14047 B16R0.303 C#CCCCCCCCCCOCCCCF 7a_100000034437_100000729493 [0,2,0,0,0,0|1,0,1]=4 14048 B16R0.303 C#CCCCCCCCCCOCCCCO 34a_100000034437_100011216708 [0,2,0,0,0,0|1,0,1]=4 14049 B16R0.303 C#CCCCCCCCCCOCCCCO 7a_100000034437_100000210776 [0,2,0,0,0,0|1,0,1]=4 14050 B16R0.303 C#CCCCCCCCCCOCCCOC 34a_100000034437_100000740836 [0,2,0,0,0,0|1,0,1]=4 14051 B16R0.303 C#CCCCCCCCCCOCCCOC 7a_100000034437_100000740836 [0,2,0,0,0,0|1,0,1]=4 14052 B16R0.303 C#CCCCCCCCCCOCCOCC 34a_100000034437_100000210147 [0,2,0,0,0,0|1,0,1]=4 14053 B16R0.303 C#CCCCCCCCCCOCCOCC 7a_100000034437_100011215890 [0,2,0,0,0,0|1,0,1]=4 14054 B16R0.303 C#CCCCCCCCCCOCCSCC 34a_100000034437_100000757381 [0,2,0,0,0,0|1,0,1]=4 14055 B16R0.303 C#CCCCCCCCCCOCCSCC 7a_100000034437_100000757381 [0,2,0,0,0,0|1,0,1]=4 14056 B16R0.303 C#CCCCCCCCCOCCCCC=C 34a_100000065265_100011215482 [0,2,0,0,0,0|1,0,1]=4 14057 B16R0.303 C#CCCCCCCCCOCCCCC=C 7a_100000065265_100011215482 [0,2,0,0,0,0|1,0,1]=4 14058 B16R0.303 C#CCCCCCCCCOCCCCC=O 7a_100000065265_100000139335 [0,2,0,0,0,0|0,0,1]=3 14059 B16R0.303 C#CCCCCCCCCOCCCCCC 34a_100000065265_100000210314 [0,2,0,0,0,0|1,0,1]=4 14060 B16R0.303 C#CCCCCCCCCOCCCCCC 7a_100000065265_100000210314 [0,2,0,0,0,0|1,0,1]=4 14061 B16R0.303 C#CCCCCCCCCOCCCCCF 34a_100000065265_100000729378 [0,2,0,0,0,0|1,0,1]=4 14062 B16R0.303 C#CCCCCCCCCOCCCCCF 7a_100000065265_100000729378 [0,2,0,0,0,0|1,0,1]=4 14063 B16R0.303 C#CCCCCCCCCOCCCCCO 34a_100000065265_100000746330 [0,2,0,0,0,0|1,0,1]=4 14064 B16R0.303 C#CCCCCCCCCOCCCCCO 7a_100000065265_100000746330 [0,2,0,0,0,0|1,0,1]=4 14065 B16R0.303 C#CCCCCCCCCOCCCCOC 34a_100000065265_100000755781 [0,2,0,0,0,0|1,0,1]=4 14066 B16R0.303 C#CCCCCCCCCOCCCCOC 7a_100000065265_100000730899 [0,2,0,0,0,0|1,0,1]=4 14067 B16R0.303 C#CCCCCCCCCOCCCOCC 34a_100000065265_100012232248 [0,2,0,0,0,0|1,0,1]=4 14068 B16R0.303 C#CCCCCCCCCOCCCOCC 7a_100000065265_100012232248 [0,2,0,0,0,0|1,0,1]=4 14069 B16R0.303 C#CCCCCCCCCOCCOCCC 34a_100000065265_100011215938 [0,2,0,0,0,0|1,0,1]=4 14070 B16R0.303 C#CCCCCCCCCOCCOCCC 7a_100000065265_100011215938 [0,2,0,0,0,0|1,0,1]=4 14071 B16R0.303 C#CCCCCCCCCOCOCCCC 34a_100000065265_100011995733 [0,2,0,0,0,0|1,0,1]=4 14072 B16R0.303 C#CCCCCCCCNCCCCCCC 2230a_100000229938_100153394163 [0,2,0,0,0,0|1,0,1]=4 14073 B16R0.303 C#CCCCCCCCNCCCCCCO 2230a_100000686447_100153394163 [0,2,0,0,0,0|1,0,1]=4 14074 B16R0.303 C#CCCCCCCCNCCCCCCO 34a_100000686447_100153394163 [0,2,0,0,0,0|1,0,1]=4 14075 B16R0.303 C#CCCCCCCCNCCCCCOC 2230a_100000747528_100153394163 [0,2,0,0,0,0|1,0,1]=4 14076 B16R0.303 C#CCCCCCCCNCCCCCOC 34a_100000747528_100153394163 [0,2,0,0,0,0|1,0,1]=4 14077 B16R0.303 C#CCCCCCCCNCCCOCCC 2230a_100011217757_100153394163 [0,2,0,0,0,0|1,0,1]=4 14078 B16R0.303 C#CCCCCCCCNCCCOCCC 34a_100011217757_100153394163 [0,2,0,0,0,0|1,0,1]=4 14079 B16R0.303 C#CCCCCCCCNCCSCCCC 2230a_100025743550_100153394163 [0,2,0,0,0,0|1,0,1]=4 14080 B16R0.303 C#CCCCCCCCOCCCCCC=C 34a_100000054614_100000700193 [0,2,0,0,0,0|1,0,1]=4 14081 B16R0.303 C#CCCCCCCCOCCCCCC=C 34a_100011216702_100153394163 [0,2,0,0,0,0|1,0,1]=4 14082 B16R0.303 C#CCCCCCCCOCCCCCC=C 7a_100000054614_100000700193 [0,2,0,0,0,0|1,0,1]=4 14083 B16R0.303 C#CCCCCCCCOCCCCCC=C 7a_100011216702_100153394163 [0,2,0,0,0,0|1,0,1]=4 14084 B16R0.303 C#CCCCCCCCOCCCCCC=O 7a_100000054614_100000139337 [0,2,0,0,0,0|0,0,1]=3 14085 B16R0.303 C#CCCCCCCCOCCCCCCBr 34a_100011215345_100153394163 [0,2,0,0,0,0|1,0,1]=4 14086 B16R0.303 C#CCCCCCCCOCCCCCCBr 7a_100011215345_100153394163 [0,2,0,0,0,0|1,0,1]=4 14087 B16R0.303 C#CCCCCCCCOCCCCCCC 34a_100000054614_100000210614 [0,2,0,0,0,0|1,0,1]=4 14088 B16R0.303 C#CCCCCCCCOCCCCCCC 34a_100000210272_100153394163 [0,2,0,0,0,0|1,0,1]=4 14089 B16R0.303 C#CCCCCCCCOCCCCCCC 7a_100000054614_100000210614 [0,2,0,0,0,0|1,0,1]=4 14090 B16R0.303 C#CCCCCCCCOCCCCCCC 7a_100000210272_100153394163 [0,2,0,0,0,0|1,0,1]=4 14091 B16R0.303 C#CCCCCCCCOCCCCCCCl 34a_100000766143_100153394163 [0,2,0,0,0,0|1,0,1]=4 14092 B16R0.303 C#CCCCCCCCOCCCCCCCl 7a_100000766143_100153394163 [0,2,0,0,0,0|1,0,1]=4 14093 B16R0.303 C#CCCCCCCCOCCCCCCF 34a_100000054614_100015922095 [0,2,0,0,0,0|1,0,1]=4 14094 B16R0.303 C#CCCCCCCCOCCCCCCF 34a_100000732779_100153394163 [0,2,0,0,0,0|1,0,1]=4 14095 B16R0.303 C#CCCCCCCCOCCCCCCF 7a_100000054614_100015922095 [0,2,0,0,0,0|1,0,1]=4 14096 B16R0.303 C#CCCCCCCCOCCCCCCF 7a_100000732779_100153394163 [0,2,0,0,0,0|1,0,1]=4 14097 B16R0.303 C#CCCCCCCCOCCCCCCN 34a_100000686447_100153394163 [0,2,0,0,0,0|1,0,1]=4 14098 B16R0.303 C#CCCCCCCCOCCCCCCO 34a_100000054614_100000766143 [0,2,0,0,0,0|1,0,1]=4 14099 B16R0.303 C#CCCCCCCCOCCCCCCO 7a_100000054614_100000766143 [0,2,0,0,0,0|1,0,1]=4 14100 B16R0.303 C#CCCCCCCCOCCCCCNC 34a_100000722520_100153394163 [0,2,0,0,0,0|1,0,1]=4 14101 B16R0.303 C#CCCCCCCCOCCOCCCC 34a_100000054614_100000743108 [0,2,0,0,0,0|1,0,1]=4 14102 B16R0.303 C#CCCCCCCCOCCOCCCC 34a_100000210238_100153394163 [0,2,0,0,0,0|1,0,1]=4 14103 B16R0.303 C#CCCCCCCCOCCOCCCC 7a_100000054614_100000743108 [0,2,0,0,0,0|1,0,1]=4 14104 B16R0.303 C#CCCCCCCCOCCOCCCC 7a_100000210238_100153394163 [0,2,0,0,0,0|1,0,1]=4 14105 B16R0.303 C#CCCCCCCCOCCSCCCC 34a_200000230436_100153394163 [0,2,0,0,0,0|1,0,1]=4 14106 B16R0.303 C#CCCCCCCCOCCSCCCC 7a_200000230436_100153394163 [0,2,0,0,0,0|1,0,1]=4 14107 B16R0.303 C#CCCCCCCCSCCCCCC=C 62a_100000700193_100153394163 [0,2,0,0,0,0|1,0,1]=4 14108 B16R0.303 C#CCCCCCCCSCCCCCC=C 62a_100153394163_100000700193 [0,2,0,0,0,0|1,0,1]=4 14109 B16R0.303 C#CCCCCCCCSCCCCCC=O 62a_100000139337_100153394163 [0,2,0,0,0,0|0,0,1]=3 14110 B16R0.303 C#CCCCCCCCSCCCCCC=O 62a_100153394163_100000139337 [0,2,0,0,0,0|0,0,1]=3 14111 B16R0.303 C#CCCCCCCCSCCCCCCC 62a_100000210614_100153394163 [0,2,0,0,0,0|1,0,1]=4 14112 B16R0.303 C#CCCCCCCCSCCCCCCC 62a_100153394163_100000210316 [0,2,0,0,0,0|1,0,1]=4 14113 B16R0.303 C#CCCCCCCCSCCCCCCF 62a_100015922095_100153394163 [0,2,0,0,0,0|1,0,1]=4 14114 B16R0.303 C#CCCCCCCCSCCCCCCF 62a_100153394163_100015922095 [0,2,0,0,0,0|1,0,1]=4 14115 B16R0.303 C#CCCCCCCCSCCCCCCO 62a_100000766143_100153394163 [0,2,0,0,0,0|1,0,1]=4 14116 B16R0.303 C#CCCCCCCCSCCCCCCO 62a_100153394163_100000766143 [0,2,0,0,0,0|1,0,1]=4 14117 B16R0.303 C#CCCCCCCCSCCOCCCC 62a_100000743108_100153394163 [0,2,0,0,0,0|1,0,1]=4 14118 B16R0.303 C#CCCCCCCCSCCOCCCC 62a_100153394163_100000743108 [0,2,0,0,0,0|1,0,1]=4 14119 B16R0.303 C#CCCCCCCNCCCCCCCC 2230a_100000229939_100012276617 [0,2,0,0,0,0|1,0,1]=4 14120 B16R0.303 C#CCCCCCCNCCCCCCCC 34a_100000229939_100012276617 [0,2,0,0,0,0|1,0,1]=4 14121 B16R0.303 C#CCCCCCCNCCCCCCCO 2230a_100011996573_100012276617 [0,2,0,0,0,0|1,0,1]=4 14122 B16R0.303 C#CCCCCCCNCCCCCCCO 34a_100011996573_100012276617 [0,2,0,0,0,0|1,0,1]=4 14123 B16R0.303 C#CCCCCCCNCCCOCCCC 2230a_200000211371_100012276617 [0,2,0,0,0,0|1,0,1]=4 14124 B16R0.303 C#CCCCCCCNCCCOCCCC 34a_200000211371_100012276617 [0,2,0,0,0,0|1,0,1]=4 14125 B16R0.303 C#CCCCCCCOCCCCCCC=C 34a_100011217361_100011215473 [0,2,0,0,0,0|1,0,1]=4 14126 B16R0.303 C#CCCCCCCOCCCCCCC=C 34a_200011216477_100012276617 [0,2,0,0,0,0|1,0,1]=4 14127 B16R0.303 C#CCCCCCCOCCCCCCC=C 7a_100011217361_100011215473 [0,2,0,0,0,0|1,0,1]=4 14128 B16R0.303 C#CCCCCCCOCCCCCCC=C 7a_200011216477_100012276617 [0,2,0,0,0,0|1,0,1]=4 14129 B16R0.303 C#CCCCCCCOCCCCCCCBr 34a_100000760002_100012276617 [0,2,0,0,0,0|1,0,1]=4 14130 B16R0.303 C#CCCCCCCOCCCCCCCBr 7a_100000760002_100012276617 [0,2,0,0,0,0|1,0,1]=4 14131 B16R0.303 C#CCCCCCCOCCCCCCCC 34a_100000210232_100012276617 [0,2,0,0,0,0|1,0,1]=4 14132 B16R0.303 C#CCCCCCCOCCCCCCCC 34a_100011217361_100000210759 [0,2,0,0,0,0|1,0,1]=4 14133 B16R0.303 C#CCCCCCCOCCCCCCCC 7a_100000210232_100012276617 [0,2,0,0,0,0|1,0,1]=4 14134 B16R0.303 C#CCCCCCCOCCCCCCCC 7a_100011217361_100000210759 [0,2,0,0,0,0|1,0,1]=4 14135 B16R0.303 C#CCCCCCCOCCCCCCCN 34a_100011996573_100012276617 [0,2,0,0,0,0|1,0,1]=4 14136 B16R0.303 C#CCCCCCCOCCCCCCCO 34a_100011217361_100000760002 [0,2,0,0,0,0|1,0,1]=4 14137 B16R0.303 C#CCCCCCCOCCCCCCCO 7a_100011217361_100000760002 [0,2,0,0,0,0|1,0,1]=4 14138 B16R0.303 C#CCCCCCCOCCCCCCOC 34a_100011217361_100011998445 [0,2,0,0,0,0|1,0,1]=4 14139 B16R0.303 C#CCCCCCCOCCCCCCOC 34a_200012092642_100012276617 [0,2,0,0,0,0|1,0,1]=4 14140 B16R0.303 C#CCCCCCCOCCCCCCOC 7a_100011217361_100011998445 [0,2,0,0,0,0|1,0,1]=4 14141 B16R0.303 C#CCCCCCCOCCCCCCOC 7a_200012092642_100012276617 [0,2,0,0,0,0|1,0,1]=4 14142 B16R0.303 C#CCCCCCCOCCCOCCCC 34a_200011215613_100012276617 [0,2,0,0,0,0|1,0,1]=4 14143 B16R0.303 C#CCCCCCCOCCCOCCCC 7a_200011215613_100012276617 [0,2,0,0,0,0|1,0,1]=4 14144 B16R0.303 C#CCCCCCCOCCNCCCCC 34a_100000224656_100012276617 [0,2,0,0,0,0|1,0,1]=4 14145 B16R0.303 C#CCCCCCCOCCOCCCCC 34a_100011215259_100012276617 [0,2,0,0,0,0|1,0,1]=4 14146 B16R0.303 C#CCCCCCCOCCOCCCCC 7a_100011215259_100012276617 [0,2,0,0,0,0|1,0,1]=4 14147 B16R0.303 C#CCCCCCCSCCCCCCC=C 62a_100011215473_100012276617 [0,2,0,0,0,0|1,0,1]=4 14148 B16R0.303 C#CCCCCCCSCCCCCCC=C 62a_100012276617_100011215473 [0,2,0,0,0,0|1,0,1]=4 14149 B16R0.303 C#CCCCCCCSCCCCCCCC 62a_100000210759_100012276617 [0,2,0,0,0,0|1,0,1]=4 14150 B16R0.303 C#CCCCCCCSCCCCCCCC 62a_100012276617_100000210317 [0,2,0,0,0,0|1,0,1]=4 14151 B16R0.303 C#CCCCCCCSCCCCCCCO 62a_100000760002_100012276617 [0,2,0,0,0,0|1,0,1]=4 14152 B16R0.303 C#CCCCCCCSCCCCCCCO 62a_100012276617_100000760002 [0,2,0,0,0,0|1,0,1]=4 14153 B16R0.303 C#CCCCCCCSCCCCCCOC 62a_100011998445_100012276617 [0,2,0,0,0,0|1,0,1]=4 14154 B16R0.303 C#CCCCCCCSCCCCCCOC 62a_100012276617_100011998445 [0,2,0,0,0,0|1,0,1]=4 14155 B16R0.303 C#CCCCCCNCCCCCCCCC 2230a_100000212291_100012094781 [0,2,0,0,0,0|1,0,1]=4 14156 B16R0.303 C#CCCCCCNCCCCCCCCC 34a_100000212291_100012094781 [0,2,0,0,0,0|1,0,1]=4 14157 B16R0.303 C#CCCCCCNCCCCCCCCO 2230a_102515433106_100012094781 [0,2,0,0,0,0|1,0,1]=4 14158 B16R0.303 C#CCCCCCNCCCCCCCCO 34a_102515433106_100012094781 [0,2,0,0,0,0|1,0,1]=4 14159 B16R0.303 C#CCCCCCOCCCCCCCC=C 34a_100000730831_100012094781 [0,2,0,0,0,0|1,0,1]=4 14160 B16R0.303 C#CCCCCCOCCCCCCCC=C 34a_100000766912_100012355270 [0,2,0,0,0,0|1,0,1]=4 14161 B16R0.303 C#CCCCCCOCCCCCCCC=C 7a_100000730831_100012094781 [0,2,0,0,0,0|1,0,1]=4 14162 B16R0.303 C#CCCCCCOCCCCCCCC=C 7a_100000766912_100012355270 [0,2,0,0,0,0|1,0,1]=4 14163 B16R0.303 C#CCCCCCOCCCCCCCCBr 34a_100009813846_100012094781 [0,2,0,0,0,0|1,0,1]=4 14164 B16R0.303 C#CCCCCCOCCCCCCCCBr 7a_100009813846_100012094781 [0,2,0,0,0,0|1,0,1]=4 14165 B16R0.303 C#CCCCCCOCCCCCCCCC 34a_100000210712_100012094781 [0,2,0,0,0,0|1,0,1]=4 14166 B16R0.303 C#CCCCCCOCCCCCCCCC 34a_100000766912_100011214924 [0,2,0,0,0,0|1,0,1]=4 14167 B16R0.303 C#CCCCCCOCCCCCCCCC 7a_100000210712_100012094781 [0,2,0,0,0,0|1,0,1]=4 14168 B16R0.303 C#CCCCCCOCCCCCCCCC 7a_100000766912_100000210328 [0,2,0,0,0,0|1,0,1]=4 14169 B16R0.303 C#CCCCCCOCCCCCCCCCl 34a_100000033203_100012094781 [0,2,0,0,0,0|1,0,1]=4 14170 B16R0.303 C#CCCCCCOCCCCCCCCCl 7a_100000033203_100012094781 [0,2,0,0,0,0|1,0,1]=4 14171 B16R0.303 C#CCCCCCOCCCCCCCCN 34a_102515433106_100012094781 [0,2,0,0,0,0|1,0,1]=4 14172 B16R0.303 C#CCCCCCOCCCCCCCCO 34a_100000766912_100000033203 [0,2,0,0,0,0|1,0,1]=4 14173 B16R0.303 C#CCCCCCOCCCCCCCCO 7a_100000766912_100000033203 [0,2,0,0,0,0|1,0,1]=4 14174 B16R0.303 C#CCCCCCOCCCCNCCCC 34a_200011216965_100012094781 [0,2,0,0,0,0|1,0,1]=4 14175 B16R0.303 C#CCCCCCOCCCCOCCCC 34a_200000760531_100012094781 [0,2,0,0,0,0|1,0,1]=4 14176 B16R0.303 C#CCCCCCOCCCCOCCCC 7a_200000760531_100012094781 [0,2,0,0,0,0|1,0,1]=4 14177 B16R0.303 C#CCCCCCOCCOCCCCCC 34a_100000691444_100012094781 [0,2,0,0,0,0|1,0,1]=4 14178 B16R0.303 C#CCCCCCOCCOCCCCCC 7a_100000691444_100012094781 [0,2,0,0,0,0|1,0,1]=4 14179 B16R0.303 C#CCCCCCSCCCCCCCC=C 62a_100012094781_100012355270 [0,2,0,0,0,0|1,0,1]=4 14180 B16R0.303 C#CCCCCCSCCCCCCCC=C 62a_100012355270_100012094781 [0,2,0,0,0,0|1,0,1]=4 14181 B16R0.303 C#CCCCCCSCCCCCCCCC 62a_100012094781_100000210670 [0,2,0,0,0,0|1,0,1]=4 14182 B16R0.303 C#CCCCCCSCCCCCCCCO 62a_100000033203_100012094781 [0,2,0,0,0,0|1,0,1]=4 14183 B16R0.303 C#CCCCCCSCCCCCCCCO 62a_100012094781_100000033203 [0,2,0,0,0,0|1,0,1]=4 14184 B16R0.303 C#CCCCCNCCCCCCCCC=C 2230a_100000706060_100011933949 [0,2,0,0,0,0|1,0,1]=4 14185 B16R0.303 C#CCCCCNCCCCCCCCC=C 34a_100000706060_100011933949 [0,2,0,0,0,0|1,0,1]=4 14186 B16R0.303 C#CCCCCNCCCCCCCCCC 2230a_100000684558_100010269958 [0,2,0,0,0,0|1,0,1]=4 14187 B16R0.303 C#CCCCCNCCCCCCCCCC 2230a_100000706060_100000210320 [0,2,0,0,0,0|1,0,1]=4 14188 B16R0.303 C#CCCCCNCCCCCCCCCC 34a_100000684558_100010269958 [0,2,0,0,0,0|1,0,1]=4 14189 B16R0.303 C#CCCCCNCCCCCCCCCC 34a_100000706060_100000210320 [0,2,0,0,0,0|1,0,1]=4 14190 B16R0.303 C#CCCCCNCCCCCCCCCO 2230a_100000078944_100010269958 [0,2,0,0,0,0|1,0,1]=4 14191 B16R0.303 C#CCCCCNCCCCCCCCCO 2230a_100000706060_100009813782 [0,2,0,0,0,0|1,0,1]=4 14192 B16R0.303 C#CCCCCNCCCCCCCCCO 34a_100000078944_100010269958 [0,2,0,0,0,0|1,0,1]=4 14193 B16R0.303 C#CCCCCNCCCCCCCCCO 34a_100000706060_100009813782 [0,2,0,0,0,0|1,0,1]=4 14194 B16R0.303 C#CCCCCOCCCCCCCCC=C 34a_100000766709_100011933949 [0,2,0,0,0,0|1,0,1]=4 14195 B16R0.303 C#CCCCCOCCCCCCCCC=C 34a_100011215194_100010269958 [0,2,0,0,0,0|1,0,1]=4 14196 B16R0.303 C#CCCCCOCCCCCCCCC=C 7a_100000766709_100011933949 [0,2,0,0,0,0|1,0,1]=4 14197 B16R0.303 C#CCCCCOCCCCCCCCC=C 7a_100011215194_100010269958 [0,2,0,0,0,0|1,0,1]=4 14198 B16R0.303 C#CCCCCOCCCCCCCCCBr 34a_100009813782_100010269958 [0,2,0,0,0,0|1,0,1]=4 14199 B16R0.303 C#CCCCCOCCCCCCCCCBr 7a_100009813782_100010269958 [0,2,0,0,0,0|1,0,1]=4 14200 B16R0.303 C#CCCCCOCCCCCCCCCC 34a_100000210711_100010269958 [0,2,0,0,0,0|1,0,1]=4 14201 B16R0.303 C#CCCCCOCCCCCCCCCC 34a_100000766709_100000210320 [0,2,0,0,0,0|1,0,1]=4 14202 B16R0.303 C#CCCCCOCCCCCCCCCC 7a_100000210711_100010269958 [0,2,0,0,0,0|1,0,1]=4 14203 B16R0.303 C#CCCCCOCCCCCCCCCC 7a_100000766709_100000210320 [0,2,0,0,0,0|1,0,1]=4 14204 B16R0.303 C#CCCCCOCCCCCCCCCCl 34a_100009868337_100010269958 [0,2,0,0,0,0|1,0,1]=4 14205 B16R0.303 C#CCCCCOCCCCCCCCCCl 7a_100009868337_100010269958 [0,2,0,0,0,0|1,0,1]=4 14206 B16R0.303 C#CCCCCOCCCCCCCCCN 34a_100000078944_100010269958 [0,2,0,0,0,0|1,0,1]=4 14207 B16R0.303 C#CCCCCOCCCCCCCCCO 34a_100000766709_100009813782 [0,2,0,0,0,0|1,0,1]=4 14208 B16R0.303 C#CCCCCOCCCCCCCCCO 7a_100000766709_100009813782 [0,2,0,0,0,0|1,0,1]=4 14209 B16R0.303 C#CCCCCSCCCCCCCCC=C 62a_100010269958_100011933949 [0,2,0,0,0,0|1,0,1]=4 14210 B16R0.303 C#CCCCCSCCCCCCCCC=C 62a_100011933949_100010269958 [0,2,0,0,0,0|1,0,1]=4 14211 B16R0.303 C#CCCCCSCCCCCCCCCC 62a_100010269958_100000210320 [0,2,0,0,0,0|1,0,1]=4 14212 B16R0.303 C#CCCCCSCCCCCCCCCO 62a_100009813782_100010269958 [0,2,0,0,0,0|1,0,1]=4 14213 B16R0.303 C#CCCCCSCCCCCCCCCO 62a_100010269958_100009813782 [0,2,0,0,0,0|1,0,1]=4 14214 B16R0.303 C#CCCCNCCCCCCCCCC=C 2230a_100000081888_100000731252 [0,2,0,0,0,0|1,0,1]=4 14215 B16R0.303 C#CCCCNCCCCCCCCCC=C 34a_100000081888_100000695029 [0,2,0,0,0,0|1,0,1]=4 14216 B16R0.303 C#CCCCNCCCCCCCCCC=C 34a_100000718082_100009814027 [0,2,0,0,0,0|1,0,1]=4 14217 B16R0.303 C#CCCCNCCCCCCCCCCC 2230a_200011215754_100000731252 [0,2,0,0,0,0|1,0,1]=4 14218 B16R0.303 C#CCCCNCCCCCCCCCCC 34a_100000718082_100011215454 [0,2,0,0,0,0|1,0,1]=4 14219 B16R0.303 C#CCCCNCCCCCCCCCCC 34a_200011215754_100000695029 [0,2,0,0,0,0|1,0,1]=4 14220 B16R0.303 C#CCCCNCCCCCCCCCCO 2230a_100000066964_100000731252 [0,2,0,0,0,0|1,0,1]=4 14221 B16R0.303 C#CCCCNCCCCCCCCCCO 34a_100000066964_100000695029 [0,2,0,0,0,0|1,0,1]=4 14222 B16R0.303 C#CCCCNCCCCCCCCCCO 34a_100000718082_100009813290 [0,2,0,0,0,0|1,0,1]=4 14223 B16R0.303 C#CCCCOCCCCCCCCCC=C 34a_100000038209_100000695029 [0,2,0,0,0,0|1,0,1]=4 14224 B16R0.303 C#CCCCOCCCCCCCCCC=C 34a_100000215630_100009814027 [0,2,0,0,0,0|1,0,1]=4 14225 B16R0.303 C#CCCCOCCCCCCCCCC=C 7a_100000038209_100011215417 [0,2,0,0,0,0|1,0,1]=4 14226 B16R0.303 C#CCCCOCCCCCCCCCC=C 7a_100000215630_100009814027 [0,2,0,0,0,0|1,0,1]=4 14227 B16R0.303 C#CCCCOCCCCCCCCCCBr 34a_100009813290_100000695029 [0,2,0,0,0,0|1,0,1]=4 14228 B16R0.303 C#CCCCOCCCCCCCCCCBr 7a_100009813290_100011215417 [0,2,0,0,0,0|1,0,1]=4 14229 B16R0.303 C#CCCCOCCCCCCCCCCC 34a_100000210809_100000695029 [0,2,0,0,0,0|1,0,1]=4 14230 B16R0.303 C#CCCCOCCCCCCCCCCC 34a_100000215630_100011215454 [0,2,0,0,0,0|1,0,1]=4 14231 B16R0.303 C#CCCCOCCCCCCCCCCC 7a_100000210809_100011215417 [0,2,0,0,0,0|1,0,1]=4 14232 B16R0.303 C#CCCCOCCCCCCCCCCC 7a_100000215630_100011215454 [0,2,0,0,0,0|1,0,1]=4 14233 B16R0.303 C#CCCCOCCCCCCCCCCCl 34a_200000033068_100000695029 [0,2,0,0,0,0|1,0,1]=4 14234 B16R0.303 C#CCCCOCCCCCCCCCCCl 7a_200000033068_100011215417 [0,2,0,0,0,0|1,0,1]=4 14235 B16R0.303 C#CCCCOCCCCCCCCCCN 34a_100000066964_100000695029 [0,2,0,0,0,0|1,0,1]=4 14236 B16R0.303 C#CCCCOCCCCCCCCCCO 34a_100000215630_100009813290 [0,2,0,0,0,0|1,0,1]=4 14237 B16R0.303 C#CCCCOCCCCCCCCCCO 7a_100000215630_100009813290 [0,2,0,0,0,0|1,0,1]=4 14238 B16R0.303 C#CCCCSCCCCCCCCCC=C 62a_100009814027_100011215417 [0,2,0,0,0,0|1,0,1]=4 14239 B16R0.303 C#CCCCSCCCCCCCCCC=C 62a_100011215417_100009814027 [0,2,0,0,0,0|1,0,1]=4 14240 B16R0.303 C#CCCCSCCCCCCCCCCC 62a_100011215417_100011215454 [0,2,0,0,0,0|1,0,1]=4 14241 B16R0.303 C#CCCCSCCCCCCCCCCO 62a_100009813290_100011215417 [0,2,0,0,0,0|1,0,1]=4 14242 B16R0.303 C#CCCCSCCCCCCCCCCO 62a_100011215417_200000033068 [0,2,0,0,0,0|1,0,1]=4 14243 B16R0.303 C#CCCNCCCCCCCCCCC=C 34a_100000755551_100011093070 [0,2,0,0,0,0|1,0,1]=4 14244 B16R0.303 C#CCCNCCCCCCCCCCCC 2230a_100000210451_100000688953 [0,2,0,0,0,0|1,0,1]=4 14245 B16R0.303 C#CCCNCCCCCCCCCCCC 34a_100000210451_100000688953 [0,2,0,0,0,0|1,0,1]=4 14246 B16R0.303 C#CCCNCCCCCCCCCCCC 34a_100000755551_100000759014 [0,2,0,0,0,0|1,0,1]=4 14247 B16R0.303 C#CCCNCCCCCCCCCCCO 34a_100000755551_100009812471 [0,2,0,0,0,0|1,0,1]=4 14248 B16R0.303 C#CCCOCCCCCCCCCCC=C 34a_100011215631_100011093070 [0,2,0,0,0,0|1,0,1]=4 14249 B16R0.303 C#CCCOCCCCCCCCCCCBr 34a_100009812471_100000688953 [0,2,0,0,0,0|1,0,1]=4 14250 B16R0.303 C#CCCOCCCCCCCCCCCBr 7a_100009812471_100000688953 [0,2,0,0,0,0|1,0,1]=4 14251 B16R0.303 C#CCCOCCCCCCCCCCCC 34a_100000210810_100000688953 [0,2,0,0,0,0|1,0,1]=4 14252 B16R0.303 C#CCCOCCCCCCCCCCCC 34a_100011215631_100000759014 [0,2,0,0,0,0|1,0,1]=4 14253 B16R0.303 C#CCCOCCCCCCCCCCCC 7a_100000210810_100000688953 [0,2,0,0,0,0|1,0,1]=4 14254 B16R0.303 C#CCCOCCCCCCCCCCCO 34a_100011215631_100009812471 [0,2,0,0,0,0|1,0,1]=4 14255 B16R0.303 C#CCCOCCCCCCCCCOCC 34a_100009875440_100000688953 [0,2,0,0,0,0|1,0,1]=4 14256 B16R0.303 C#CCCOCCCCCCCCCOCC 7a_100009875440_100000688953 [0,2,0,0,0,0|1,0,1]=4 14257 B16R0.303 C#CCCSCCCCCCCCCCC=C 62a_100000688953_100011093070 [0,2,0,0,0,0|1,0,1]=4 14258 B16R0.303 C#CCCSCCCCCCCCCCC=C 62a_100011093070_100000688953 [0,2,0,0,0,0|1,0,1]=4 14259 B16R0.303 C#CCCSCCCCCCCCCCCC 62a_100000688953_100000759014 [0,2,0,0,0,0|1,0,1]=4 14260 B16R0.303 C#CCCSCCCCCCCCCCCO 62a_100009812471_100000688953 [0,2,0,0,0,0|1,0,1]=4 14261 B16R0.303 C#CCNCCCCCCCCCCCC=C 34a_100000212058_102130925996 [0,2,0,0,0,0|1,0,1]=4 14262 B16R0.303 C#CCNCCCCCCCCCCCCC 2230a_100011215765_100000038162 [0,2,0,0,0,0|1,0,1]=4 14263 B16R0.303 C#CCNCCCCCCCCCCCCC 34a_100000212058_100000210684 [0,2,0,0,0,0|1,0,1]=4 14264 B16R0.303 C#CCNCCCCCCCCCCCCC 34a_100011215765_100000184674 [0,2,0,0,0,0|1,0,1]=4 14265 B16R0.303 C#CCNCCCCCCCCCCCCO 2230a_100000066677_100000038162 [0,2,0,0,0,0|1,0,1]=4 14266 B16R0.303 C#CCNCCCCCCCCCCCCO 34a_100000066677_100000184674 [0,2,0,0,0,0|1,0,1]=4 14267 B16R0.303 C#CCNCCCCCCCCCCCCO 34a_100000212058_100009813331 [0,2,0,0,0,0|1,0,1]=4 14268 B16R0.303 C#CCOCCCCCCCCCCCC=C 34a_100000210247_102130925996 [0,2,0,0,0,0|1,0,1]=4 14269 B16R0.303 C#CCOCCCCCCCCCCCCBr 34a_100009813331_100000184674 [0,2,0,0,0,0|1,0,1]=4 14270 B16R0.303 C#CCOCCCCCCCCCCCCBr 7a_100009813331_100000038162 [0,2,0,0,0,0|1,0,1]=4 14271 B16R0.303 C#CCOCCCCCCCCCCCCC 34a_100000185773_100000184674 [0,2,0,0,0,0|1,0,1]=4 14272 B16R0.303 C#CCOCCCCCCCCCCCCC 34a_100000210247_100000210684 [0,2,0,0,0,0|1,0,1]=4 14273 B16R0.303 C#CCOCCCCCCCCCCCCC 7a_100000185773_100000038162 [0,2,0,0,0,0|1,0,1]=4 14274 B16R0.303 C#CCOCCCCCCCCCCCCN 34a_100000066677_100000184674 [0,2,0,0,0,0|1,0,1]=4 14275 B16R0.303 C#CCOCCCCCCCCCCCCO 34a_100000210247_100009813331 [0,2,0,0,0,0|1,0,1]=4 14276 B16R0.303 C#CCOCCCCCCOCCCCC=O 7a_200011021349_100000139335 [0,2,0,0,0,0|0,0,2]=4 14277 B16R0.303 C#CCOCCCCCCOCCCCCC 34a_200011021349_100000210314 [0,2,0,0,0,0|1,0,1]=4 14278 B16R0.303 C#CCOCCCCCCOCCCCCC 7a_200011021349_100000210314 [0,2,0,0,0,0|1,0,1]=4 14279 B16R0.303 C#CCOCCNCCCCCCCCCC 2230a_100000684558_100010402529 [0,2,0,0,0,0|1,0,1]=4 14280 B16R0.303 C#CCOCCNCCCCCCCCCC 2230a_100000700922_100000210320 [0,2,0,0,0,0|1,0,1]=4 14281 B16R0.303 C#CCOCCNCCCCCCCCCC 34a_100000684558_100010402529 [0,2,0,0,0,0|1,0,1]=4 14282 B16R0.303 C#CCOCCNCCCCCCCCCC 34a_100000700922_100000210320 [0,2,0,0,0,0|1,0,1]=4 14283 B16R0.303 C#CCOCCOCCCCCCCCCC 34a_100000054580_100000210320 [0,2,0,0,0,0|1,0,1]=4 14284 B16R0.303 C#CCOCCOCCCCCCCCCC 34a_100000210711_100010402529 [0,2,0,0,0,0|1,0,1]=4 14285 B16R0.303 C#CCOCCOCCCCCCCCCC 7a_100000054580_100000210320 [0,2,0,0,0,0|1,0,1]=4 14286 B16R0.303 C#CCOCCOCCCCCCCCCC 7a_100000210711_100010402529 [0,2,0,0,0,0|1,0,1]=4 14287 B16R0.303 C#CCOCCSCCCCCCCCCC 34a_100011628728_100000184674 [0,2,0,0,0,0|1,0,1]=4 14288 B16R0.303 C#CCOCCSCCCCCCCCCC 62a_100010402529_100000210320 [0,2,0,0,0,0|1,0,1]=4 14289 B16R0.303 C#CCOCCSCCCCCCCCCC 7a_100011628728_100000038162 [0,2,0,0,0,0|1,0,1]=4 14290 B16R0.303 C#CCSCCCCCCCCCCCC=C 62a_100000038162_102130925996 [0,2,0,0,0,0|1,0,1]=4 14291 B16R0.303 C#CCSCCCCCCCCCCCCC 62a_100000038162_100011934334 [0,2,0,0,0,0|1,0,1]=4 14292 B16R0.303 C/C=C/CCOCCCCCCCCCCC 34a_100016278192_100011215454 [0,2,0,0,0,0|1,0,0]=3 14293 B16R0.303 C/C=C/CCOCCCCCCCCCCO 34a_100016278192_100009813290 [0,2,0,0,0,0|1,0,1]=4 14294 B16R0.303 C/C=C/CNCCCCCCCCCCCC 34a_100000210451_100102629194 [0,2,0,0,0,0|1,0,0]=3 14295 B16R0.303 C/C=C/COCCCCCCCCCCCBr 34a_100009812471_100102629194 [0,2,0,0,0,0|1,0,1]=4 14296 B16R0.303 C/C=C/COCCCCCCCCCCCBr 7a_100009812471_100102629194 [0,2,0,0,0,0|1,0,1]=4 14297 B16R0.303 C/C=C/COCCCCCCCCCCCC 34a_100000210810_100102629194 [0,2,0,0,0,0|1,0,0]=3 14298 B16R0.303 C/C=C/COCCCCCCCCCCCC 34a_100016270725_100000759014 [0,2,0,0,0,0|1,0,0]=3 14299 B16R0.303 C/C=C/COCCCCCCCCCCCC 7a_100000210810_100102629194 [0,2,0,0,0,0|1,0,0]=3 14300 B16R0.303 C/C=C/COCCCCCCCCCCCO 34a_100016270725_100009812471 [0,2,0,0,0,0|1,0,1]=4 14301 B16R0.303 C/C=C/COCCCCCCCCCOCC 34a_100009875440_100102629194 [0,2,0,0,0,0|1,0,1]=4 14302 B16R0.303 C/C=C/COCCCCCCCCCOCC 7a_100009875440_100102629194 [0,2,0,0,0,0|1,0,1]=4 14303 B16R0.303 C/C=C/CSCCCCCCCCCCCO 62a_100009812471_100102629194 [0,2,0,0,0,0|1,0,1]=4 14304 B16R0.303 C=CCCC/C=C/COCCCCCCCC 34a_200016268473_100000210759 [0,2,0,0,0,0|1,0,1]=4 14305 B16R0.303 C=CCCC/C=C/COCCCCCCCC 7a_200016268473_100000210759 [0,2,0,0,0,0|1,0,1]=4 14306 B16R0.303 C=CCCCCCCCCC=NNCCCC 4a_100025702795_100000039675 [0,2,0,0,0,0|1,0,1]=4 14307 B16R0.303 C=CCCCCCCCCCCCCCNC 2230a_106832991635_102495333938 [0,2,0,0,0,0|1,0,0]=3 14308 B16R0.303 C=CCCCCCCCCCCCCCNC 34a_100102657272_102495333938 [0,2,0,0,0,0|1,0,0]=3 14309 B16R0.303 C=CCCCCCCCCCCCCCNC 7a_106832991635_102495333938 [0,2,0,0,0,0|1,0,0]=3 14310 B16R0.303 C=CCCCCCCCCCCCCCOC 34a_100138415774_102495333938 [0,2,0,0,0,0|1,0,0]=3 14311 B16R0.303 C=CCCCCCCCCCCCNCC=C 2230a_100020586998_102130925996 [0,2,0,0,0,0|1,0,1]=4 14312 B16R0.303 C=CCCCCCCCCCCCNCCF 34a_100000724931_102130925996 [0,2,0,0,0,0|1,0,0]=3 14313 B16R0.303 C=CCCCCCCCCCCCNCCO 2230a_100016997473_102130925996 [0,2,0,0,0,0|1,0,0]=3 14314 B16R0.303 C=CCCCCCCCCCCCNCCO 34a_100016990907_102130925996 [0,2,0,0,0,0|1,0,0]=3 14315 B16R0.303 C=CCCCCCCCCCCCOCC=C 34a_200000210373_102130925996 [0,2,0,0,0,0|1,0,1]=4 14316 B16R0.303 C=CCCCCCCCCCCCOCCBr 34a_100000211926_102130925996 [0,2,0,0,0,0|1,0,0]=3 14317 B16R0.303 C=CCCCCCCCCCCCOCCC 34a_100000210258_102130925996 [0,2,0,0,0,0|1,0,0]=3 14318 B16R0.303 C=CCCCCCCCCCCCOCCN 34a_100000210304_102130925996 [0,2,0,0,0,0|1,0,0]=3 14319 B16R0.303 C=CCCCCCCCCCCCSCC#N 62a_100011215382_102130925996 [0,2,0,0,0,0|1,0,1]=4 14320 B16R0.303 C=CCCCCCCCCCCCSCC#N 62a_102130925996_100011215382 [0,2,0,0,0,0|1,0,1]=4 14321 B16R0.303 C=CCCCCCCCCCCCSCC=C 62a_100000210623_102130925996 [0,2,0,0,0,0|1,0,1]=4 14322 B16R0.303 C=CCCCCCCCCCCCSCC=C 62a_102130925996_100000210623 [0,2,0,0,0,0|1,0,1]=4 14323 B16R0.303 C=CCCCCCCCCCCCSCC=O 62a_102130925996_200015260668 [0,2,0,0,0,0|0,0,1]=3 14324 B16R0.303 C=CCCCCCCCCCCCSCC=O 62a_200015260668_102130925996 [0,2,0,0,0,0|0,0,1]=3 14325 B16R0.303 C=CCCCCCCCCCCCSCCF 62a_100011217306_102130925996 [0,2,0,0,0,0|1,0,0]=3 14326 B16R0.303 C=CCCCCCCCCCCCSCCF 62a_102130925996_100011217306 [0,2,0,0,0,0|1,0,0]=3 14327 B16R0.303 C=CCCCCCCCCCCCSCCO 62a_100000211926_102130925996 [0,2,0,0,0,0|1,0,0]=3 14328 B16R0.303 C=CCCCCCCCCCCCSCCO 62a_102130925996_100000211926 [0,2,0,0,0,0|1,0,0]=3 14329 B16R0.303 C=CCCCCCCCCCCCSCOC 62a_100000766300_102130925996 [0,2,0,0,0,0|1,0,0]=3 14330 B16R0.303 C=CCCCCCCCCCCCSCOC 62a_102130925996_100000766300 [0,2,0,0,0,0|1,0,0]=3 14331 B16R0.303 C=CCCCCCCCCCCNCC#CC 2230a_100000685387_100011093070 [0,2,0,0,0,0|1,0,1]=4 14332 B16R0.303 C=CCCCCCCCCCCNCC#CC 34a_100000685387_100011093070 [0,2,0,0,0,0|1,0,1]=4 14333 B16R0.303 C=CCCCCCCCCCCNCCC=C 2230a_100015191253_100011093070 [0,2,0,0,0,0|1,0,1]=4 14334 B16R0.303 C=CCCCCCCCCCCNCCCC 2230a_100000102301_100011093070 [0,2,0,0,0,0|1,0,0]=3 14335 B16R0.303 C=CCCCCCCCCCCNCCCC 7a_106832991798_100011093070 [0,2,0,0,0,0|1,0,0]=3 14336 B16R0.303 C=CCCCCCCCCCCNCCCF 2230a_100015189416_100011093070 [0,2,0,0,0,0|1,0,0]=3 14337 B16R0.303 C=CCCCCCCCCCCNCCCF 34a_100015189416_100011093070 [0,2,0,0,0,0|1,0,0]=3 14338 B16R0.303 C=CCCCCCCCCCCNCCOC 2230a_100000209980_100011093070 [0,2,0,0,0,0|1,0,0]=3 14339 B16R0.303 C=CCCCCCCCCCCNCCSC 2230a_100020590264_100011093070 [0,2,0,0,0,0|1,0,0]=3 14340 B16R0.303 C=CCCCCCCCCCCOC/C=C/C 34a_100016270725_100011093070 [0,2,0,0,0,0|1,0,1]=4 14341 B16R0.303 C=CCCCCCCCCCCOCC#CC 34a_100000761923_100011093070 [0,2,0,0,0,0|1,0,1]=4 14342 B16R0.303 C=CCCCCCCCCCCOCCC=C 34a_100011205117_100011093070 [0,2,0,0,0,0|1,0,1]=4 14343 B16R0.303 C=CCCCCCCCCCCOCCCBr 34a_100011217188_100011093070 [0,2,0,0,0,0|1,0,0]=3 14344 B16R0.303 C=CCCCCCCCCCCOCCCC 34a_100000210227_100011093070 [0,2,0,0,0,0|1,0,0]=3 14345 B16R0.303 C=CCCCCCCCCCCOCCCC 7a_100000210227_100011093070 [0,2,0,0,0,0|1,0,0]=3 14346 B16R0.303 C=CCCCCCCCCCCOCCCCl 34a_100000230001_100011093070 [0,2,0,0,0,0|1,0,0]=3 14347 B16R0.303 C=CCCCCCCCCCCOCCCF 34a_100000759539_100011093070 [0,2,0,0,0,0|1,0,0]=3 14348 B16R0.303 C=CCCCCCCCCCCOCCCN 34a_100000182051_100011093070 [0,2,0,0,0,0|1,0,0]=3 14349 B16R0.303 C=CCCCCCCCCCCOCCOC 34a_100000210237_100011093070 [0,2,0,0,0,0|1,0,0]=3 14350 B16R0.303 C=CCCCCCCCCCCOCCON 34a_100000700252_100011093070 [0,2,0,0,0,0|2,0,0]=4 14351 B16R0.303 C=CCCCCCCCCCCOCCSC 34a_100000230434_100011093070 [0,2,0,0,0,0|1,0,0]=3 14352 B16R0.303 C=CCCCCCCCCCCOCCSC 7a_100000230434_100011093070 [0,2,0,0,0,0|1,0,0]=3 14353 B16R0.303 C=CCCCCCCCCCCSC/C=C/C 62a_100011093070_100102629194 [0,2,0,0,0,0|1,0,1]=4 14354 B16R0.303 C=CCCCCCCCCCCSC/C=C/C 62a_100102629194_100011093070 [0,2,0,0,0,0|1,0,1]=4 14355 B16R0.303 C=CCCCCCCCCCCSCC#CC 62a_100000748600_100011093070 [0,2,0,0,0,0|1,0,1]=4 14356 B16R0.303 C=CCCCCCCCCCCSCC#CC 62a_100011093070_100000748600 [0,2,0,0,0,0|1,0,1]=4 14357 B16R0.303 C=CCCCCCCCCCCSCC=CC 62a_100000070051_100011093070 [0,2,0,0,0,0|1,0,1]=4 14358 B16R0.303 C=CCCCCCCCCCCSCC=CC 62a_100011093070_100000070051 [0,2,0,0,0,0|1,0,1]=4 14359 B16R0.303 C=CCCCCCCCCCCSCCC#N 62a_100011093070_100011215226 [0,2,0,0,0,0|1,0,1]=4 14360 B16R0.303 C=CCCCCCCCCCCSCCC#N 62a_100011215226_100011093070 [0,2,0,0,0,0|1,0,1]=4 14361 B16R0.303 C=CCCCCCCCCCCSCCC=C 62a_100000754431_100011093070 [0,2,0,0,0,0|1,0,1]=4 14362 B16R0.303 C=CCCCCCCCCCCSCCC=C 62a_100011093070_100000754431 [0,2,0,0,0,0|1,0,1]=4 14363 B16R0.303 C=CCCCCCCCCCCSCCCF 62a_100011093070_100011934791 [0,2,0,0,0,0|1,0,0]=3 14364 B16R0.303 C=CCCCCCCCCCCSCCCF 62a_100011934791_100011093070 [0,2,0,0,0,0|1,0,0]=3 14365 B16R0.303 C=CCCCCCCCCCCSCCCO 62a_100011093070_100011215043 [0,2,0,0,0,0|1,0,0]=3 14366 B16R0.303 C=CCCCCCCCCCCSCCCO 62a_100011215043_100011093070 [0,2,0,0,0,0|1,0,0]=3 14367 B16R0.303 C=CCCCCCCCCCCSCCOC 62a_100000233755_100011093070 [0,2,0,0,0,0|1,0,0]=3 14368 B16R0.303 C=CCCCCCCCCCCSCCOC 62a_100011093070_100000233755 [0,2,0,0,0,0|1,0,0]=3 14369 B16R0.303 C=CCCCCCCCCCCSCCSC 62a_100000212216_100011093070 [0,2,0,0,0,0|1,0,0]=3 14370 B16R0.303 C=CCCCCCCCCCCSCCSC 62a_100011093070_100000751147 [0,2,0,0,0,0|1,0,0]=3 14371 B16R0.303 C=CCCCCCCCCCCSCOCC 62a_100000739092_100011093070 [0,2,0,0,0,0|1,0,0]=3 14372 B16R0.303 C=CCCCCCCCCCCSCOCC 62a_100011093070_100000739092 [0,2,0,0,0,0|1,0,0]=3 14373 B16R0.303 C=CCCCCCCCCCNC/C=C\CC 2230a_100000081888_100103147603 [0,2,0,0,0,0|1,0,1]=4 14374 B16R0.303 C=CCCCCCCCCCNC/C=C\CC 34a_100000081888_100103147603 [0,2,0,0,0,0|1,0,1]=4 14375 B16R0.303 C=CCCCCCCCCCNCC#CCC 2230a_100000081888_100009813939 [0,2,0,0,0,0|1,0,1]=4 14376 B16R0.303 C=CCCCCCCCCCNCC#CCC 34a_100000081888_100009813939 [0,2,0,0,0,0|1,0,1]=4 14377 B16R0.303 C=CCCCCCCCCCNCCCC#N 2230a_100000081888_100000687738 [0,2,0,0,0,0|1,0,1]=4 14378 B16R0.303 C=CCCCCCCCCCNCCCC=C 2230a_100000081888_100011713584 [0,2,0,0,0,0|1,0,1]=4 14379 B16R0.303 C=CCCCCCCCCCNCCCC=C 2230a_100000700776_100009814027 [0,2,0,0,0,0|1,0,1]=4 14380 B16R0.303 C=CCCCCCCCCCNCCCC=C 34a_100000081888_100000757094 [0,2,0,0,0,0|1,0,1]=4 14381 B16R0.303 C=CCCCCCCCCCNCCCC=C 34a_100000700776_100009814027 [0,2,0,0,0,0|1,0,1]=4 14382 B16R0.303 C=CCCCCCCCCCNCCCC=O 2230a_100000081888_200011292268 [0,2,0,0,0,0|0,0,1]=3 14383 B16R0.303 C=CCCCCCCCCCNCCCCC 2230a_100000081888_100000210326 [0,2,0,0,0,0|1,0,0]=3 14384 B16R0.303 C=CCCCCCCCCCNCCCCC 2230a_100000209983_100009814027 [0,2,0,0,0,0|1,0,0]=3 14385 B16R0.303 C=CCCCCCCCCCNCCCCC 34a_100000081888_100000718602 [0,2,0,0,0,0|1,0,0]=3 14386 B16R0.303 C=CCCCCCCCCCNCCCCF 2230a_100000081888_100000729493 [0,2,0,0,0,0|1,0,0]=3 14387 B16R0.303 C=CCCCCCCCCCNCCCCF 34a_100000081888_100000729493 [0,2,0,0,0,0|1,0,0]=3 14388 B16R0.303 C=CCCCCCCCCCNCCCCO 2230a_100000081888_100000210776 [0,2,0,0,0,0|1,0,0]=3 14389 B16R0.303 C=CCCCCCCCCCNCCCCO 2230a_100000750430_100009814027 [0,2,0,0,0,0|1,0,0]=3 14390 B16R0.303 C=CCCCCCCCCCNCCCCO 34a_100000081888_100011216708 [0,2,0,0,0,0|1,0,0]=3 14391 B16R0.303 C=CCCCCCCCCCNCCCCO 34a_100000750430_100009814027 [0,2,0,0,0,0|1,0,0]=3 14392 B16R0.303 C=CCCCCCCCCCNCCCOC 2230a_100000081888_100000740836 [0,2,0,0,0,0|1,0,0]=3 14393 B16R0.303 C=CCCCCCCCCCNCCCOC 34a_100000081888_100000740836 [0,2,0,0,0,0|1,0,0]=3 14394 B16R0.303 C=CCCCCCCCCCNCCCOC 34a_100150723488_100009814027 [0,2,0,0,0,0|1,0,0]=3 14395 B16R0.303 C=CCCCCCCCCCNCCCSC 2230a_100000749238_100009814027 [0,2,0,0,0,0|1,0,0]=3 14396 B16R0.303 C=CCCCCCCCCCNCCOCC 2230a_100000081888_100011215890 [0,2,0,0,0,0|1,0,0]=3 14397 B16R0.303 C=CCCCCCCCCCNCCOCC 2230a_102516460346_100009814027 [0,2,0,0,0,0|1,0,0]=3 14398 B16R0.303 C=CCCCCCCCCCNCCOCC 34a_100000081888_100000210147 [0,2,0,0,0,0|1,0,0]=3 14399 B16R0.303 C=CCCCCCCCCCNCCOCC 34a_102516460346_100009814027 [0,2,0,0,0,0|1,0,0]=3 14400 B16R0.303 C=CCCCCCCCCCNCCSCC 2230a_100000081888_100000757381 [0,2,0,0,0,0|1,0,0]=3 14401 B16R0.303 C=CCCCCCCCCCNCCSCC 2230a_100000106463_100009814027 [0,2,0,0,0,0|1,0,0]=3 14402 B16R0.303 C=CCCCCCCCCCNCCSCC 34a_100000081888_100000757381 [0,2,0,0,0,0|1,0,0]=3 14403 B16R0.303 C=CCCCCCCCCCOC/C=C\CC 34a_100000038209_100103147603 [0,2,0,0,0,0|1,0,1]=4 14404 B16R0.303 C=CCCCCCCCCCOC/C=C\CC 34a_100016268518_100009814027 [0,2,0,0,0,0|1,0,1]=4 14405 B16R0.303 C=CCCCCCCCCCOC/C=C\CC 7a_100000038209_100103147603 [0,2,0,0,0,0|1,0,1]=4 14406 B16R0.303 C=CCCCCCCCCCOCC#CCC 34a_100000032950_100009814027 [0,2,0,0,0,0|1,0,1]=4 14407 B16R0.303 C=CCCCCCCCCCOCC#CCC 34a_100000038209_100009813939 [0,2,0,0,0,0|1,0,1]=4 14408 B16R0.303 C=CCCCCCCCCCOCC#CCC 7a_100000038209_100009813939 [0,2,0,0,0,0|1,0,1]=4 14409 B16R0.303 C=CCCCCCCCCCOCC/C=C/C 34a_100016278192_100009814027 [0,2,0,0,0,0|1,0,1]=4 14410 B16R0.303 C=CCCCCCCCCCOCCC#CC 34a_100000750427_100009814027 [0,2,0,0,0,0|1,0,1]=4 14411 B16R0.303 C=CCCCCCCCCCOCCCC#N 7a_100000038209_100000687738 [0,2,0,0,0,0|1,0,1]=4 14412 B16R0.303 C=CCCCCCCCCCOCCCC=C 34a_100000038209_100000757094 [0,2,0,0,0,0|1,0,1]=4 14413 B16R0.303 C=CCCCCCCCCCOCCCC=C 34a_100000758997_100009814027 [0,2,0,0,0,0|1,0,1]=4 14414 B16R0.303 C=CCCCCCCCCCOCCCC=C 7a_100000038209_100000757094 [0,2,0,0,0,0|1,0,1]=4 14415 B16R0.303 C=CCCCCCCCCCOCCCC=C 7a_100000758997_100009814027 [0,2,0,0,0,0|1,0,1]=4 14416 B16R0.303 C=CCCCCCCCCCOCCCC=O 7a_100000038209_200011292268 [0,2,0,0,0,0|0,0,1]=3 14417 B16R0.303 C=CCCCCCCCCCOCCCCBr 34a_100011216708_100009814027 [0,2,0,0,0,0|1,0,0]=3 14418 B16R0.303 C=CCCCCCCCCCOCCCCC 34a_100000038209_100000718602 [0,2,0,0,0,0|1,0,0]=3 14419 B16R0.303 C=CCCCCCCCCCOCCCCC 34a_100000210253_100009814027 [0,2,0,0,0,0|1,0,0]=3 14420 B16R0.303 C=CCCCCCCCCCOCCCCC 7a_100000038209_100000210326 [0,2,0,0,0,0|1,0,0]=3 14421 B16R0.303 C=CCCCCCCCCCOCCCCC 7a_100000210253_100009814027 [0,2,0,0,0,0|1,0,0]=3 14422 B16R0.303 C=CCCCCCCCCCOCCCCCl 34a_100000210776_100009814027 [0,2,0,0,0,0|1,0,0]=3 14423 B16R0.303 C=CCCCCCCCCCOCCCCCl 7a_100000210776_100009814027 [0,2,0,0,0,0|1,0,0]=3 14424 B16R0.303 C=CCCCCCCCCCOCCCCF 34a_100000038209_100000729493 [0,2,0,0,0,0|1,0,0]=3 14425 B16R0.303 C=CCCCCCCCCCOCCCCF 34a_100011995726_100009814027 [0,2,0,0,0,0|1,0,0]=3 14426 B16R0.303 C=CCCCCCCCCCOCCCCF 7a_100000038209_100000729493 [0,2,0,0,0,0|1,0,0]=3 14427 B16R0.303 C=CCCCCCCCCCOCCCCF 7a_100011995726_100009814027 [0,2,0,0,0,0|1,0,0]=3 14428 B16R0.303 C=CCCCCCCCCCOCCCCI 34a_200012148704_100009814027 [0,2,0,0,0,0|1,0,0]=3 14429 B16R0.303 C=CCCCCCCCCCOCCCCN 34a_100000750430_100009814027 [0,2,0,0,0,0|1,0,0]=3 14430 B16R0.303 C=CCCCCCCCCCOCCCCO 34a_100000038209_100011216708 [0,2,0,0,0,0|1,0,0]=3 14431 B16R0.303 C=CCCCCCCCCCOCCCCO 7a_100000038209_100000210776 [0,2,0,0,0,0|1,0,0]=3 14432 B16R0.303 C=CCCCCCCCCCOCCCNC 34a_100000213112_100009814027 [0,2,0,0,0,0|1,0,0]=3 14433 B16R0.303 C=CCCCCCCCCCOCCCOC 34a_100000038209_100000740836 [0,2,0,0,0,0|1,0,0]=3 14434 B16R0.303 C=CCCCCCCCCCOCCCOC 34a_100000740835_100009814027 [0,2,0,0,0,0|1,0,0]=3 14435 B16R0.303 C=CCCCCCCCCCOCCCOC 7a_100000038209_100000740836 [0,2,0,0,0,0|1,0,0]=3 14436 B16R0.303 C=CCCCCCCCCCOCCCSC 34a_100000690336_100009814027 [0,2,0,0,0,0|1,0,0]=3 14437 B16R0.303 C=CCCCCCCCCCOCCCSC 7a_100000690336_100009814027 [0,2,0,0,0,0|1,0,0]=3 14438 B16R0.303 C=CCCCCCCCCCOCCOCC 34a_100000038209_100000210147 [0,2,0,0,0,0|1,0,0]=3 14439 B16R0.303 C=CCCCCCCCCCOCCOCC 34a_100000210136_100009814027 [0,2,0,0,0,0|1,0,0]=3 14440 B16R0.303 C=CCCCCCCCCCOCCOCC 7a_100000038209_100011215890 [0,2,0,0,0,0|1,0,0]=3 14441 B16R0.303 C=CCCCCCCCCCOCCOCC 7a_100000210136_100009814027 [0,2,0,0,0,0|1,0,0]=3 14442 B16R0.303 C=CCCCCCCCCCOCCSCC 34a_100000038209_100000757381 [0,2,0,0,0,0|1,0,0]=3 14443 B16R0.303 C=CCCCCCCCCCOCCSCC 34a_100000212035_100009814027 [0,2,0,0,0,0|1,0,0]=3 14444 B16R0.303 C=CCCCCCCCCCOCCSCC 7a_100000038209_100000757381 [0,2,0,0,0,0|1,0,0]=3 14445 B16R0.303 C=CCCCCCCCCCOCCSCC 7a_100000212035_100009814027 [0,2,0,0,0,0|1,0,0]=3 14446 B16R0.303 C=CCCCCCCCCCSC/C=C\CC 62a_100009814027_100103147603 [0,2,0,0,0,0|1,0,1]=4 14447 B16R0.303 C=CCCCCCCCCCSC/C=C\CC 62a_100103147603_100009814027 [0,2,0,0,0,0|1,0,1]=4 14448 B16R0.303 C=CCCCCCCCCCSCC#CCC 62a_100009813939_100009814027 [0,2,0,0,0,0|1,0,1]=4 14449 B16R0.303 C=CCCCCCCCCCSCC#CCC 62a_100009814027_100009813939 [0,2,0,0,0,0|1,0,1]=4 14450 B16R0.303 C=CCCCCCCCCCSCCCC#N 62a_100000687738_100009814027 [0,2,0,0,0,0|1,0,1]=4 14451 B16R0.303 C=CCCCCCCCCCSCCCC#N 62a_100009814027_100000687738 [0,2,0,0,0,0|1,0,1]=4 14452 B16R0.303 C=CCCCCCCCCCSCCCC=C 62a_100009814027_100000757094 [0,2,0,0,0,0|1,0,1]=4 14453 B16R0.303 C=CCCCCCCCCCSCCCC=C 62a_100011713584_100009814027 [0,2,0,0,0,0|1,0,1]=4 14454 B16R0.303 C=CCCCCCCCCCSCCCC=O 62a_100009814027_200011292268 [0,2,0,0,0,0|0,0,1]=3 14455 B16R0.303 C=CCCCCCCCCCSCCCC=O 62a_200011292268_100009814027 [0,2,0,0,0,0|0,0,1]=3 14456 B16R0.303 C=CCCCCCCCCCSCCCCF 62a_100000729493_100009814027 [0,2,0,0,0,0|1,0,0]=3 14457 B16R0.303 C=CCCCCCCCCCSCCCCF 62a_100009814027_100000729493 [0,2,0,0,0,0|1,0,0]=3 14458 B16R0.303 C=CCCCCCCCCCSCCCCO 62a_100000210776_100009814027 [0,2,0,0,0,0|1,0,0]=3 14459 B16R0.303 C=CCCCCCCCCCSCCCCO 62a_100009814027_100000210776 [0,2,0,0,0,0|1,0,0]=3 14460 B16R0.303 C=CCCCCCCCCCSCCCOC 62a_100000709357_100009814027 [0,2,0,0,0,0|1,0,0]=3 14461 B16R0.303 C=CCCCCCCCCCSCCCOC 62a_100009814027_100000709357 [0,2,0,0,0,0|1,0,0]=3 14462 B16R0.303 C=CCCCCCCCCCSCCOCC 62a_100000210147_100009814027 [0,2,0,0,0,0|1,0,0]=3 14463 B16R0.303 C=CCCCCCCCCCSCCOCC 62a_100009814027_100011215890 [0,2,0,0,0,0|1,0,0]=3 14464 B16R0.303 C=CCCCCCCCCCSCCSCC 62a_100000757381_100009814027 [0,2,0,0,0,0|1,0,0]=3 14465 B16R0.303 C=CCCCCCCCCCSCCSCC 62a_100009814027_100000757381 [0,2,0,0,0,0|1,0,0]=3 14466 B16R0.303 C=CCCCCCCCCNCCCCC=C 2230a_100000703577_100011933949 [0,2,0,0,0,0|1,0,1]=4 14467 B16R0.303 C=CCCCCCCCCNCCCCC=C 34a_100000703577_100011933949 [0,2,0,0,0,0|1,0,1]=4 14468 B16R0.303 C=CCCCCCCCCNCCCCCC 2230a_100000210581_100011933949 [0,2,0,0,0,0|1,0,0]=3 14469 B16R0.303 C=CCCCCCCCCNCCCCCO 2230a_100000762737_100011933949 [0,2,0,0,0,0|1,0,0]=3 14470 B16R0.303 C=CCCCCCCCCNCCCCCO 34a_100000762737_100011933949 [0,2,0,0,0,0|1,0,0]=3 14471 B16R0.303 C=CCCCCCCCCNCCCOCC 2230a_100000210961_100011933949 [0,2,0,0,0,0|1,0,0]=3 14472 B16R0.303 C=CCCCCCCCCNCCCOCC 34a_100000210961_100011933949 [0,2,0,0,0,0|1,0,0]=3 14473 B16R0.303 C=CCCCCCCCCNCCOCCC 2230a_100161115042_100011933949 [0,2,0,0,0,0|1,0,0]=3 14474 B16R0.303 C=CCCCCCCCCNCCOCCC 34a_100161115042_100011933949 [0,2,0,0,0,0|1,0,0]=3 14475 B16R0.303 C=CCCCCCCCCNCCOCCO 2230a_100000211614_100011933949 [0,2,0,0,0,0|2,0,0]=4 14476 B16R0.303 C=CCCCCCCCCNCCOCCO 34a_100000211614_100011933949 [0,2,0,0,0,0|2,0,0]=4 14477 B16R0.303 C=CCCCCCCCCNCCSCCC 2230a_100020603323_100011933949 [0,2,0,0,0,0|1,0,0]=3 14478 B16R0.303 C=CCCCCCCCCNCCSCCO 2230a_100011219999_100011933949 [0,2,0,0,0,0|2,0,0]=4 14479 B16R0.303 C=CCCCCCCCCOC/C=C/CCC 34a_100016278788_100011933949 [0,2,0,0,0,0|1,0,1]=4 14480 B16R0.303 C=CCCCCCCCCOC/C=C/CCC 7a_100016278788_100011933949 [0,2,0,0,0,0|1,0,1]=4 14481 B16R0.303 C=CCCCCCCCCOCC#CCCC 34a_100000034806_100011933949 [0,2,0,0,0,0|1,0,1]=4 14482 B16R0.303 C=CCCCCCCCCOCC#CCCC 7a_100000034806_100011933949 [0,2,0,0,0,0|1,0,1]=4 14483 B16R0.303 C=CCCCCCCCCOCC/C=C\CC 34a_100011215194_100015370543 [0,2,0,0,0,0|1,0,1]=4 14484 B16R0.303 C=CCCCCCCCCOCC/C=C\CC 34a_100016288707_100011933949 [0,2,0,0,0,0|1,0,1]=4 14485 B16R0.303 C=CCCCCCCCCOCC/C=C\CC 7a_100011215194_100015370543 [0,2,0,0,0,0|1,0,1]=4 14486 B16R0.303 C=CCCCCCCCCOCC/C=C\CC 7a_100016288707_100011933949 [0,2,0,0,0,0|1,0,1]=4 14487 B16R0.303 C=CCCCCCCCCOCCC#CCC 34a_100000036655_100011933949 [0,2,0,0,0,0|1,0,1]=4 14488 B16R0.303 C=CCCCCCCCCOCCC#CCC 7a_100000036655_100011933949 [0,2,0,0,0,0|1,0,1]=4 14489 B16R0.303 C=CCCCCCCCCOCCCC=CC 34a_100020645299_100011933949 [0,2,0,0,0,0|1,0,1]=4 14490 B16R0.303 C=CCCCCCCCCOCCCCC#N 7a_100011215194_100000211819 [0,2,0,0,0,0|1,0,1]=4 14491 B16R0.303 C=CCCCCCCCCOCCCCC=C 34a_100000766645_100011933949 [0,2,0,0,0,0|1,0,1]=4 14492 B16R0.303 C=CCCCCCCCCOCCCCC=C 34a_100011215194_100011215482 [0,2,0,0,0,0|1,0,1]=4 14493 B16R0.303 C=CCCCCCCCCOCCCCC=C 7a_100000766645_100011933949 [0,2,0,0,0,0|1,0,1]=4 14494 B16R0.303 C=CCCCCCCCCOCCCCC=C 7a_100011215194_100011215482 [0,2,0,0,0,0|1,0,1]=4 14495 B16R0.303 C=CCCCCCCCCOCCCCC=O 7a_100011215194_100000139335 [0,2,0,0,0,0|0,0,1]=3 14496 B16R0.303 C=CCCCCCCCCOCCCCCBr 34a_100000746331_100011933949 [0,2,0,0,0,0|1,0,0]=3 14497 B16R0.303 C=CCCCCCCCCOCCCCCBr 7a_100000746331_100011933949 [0,2,0,0,0,0|1,0,0]=3 14498 B16R0.303 C=CCCCCCCCCOCCCCCC 34a_100000210259_100011933949 [0,2,0,0,0,0|1,0,0]=3 14499 B16R0.303 C=CCCCCCCCCOCCCCCC 34a_100011215194_100000210314 [0,2,0,0,0,0|1,0,0]=3 14500 B16R0.303 C=CCCCCCCCCOCCCCCC 7a_100000210259_100011933949 [0,2,0,0,0,0|1,0,0]=3 14501 B16R0.303 C=CCCCCCCCCOCCCCCC 7a_100011215194_100000210314 [0,2,0,0,0,0|1,0,0]=3 14502 B16R0.303 C=CCCCCCCCCOCCCCCCl 34a_100000746330_100011933949 [0,2,0,0,0,0|1,0,0]=3 14503 B16R0.303 C=CCCCCCCCCOCCCCCCl 7a_100000746330_100011933949 [0,2,0,0,0,0|1,0,0]=3 14504 B16R0.303 C=CCCCCCCCCOCCCCCF 34a_100011215194_100000729378 [0,2,0,0,0,0|1,0,0]=3 14505 B16R0.303 C=CCCCCCCCCOCCCCCF 7a_100011215194_100000729378 [0,2,0,0,0,0|1,0,0]=3 14506 B16R0.303 C=CCCCCCCCCOCCCCCI 34a_200012148887_100011933949 [0,2,0,0,0,0|1,0,0]=3 14507 B16R0.303 C=CCCCCCCCCOCCCCCI 7a_200012148887_100011933949 [0,2,0,0,0,0|1,0,0]=3 14508 B16R0.303 C=CCCCCCCCCOCCCCCN 34a_100000762737_100011933949 [0,2,0,0,0,0|1,0,0]=3 14509 B16R0.303 C=CCCCCCCCCOCCCCCO 34a_100011215194_100000746330 [0,2,0,0,0,0|1,0,0]=3 14510 B16R0.303 C=CCCCCCCCCOCCCCCO 7a_100011215194_100000746330 [0,2,0,0,0,0|1,0,0]=3 14511 B16R0.303 C=CCCCCCCCCOCCCCOC 34a_100000740925_100011933949 [0,2,0,0,0,0|1,0,0]=3 14512 B16R0.303 C=CCCCCCCCCOCCCCOC 34a_100011215194_100000755781 [0,2,0,0,0,0|1,0,0]=3 14513 B16R0.303 C=CCCCCCCCCOCCCCOC 7a_100011215194_100000730899 [0,2,0,0,0,0|1,0,0]=3 14514 B16R0.303 C=CCCCCCCCCOCCCCSC 34a_100011217163_100011933949 [0,2,0,0,0,0|1,0,0]=3 14515 B16R0.303 C=CCCCCCCCCOCCCCSC 7a_100011217163_100011933949 [0,2,0,0,0,0|1,0,0]=3 14516 B16R0.303 C=CCCCCCCCCOCCCOCC 34a_100000757476_100011933949 [0,2,0,0,0,0|1,0,0]=3 14517 B16R0.303 C=CCCCCCCCCOCCCOCC 34a_100011215194_100012232248 [0,2,0,0,0,0|1,0,0]=3 14518 B16R0.303 C=CCCCCCCCCOCCCOCC 7a_100000757476_100011933949 [0,2,0,0,0,0|1,0,0]=3 14519 B16R0.303 C=CCCCCCCCCOCCCOCC 7a_100011215194_100012232248 [0,2,0,0,0,0|1,0,0]=3 14520 B16R0.303 C=CCCCCCCCCOCCCSCC 34a_100011216438_100011933949 [0,2,0,0,0,0|1,0,0]=3 14521 B16R0.303 C=CCCCCCCCCOCCCSCC 7a_100011216438_100011933949 [0,2,0,0,0,0|1,0,0]=3 14522 B16R0.303 C=CCCCCCCCCOCCOCCBr 34a_100000692535_100011933949 [0,2,0,0,0,0|2,0,0]=4 14523 B16R0.303 C=CCCCCCCCCOCCOCCBr 7a_100000692535_100011933949 [0,2,0,0,0,0|2,0,0]=4 14524 B16R0.303 C=CCCCCCCCCOCCOCCC 34a_100000752267_100011933949 [0,2,0,0,0,0|1,0,0]=3 14525 B16R0.303 C=CCCCCCCCCOCCOCCC 34a_100011215194_100011215938 [0,2,0,0,0,0|1,0,0]=3 14526 B16R0.303 C=CCCCCCCCCOCCOCCC 7a_100000752267_100011933949 [0,2,0,0,0,0|1,0,0]=3 14527 B16R0.303 C=CCCCCCCCCOCCOCCC 7a_100011215194_100011215938 [0,2,0,0,0,0|1,0,0]=3 14528 B16R0.303 C=CCCCCCCCCOCCOCCCl 34a_100011215305_100011933949 [0,2,0,0,0,0|2,0,0]=4 14529 B16R0.303 C=CCCCCCCCCOCCOCCCl 7a_100011215305_100011933949 [0,2,0,0,0,0|2,0,0]=4 14530 B16R0.303 C=CCCCCCCCCOCCOCCF 34a_200015357709_100011933949 [0,2,0,0,0,0|2,0,0]=4 14531 B16R0.303 C=CCCCCCCCCOCCOCCF 7a_200015357709_100011933949 [0,2,0,0,0,0|2,0,0]=4 14532 B16R0.303 C=CCCCCCCCCOCCOCCI 34a_100012149058_100011933949 [0,2,0,0,0,0|2,0,0]=4 14533 B16R0.303 C=CCCCCCCCCOCCOCCI 7a_100012149058_100011933949 [0,2,0,0,0,0|2,0,0]=4 14534 B16R0.303 C=CCCCCCCCCOCCOCCN 34a_100000211614_100011933949 [0,2,0,0,0,0|2,0,0]=4 14535 B16R0.303 C=CCCCCCCCCOCCOCCO 34a_100011215194_100000692535 [0,2,0,0,0,0|2,0,0]=4 14536 B16R0.303 C=CCCCCCCCCOCCOCCO 7a_100011215194_100011215305 [0,2,0,0,0,0|2,0,0]=4 14537 B16R0.303 C=CCCCCCCCCOCCSCCC 34a_200000230433_100011933949 [0,2,0,0,0,0|1,0,0]=3 14538 B16R0.303 C=CCCCCCCCCOCCSCCC 7a_200000230433_100011933949 [0,2,0,0,0,0|1,0,0]=3 14539 B16R0.303 C=CCCCCCCCCOCOCCCC 34a_100011215194_100011995733 [0,2,0,0,0,0|1,0,0]=3 14540 B16R0.303 C=CCCCCCCCCSCC/C=C\CC 62a_100011933949_100015370543 [0,2,0,0,0,0|1,0,1]=4 14541 B16R0.303 C=CCCCCCCCCSCC/C=C\CC 62a_100015370543_100011933949 [0,2,0,0,0,0|1,0,1]=4 14542 B16R0.303 C=CCCCCCCCCSCCCCC#N 62a_100011219923_100011933949 [0,2,0,0,0,0|1,0,1]=4 14543 B16R0.303 C=CCCCCCCCCSCCCCC#N 62a_100011933949_100000211819 [0,2,0,0,0,0|1,0,1]=4 14544 B16R0.303 C=CCCCCCCCCSCCCCC=C 62a_100011215482_100011933949 [0,2,0,0,0,0|1,0,1]=4 14545 B16R0.303 C=CCCCCCCCCSCCCCC=C 62a_100011933949_100011215482 [0,2,0,0,0,0|1,0,1]=4 14546 B16R0.303 C=CCCCCCCCCSCCCCC=O 62a_100000139335_100011933949 [0,2,0,0,0,0|0,0,1]=3 14547 B16R0.303 C=CCCCCCCCCSCCCCC=O 62a_100011933949_100000139335 [0,2,0,0,0,0|0,0,1]=3 14548 B16R0.303 C=CCCCCCCCCSCCCCCF 62a_100000729378_100011933949 [0,2,0,0,0,0|1,0,0]=3 14549 B16R0.303 C=CCCCCCCCCSCCCCCF 62a_100011933949_100000729378 [0,2,0,0,0,0|1,0,0]=3 14550 B16R0.303 C=CCCCCCCCCSCCCCCO 62a_100000746330_100011933949 [0,2,0,0,0,0|1,0,0]=3 14551 B16R0.303 C=CCCCCCCCCSCCCCCO 62a_100011933949_100000746330 [0,2,0,0,0,0|1,0,0]=3 14552 B16R0.303 C=CCCCCCCCCSCCCCOC 62a_100000730899_100011933949 [0,2,0,0,0,0|1,0,0]=3 14553 B16R0.303 C=CCCCCCCCCSCCCCOC 62a_100011933949_100000730899 [0,2,0,0,0,0|1,0,0]=3 14554 B16R0.303 C=CCCCCCCCCSCCCOCC 62a_100011933949_100012232248 [0,2,0,0,0,0|1,0,0]=3 14555 B16R0.303 C=CCCCCCCCCSCCCOCC 62a_100012232248_100011933949 [0,2,0,0,0,0|1,0,0]=3 14556 B16R0.303 C=CCCCCCCCCSCCOCCC 62a_100011215938_100011933949 [0,2,0,0,0,0|1,0,0]=3 14557 B16R0.303 C=CCCCCCCCCSCCOCCC 62a_100011933949_100011215938 [0,2,0,0,0,0|1,0,0]=3 14558 B16R0.303 C=CCCCCCCCCSCCOCCO 62a_100011215305_100011933949 [0,2,0,0,0,0|2,0,0]=4 14559 B16R0.303 C=CCCCCCCCCSCCOCCO 62a_100011933949_100011215305 [0,2,0,0,0,0|2,0,0]=4 14560 B16R0.303 C=CCCCCCCCCSCOCCCC 62a_100011933949_100011995733 [0,2,0,0,0,0|1,0,0]=3 14561 B16R0.303 C=CCCCCCCCCSCOCCCC 62a_100011995733_100011933949 [0,2,0,0,0,0|1,0,0]=3 14562 B16R0.303 C=CCCCCCCCCSCOCCOC 62a_100000231047_100011933949 [0,2,0,0,0,0|2,0,0]=4 14563 B16R0.303 C=CCCCCCCCCSCOCCOC 62a_100011933949_100000231047 [0,2,0,0,0,0|2,0,0]=4 14564 B16R0.303 C=CCCCCCCCNCCCCCCC 2230a_100000229938_100012355270 [0,2,0,0,0,0|1,0,0]=3 14565 B16R0.303 C=CCCCCCCCNCCCCCCO 2230a_100000686447_100012355270 [0,2,0,0,0,0|1,0,0]=3 14566 B16R0.303 C=CCCCCCCCNCCCCCCO 34a_100000686447_100012355270 [0,2,0,0,0,0|1,0,0]=3 14567 B16R0.303 C=CCCCCCCCNCCCCCOC 2230a_100000747528_100012355270 [0,2,0,0,0,0|1,0,0]=3 14568 B16R0.303 C=CCCCCCCCNCCCCCOC 34a_100000747528_100012355270 [0,2,0,0,0,0|1,0,0]=3 14569 B16R0.303 C=CCCCCCCCNCCCOCCC 2230a_100011217757_100012355270 [0,2,0,0,0,0|1,0,0]=3 14570 B16R0.303 C=CCCCCCCCNCCCOCCC 34a_100011217757_100012355270 [0,2,0,0,0,0|1,0,0]=3 14571 B16R0.303 C=CCCCCCCCNCCOCCOC 2230a_100000745349_100012355270 [0,2,0,0,0,0|2,0,0]=4 14572 B16R0.303 C=CCCCCCCCNCCOCCOC 34a_100000745349_100012355270 [0,2,0,0,0,0|2,0,0]=4 14573 B16R0.303 C=CCCCCCCCNCCSCCCC 2230a_100025743550_100012355270 [0,2,0,0,0,0|1,0,0]=3 14574 B16R0.303 C=CCCCCCCCOC/C=C/CCCC 34a_200016272032_100012355270 [0,2,0,0,0,0|1,0,1]=4 14575 B16R0.303 C=CCCCCCCCOC/C=C/CCCC 7a_200016272032_100012355270 [0,2,0,0,0,0|1,0,1]=4 14576 B16R0.303 C=CCCCCCCCOCC#CCCCC 34a_200000034558_100012355270 [0,2,0,0,0,0|1,0,1]=4 14577 B16R0.303 C=CCCCCCCCOCC#CCCCC 7a_200000034558_100012355270 [0,2,0,0,0,0|1,0,1]=4 14578 B16R0.303 C=CCCCCCCCOCCC#CCCC 34a_100000042726_100012355270 [0,2,0,0,0,0|1,0,1]=4 14579 B16R0.303 C=CCCCCCCCOCCC#CCCC 7a_100000042726_100012355270 [0,2,0,0,0,0|1,0,1]=4 14580 B16R0.303 C=CCCCCCCCOCCC/C=C/CC 34a_100016287902_100012355270 [0,2,0,0,0,0|1,0,1]=4 14581 B16R0.303 C=CCCCCCCCOCCC/C=C/CC 7a_100016287902_100012355270 [0,2,0,0,0,0|1,0,1]=4 14582 B16R0.303 C=CCCCCCCCOCCCCCC#N 7a_100000730831_100009813376 [0,2,0,0,0,0|1,0,1]=4 14583 B16R0.303 C=CCCCCCCCOCCCCCC=C 34a_100000730831_100000700193 [0,2,0,0,0,0|1,0,1]=4 14584 B16R0.303 C=CCCCCCCCOCCCCCC=C 34a_100011216702_100012355270 [0,2,0,0,0,0|1,0,1]=4 14585 B16R0.303 C=CCCCCCCCOCCCCCC=C 7a_100000730831_100000700193 [0,2,0,0,0,0|1,0,1]=4 14586 B16R0.303 C=CCCCCCCCOCCCCCC=C 7a_100011216702_100012355270 [0,2,0,0,0,0|1,0,1]=4 14587 B16R0.303 C=CCCCCCCCOCCCCCC=O 7a_100000730831_100000139337 [0,2,0,0,0,0|0,0,1]=3 14588 B16R0.303 C=CCCCCCCCOCCCCCCBr 34a_100011215345_100012355270 [0,2,0,0,0,0|1,0,0]=3 14589 B16R0.303 C=CCCCCCCCOCCCCCCBr 7a_100011215345_100012355270 [0,2,0,0,0,0|1,0,0]=3 14590 B16R0.303 C=CCCCCCCCOCCCCCCC 34a_100000210272_100012355270 [0,2,0,0,0,0|1,0,0]=3 14591 B16R0.303 C=CCCCCCCCOCCCCCCC 34a_100000730831_100000210614 [0,2,0,0,0,0|1,0,0]=3 14592 B16R0.303 C=CCCCCCCCOCCCCCCC 7a_100000210272_100012355270 [0,2,0,0,0,0|1,0,0]=3 14593 B16R0.303 C=CCCCCCCCOCCCCCCC 7a_100000730831_100000210614 [0,2,0,0,0,0|1,0,0]=3 14594 B16R0.303 C=CCCCCCCCOCCCCCCCl 34a_100000766143_100012355270 [0,2,0,0,0,0|1,0,0]=3 14595 B16R0.303 C=CCCCCCCCOCCCCCCCl 7a_100000766143_100012355270 [0,2,0,0,0,0|1,0,0]=3 14596 B16R0.303 C=CCCCCCCCOCCCCCCF 34a_100000730831_100015922095 [0,2,0,0,0,0|1,0,0]=3 14597 B16R0.303 C=CCCCCCCCOCCCCCCF 34a_100000732779_100012355270 [0,2,0,0,0,0|1,0,0]=3 14598 B16R0.303 C=CCCCCCCCOCCCCCCF 7a_100000730831_100015922095 [0,2,0,0,0,0|1,0,0]=3 14599 B16R0.303 C=CCCCCCCCOCCCCCCF 7a_100000732779_100012355270 [0,2,0,0,0,0|1,0,0]=3 14600 B16R0.303 C=CCCCCCCCOCCCCCCN 34a_100000686447_100012355270 [0,2,0,0,0,0|1,0,0]=3 14601 B16R0.303 C=CCCCCCCCOCCCCCCO 34a_100000730831_100000766143 [0,2,0,0,0,0|1,0,0]=3 14602 B16R0.303 C=CCCCCCCCOCCCCCCO 7a_100000730831_100000766143 [0,2,0,0,0,0|1,0,0]=3 14603 B16R0.303 C=CCCCCCCCOCCCCCNC 34a_100000722520_100012355270 [0,2,0,0,0,0|1,0,0]=3 14604 B16R0.303 C=CCCCCCCCOCCOCCCC 34a_100000210238_100012355270 [0,2,0,0,0,0|1,0,0]=3 14605 B16R0.303 C=CCCCCCCCOCCOCCCC 34a_100000730831_100000743108 [0,2,0,0,0,0|1,0,0]=3 14606 B16R0.303 C=CCCCCCCCOCCOCCCC 7a_100000210238_100012355270 [0,2,0,0,0,0|1,0,0]=3 14607 B16R0.303 C=CCCCCCCCOCCOCCCC 7a_100000730831_100000743108 [0,2,0,0,0,0|1,0,0]=3 14608 B16R0.303 C=CCCCCCCCOCCOCCNC 34a_100000228057_100012355270 [0,2,0,0,0,0|2,0,0]=4 14609 B16R0.303 C=CCCCCCCCOCCOCCOC 34a_100000730831_100000695917 [0,2,0,0,0,0|2,0,0]=4 14610 B16R0.303 C=CCCCCCCCOCCOCCOC 34a_100011215163_100012355270 [0,2,0,0,0,0|2,0,0]=4 14611 B16R0.303 C=CCCCCCCCOCCOCCOC 7a_100000730831_100000695917 [0,2,0,0,0,0|2,0,0]=4 14612 B16R0.303 C=CCCCCCCCOCCOCCOC 7a_100011215163_100012355270 [0,2,0,0,0,0|2,0,0]=4 14613 B16R0.303 C=CCCCCCCCOCCSCCCC 34a_200000230436_100012355270 [0,2,0,0,0,0|1,0,0]=3 14614 B16R0.303 C=CCCCCCCCOCCSCCCC 7a_200000230436_100012355270 [0,2,0,0,0,0|1,0,0]=3 14615 B16R0.303 C=CCCCCCCCSCCCCCC#N 62a_100009813376_100012355270 [0,2,0,0,0,0|1,0,1]=4 14616 B16R0.303 C=CCCCCCCCSCCCCCC#N 62a_100012355270_100009813376 [0,2,0,0,0,0|1,0,1]=4 14617 B16R0.303 C=CCCCCCCCSCCCCCC=C 62a_100000700193_100012355270 [0,2,0,0,0,0|1,0,1]=4 14618 B16R0.303 C=CCCCCCCCSCCCCCC=C 62a_100012355270_100000700193 [0,2,0,0,0,0|1,0,1]=4 14619 B16R0.303 C=CCCCCCCCSCCCCCC=O 62a_100000139337_100012355270 [0,2,0,0,0,0|0,0,1]=3 14620 B16R0.303 C=CCCCCCCCSCCCCCC=O 62a_100012355270_100000139337 [0,2,0,0,0,0|0,0,1]=3 14621 B16R0.303 C=CCCCCCCCSCCCCCCF 62a_100012355270_100015922095 [0,2,0,0,0,0|1,0,0]=3 14622 B16R0.303 C=CCCCCCCCSCCCCCCF 62a_100015922095_100012355270 [0,2,0,0,0,0|1,0,0]=3 14623 B16R0.303 C=CCCCCCCCSCCCCCCO 62a_100000766143_100012355270 [0,2,0,0,0,0|1,0,0]=3 14624 B16R0.303 C=CCCCCCCCSCCCCCCO 62a_100012355270_100000766143 [0,2,0,0,0,0|1,0,0]=3 14625 B16R0.303 C=CCCCCCCCSCCOCCCC 62a_100000743108_100012355270 [0,2,0,0,0,0|1,0,0]=3 14626 B16R0.303 C=CCCCCCCCSCCOCCCC 62a_100012355270_100000743108 [0,2,0,0,0,0|1,0,0]=3 14627 B16R0.303 C=CCCCCCCCSCCOCCOC 62a_100000695917_100012355270 [0,2,0,0,0,0|2,0,0]=4 14628 B16R0.303 C=CCCCCCCCSCCOCCOC 62a_100012355270_100000695917 [0,2,0,0,0,0|2,0,0]=4 14629 B16R0.303 C=CCCCCCCNCCCCCCCC 2230a_100000229939_100011215473 [0,2,0,0,0,0|1,0,0]=3 14630 B16R0.303 C=CCCCCCCNCCCCCCCC 34a_100000229939_100011215473 [0,2,0,0,0,0|1,0,0]=3 14631 B16R0.303 C=CCCCCCCNCCCCCCCO 2230a_100011996573_100011215473 [0,2,0,0,0,0|1,0,0]=3 14632 B16R0.303 C=CCCCCCCNCCCCCCCO 34a_100011996573_100011215473 [0,2,0,0,0,0|1,0,0]=3 14633 B16R0.303 C=CCCCCCCNCCCOCCCC 2230a_200000211371_100011215473 [0,2,0,0,0,0|1,0,0]=3 14634 B16R0.303 C=CCCCCCCNCCCOCCCC 34a_200000211371_100011215473 [0,2,0,0,0,0|1,0,0]=3 14635 B16R0.303 C=CCCCCCCNCCCOCCCO 2230a_100011310245_100011215473 [0,2,0,0,0,0|2,0,0]=4 14636 B16R0.303 C=CCCCCCCNCCCOCCCO 34a_100011310245_100011215473 [0,2,0,0,0,0|2,0,0]=4 14637 B16R0.303 C=CCCCCCCNCCCOCCOC 2230a_100000206027_100011215473 [0,2,0,0,0,0|2,0,0]=4 14638 B16R0.303 C=CCCCCCCNCCCOCCOC 34a_100000206027_100011215473 [0,2,0,0,0,0|2,0,0]=4 14639 B16R0.303 C=CCCCCCCNCCOCCOCC 2230a_100102712874_100011215473 [0,2,0,0,0,0|2,0,0]=4 14640 B16R0.303 C=CCCCCCCNCCOCCOCC 34a_100102712874_100011215473 [0,2,0,0,0,0|2,0,0]=4 14641 B16R0.303 C=CCCCCCCOC/C=C/CCCCC 34a_100016258190_100011215473 [0,2,0,0,0,0|1,0,1]=4 14642 B16R0.303 C=CCCCCCCOC/C=C/CCCCC 7a_100016258190_100011215473 [0,2,0,0,0,0|1,0,1]=4 14643 B16R0.303 C=CCCCCCCOCC#CCCCCC 34a_200000033628_100011215473 [0,2,0,0,0,0|1,0,1]=4 14644 B16R0.303 C=CCCCCCCOCC#CCCCCC 34a_200011216477_100009816472 [0,2,0,0,0,0|1,0,1]=4 14645 B16R0.303 C=CCCCCCCOCC#CCCCCC 7a_200000033628_100011215473 [0,2,0,0,0,0|1,0,1]=4 14646 B16R0.303 C=CCCCCCCOCC#CCCCCC 7a_200011216477_100009816472 [0,2,0,0,0,0|1,0,1]=4 14647 B16R0.303 C=CCCCCCCOCC/C=C\CCCC 34a_200016286491_100011215473 [0,2,0,0,0,0|1,0,1]=4 14648 B16R0.303 C=CCCCCCCOCC/C=C\CCCC 7a_200016286491_100011215473 [0,2,0,0,0,0|1,0,1]=4 14649 B16R0.303 C=CCCCCCCOCCC#CCCCC 34a_100000037610_100011215473 [0,2,0,0,0,0|1,0,1]=4 14650 B16R0.303 C=CCCCCCCOCCC#CCCCC 7a_100000037610_100011215473 [0,2,0,0,0,0|1,0,1]=4 14651 B16R0.303 C=CCCCCCCOCCCC/C=C\CC 34a_100016287862_100011215473 [0,2,0,0,0,0|1,0,1]=4 14652 B16R0.303 C=CCCCCCCOCCCC/C=C\CC 7a_100016287862_100011215473 [0,2,0,0,0,0|1,0,1]=4 14653 B16R0.303 C=CCCCCCCOCCCCCCC#N 7a_200011216477_100009813337 [0,2,0,0,0,0|1,0,1]=4 14654 B16R0.303 C=CCCCCCCOCCCCCCC=C 34a_200011216477_100011215473 [0,2,0,0,0,0|1,0,1]=4 14655 B16R0.303 C=CCCCCCCOCCCCCCC=C 7a_200011216477_100011215473 [0,2,0,0,0,0|1,0,1]=4 14656 B16R0.303 C=CCCCCCCOCCCCCCCBr 34a_100000760002_100011215473 [0,2,0,0,0,0|1,0,0]=3 14657 B16R0.303 C=CCCCCCCOCCCCCCCBr 7a_100000760002_100011215473 [0,2,0,0,0,0|1,0,0]=3 14658 B16R0.303 C=CCCCCCCOCCCCCCCC 34a_100000210232_100011215473 [0,2,0,0,0,0|1,0,0]=3 14659 B16R0.303 C=CCCCCCCOCCCCCCCC 34a_200011216477_100000210759 [0,2,0,0,0,0|1,0,0]=3 14660 B16R0.303 C=CCCCCCCOCCCCCCCC 7a_100000210232_100011215473 [0,2,0,0,0,0|1,0,0]=3 14661 B16R0.303 C=CCCCCCCOCCCCCCCC 7a_200011216477_100000210759 [0,2,0,0,0,0|1,0,0]=3 14662 B16R0.303 C=CCCCCCCOCCCCCCCN 34a_100011996573_100011215473 [0,2,0,0,0,0|1,0,0]=3 14663 B16R0.303 C=CCCCCCCOCCCCCCCO 34a_200011216477_100000760002 [0,2,0,0,0,0|1,0,0]=3 14664 B16R0.303 C=CCCCCCCOCCCCCCCO 7a_200011216477_100000760002 [0,2,0,0,0,0|1,0,0]=3 14665 B16R0.303 C=CCCCCCCOCCCCCCOC 34a_200011216477_100011998445 [0,2,0,0,0,0|1,0,0]=3 14666 B16R0.303 C=CCCCCCCOCCCCCCOC 34a_200012092642_100011215473 [0,2,0,0,0,0|1,0,0]=3 14667 B16R0.303 C=CCCCCCCOCCCCCCOC 7a_200011216477_100011998445 [0,2,0,0,0,0|1,0,0]=3 14668 B16R0.303 C=CCCCCCCOCCCCCCOC 7a_200012092642_100011215473 [0,2,0,0,0,0|1,0,0]=3 14669 B16R0.303 C=CCCCCCCOCCCOCCCC 34a_200011215613_100011215473 [0,2,0,0,0,0|1,0,0]=3 14670 B16R0.303 C=CCCCCCCOCCCOCCCC 7a_200011215613_100011215473 [0,2,0,0,0,0|1,0,0]=3 14671 B16R0.303 C=CCCCCCCOCCCOCCCN 34a_100011310245_100011215473 [0,2,0,0,0,0|2,0,0]=4 14672 B16R0.303 C=CCCCCCCOCCCOCCOC 34a_200011216477_100011216529 [0,2,0,0,0,0|2,0,0]=4 14673 B16R0.303 C=CCCCCCCOCCCOCCOC 7a_200011216477_100011216529 [0,2,0,0,0,0|2,0,0]=4 14674 B16R0.303 C=CCCCCCCOCCNCCCCC 34a_100000224656_100011215473 [0,2,0,0,0,0|1,0,0]=3 14675 B16R0.303 C=CCCCCCCOCCOCCCCC 34a_100011215259_100011215473 [0,2,0,0,0,0|1,0,0]=3 14676 B16R0.303 C=CCCCCCCOCCOCCCCC 7a_100011215259_100011215473 [0,2,0,0,0,0|1,0,0]=3 14677 B16R0.303 C=CCCCCCCOCCOCCOCC 34a_100000210240_100011215473 [0,2,0,0,0,0|2,0,0]=4 14678 B16R0.303 C=CCCCCCCOCCOCCOCC 34a_200011216477_100011211534 [0,2,0,0,0,0|2,0,0]=4 14679 B16R0.303 C=CCCCCCCOCCOCCOCC 7a_100000210240_100011215473 [0,2,0,0,0,0|2,0,0]=4 14680 B16R0.303 C=CCCCCCCOCCOCCOCC 7a_200011216477_100011211534 [0,2,0,0,0,0|2,0,0]=4 14681 B16R0.303 C=CCCCCCCSCC#CCCCCC 62a_100009816472_100011215473 [0,2,0,0,0,0|1,0,1]=4 14682 B16R0.303 C=CCCCCCCSCC#CCCCCC 62a_100011215473_100009816472 [0,2,0,0,0,0|1,0,1]=4 14683 B16R0.303 C=CCCCCCCSCCCCCCC#N 62a_100009813337_100011215473 [0,2,0,0,0,0|1,0,1]=4 14684 B16R0.303 C=CCCCCCCSCCCCCCC#N 62a_100011215473_100009813337 [0,2,0,0,0,0|1,0,1]=4 14685 B16R0.303 C=CCCCCCCSCCCCCCC=C 62a_100011215473_100011215473 [0,2,0,0,0,0|1,0,1]=4 14686 B16R0.303 C=CCCCCCCSCCCCCCCO 62a_100000760002_100011215473 [0,2,0,0,0,0|1,0,0]=3 14687 B16R0.303 C=CCCCCCCSCCCCCCCO 62a_100011215473_100000760002 [0,2,0,0,0,0|1,0,0]=3 14688 B16R0.303 C=CCCCCCCSCCCCCCOC 62a_100011215473_100011998445 [0,2,0,0,0,0|1,0,0]=3 14689 B16R0.303 C=CCCCCCCSCCCCCCOC 62a_100011998445_100011215473 [0,2,0,0,0,0|1,0,0]=3 14690 B16R0.303 C=CCCCCCCSCCCOCCOC 62a_100011215473_100011216529 [0,2,0,0,0,0|2,0,0]=4 14691 B16R0.303 C=CCCCCCCSCCCOCCOC 62a_100011216529_100011215473 [0,2,0,0,0,0|2,0,0]=4 14692 B16R0.303 C=CCCCCCCSCCOCCOCC 62a_100011211534_100011215473 [0,2,0,0,0,0|2,0,0]=4 14693 B16R0.303 C=CCCCCCCSCCOCCOCC 62a_100011215473_100011211534 [0,2,0,0,0,0|2,0,0]=4 14694 B16R0.303 C=CCCCCCNCCCCCCCCC 2230a_100000212291_100000700193 [0,2,0,0,0,0|1,0,0]=3 14695 B16R0.303 C=CCCCCCNCCCCCCCCC 34a_100000212291_100000700193 [0,2,0,0,0,0|1,0,0]=3 14696 B16R0.303 C=CCCCCCNCCCCCCCCO 2230a_102515433106_100000700193 [0,2,0,0,0,0|1,0,0]=3 14697 B16R0.303 C=CCCCCCNCCCCCCCCO 34a_102515433106_100000700193 [0,2,0,0,0,0|1,0,0]=3 14698 B16R0.303 C=CCCCCCNCCOCCOCCC 2230a_200011904461_100000700193 [0,2,0,0,0,0|2,0,0]=4 14699 B16R0.303 C=CCCCCCNCCOCCOCCC 34a_200011904461_100000700193 [0,2,0,0,0,0|2,0,0]=4 14700 B16R0.303 C=CCCCCCOC/C=C/CCCCCC 34a_200016276170_100000700193 [0,2,0,0,0,0|1,0,1]=4 14701 B16R0.303 C=CCCCCCOC/C=C/CCCCCC 7a_200016276170_100000700193 [0,2,0,0,0,0|1,0,1]=4 14702 B16R0.303 C=CCCCCCOCC#CCCCCCC 34a_200000037284_100000700193 [0,2,0,0,0,0|1,0,1]=4 14703 B16R0.303 C=CCCCCCOCC#CCCCCCC 7a_200000037284_100000700193 [0,2,0,0,0,0|1,0,1]=4 14704 B16R0.303 C=CCCCCCOCC/C=C\CCCCC 34a_100016277358_100000700193 [0,2,0,0,0,0|1,0,1]=4 14705 B16R0.303 C=CCCCCCOCC/C=C\CCCCC 7a_100016277358_100000700193 [0,2,0,0,0,0|1,0,1]=4 14706 B16R0.303 C=CCCCCCOCCC#CCCCCC 34a_200000042877_100000700193 [0,2,0,0,0,0|1,0,1]=4 14707 B16R0.303 C=CCCCCCOCCC#CCCCCC 7a_200000042877_100000700193 [0,2,0,0,0,0|1,0,1]=4 14708 B16R0.303 C=CCCCCCOCCCC#CCCCC 34a_100011216702_200000047210 [0,2,0,0,0,0|1,0,1]=4 14709 B16R0.303 C=CCCCCCOCCCC#CCCCC 7a_100011216702_200000047210 [0,2,0,0,0,0|1,0,1]=4 14710 B16R0.303 C=CCCCCCOCCCCC/C=C\CC 34a_100016268722_100000700193 [0,2,0,0,0,0|1,0,1]=4 14711 B16R0.303 C=CCCCCCOCCCCC/C=C\CC 7a_100016268722_100000700193 [0,2,0,0,0,0|1,0,1]=4 14712 B16R0.303 C=CCCCCCOCCCCCCCCBr 34a_100009813846_100000700193 [0,2,0,0,0,0|1,0,0]=3 14713 B16R0.303 C=CCCCCCOCCCCCCCCBr 7a_100009813846_100000700193 [0,2,0,0,0,0|1,0,0]=3 14714 B16R0.303 C=CCCCCCOCCCCCCCCC 34a_100000210712_100000700193 [0,2,0,0,0,0|1,0,0]=3 14715 B16R0.303 C=CCCCCCOCCCCCCCCC 34a_100011216702_100011214924 [0,2,0,0,0,0|1,0,0]=3 14716 B16R0.303 C=CCCCCCOCCCCCCCCC 7a_100000210712_100000700193 [0,2,0,0,0,0|1,0,0]=3 14717 B16R0.303 C=CCCCCCOCCCCCCCCC 7a_100011216702_100000210328 [0,2,0,0,0,0|1,0,0]=3 14718 B16R0.303 C=CCCCCCOCCCCCCCCCl 34a_100000033203_100000700193 [0,2,0,0,0,0|1,0,0]=3 14719 B16R0.303 C=CCCCCCOCCCCCCCCCl 7a_100000033203_100000700193 [0,2,0,0,0,0|1,0,0]=3 14720 B16R0.303 C=CCCCCCOCCCCCCCCN 34a_102515433106_100000700193 [0,2,0,0,0,0|1,0,0]=3 14721 B16R0.303 C=CCCCCCOCCCCCCCCO 34a_100011216702_100000033203 [0,2,0,0,0,0|1,0,0]=3 14722 B16R0.303 C=CCCCCCOCCCCCCCCO 7a_100011216702_100000033203 [0,2,0,0,0,0|1,0,0]=3 14723 B16R0.303 C=CCCCCCOCCCCCNCCN 34a_103619048469_100000700193 [0,2,0,0,0,0|2,0,0]=4 14724 B16R0.303 C=CCCCCCOCCCCNCCCC 34a_200011216965_100000700193 [0,2,0,0,0,0|1,0,0]=3 14725 B16R0.303 C=CCCCCCOCCCCOCCCC 34a_200000760531_100000700193 [0,2,0,0,0,0|1,0,0]=3 14726 B16R0.303 C=CCCCCCOCCCCOCCCC 7a_200000760531_100000700193 [0,2,0,0,0,0|1,0,0]=3 14727 B16R0.303 C=CCCCCCOCCCOCCCOC 34a_200011215475_100000700193 [0,2,0,0,0,0|2,0,0]=4 14728 B16R0.303 C=CCCCCCOCCCOCCCOC 7a_200011215475_100000700193 [0,2,0,0,0,0|2,0,0]=4 14729 B16R0.303 C=CCCCCCOCCOCCCCCC 34a_100000691444_100000700193 [0,2,0,0,0,0|1,0,0]=3 14730 B16R0.303 C=CCCCCCOCCOCCCCCC 7a_100000691444_100000700193 [0,2,0,0,0,0|1,0,0]=3 14731 B16R0.303 C=CCCCCCSCCCC#CCCCC 62a_100000700193_200000047210 [0,2,0,0,0,0|1,0,1]=4 14732 B16R0.303 C=CCCCCCSCCCC#CCCCC 62a_200000047210_100000700193 [0,2,0,0,0,0|1,0,1]=4 14733 B16R0.303 C=CCCCCCSCCCCCCCCO 62a_100000033203_100000700193 [0,2,0,0,0,0|1,0,0]=3 14734 B16R0.303 C=CCCCCCSCCCCCCCCO 62a_100000700193_100000033203 [0,2,0,0,0,0|1,0,0]=3 14735 B16R0.303 C=CCCCCNCCCCCCC#CCC 2230a_100000703577_200000036426 [0,2,0,0,0,0|1,0,1]=4 14736 B16R0.303 C=CCCCCNCCCCCCC#CCC 34a_100000703577_200000036426 [0,2,0,0,0,0|1,0,1]=4 14737 B16R0.303 C=CCCCCNCCCCCCCCCC 2230a_100000684558_100011215482 [0,2,0,0,0,0|1,0,0]=3 14738 B16R0.303 C=CCCCCNCCCCCCCCCC 2230a_100000703577_100000210320 [0,2,0,0,0,0|1,0,0]=3 14739 B16R0.303 C=CCCCCNCCCCCCCCCC 34a_100000684558_100011215482 [0,2,0,0,0,0|1,0,0]=3 14740 B16R0.303 C=CCCCCNCCCCCCCCCC 34a_100000703577_100000210320 [0,2,0,0,0,0|1,0,0]=3 14741 B16R0.303 C=CCCCCNCCCCCCCCCO 2230a_100000078944_100011215482 [0,2,0,0,0,0|1,0,0]=3 14742 B16R0.303 C=CCCCCNCCCCCCCCCO 2230a_100000703577_100009813782 [0,2,0,0,0,0|1,0,0]=3 14743 B16R0.303 C=CCCCCNCCCCCCCCCO 34a_100000078944_100011215482 [0,2,0,0,0,0|1,0,0]=3 14744 B16R0.303 C=CCCCCNCCCCCCCCCO 34a_100000703577_100009813782 [0,2,0,0,0,0|1,0,0]=3 14745 B16R0.303 C=CCCCCOCC#CCCCCCCC 34a_200000061759_100011215482 [0,2,0,0,0,0|1,0,1]=4 14746 B16R0.303 C=CCCCCOCC#CCCCCCCC 7a_200000061759_100011215482 [0,2,0,0,0,0|1,0,1]=4 14747 B16R0.303 C=CCCCCOCCC#CCCCCCC 34a_200000033163_100011215482 [0,2,0,0,0,0|1,0,1]=4 14748 B16R0.303 C=CCCCCOCCC#CCCCCCC 7a_200000033163_100011215482 [0,2,0,0,0,0|1,0,1]=4 14749 B16R0.303 C=CCCCCOCCC/C=C\CCCCC 34a_100020655193_100011215482 [0,2,0,0,0,0|1,0,1]=4 14750 B16R0.303 C=CCCCCOCCC/C=C\CCCCC 7a_100020655193_100011215482 [0,2,0,0,0,0|1,0,1]=4 14751 B16R0.303 C=CCCCCOCCCC/C=C/CCCC 34a_200020645093_100011215482 [0,2,0,0,0,0|1,0,1]=4 14752 B16R0.303 C=CCCCCOCCCC/C=C/CCCC 7a_200020645093_100011215482 [0,2,0,0,0,0|1,0,1]=4 14753 B16R0.303 C=CCCCCOCCCCC#CCCCC 34a_200000066234_100011215482 [0,2,0,0,0,0|1,0,1]=4 14754 B16R0.303 C=CCCCCOCCCCC#CCCCC 7a_200000066234_100011215482 [0,2,0,0,0,0|1,0,1]=4 14755 B16R0.303 C=CCCCCOCCCCCCC#CCC 34a_100000766645_200000036426 [0,2,0,0,0,0|1,0,1]=4 14756 B16R0.303 C=CCCCCOCCCCCCC#CCC 7a_100000766645_200000036426 [0,2,0,0,0,0|1,0,1]=4 14757 B16R0.303 C=CCCCCOCCCCCCCCCBr 34a_100009813782_100011215482 [0,2,0,0,0,0|1,0,0]=3 14758 B16R0.303 C=CCCCCOCCCCCCCCCBr 7a_100009813782_100011215482 [0,2,0,0,0,0|1,0,0]=3 14759 B16R0.303 C=CCCCCOCCCCCCCCCC 34a_100000210711_100011215482 [0,2,0,0,0,0|1,0,0]=3 14760 B16R0.303 C=CCCCCOCCCCCCCCCC 34a_100000766645_100000210320 [0,2,0,0,0,0|1,0,0]=3 14761 B16R0.303 C=CCCCCOCCCCCCCCCC 7a_100000210711_100011215482 [0,2,0,0,0,0|1,0,0]=3 14762 B16R0.303 C=CCCCCOCCCCCCCCCC 7a_100000766645_100000210320 [0,2,0,0,0,0|1,0,0]=3 14763 B16R0.303 C=CCCCCOCCCCCCCCCCl 34a_100009868337_100011215482 [0,2,0,0,0,0|1,0,0]=3 14764 B16R0.303 C=CCCCCOCCCCCCCCCCl 7a_100009868337_100011215482 [0,2,0,0,0,0|1,0,0]=3 14765 B16R0.303 C=CCCCCOCCCCCCCCCN 34a_100000078944_100011215482 [0,2,0,0,0,0|1,0,0]=3 14766 B16R0.303 C=CCCCCOCCCCCCCCCO 34a_100000766645_100009813782 [0,2,0,0,0,0|1,0,0]=3 14767 B16R0.303 C=CCCCCOCCCCCCCCCO 7a_100000766645_100009813782 [0,2,0,0,0,0|1,0,0]=3 14768 B16R0.303 C=CCCCCOCCOCCOCCCC 34a_100011215186_100011215482 [0,2,0,0,0,0|2,0,0]=4 14769 B16R0.303 C=CCCCCOCCOCCOCCCC 7a_100011215186_100011215482 [0,2,0,0,0,0|2,0,0]=4 14770 B16R0.303 C=CCCCCSCCCCCCC#CCC 62a_100011215482_200000036426 [0,2,0,0,0,0|1,0,1]=4 14771 B16R0.303 C=CCCCCSCCCCCCC#CCC 62a_200000036426_100011215482 [0,2,0,0,0,0|1,0,1]=4 14772 B16R0.303 C=CCCCCSCCCCCCCCCO 62a_100009813782_100011215482 [0,2,0,0,0,0|1,0,0]=3 14773 B16R0.303 C=CCCCCSCCCCCCCCCO 62a_100011215482_100009813782 [0,2,0,0,0,0|1,0,0]=3 14774 B16R0.303 C=CCCCNCCCCCCC/C=C\CC 269862a_100000700776_200025770492 [0,2,0,0,0,0|1,0,1]=4 14775 B16R0.303 C=CCCCNCCCCCCCCCCC 2230a_100000700776_100011215454 [0,2,0,0,0,0|1,0,0]=3 14776 B16R0.303 C=CCCCNCCCCCCCCCCC 2230a_200011215754_100011713584 [0,2,0,0,0,0|1,0,0]=3 14777 B16R0.303 C=CCCCNCCCCCCCCCCC 34a_100000700776_100011215454 [0,2,0,0,0,0|1,0,0]=3 14778 B16R0.303 C=CCCCNCCCCCCCCCCC 34a_200011215754_100000757094 [0,2,0,0,0,0|1,0,0]=3 14779 B16R0.303 C=CCCCNCCCCCCCCCCO 2230a_100000066964_100011713584 [0,2,0,0,0,0|1,0,0]=3 14780 B16R0.303 C=CCCCNCCCCCCCCCCO 2230a_100000700776_100009813290 [0,2,0,0,0,0|1,0,0]=3 14781 B16R0.303 C=CCCCNCCCCCCCCCCO 34a_100000066964_100000757094 [0,2,0,0,0,0|1,0,0]=3 14782 B16R0.303 C=CCCCNCCCCCCCCCCO 34a_100000700776_100009813290 [0,2,0,0,0,0|1,0,0]=3 14783 B16R0.303 C=CCCCOC/C=C/CCCCCCCC 34a_200020667288_100000757094 [0,2,0,0,0,0|1,0,1]=4 14784 B16R0.303 C=CCCCOC/C=C/CCCCCCCC 7a_200020667288_100000757094 [0,2,0,0,0,0|1,0,1]=4 14785 B16R0.303 C=CCCCOCCCCCCCCCCBr 34a_100009813290_100000757094 [0,2,0,0,0,0|1,0,0]=3 14786 B16R0.303 C=CCCCOCCCCCCCCCCBr 7a_100009813290_100000757094 [0,2,0,0,0,0|1,0,0]=3 14787 B16R0.303 C=CCCCOCCCCCCCCCCC 34a_100000210809_100000757094 [0,2,0,0,0,0|1,0,0]=3 14788 B16R0.303 C=CCCCOCCCCCCCCCCC 34a_100000758997_100011215454 [0,2,0,0,0,0|1,0,0]=3 14789 B16R0.303 C=CCCCOCCCCCCCCCCC 7a_100000210809_100000757094 [0,2,0,0,0,0|1,0,0]=3 14790 B16R0.303 C=CCCCOCCCCCCCCCCC 7a_100000758997_100011215454 [0,2,0,0,0,0|1,0,0]=3 14791 B16R0.303 C=CCCCOCCCCCCCCCCCl 34a_200000033068_100000757094 [0,2,0,0,0,0|1,0,0]=3 14792 B16R0.303 C=CCCCOCCCCCCCCCCCl 7a_200000033068_100000757094 [0,2,0,0,0,0|1,0,0]=3 14793 B16R0.303 C=CCCCOCCCCCCCCCCN 34a_100000066964_100000757094 [0,2,0,0,0,0|1,0,0]=3 14794 B16R0.303 C=CCCCOCCCCCCCCCCO 34a_100000758997_100009813290 [0,2,0,0,0,0|1,0,0]=3 14795 B16R0.303 C=CCCCOCCCCCCCCCCO 7a_100000758997_100009813290 [0,2,0,0,0,0|1,0,0]=3 14796 B16R0.303 C=CCCCSCCCCCCCCCCO 62a_100009813290_100000757094 [0,2,0,0,0,0|1,0,0]=3 14797 B16R0.303 C=CCCCSCCCCCCCCCCO 62a_100011713584_200000033068 [0,2,0,0,0,0|1,0,0]=3 14798 B16R0.303 C=CCCNCCCCCCC#CCCCC 2230a_100015191253_200000043322 [0,2,0,0,0,0|1,0,1]=4 14799 B16R0.303 C=CCCNCCCCCCCCCCCC 2230a_100000210451_100000754431 [0,2,0,0,0,0|1,0,0]=3 14800 B16R0.303 C=CCCNCCCCCCCCCCCC 2230a_100015191253_100011215052 [0,2,0,0,0,0|1,0,0]=3 14801 B16R0.303 C=CCCNCCCCCCCCCCCC 270004a_100015191253_100011218549 [0,2,0,0,0,0|1,0,0]=3 14802 B16R0.303 C=CCCNCCCCCCCCCCCC 34a_100000210451_100000754431 [0,2,0,0,0,0|1,0,0]=3 14803 B16R0.303 C=CCCNCCCCCCCCCCCO 2230a_100015191253_100009812471 [0,2,0,0,0,0|1,0,0]=3 14804 B16R0.303 C=CCCOC/C=C/CCCCCCCCC 34a_100015232335_100000754431 [0,2,0,0,0,0|1,0,1]=4 14805 B16R0.303 C=CCCOC/C=C/CCCCCCCCC 7a_100015232335_100000754431 [0,2,0,0,0,0|1,0,1]=4 14806 B16R0.303 C=CCCOCCCCCCC#CCCCC 34a_100011205117_200000043322 [0,2,0,0,0,0|1,0,1]=4 14807 B16R0.303 C=CCCOCCCCCCCCC#CCC 34a_200000031908_100000754431 [0,2,0,0,0,0|1,0,1]=4 14808 B16R0.303 C=CCCOCCCCCCCCC#CCC 7a_200000031908_100000754431 [0,2,0,0,0,0|1,0,1]=4 14809 B16R0.303 C=CCCOCCCCCCCCCCCBr 34a_100009812471_100000754431 [0,2,0,0,0,0|1,0,0]=3 14810 B16R0.303 C=CCCOCCCCCCCCCCCBr 7a_100009812471_100000754431 [0,2,0,0,0,0|1,0,0]=3 14811 B16R0.303 C=CCCOCCCCCCCCCCCC 34a_100000210810_100000754431 [0,2,0,0,0,0|1,0,0]=3 14812 B16R0.303 C=CCCOCCCCCCCCCCCC 34a_100011205117_100000759014 [0,2,0,0,0,0|1,0,0]=3 14813 B16R0.303 C=CCCOCCCCCCCCCCCC 7a_100000210810_100000754431 [0,2,0,0,0,0|1,0,0]=3 14814 B16R0.303 C=CCCOCCCCCCCCCCCO 34a_100011205117_100009812471 [0,2,0,0,0,0|1,0,0]=3 14815 B16R0.303 C=CCCOCCCCCCCCCOCC 34a_100009875440_100000754431 [0,2,0,0,0,0|1,0,0]=3 14816 B16R0.303 C=CCCOCCCCCCCCCOCC 7a_100009875440_100000754431 [0,2,0,0,0,0|1,0,0]=3 14817 B16R0.303 C=CCCOCCOCCOCCCCCC 34a_100000032842_100000754431 [0,2,0,0,0,0|2,0,0]=4 14818 B16R0.303 C=CCCOCCOCCOCCCCCC 7a_100000032842_100000754431 [0,2,0,0,0,0|2,0,0]=4 14819 B16R0.303 C=CCCSCCCCCCC#CCCCC 62a_100000754431_200000043322 [0,2,0,0,0,0|1,0,1]=4 14820 B16R0.303 C=CCCSCCCCCCC#CCCCC 62a_200000043322_100000754431 [0,2,0,0,0,0|1,0,1]=4 14821 B16R0.303 C=CCCSCCCCCCCCCCCO 62a_100009812471_100000754431 [0,2,0,0,0,0|1,0,0]=3 14822 B16R0.303 C=CCNCCCCCCCCCCCCC 2230a_100011215765_100000210623 [0,2,0,0,0,0|1,0,0]=3 14823 B16R0.303 C=CCNCCCCCCCCCCCCC 2230a_100020586998_100000210684 [0,2,0,0,0,0|1,0,0]=3 14824 B16R0.303 C=CCNCCCCCCCCCCCCC 270004a_100020586998_200011215488 [0,2,0,0,0,0|1,0,0]=3 14825 B16R0.303 C=CCNCCCCCCCCCCCCC 34a_100011215765_100015514636 [0,2,0,0,0,0|1,0,0]=3 14826 B16R0.303 C=CCNCCCCCCCCCCCCO 2230a_100000066677_100000210623 [0,2,0,0,0,0|1,0,0]=3 14827 B16R0.303 C=CCNCCCCCCCCCCCCO 2230a_100020586998_100009813331 [0,2,0,0,0,0|1,0,0]=3 14828 B16R0.303 C=CCNCCCCCCCCCCCCO 34a_100000066677_100015514636 [0,2,0,0,0,0|1,0,0]=3 14829 B16R0.303 C=CCNCCCCCCOCCCCCO 2230a_100020586998_200132310570 [0,2,0,0,0,0|2,0,0]=4 14830 B16R0.303 C=CCOC/C=C/CCCCCCCCCC 34a_200025761149_100015514636 [0,2,0,0,0,0|1,0,1]=4 14831 B16R0.303 C=CCOC/C=C/CCCCCCCCCC 7a_200025761149_100015514636 [0,2,0,0,0,0|1,0,1]=4 14832 B16R0.303 C=CCOCCCCCCCCCCCCBr 34a_100009813331_100015514636 [0,2,0,0,0,0|1,0,0]=3 14833 B16R0.303 C=CCOCCCCCCCCCCCCBr 7a_100009813331_100015514636 [0,2,0,0,0,0|1,0,0]=3 14834 B16R0.303 C=CCOCCCCCCCCCCCCC 34a_100000185773_100015514636 [0,2,0,0,0,0|1,0,0]=3 14835 B16R0.303 C=CCOCCCCCCCCCCCCC 34a_200000210373_100000210684 [0,2,0,0,0,0|1,0,0]=3 14836 B16R0.303 C=CCOCCCCCCCCCCCCC 7a_100000185773_100015514636 [0,2,0,0,0,0|1,0,0]=3 14837 B16R0.303 C=CCOCCCCCCCCCCCCN 34a_100000066677_100015514636 [0,2,0,0,0,0|1,0,0]=3 14838 B16R0.303 C=CCOCCCCCCCCCCCCO 34a_200000210373_100009813331 [0,2,0,0,0,0|1,0,0]=3 14839 B16R0.303 C=CCOCCCCCCOCCCCCO 34a_200000210373_200132310570 [0,2,0,0,0,0|2,0,0]=4 14840 B16R0.303 C=CCOCCCCCOCCCCCCCl 34a_200132310570_100015514636 [0,2,0,0,0,0|2,0,0]=4 14841 B16R0.303 C=CCOCCCCCOCCCCCCCl 7a_200132310570_100015514636 [0,2,0,0,0,0|2,0,0]=4 14842 B16R0.303 C=CCOCCOCCCCCCCCCC 34a_100000037705_100000210320 [0,2,0,0,0,0|1,0,0]=3 14843 B16R0.303 C=CCOCCOCCCCCCCCCC 7a_100000037705_100000210320 [0,2,0,0,0,0|1,0,0]=3 14844 B16R0.303 C=CCOCCOCCCCCCCCCO 34a_100000037705_100009813782 [0,2,0,0,0,0|2,0,0]=4 14845 B16R0.303 C=CCOCCOCCCCCCCCCO 7a_100000037705_100009813782 [0,2,0,0,0,0|2,0,0]=4 14846 B16R0.303 C=CCOCCOCCOCCCCCCC 34a_100000065479_100000210614 [0,2,0,0,0,0|2,0,0]=4 14847 B16R0.303 C=CCOCCOCCOCCCCCCC 7a_100000065479_100000210614 [0,2,0,0,0,0|2,0,0]=4 14848 B16R0.303 C=CCOCCSCCCCCCCCCC 34a_100011628728_100015514636 [0,2,0,0,0,0|1,0,0]=3 14849 B16R0.303 C=CCOCCSCCCCCCCCCC 7a_100011628728_100015514636 [0,2,0,0,0,0|1,0,0]=3 14850 B16R0.303 C=CCSCCCCCCCCCCCCO 62a_100009813331_100000210623 [0,2,0,0,0,0|1,0,0]=3 14851 B16R0.303 C=CCSCCCCCCOCCCCCO 62a_100000210623_200132310570 [0,2,0,0,0,0|2,0,0]=4 14852 B16R0.303 C=CCSCCCCCCOCCCCCO 62a_200132310570_100000210623 [0,2,0,0,0,0|2,0,0]=4 14853 B16R0.303 C=COCCCCOCCCCCCCCC 34a_100000031558_100011214924 [0,2,0,0,0,0|1,0,0]=3 14854 B16R0.303 C=COCCCCOCCCCCCCCC 7a_100000031558_100000210328 [0,2,0,0,0,0|1,0,0]=3 14855 B16R0.303 C=COCCCCOCCCCCCCCO 34a_100000031558_100000033203 [0,2,0,0,0,0|2,0,0]=4 14856 B16R0.303 C=COCCCCOCCCCCCCCO 7a_100000031558_100000033203 [0,2,0,0,0,0|2,0,0]=4 14857 B16R0.303 C=COCCCNCCCCCCCCCC 2230a_100000210767_100000210320 [0,2,0,0,0,0|1,0,0]=3 14858 B16R0.303 C=COCCCNCCCCCCCCCC 34a_100000210767_100000210320 [0,2,0,0,0,0|1,0,0]=3 14859 B16R0.303 C=COCCCNCCCCCCCCCO 2230a_100000210767_100009813782 [0,2,0,0,0,0|2,0,0]=4 14860 B16R0.303 C=COCCCNCCCCCCCCCO 34a_100000210767_100009813782 [0,2,0,0,0,0|2,0,0]=4 14861 B16R0.303 C=COCCNCCCCCCCCCCC 2230a_200011215754_100000039644 [0,2,0,0,0,0|1,0,0]=3 14862 B16R0.303 C=COCCNCCCCCCCCCCC 34a_200011215754_100000039644 [0,2,0,0,0,0|1,0,0]=3 14863 B16R0.303 C=COCCNCCCCCCCCCCO 2230a_100000066964_100000039644 [0,2,0,0,0,0|2,0,0]=4 14864 B16R0.303 C=COCCNCCCCCCCCCCO 34a_100000066964_100000039644 [0,2,0,0,0,0|2,0,0]=4 14865 B16R0.303 C=COCCOCCCCCCCCCCBr 34a_100009813290_100000039644 [0,2,0,0,0,0|2,0,0]=4 14866 B16R0.303 C=COCCOCCCCCCCCCCBr 7a_100009813290_100000039644 [0,2,0,0,0,0|2,0,0]=4 14867 B16R0.303 C=COCCOCCCCCCCCCCC 34a_100000033082_100011215454 [0,2,0,0,0,0|1,0,0]=3 14868 B16R0.303 C=COCCOCCCCCCCCCCC 34a_100000210809_100000039644 [0,2,0,0,0,0|1,0,0]=3 14869 B16R0.303 C=COCCOCCCCCCCCCCC 7a_100000210809_100000039644 [0,2,0,0,0,0|1,0,0]=3 14870 B16R0.303 C=COCCOCCCCCCCCCCCl 34a_200000033068_100000039644 [0,2,0,0,0,0|2,0,0]=4 14871 B16R0.303 C=COCCOCCCCCCCCCCCl 7a_200000033068_100000039644 [0,2,0,0,0,0|2,0,0]=4 14872 B16R0.303 C=COCCOCCCCCCCCCCN 34a_100000066964_100000039644 [0,2,0,0,0,0|2,0,0]=4 14873 B16R0.303 C=COCCOCCCCCCCCCCO 34a_100000033082_100009813290 [0,2,0,0,0,0|2,0,0]=4 14874 B16R0.303 C=COCCOCCOCCCCCCCC 34a_100000039918_100000210759 [0,2,0,0,0,0|2,0,0]=4 14875 B16R0.303 C=COCCOCCOCCCCCCCC 7a_100000039918_100000210759 [0,2,0,0,0,0|2,0,0]=4 14876 B16R0.303 C=COCCSCCCCCCCCCCC 62a_100000039644_100011215454 [0,2,0,0,0,0|1,0,0]=3 14877 B16R0.303 C=COCCSCCCCCCCCCCO 62a_100000039644_200000033068 [0,2,0,0,0,0|2,0,0]=4 14878 B16R0.303 C=COCCSCCCCCCCCCCO 62a_100009813290_100000039644 [0,2,0,0,0,0|2,0,0]=4 14879 B16R0.303 CC#CCCOCCCCCCCCCCC 34a_100000750427_100011215454 [0,2,0,0,0,0|1,0,1]=4 14880 B16R0.303 CC#CCNCCCCCCCCCCCC 2230a_100000210451_100000748600 [0,2,0,0,0,0|1,0,1]=4 14881 B16R0.303 CC#CCNCCCCCCCCCCCC 2230a_100000685387_100011215052 [0,2,0,0,0,0|1,0,1]=4 14882 B16R0.303 CC#CCNCCCCCCCCCCCC 34a_100000210451_100000748600 [0,2,0,0,0,0|1,0,1]=4 14883 B16R0.303 CC#CCNCCCCCCCCCCCC 34a_100000685387_100000759014 [0,2,0,0,0,0|1,0,1]=4 14884 B16R0.303 CC#CCOCCCCCCCCCCCC 34a_100000210810_100000748600 [0,2,0,0,0,0|1,0,1]=4 14885 B16R0.303 CC#CCOCCCCCCCCCCCC 34a_100000761923_100000759014 [0,2,0,0,0,0|1,0,1]=4 14886 B16R0.303 CC#CCOCCCCCCCCCCCC 7a_100000210810_100000748600 [0,2,0,0,0,0|1,0,1]=4 14887 B16R0.303 CC#CCSCCCCCCCCCCCC 62a_100000748600_100000759014 [0,2,0,0,0,0|1,0,1]=4 14888 B16R0.303 CC/C=C/CCCCCCCCCCOCC 34a_200025759790_100000210202 [0,2,0,0,0,0|1,0,1]=4 14889 B16R0.303 CC/C=C/CCCCCCCCCCOCC 7a_200025759790_100000210202 [0,2,0,0,0,0|1,0,1]=4 14890 B16R0.303 CC/C=C/CCCOCCCCCCCCC 34a_100016287902_100011214924 [0,2,0,0,0,0|1,0,1]=4 14891 B16R0.303 CC/C=C/CCCOCCCCCCCCC 7a_100016287902_100000210328 [0,2,0,0,0,0|1,0,1]=4 14892 B16R0.303 CC/C=C\CCCCCCCNCCCCC 269862a_100000209983_200025770492 [0,2,0,0,0,0|1,0,1]=4 14893 B16R0.303 CC/C=C\CCCCCNCCCCCCC 269862a_100000229938_100016288537 [0,2,0,0,0,0|1,0,1]=4 14894 B16R0.303 CC/C=C\CCCCCOCCCCCC=O 7a_100016268722_100000139337 [0,2,0,0,0,0|0,0,1]=3 14895 B16R0.303 CC/C=C\CCCCCOCCCCCCC 34a_100016268722_100000210614 [0,2,0,0,0,0|1,0,1]=4 14896 B16R0.303 CC/C=C\CCCCCOCCCCCCC 7a_100016268722_100000210614 [0,2,0,0,0,0|1,0,1]=4 14897 B16R0.303 CC/C=C\CCCCOCCCCCCCC 34a_100016287862_100000210759 [0,2,0,0,0,0|1,0,1]=4 14898 B16R0.303 CC/C=C\CCCCOCCCCCCCC 7a_100016287862_100000210759 [0,2,0,0,0,0|1,0,1]=4 14899 B16R0.303 CC/C=C\CCNCCCCCCCCCC 2230a_100000684558_100015370543 [0,2,0,0,0,0|1,0,1]=4 14900 B16R0.303 CC/C=C\CCNCCCCCCCCCC 34a_100000684558_100015370543 [0,2,0,0,0,0|1,0,1]=4 14901 B16R0.303 CC/C=C\CCOCCCCCCCCCC 34a_100000210711_100015370543 [0,2,0,0,0,0|1,0,1]=4 14902 B16R0.303 CC/C=C\CCOCCCCCCCCCC 34a_100016288707_100000210320 [0,2,0,0,0,0|1,0,1]=4 14903 B16R0.303 CC/C=C\CCOCCCCCCCCCC 7a_100000210711_100015370543 [0,2,0,0,0,0|1,0,1]=4 14904 B16R0.303 CC/C=C\CCOCCCCCCCCCC 7a_100016288707_100000210320 [0,2,0,0,0,0|1,0,1]=4 14905 B16R0.303 CC/C=C\CNCCCCCCCCCCC 2230a_200011215754_100103147603 [0,2,0,0,0,0|1,0,1]=4 14906 B16R0.303 CC/C=C\CNCCCCCCCCCCC 34a_200011215754_100103147603 [0,2,0,0,0,0|1,0,1]=4 14907 B16R0.303 CC/C=C\COCCCCCCCCCCC 34a_100000210809_100103147603 [0,2,0,0,0,0|1,0,1]=4 14908 B16R0.303 CC/C=C\COCCCCCCCCCCC 34a_100016268518_100011215454 [0,2,0,0,0,0|1,0,1]=4 14909 B16R0.303 CC/C=C\COCCCCCCCCCCC 7a_100000210809_100103147603 [0,2,0,0,0,0|1,0,1]=4 14910 B16R0.303 CC=C=CCCOCCCCCCCCCC 34a_100011020354_100000210320 [0,2,0,0,0,0|1,0,1]=4 14911 B16R0.303 CC=CCCCOCCCCCCCCCC 34a_100020645299_100000210320 [0,2,0,0,0,0|1,0,0]=3 14912 B16R0.303 CC=CCCCOCCCCCCCCCO 34a_100020645299_100009813782 [0,2,0,0,0,0|1,0,1]=4 14913 B16R0.303 CC=CCNCCCCCCCCCCCC 2230a_100000210451_100000070051 [0,2,0,0,0,0|1,0,0]=3 14914 B16R0.303 CC=CCNCCCCCCCCCCCC 34a_100000210451_100000070051 [0,2,0,0,0,0|1,0,0]=3 14915 B16R0.303 CC=CCOCCCCCCCCCCCBr 34a_100009812471_100000070051 [0,2,0,0,0,0|1,0,1]=4 14916 B16R0.303 CC=CCOCCCCCCCCCCCBr 7a_100009812471_100000070051 [0,2,0,0,0,0|1,0,1]=4 14917 B16R0.303 CC=CCOCCCCCCCCCCCC 34a_100000210810_100000070051 [0,2,0,0,0,0|1,0,0]=3 14918 B16R0.303 CC=CCOCCCCCCCCCCCC 7a_100000210810_100000070051 [0,2,0,0,0,0|1,0,0]=3 14919 B16R0.303 CC=CCOCCCCCCCCCOCC 34a_100009875440_100000070051 [0,2,0,0,0,0|1,0,1]=4 14920 B16R0.303 CC=CCOCCCCCCCCCOCC 7a_100009875440_100000070051 [0,2,0,0,0,0|1,0,1]=4 14921 B16R0.303 CC=CCSCCCCCCCCCCCO 62a_100009812471_100000070051 [0,2,0,0,0,0|1,0,1]=4 14922 B16R0.303 CCC#CCCCCCCSCCCCC=O 62a_100000139335_200000036426 [0,2,0,0,0,0|0,0,1]=3 14923 B16R0.303 CCC#CCCCCCCSCCCCC=O 62a_200000036426_100000139335 [0,2,0,0,0,0|0,0,1]=3 14924 B16R0.303 CCCC/C=C/CCCCOCCCCC=O 7a_200020645093_100000139335 [0,2,0,0,0,0|0,0,1]=3 14925 B16R0.303 CCCCC#CCCCCOCCCCC=O 7a_200000066234_100000139335 [0,2,0,0,0,0|0,0,1]=3 14926 B16R0.303 CCCCC#CCCCSCCCCCC=O 62a_100000139337_200000047210 [0,2,0,0,0,0|0,0,1]=3 14927 B16R0.303 CCCCC#CCCCSCCCCCC=O 62a_200000047210_100000139337 [0,2,0,0,0,0|0,0,1]=3 14928 B16R0.303 CCCCC/C=C\CCCOCCCCC=O 7a_100020655193_100000139335 [0,2,0,0,0,0|0,0,1]=3 14929 B16R0.303 CCCCC/C=C\CCOCCCCCC=O 7a_100016277358_100000139337 [0,2,0,0,0,0|0,0,1]=3 14930 B16R0.303 CCCCCC#CCCOCCCCCC=O 7a_200000042877_100000139337 [0,2,0,0,0,0|0,0,1]=3 14931 B16R0.303 CCCCCC/C=C/COCCCCCC=O 7a_200016276170_100000139337 [0,2,0,0,0,0|0,0,1]=3 14932 B16R0.303 CCCCCCC#CCCOCCCCC=O 7a_200000033163_100000139335 [0,2,0,0,0,0|0,0,1]=3 14933 B16R0.303 CCCCCCC#CCOCCCCCC=O 7a_200000037284_100000139337 [0,2,0,0,0,0|0,0,1]=3 14934 B16R0.303 CCCCCCCC#CCOCCCCC=O 7a_200000061759_100000139335 [0,2,0,0,0,0|0,0,1]=3 14935 B16R0.303 CCCCCCCC/C=C/COCCCC=O 7a_200020667288_200011292268 [0,2,0,0,0,0|0,0,1]=3 14936 B16R0.303 CCCCCCCCCC/C=C/COCC=O 34a_200025761149_200009817547 [0,2,0,0,0,0|0,0,1]=3 14937 B16R0.303 CCCCCCCCCC/C=C/COCC=O 7a_200025761149_200015260668 [0,2,0,0,0,0|0,0,1]=3 14938 B16R0.303 CCCCCCCCCCCCCCCNC 2230a_106832991635_100000210322 [0,2,0,0,0,0|1,0,1]=4 14939 B16R0.303 CCCCCCCCCCCCCCCNC 2230a_200000297553_200000210301 [0,2,0,0,0,0|1,0,1]=4 14940 B16R0.303 CCCCCCCCCCCCCCCNC 270004a_106832991635_100012088177 [0,2,0,0,0,0|1,0,1]=4 14941 B16R0.303 CCCCCCCCCCCCCCCNC 34a_100102657272_100000210322 [0,2,0,0,0,0|1,0,1]=4 14942 B16R0.303 CCCCCCCCCCCCCCCNC 34a_200000297553_200000210301 [0,2,0,0,0,0|1,0,1]=4 14943 B16R0.303 CCCCCCCCCCCCCCCNC 7a_106832991635_100000210322 [0,2,0,0,0,0|1,0,1]=4 14944 B16R0.303 CCCCCCCCCCCCCCCN[13CH3] 2230a_200000297553_200025704644 [0,2,0,0,0,0|1,0,1]=4 14945 B16R0.303 CCCCCCCCCCCCCCCN[13CH3] 34a_200000297553_200025704644 [0,2,0,0,0,0|1,0,1]=4 14946 B16R0.303 CCCCCCCCCCCCCCCOC 34a_100000272386_200000210301 [0,2,0,0,0,0|0,0,2]=4 14947 B16R0.303 CCCCCCCCCCCCCCCOC 34a_100138415774_100000210322 [0,2,0,0,0,0|0,0,2]=4 14948 B16R0.303 CCCCCCCCCCCCCCCOC 7a_100000272386_200000210301 [0,2,0,0,0,0|0,0,2]=4 14949 B16R0.303 CCCCCCCCCCCCCCCO[13CH3] 34a_100000272386_200025704644 [0,2,0,0,0,0|0,0,2]=4 14950 B16R0.303 CCCCCCCCCCCCCCCO[13CH3] 7a_100000272386_200025704644 [0,2,0,0,0,0|0,0,2]=4 14951 B16R0.303 CCCCCCCCCCCCCCNCC 2230a_100011217771_100000210202 [0,2,0,0,0,0|1,0,1]=4 14952 B16R0.303 CCCCCCCCCCCCCCNCC 2230a_100015525214_100011215471 [0,2,0,0,0,0|1,0,1]=4 14953 B16R0.303 CCCCCCCCCCCCCCNCC 270004a_100015525214_200011216147 [0,2,0,0,0,0|1,0,1]=4 14954 B16R0.303 CCCCCCCCCCCCCCNCC 34a_100011217771_100000210202 [0,2,0,0,0,0|1,0,1]=4 14955 B16R0.303 CCCCCCCCCCCCCCNCF 34a_100011217771_100015361967 [0,2,0,0,0,0|1,0,1]=4 14956 B16R0.303 CCCCCCCCCCCCCCOCC 34a_100000210739_100000210202 [0,2,0,0,0,0|0,0,2]=4 14957 B16R0.303 CCCCCCCCCCCCCCOCC 34a_100121572206_100011215471 [0,2,0,0,0,0|0,0,2]=4 14958 B16R0.303 CCCCCCCCCCCCCCOCC 7a_100000210739_100000210202 [0,2,0,0,0,0|0,0,2]=4 14959 B16R0.303 CCCCCCCCCCCCCCOCF 34a_100000210739_100015361967 [0,2,0,0,0,0|0,0,2]=4 14960 B16R0.303 CCCCCCCCCCCCCCOCF 7a_100000210739_100015361967 [0,2,0,0,0,0|0,0,2]=4 14961 B16R0.303 CCCCCCCCCCCCCNCC#N 2230a_100011215765_100011215382 [0,2,0,0,0,0|1,0,1]=4 14962 B16R0.303 CCCCCCCCCCCCCNCC=O 2230a_100011215765_200015260668 [0,2,0,0,0,0|0,0,0]=2 14963 B16R0.303 CCCCCCCCCCCCCNCC=O 34a_100011215765_200009817547 [0,2,0,0,0,0|0,0,0]=2 14964 B16R0.303 CCCCCCCCCCCCCNCCC 2230a_100011215765_100000210303 [0,2,0,0,0,0|1,0,1]=4 14965 B16R0.303 CCCCCCCCCCCCCNCCC 270004a_100020643023_200011215488 [0,2,0,0,0,0|1,0,1]=4 14966 B16R0.303 CCCCCCCCCCCCCNCCC 34a_100011215765_100000210303 [0,2,0,0,0,0|1,0,1]=4 14967 B16R0.303 CCCCCCCCCCCCCNCCF 2230a_100011215765_100011217306 [0,2,0,0,0,0|1,0,1]=4 14968 B16R0.303 CCCCCCCCCCCCCNCCF 34a_100000724931_100000210684 [0,2,0,0,0,0|1,0,1]=4 14969 B16R0.303 CCCCCCCCCCCCCNCCF 34a_100011215765_100011217306 [0,2,0,0,0,0|1,0,1]=4 14970 B16R0.303 CCCCCCCCCCCCCNCCO 2230a_100011215765_100000211926 [0,2,0,0,0,0|0,0,2]=4 14971 B16R0.303 CCCCCCCCCCCCCNCCO 2230a_100016997473_100000210684 [0,2,0,0,0,0|0,0,2]=4 14972 B16R0.303 CCCCCCCCCCCCCNCCO 270004a_100000210304_200011215488 [0,2,0,0,0,0|0,0,2]=4 14973 B16R0.303 CCCCCCCCCCCCCNCCO 34a_100011215765_100000211926 [0,2,0,0,0,0|0,0,2]=4 14974 B16R0.303 CCCCCCCCCCCCCNCCO 34a_100016990907_100000210684 [0,2,0,0,0,0|0,0,2]=4 14975 B16R0.303 CCCCCCCCCCCCCNCOC 2230a_100011215765_100000766300 [0,2,0,0,0,0|0,0,2]=4 14976 B16R0.303 CCCCCCCCCCCCCNCSC 2230a_100011215765_100011218213 [0,2,0,0,0,0|0,1,1]=4 14977 B16R0.303 CCCCCCCCCCCCCNCSC 34a_100011215765_100011218213 [0,2,0,0,0,0|0,1,1]=4 14978 B16R0.303 CCCCCCCCCCCCCOCC#N 7a_100000185773_100011215382 [0,2,0,0,0,0|1,0,1]=4 14979 B16R0.303 CCCCCCCCCCCCCOCC=O 34a_100000185773_200009817547 [0,2,0,0,0,0|0,0,0]=2 14980 B16R0.303 CCCCCCCCCCCCCOCC=O 7a_100000185773_200015260668 [0,2,0,0,0,0|0,0,0]=2 14981 B16R0.303 CCCCCCCCCCCCCOCCBr 34a_100000211926_100000210684 [0,2,0,0,0,0|1,0,1]=4 14982 B16R0.303 CCCCCCCCCCCCCOCCC 34a_100000185773_100000210303 [0,2,0,0,0,0|1,0,1]=4 14983 B16R0.303 CCCCCCCCCCCCCOCCC 34a_100000210258_100000210684 [0,2,0,0,0,0|1,0,1]=4 14984 B16R0.303 CCCCCCCCCCCCCOCCC 7a_100000185773_100000210303 [0,2,0,0,0,0|1,0,1]=4 14985 B16R0.303 CCCCCCCCCCCCCOCCF 34a_100000185773_100011217306 [0,2,0,0,0,0|1,0,1]=4 14986 B16R0.303 CCCCCCCCCCCCCOCCF 7a_100000185773_100011217306 [0,2,0,0,0,0|1,0,1]=4 14987 B16R0.303 CCCCCCCCCCCCCOCCN 34a_100000210304_100000210684 [0,2,0,0,0,0|1,0,1]=4 14988 B16R0.303 CCCCCCCCCCCCCOCCO 34a_100000185773_100000211926 [0,2,0,0,0,0|0,0,2]=4 14989 B16R0.303 CCCCCCCCCCCCCOCCO 7a_100000185773_100000211926 [0,2,0,0,0,0|0,0,2]=4 14990 B16R0.303 CCCCCCCCCCCCCOCSC 34a_100000185773_100011218213 [0,2,0,0,0,0|0,1,1]=4 14991 B16R0.303 CCCCCCCCCCCCCSCC#N 62a_100011215382_100011934334 [0,2,0,0,0,0|1,0,1]=4 14992 B16R0.303 CCCCCCCCCCCCCSCC=O 62a_200015260668_100011934334 [0,2,0,0,0,0|0,0,0]=2 14993 B16R0.303 CCCCCCCCCCCCCSCCO 62a_100000211926_100011934334 [0,2,0,0,0,0|0,0,2]=4 14994 B16R0.303 CCCCCCCCCCCCCSCOC 62a_100000766300_100011934334 [0,2,0,0,0,0|0,0,2]=4 14995 B16R0.303 CCCCCCCCCCCCNCCC#N 2230a_100000210451_100011215226 [0,2,0,0,0,0|1,0,1]=4 14996 B16R0.303 CCCCCCCCCCCCNCCC#N 270004a_100000720768_100011218549 [0,2,0,0,0,0|1,0,1]=4 14997 B16R0.303 CCCCCCCCCCCCNCCCC 2230a_100000102301_100011215052 [0,2,0,0,0,0|1,0,1]=4 14998 B16R0.303 CCCCCCCCCCCCNCCCC 2230a_100000210451_100000210211 [0,2,0,0,0,0|1,0,1]=4 14999 B16R0.303 CCCCCCCCCCCCNCCCC 270004a_100000102301_100011218549 [0,2,0,0,0,0|1,0,1]=4 15000 B16R0.303 CCCCCCCCCCCCNCCCC 34a_100000210451_100000210210 [0,2,0,0,0,0|1,0,1]=4 15001 B16R0.303 CCCCCCCCCCCCNCCCC 7a_106832991798_100000759014 [0,2,0,0,0,0|1,0,1]=4 15002 B16R0.303 CCCCCCCCCCCCNCCCF 2230a_100000210451_100011934791 [0,2,0,0,0,0|1,0,1]=4 15003 B16R0.303 CCCCCCCCCCCCNCCCF 2230a_100015189416_100011215052 [0,2,0,0,0,0|1,0,1]=4 15004 B16R0.303 CCCCCCCCCCCCNCCCF 270004a_100015189416_100011218549 [0,2,0,0,0,0|1,0,1]=4 15005 B16R0.303 CCCCCCCCCCCCNCCCF 34a_100000210451_100011934791 [0,2,0,0,0,0|1,0,1]=4 15006 B16R0.303 CCCCCCCCCCCCNCCCF 34a_100015189416_100000759014 [0,2,0,0,0,0|1,0,1]=4 15007 B16R0.303 CCCCCCCCCCCCNCCCO 2230a_100000210451_100000230001 [0,2,0,0,0,0|0,0,2]=4 15008 B16R0.303 CCCCCCCCCCCCNCCCO 270004a_100000182051_100011218549 [0,2,0,0,0,0|0,0,2]=4 15009 B16R0.303 CCCCCCCCCCCCNCCCO 34a_100000210451_100000230001 [0,2,0,0,0,0|0,0,2]=4 15010 B16R0.303 CCCCCCCCCCCCNCCOC 2230a_100000209980_100011215052 [0,2,0,0,0,0|0,0,2]=4 15011 B16R0.303 CCCCCCCCCCCCNCCOC 2230a_100000210451_100011201679 [0,2,0,0,0,0|0,0,2]=4 15012 B16R0.303 CCCCCCCCCCCCNCCOC 270004a_100000209980_100011218549 [0,2,0,0,0,0|0,0,2]=4 15013 B16R0.303 CCCCCCCCCCCCNCCOC 34a_100000210451_100011201679 [0,2,0,0,0,0|0,0,2]=4 15014 B16R0.303 CCCCCCCCCCCCNCCSC 2230a_100000210451_100000751147 [0,2,0,0,0,0|0,1,1]=4 15015 B16R0.303 CCCCCCCCCCCCNCCSC 2230a_100020590264_100011215052 [0,2,0,0,0,0|0,1,1]=4 15016 B16R0.303 CCCCCCCCCCCCNCCSC 270004a_100020590264_100011218549 [0,2,0,0,0,0|0,1,1]=4 15017 B16R0.303 CCCCCCCCCCCCNCCSC 34a_100000210451_100000212216 [0,2,0,0,0,0|0,1,1]=4 15018 B16R0.303 CCCCCCCCCCCCOCCC#N 7a_100000210810_100000184422 [0,2,0,0,0,0|1,0,1]=4 15019 B16R0.303 CCCCCCCCCCCCOCCCBr 34a_100011217188_100000759014 [0,2,0,0,0,0|1,0,1]=4 15020 B16R0.303 CCCCCCCCCCCCOCCCC 34a_100000210227_100000759014 [0,2,0,0,0,0|1,0,1]=4 15021 B16R0.303 CCCCCCCCCCCCOCCCC 34a_100000210810_100000210210 [0,2,0,0,0,0|1,0,1]=4 15022 B16R0.303 CCCCCCCCCCCCOCCCC 7a_100000210227_100000759014 [0,2,0,0,0,0|1,0,1]=4 15023 B16R0.303 CCCCCCCCCCCCOCCCC 7a_100000210810_100000210211 [0,2,0,0,0,0|1,0,1]=4 15024 B16R0.303 CCCCCCCCCCCCOCCCCl 34a_100000230001_100000759014 [0,2,0,0,0,0|1,0,1]=4 15025 B16R0.303 CCCCCCCCCCCCOCCCF 34a_100000210810_100011934791 [0,2,0,0,0,0|1,0,1]=4 15026 B16R0.303 CCCCCCCCCCCCOCCCF 34a_100000759539_100000759014 [0,2,0,0,0,0|1,0,1]=4 15027 B16R0.303 CCCCCCCCCCCCOCCCF 7a_100000210810_100011934791 [0,2,0,0,0,0|1,0,1]=4 15028 B16R0.303 CCCCCCCCCCCCOCCCN 34a_100000182051_100000759014 [0,2,0,0,0,0|1,0,1]=4 15029 B16R0.303 CCCCCCCCCCCCOCCCO 34a_100000210810_100000230001 [0,2,0,0,0,0|0,0,2]=4 15030 B16R0.303 CCCCCCCCCCCCOCCCO 7a_100000210810_100011215043 [0,2,0,0,0,0|0,0,2]=4 15031 B16R0.303 CCCCCCCCCCCCOCCOC 34a_100000210237_100000759014 [0,2,0,0,0,0|0,0,2]=4 15032 B16R0.303 CCCCCCCCCCCCOCCOC 34a_100000210810_100011201679 [0,2,0,0,0,0|0,0,2]=4 15033 B16R0.303 CCCCCCCCCCCCOCCOC 7a_100000210810_100000233755 [0,2,0,0,0,0|0,0,2]=4 15034 B16R0.303 CCCCCCCCCCCCOCCON 34a_100000700252_100000759014 [0,2,0,0,0,0|0,0,2]=4 15035 B16R0.303 CCCCCCCCCCCCOCCSC 34a_100000210810_100000212216 [0,2,0,0,0,0|0,1,1]=4 15036 B16R0.303 CCCCCCCCCCCCOCCSC 34a_100000230434_100000759014 [0,2,0,0,0,0|0,1,1]=4 15037 B16R0.303 CCCCCCCCCCCCOCCSC 7a_100000210810_100000212216 [0,2,0,0,0,0|0,1,1]=4 15038 B16R0.303 CCCCCCCCCCCCOCCSC 7a_100000230434_100000759014 [0,2,0,0,0,0|0,1,1]=4 15039 B16R0.303 CCCCCCCCCCCCSCCC#N 62a_100011215226_100000759014 [0,2,0,0,0,0|1,0,1]=4 15040 B16R0.303 CCCCCCCCCCCCSCCCO 62a_100011215043_100000759014 [0,2,0,0,0,0|0,0,2]=4 15041 B16R0.303 CCCCCCCCCCCCSCCOC 34a_100005618841_200000210301 [0,2,0,0,0,0|0,0,2]=4 15042 B16R0.303 CCCCCCCCCCCCSCCOC 62a_100000233755_100000759014 [0,2,0,0,0,0|0,0,2]=4 15043 B16R0.303 CCCCCCCCCCCCSCCOC 7a_100005618841_200000210301 [0,2,0,0,0,0|0,0,2]=4 15044 B16R0.303 CCCCCCCCCCCCSCCO[13CH3] 34a_100005618841_200025704644 [0,2,0,0,0,0|0,0,2]=4 15045 B16R0.303 CCCCCCCCCCCCSCCO[13CH3] 7a_100005618841_200025704644 [0,2,0,0,0,0|0,0,2]=4 15046 B16R0.303 CCCCCCCCCCCCSCOCC 62a_100000739092_100000759014 [0,2,0,0,0,0|1,0,1]=4 15047 B16R0.303 CCCCCCCCCCCCSCSC#N 62a_100000211825_100000759014 [0,2,0,0,0,0|1,0,1]=4 15048 B16R0.303 CCCCCCCCCCCNCCCC#N 2230a_200011215754_100000687738 [0,2,0,0,0,0|1,0,1]=4 15049 B16R0.303 CCCCCCCCCCCNCCCC=O 2230a_200011215754_200011292268 [0,2,0,0,0,0|0,0,0]=2 15050 B16R0.303 CCCCCCCCCCCNCCCCC 2230a_100000209983_100011215454 [0,2,0,0,0,0|1,0,1]=4 15051 B16R0.303 CCCCCCCCCCCNCCCCC 2230a_200011215754_100000210326 [0,2,0,0,0,0|1,0,1]=4 15052 B16R0.303 CCCCCCCCCCCNCCCCC 34a_200011215754_100000718602 [0,2,0,0,0,0|1,0,1]=4 15053 B16R0.303 CCCCCCCCCCCNCCCCF 2230a_200011215754_100000729493 [0,2,0,0,0,0|1,0,1]=4 15054 B16R0.303 CCCCCCCCCCCNCCCCF 34a_200011215754_100000729493 [0,2,0,0,0,0|1,0,1]=4 15055 B16R0.303 CCCCCCCCCCCNCCCCO 2230a_100000750430_100011215454 [0,2,0,0,0,0|0,0,2]=4 15056 B16R0.303 CCCCCCCCCCCNCCCCO 2230a_200011215754_100000210776 [0,2,0,0,0,0|0,0,2]=4 15057 B16R0.303 CCCCCCCCCCCNCCCCO 34a_100000750430_100011215454 [0,2,0,0,0,0|0,0,2]=4 15058 B16R0.303 CCCCCCCCCCCNCCCCO 34a_200011215754_100011216708 [0,2,0,0,0,0|0,0,2]=4 15059 B16R0.303 CCCCCCCCCCCNCCCOC 2230a_200011215754_100000740836 [0,2,0,0,0,0|0,0,2]=4 15060 B16R0.303 CCCCCCCCCCCNCCCOC 34a_100150723488_100011215454 [0,2,0,0,0,0|0,0,2]=4 15061 B16R0.303 CCCCCCCCCCCNCCCOC 34a_200011215754_100000740836 [0,2,0,0,0,0|0,0,2]=4 15062 B16R0.303 CCCCCCCCCCCNCCCSC 2230a_100000749238_100011215454 [0,2,0,0,0,0|0,1,1]=4 15063 B16R0.303 CCCCCCCCCCCNCCOCC 2230a_102516460346_100011215454 [0,2,0,0,0,0|1,0,1]=4 15064 B16R0.303 CCCCCCCCCCCNCCOCC 2230a_200011215754_100011215890 [0,2,0,0,0,0|1,0,1]=4 15065 B16R0.303 CCCCCCCCCCCNCCOCC 34a_102516460346_100011215454 [0,2,0,0,0,0|1,0,1]=4 15066 B16R0.303 CCCCCCCCCCCNCCOCC 34a_200011215754_100000210147 [0,2,0,0,0,0|1,0,1]=4 15067 B16R0.303 CCCCCCCCCCCNCCSCC 2230a_100000106463_100011215454 [0,2,0,0,0,0|1,0,1]=4 15068 B16R0.303 CCCCCCCCCCCNCCSCC 2230a_200011215754_100000757381 [0,2,0,0,0,0|1,0,1]=4 15069 B16R0.303 CCCCCCCCCCCNCCSCC 34a_200011215754_100000757381 [0,2,0,0,0,0|1,0,1]=4 15070 B16R0.303 CCCCCCCCCCCOCCCC#N 7a_100000210809_100000687738 [0,2,0,0,0,0|1,0,1]=4 15071 B16R0.303 CCCCCCCCCCCOCCCC=O 7a_100000210809_200011292268 [0,2,0,0,0,0|0,0,0]=2 15072 B16R0.303 CCCCCCCCCCCOCCCCBr 34a_100011216708_100011215454 [0,2,0,0,0,0|1,0,1]=4 15073 B16R0.303 CCCCCCCCCCCOCCCCC 34a_100000210253_100011215454 [0,2,0,0,0,0|1,0,1]=4 15074 B16R0.303 CCCCCCCCCCCOCCCCC 34a_100000210809_100000718602 [0,2,0,0,0,0|1,0,1]=4 15075 B16R0.303 CCCCCCCCCCCOCCCCC 7a_100000210253_100011215454 [0,2,0,0,0,0|1,0,1]=4 15076 B16R0.303 CCCCCCCCCCCOCCCCC 7a_100000210809_100000210326 [0,2,0,0,0,0|1,0,1]=4 15077 B16R0.303 CCCCCCCCCCCOCCCCCl 34a_100000210776_100011215454 [0,2,0,0,0,0|1,0,1]=4 15078 B16R0.303 CCCCCCCCCCCOCCCCCl 7a_100000210776_100011215454 [0,2,0,0,0,0|1,0,1]=4 15079 B16R0.303 CCCCCCCCCCCOCCCCF 34a_100000210809_100000729493 [0,2,0,0,0,0|1,0,1]=4 15080 B16R0.303 CCCCCCCCCCCOCCCCF 34a_100011995726_100011215454 [0,2,0,0,0,0|1,0,1]=4 15081 B16R0.303 CCCCCCCCCCCOCCCCF 7a_100000210809_100000729493 [0,2,0,0,0,0|1,0,1]=4 15082 B16R0.303 CCCCCCCCCCCOCCCCF 7a_100011995726_100011215454 [0,2,0,0,0,0|1,0,1]=4 15083 B16R0.303 CCCCCCCCCCCOCCCCI 34a_200012148704_100011215454 [0,2,0,0,0,0|1,0,1]=4 15084 B16R0.303 CCCCCCCCCCCOCCCCN 34a_100000750430_100011215454 [0,2,0,0,0,0|1,0,1]=4 15085 B16R0.303 CCCCCCCCCCCOCCCCO 34a_100000210809_100011216708 [0,2,0,0,0,0|0,0,2]=4 15086 B16R0.303 CCCCCCCCCCCOCCCCO 7a_100000210809_100000210776 [0,2,0,0,0,0|0,0,2]=4 15087 B16R0.303 CCCCCCCCCCCOCCCNC 34a_100000213112_100011215454 [0,2,0,0,0,0|1,0,1]=4 15088 B16R0.303 CCCCCCCCCCCOCCCOC 34a_100000210809_100000740836 [0,2,0,0,0,0|0,0,2]=4 15089 B16R0.303 CCCCCCCCCCCOCCCOC 34a_100000740835_100011215454 [0,2,0,0,0,0|0,0,2]=4 15090 B16R0.303 CCCCCCCCCCCOCCCOC 7a_100000210809_100000740836 [0,2,0,0,0,0|0,0,2]=4 15091 B16R0.303 CCCCCCCCCCCOCCCSC 34a_100000690336_100011215454 [0,2,0,0,0,0|0,1,1]=4 15092 B16R0.303 CCCCCCCCCCCOCCCSC 7a_100000690336_100011215454 [0,2,0,0,0,0|0,1,1]=4 15093 B16R0.303 CCCCCCCCCCCOCCOCC 34a_100000210136_100011215454 [0,2,0,0,0,0|1,0,1]=4 15094 B16R0.303 CCCCCCCCCCCOCCOCC 34a_100000210809_100000210147 [0,2,0,0,0,0|1,0,1]=4 15095 B16R0.303 CCCCCCCCCCCOCCOCC 34a_100010166600_100000210202 [0,2,0,0,0,0|1,0,1]=4 15096 B16R0.303 CCCCCCCCCCCOCCOCC 7a_100000210136_100011215454 [0,2,0,0,0,0|1,0,1]=4 15097 B16R0.303 CCCCCCCCCCCOCCOCC 7a_100000210809_100011215890 [0,2,0,0,0,0|1,0,1]=4 15098 B16R0.303 CCCCCCCCCCCOCCOCC 7a_100010166600_100000210202 [0,2,0,0,0,0|1,0,1]=4 15099 B16R0.303 CCCCCCCCCCCOCCOCF 34a_100010166600_100015361967 [0,2,0,0,0,0|1,0,1]=4 15100 B16R0.303 CCCCCCCCCCCOCCOCF 7a_100010166600_100015361967 [0,2,0,0,0,0|1,0,1]=4 15101 B16R0.303 CCCCCCCCCCCOCCSCC 34a_100000210809_100000757381 [0,2,0,0,0,0|1,0,1]=4 15102 B16R0.303 CCCCCCCCCCCOCCSCC 34a_100000212035_100011215454 [0,2,0,0,0,0|1,0,1]=4 15103 B16R0.303 CCCCCCCCCCCOCCSCC 7a_100000210809_100000757381 [0,2,0,0,0,0|1,0,1]=4 15104 B16R0.303 CCCCCCCCCCCOCCSCC 7a_100000212035_100011215454 [0,2,0,0,0,0|1,0,1]=4 15105 B16R0.303 CCCCCCCCCCCSCCCC#N 62a_100000687738_100011215454 [0,2,0,0,0,0|1,0,1]=4 15106 B16R0.303 CCCCCCCCCCCSCCCC=O 62a_200011292268_100011215454 [0,2,0,0,0,0|0,0,0]=2 15107 B16R0.303 CCCCCCCCCCCSCCCCO 62a_100000210776_100011215454 [0,2,0,0,0,0|0,0,2]=4 15108 B16R0.303 CCCCCCCCCCCSCCCOC 62a_100000709357_100011215454 [0,2,0,0,0,0|0,0,2]=4 15109 B16R0.303 CCCCCCCCCCCSCCOCC 62a_100000210147_100011215454 [0,2,0,0,0,0|1,0,1]=4 15110 B16R0.303 CCCCCCCCCCCSCCSC#N 62a_100000034367_100011215454 [0,2,0,0,0,0|1,0,1]=4 15111 B16R0.303 CCCCCCCCCCNCCCCC#N 2230a_100000684558_100000211819 [0,2,0,0,0,0|1,0,1]=4 15112 B16R0.303 CCCCCCCCCCNCCCCC=O 2230a_100000684558_100000139335 [0,2,0,0,0,0|0,0,0]=2 15113 B16R0.303 CCCCCCCCCCNCCCCCC 2230a_100000210581_100000210320 [0,2,0,0,0,0|1,0,1]=4 15114 B16R0.303 CCCCCCCCCCNCCCCCC 2230a_100000684558_100000210314 [0,2,0,0,0,0|1,0,1]=4 15115 B16R0.303 CCCCCCCCCCNCCCCCC 34a_100000684558_100000210314 [0,2,0,0,0,0|1,0,1]=4 15116 B16R0.303 CCCCCCCCCCNCCCCCF 2230a_100000684558_100000729378 [0,2,0,0,0,0|1,0,1]=4 15117 B16R0.303 CCCCCCCCCCNCCCCCF 34a_100000684558_100000729378 [0,2,0,0,0,0|1,0,1]=4 15118 B16R0.303 CCCCCCCCCCNCCCCCO 2230a_100000684558_100000746330 [0,2,0,0,0,0|0,0,2]=4 15119 B16R0.303 CCCCCCCCCCNCCCCCO 2230a_100000762737_100000210320 [0,2,0,0,0,0|0,0,2]=4 15120 B16R0.303 CCCCCCCCCCNCCCCCO 34a_100000684558_100000746330 [0,2,0,0,0,0|0,0,2]=4 15121 B16R0.303 CCCCCCCCCCNCCCCCO 34a_100000762737_100000210320 [0,2,0,0,0,0|0,0,2]=4 15122 B16R0.303 CCCCCCCCCCNCCCCOC 2230a_100000684558_100000730899 [0,2,0,0,0,0|0,0,2]=4 15123 B16R0.303 CCCCCCCCCCNCCCCOC 34a_100000684558_100000755781 [0,2,0,0,0,0|0,0,2]=4 15124 B16R0.303 CCCCCCCCCCNCCCN=[N+]=[N-] 2230a_100000744732_100000210320 [0,2,0,0,0,0|2,0,0]=4 15125 B16R0.303 CCCCCCCCCCNCCCOCC 2230a_100000210961_100000210320 [0,2,0,0,0,0|1,0,1]=4 15126 B16R0.303 CCCCCCCCCCNCCCOCC 2230a_100000684558_100012232248 [0,2,0,0,0,0|1,0,1]=4 15127 B16R0.303 CCCCCCCCCCNCCCOCC 34a_100000210961_100000210320 [0,2,0,0,0,0|1,0,1]=4 15128 B16R0.303 CCCCCCCCCCNCCCOCC 34a_100000684558_100012232248 [0,2,0,0,0,0|1,0,1]=4 15129 B16R0.303 CCCCCCCCCCNCCOCC#N 2230a_100000684558_200000047693 [0,2,0,0,0,0|1,0,1]=4 15130 B16R0.303 CCCCCCCCCCNCCOCCC 2230a_100000684558_100011215938 [0,2,0,0,0,0|1,0,1]=4 15131 B16R0.303 CCCCCCCCCCNCCOCCC 2230a_100161115042_100000210320 [0,2,0,0,0,0|1,0,1]=4 15132 B16R0.303 CCCCCCCCCCNCCOCCC 34a_100000684558_100011215938 [0,2,0,0,0,0|1,0,1]=4 15133 B16R0.303 CCCCCCCCCCNCCOCCC 34a_100161115042_100000210320 [0,2,0,0,0,0|1,0,1]=4 15134 B16R0.303 CCCCCCCCCCNCCOCCO 2230a_100000211614_100000210320 [0,2,0,0,0,0|0,0,2]=4 15135 B16R0.303 CCCCCCCCCCNCCOCCO 2230a_100000684558_100011215305 [0,2,0,0,0,0|0,0,2]=4 15136 B16R0.303 CCCCCCCCCCNCCOCCO 34a_100000211614_100000210320 [0,2,0,0,0,0|0,0,2]=4 15137 B16R0.303 CCCCCCCCCCNCCOCCO 34a_100000684558_100000692535 [0,2,0,0,0,0|0,0,2]=4 15138 B16R0.303 CCCCCCCCCCNCCSCCC 2230a_100020603323_100000210320 [0,2,0,0,0,0|1,0,1]=4 15139 B16R0.303 CCCCCCCCCCNCCSCCO 2230a_100011219999_100000210320 [0,2,0,0,0,0|0,0,2]=4 15140 B16R0.303 CCCCCCCCCCNCOCCCC 2230a_100000684558_100011995733 [0,2,0,0,0,0|1,0,1]=4 15141 B16R0.303 CCCCCCCCCCNCOCCCC 34a_100000684558_100011995733 [0,2,0,0,0,0|1,0,1]=4 15142 B16R0.303 CCCCCCCCCCNCOCCOC 2230a_100000684558_100000231047 [0,2,0,0,0,0|2,0,0]=4 15143 B16R0.303 CCCCCCCCCCOCCCCC#N 7a_100000210711_100000211819 [0,2,0,0,0,0|1,0,1]=4 15144 B16R0.303 CCCCCCCCCCOCCCCC=O 7a_100000210711_100000139335 [0,2,0,0,0,0|0,0,0]=2 15145 B16R0.303 CCCCCCCCCCOCCCCCBr 34a_100000746331_100000210320 [0,2,0,0,0,0|1,0,1]=4 15146 B16R0.303 CCCCCCCCCCOCCCCCBr 7a_100000746331_100000210320 [0,2,0,0,0,0|1,0,1]=4 15147 B16R0.303 CCCCCCCCCCOCCCCCC 34a_100000210259_100000210320 [0,2,0,0,0,0|1,0,1]=4 15148 B16R0.303 CCCCCCCCCCOCCCCCC 34a_100000210711_100000210314 [0,2,0,0,0,0|1,0,1]=4 15149 B16R0.303 CCCCCCCCCCOCCCCCC 7a_100000210259_100000210320 [0,2,0,0,0,0|1,0,1]=4 15150 B16R0.303 CCCCCCCCCCOCCCCCC 7a_100000210711_100000210314 [0,2,0,0,0,0|1,0,1]=4 15151 B16R0.303 CCCCCCCCCCOCCCCCCl 34a_100000746330_100000210320 [0,2,0,0,0,0|1,0,1]=4 15152 B16R0.303 CCCCCCCCCCOCCCCCCl 7a_100000746330_100000210320 [0,2,0,0,0,0|1,0,1]=4 15153 B16R0.303 CCCCCCCCCCOCCCCCF 34a_100000210711_100000729378 [0,2,0,0,0,0|1,0,1]=4 15154 B16R0.303 CCCCCCCCCCOCCCCCF 7a_100000210711_100000729378 [0,2,0,0,0,0|1,0,1]=4 15155 B16R0.303 CCCCCCCCCCOCCCCCI 34a_200012148887_100000210320 [0,2,0,0,0,0|1,0,1]=4 15156 B16R0.303 CCCCCCCCCCOCCCCCI 7a_200012148887_100000210320 [0,2,0,0,0,0|1,0,1]=4 15157 B16R0.303 CCCCCCCCCCOCCCCCN 34a_100000762737_100000210320 [0,2,0,0,0,0|1,0,1]=4 15158 B16R0.303 CCCCCCCCCCOCCCCCO 34a_100000210711_100000746330 [0,2,0,0,0,0|0,0,2]=4 15159 B16R0.303 CCCCCCCCCCOCCCCCO 7a_100000210711_100000746330 [0,2,0,0,0,0|0,0,2]=4 15160 B16R0.303 CCCCCCCCCCOCCCCOC 34a_100000210711_100000755781 [0,2,0,0,0,0|0,0,2]=4 15161 B16R0.303 CCCCCCCCCCOCCCCOC 34a_100000740925_100000210320 [0,2,0,0,0,0|0,0,2]=4 15162 B16R0.303 CCCCCCCCCCOCCCCOC 34a_200010776780_200000210301 [0,2,0,0,0,0|0,0,2]=4 15163 B16R0.303 CCCCCCCCCCOCCCCOC 7a_100000210711_100000730899 [0,2,0,0,0,0|0,0,2]=4 15164 B16R0.303 CCCCCCCCCCOCCCCOC 7a_200010776780_200000210301 [0,2,0,0,0,0|0,0,2]=4 15165 B16R0.303 CCCCCCCCCCOCCCCO[13CH3] 34a_200010776780_200025704644 [0,2,0,0,0,0|0,0,2]=4 15166 B16R0.303 CCCCCCCCCCOCCCCO[13CH3] 7a_200010776780_200025704644 [0,2,0,0,0,0|0,0,2]=4 15167 B16R0.303 CCCCCCCCCCOCCCCSC 34a_100011217163_100000210320 [0,2,0,0,0,0|0,1,1]=4 15168 B16R0.303 CCCCCCCCCCOCCCCSC 7a_100011217163_100000210320 [0,2,0,0,0,0|0,1,1]=4 15169 B16R0.303 CCCCCCCCCCOCCCOCC 34a_100000210711_100012232248 [0,2,0,0,0,0|1,0,1]=4 15170 B16R0.303 CCCCCCCCCCOCCCOCC 34a_100000757476_100000210320 [0,2,0,0,0,0|1,0,1]=4 15171 B16R0.303 CCCCCCCCCCOCCCOCC 7a_100000210711_100012232248 [0,2,0,0,0,0|1,0,1]=4 15172 B16R0.303 CCCCCCCCCCOCCCOCC 7a_100000757476_100000210320 [0,2,0,0,0,0|1,0,1]=4 15173 B16R0.303 CCCCCCCCCCOCCCSCC 34a_100011216438_100000210320 [0,2,0,0,0,0|1,0,1]=4 15174 B16R0.303 CCCCCCCCCCOCCCSCC 7a_100011216438_100000210320 [0,2,0,0,0,0|1,0,1]=4 15175 B16R0.303 CCCCCCCCCCOCCOCC#N 7a_100000210711_200000047693 [0,2,0,0,0,0|1,0,1]=4 15176 B16R0.303 CCCCCCCCCCOCCOCCBr 34a_100000692535_100000210320 [0,2,0,0,0,0|1,0,1]=4 15177 B16R0.303 CCCCCCCCCCOCCOCCBr 7a_100000692535_100000210320 [0,2,0,0,0,0|1,0,1]=4 15178 B16R0.303 CCCCCCCCCCOCCOCCC 34a_100000210711_100011215938 [0,2,0,0,0,0|1,0,1]=4 15179 B16R0.303 CCCCCCCCCCOCCOCCC 34a_100000752267_100000210320 [0,2,0,0,0,0|1,0,1]=4 15180 B16R0.303 CCCCCCCCCCOCCOCCC 7a_100000210711_100011215938 [0,2,0,0,0,0|1,0,1]=4 15181 B16R0.303 CCCCCCCCCCOCCOCCC 7a_100000752267_100000210320 [0,2,0,0,0,0|1,0,1]=4 15182 B16R0.303 CCCCCCCCCCOCCOCCCl 34a_100011215305_100000210320 [0,2,0,0,0,0|1,0,1]=4 15183 B16R0.303 CCCCCCCCCCOCCOCCCl 7a_100011215305_100000210320 [0,2,0,0,0,0|1,0,1]=4 15184 B16R0.303 CCCCCCCCCCOCCOCCF 34a_200015357709_100000210320 [0,2,0,0,0,0|1,0,1]=4 15185 B16R0.303 CCCCCCCCCCOCCOCCF 7a_200015357709_100000210320 [0,2,0,0,0,0|1,0,1]=4 15186 B16R0.303 CCCCCCCCCCOCCOCCI 34a_100012149058_100000210320 [0,2,0,0,0,0|1,0,1]=4 15187 B16R0.303 CCCCCCCCCCOCCOCCI 7a_100012149058_100000210320 [0,2,0,0,0,0|1,0,1]=4 15188 B16R0.303 CCCCCCCCCCOCCOCCN 34a_100000211614_100000210320 [0,2,0,0,0,0|1,0,1]=4 15189 B16R0.303 CCCCCCCCCCOCCOCCO 34a_100000210711_100000692535 [0,2,0,0,0,0|0,0,2]=4 15190 B16R0.303 CCCCCCCCCCOCCOCCO 7a_100000210711_100011215305 [0,2,0,0,0,0|0,0,2]=4 15191 B16R0.303 CCCCCCCCCCOCCSCCC 34a_200000230433_100000210320 [0,2,0,0,0,0|1,0,1]=4 15192 B16R0.303 CCCCCCCCCCOCCSCCC 7a_200000230433_100000210320 [0,2,0,0,0,0|1,0,1]=4 15193 B16R0.303 CCCCCCCCCCOCOCCCC 34a_100000210711_100011995733 [0,2,0,0,0,0|1,0,1]=4 15194 B16R0.303 CCCCCCCCCCSCCCCC#N 62a_100011219923_100000210320 [0,2,0,0,0,0|1,0,1]=4 15195 B16R0.303 CCCCCCCCCCSCCCCC=O 62a_100000139335_100000210320 [0,2,0,0,0,0|0,0,0]=2 15196 B16R0.303 CCCCCCCCCCSCCCCCO 62a_100000746330_100000210320 [0,2,0,0,0,0|0,0,2]=4 15197 B16R0.303 CCCCCCCCCCSCCCCOC 62a_100000730899_100000210320 [0,2,0,0,0,0|0,0,2]=4 15198 B16R0.303 CCCCCCCCCCSCCCOCC 62a_100012232248_100000210320 [0,2,0,0,0,0|1,0,1]=4 15199 B16R0.303 CCCCCCCCCCSCCOCC#N 62a_200000047693_100000210320 [0,2,0,0,0,0|1,0,1]=4 15200 B16R0.303 CCCCCCCCCCSCCOCC#N 7a_100011628728_100011215382 [0,2,0,0,0,0|1,0,1]=4 15201 B16R0.303 CCCCCCCCCCSCCOCC=O 34a_100011628728_200009817547 [0,2,0,0,0,0|0,0,0]=2 15202 B16R0.303 CCCCCCCCCCSCCOCC=O 7a_100011628728_200015260668 [0,2,0,0,0,0|0,0,0]=2 15203 B16R0.303 CCCCCCCCCCSCCOCCC 34a_100011628728_100000210303 [0,2,0,0,0,0|1,0,1]=4 15204 B16R0.303 CCCCCCCCCCSCCOCCC 62a_100011215938_100000210320 [0,2,0,0,0,0|1,0,1]=4 15205 B16R0.303 CCCCCCCCCCSCCOCCC 7a_100011628728_100000210303 [0,2,0,0,0,0|1,0,1]=4 15206 B16R0.303 CCCCCCCCCCSCCOCCF 34a_100011628728_100011217306 [0,2,0,0,0,0|1,0,1]=4 15207 B16R0.303 CCCCCCCCCCSCCOCCF 7a_100011628728_100011217306 [0,2,0,0,0,0|1,0,1]=4 15208 B16R0.303 CCCCCCCCCCSCCOCCO 34a_100011628728_100000211926 [0,2,0,0,0,0|0,0,2]=4 15209 B16R0.303 CCCCCCCCCCSCCOCCO 62a_100011215305_100000210320 [0,2,0,0,0,0|0,0,2]=4 15210 B16R0.303 CCCCCCCCCCSCCOCCO 7a_100011628728_100000211926 [0,2,0,0,0,0|0,0,2]=4 15211 B16R0.303 CCCCCCCCCCSCCOCSC 34a_100011628728_100011218213 [0,2,0,0,0,0|2,0,0]=4 15212 B16R0.303 CCCCCCCCCCSCOCCCC 62a_100011995733_100000210320 [0,2,0,0,0,0|1,0,1]=4 15213 B16R0.303 CCCCCCCCCCSCOCCOC 62a_100000231047_100000210320 [0,2,0,0,0,0|2,0,0]=4 15214 B16R0.303 CCCCCCCCCNCCCCCC#N 2230a_100000212291_100009813376 [0,2,0,0,0,0|1,0,1]=4 15215 B16R0.303 CCCCCCCCCNCCCCCC=O 2230a_100000212291_100000139337 [0,2,0,0,0,0|0,0,0]=2 15216 B16R0.303 CCCCCCCCCNCCCCCCC 2230a_100000212291_100000210681 [0,2,0,0,0,0|1,0,1]=4 15217 B16R0.303 CCCCCCCCCNCCCCCCC 2230a_100000229938_100011214924 [0,2,0,0,0,0|1,0,1]=4 15218 B16R0.303 CCCCCCCCCNCCCCCCC 34a_100000212291_100000210614 [0,2,0,0,0,0|1,0,1]=4 15219 B16R0.303 CCCCCCCCCNCCCCCCF 2230a_100000212291_100015922095 [0,2,0,0,0,0|1,0,1]=4 15220 B16R0.303 CCCCCCCCCNCCCCCCF 34a_100000212291_100015922095 [0,2,0,0,0,0|1,0,1]=4 15221 B16R0.303 CCCCCCCCCNCCCCCCO 2230a_100000212291_100000766143 [0,2,0,0,0,0|0,0,2]=4 15222 B16R0.303 CCCCCCCCCNCCCCCCO 2230a_100000686447_100011214924 [0,2,0,0,0,0|0,0,2]=4 15223 B16R0.303 CCCCCCCCCNCCCCCCO 34a_100000212291_100000766143 [0,2,0,0,0,0|0,0,2]=4 15224 B16R0.303 CCCCCCCCCNCCCCCCO 34a_100000686447_100011214924 [0,2,0,0,0,0|0,0,2]=4 15225 B16R0.303 CCCCCCCCCNCCCCCOC 2230a_100000747528_100011214924 [0,2,0,0,0,0|0,0,2]=4 15226 B16R0.303 CCCCCCCCCNCCCCCOC 34a_100000747528_100011214924 [0,2,0,0,0,0|0,0,2]=4 15227 B16R0.303 CCCCCCCCCNCCCCN=[N+]=[N-] 2230a_100000101370_100011214924 [0,2,0,0,0,0|2,0,0]=4 15228 B16R0.303 CCCCCCCCCNCCCOCCC 2230a_100011217757_100011214924 [0,2,0,0,0,0|1,0,1]=4 15229 B16R0.303 CCCCCCCCCNCCCOCCC 34a_100011217757_100011214924 [0,2,0,0,0,0|1,0,1]=4 15230 B16R0.303 CCCCCCCCCNCCOCCCC 2230a_100000212291_100000743108 [0,2,0,0,0,0|1,0,1]=4 15231 B16R0.303 CCCCCCCCCNCCOCCCC 34a_100000212291_100000743108 [0,2,0,0,0,0|1,0,1]=4 15232 B16R0.303 CCCCCCCCCNCCOCCOC 2230a_100000212291_100000695917 [0,2,0,0,0,0|2,0,0]=4 15233 B16R0.303 CCCCCCCCCNCCOCCOC 2230a_100000745349_100011214924 [0,2,0,0,0,0|2,0,0]=4 15234 B16R0.303 CCCCCCCCCNCCOCCOC 34a_100000212291_100000695917 [0,2,0,0,0,0|2,0,0]=4 15235 B16R0.303 CCCCCCCCCNCCOCCOC 34a_100000745349_100011214924 [0,2,0,0,0,0|2,0,0]=4 15236 B16R0.303 CCCCCCCCCNCCSCCCC 2230a_100025743550_100011214924 [0,2,0,0,0,0|1,0,1]=4 15237 B16R0.303 CCCCCCCCCOCCCCCC#N 7a_100000210712_100009813376 [0,2,0,0,0,0|1,0,1]=4 15238 B16R0.303 CCCCCCCCCOCCCCCC=O 7a_100000210712_100000139337 [0,2,0,0,0,0|0,0,0]=2 15239 B16R0.303 CCCCCCCCCOCCCCCCBr 34a_100011215345_100011214924 [0,2,0,0,0,0|1,0,1]=4 15240 B16R0.303 CCCCCCCCCOCCCCCCBr 7a_100011215345_100000210328 [0,2,0,0,0,0|1,0,1]=4 15241 B16R0.303 CCCCCCCCCOCCCCCCC 34a_100000210272_100011214924 [0,2,0,0,0,0|1,0,1]=4 15242 B16R0.303 CCCCCCCCCOCCCCCCC 34a_100000210712_100000210614 [0,2,0,0,0,0|1,0,1]=4 15243 B16R0.303 CCCCCCCCCOCCCCCCC 7a_100000210272_100000210328 [0,2,0,0,0,0|1,0,1]=4 15244 B16R0.303 CCCCCCCCCOCCCCCCC 7a_100000210712_100000210614 [0,2,0,0,0,0|1,0,1]=4 15245 B16R0.303 CCCCCCCCCOCCCCCCCl 34a_100000766143_100011214924 [0,2,0,0,0,0|1,0,1]=4 15246 B16R0.303 CCCCCCCCCOCCCCCCCl 7a_100000766143_100000210328 [0,2,0,0,0,0|1,0,1]=4 15247 B16R0.303 CCCCCCCCCOCCCCCCF 34a_100000210712_100015922095 [0,2,0,0,0,0|1,0,1]=4 15248 B16R0.303 CCCCCCCCCOCCCCCCF 34a_100000732779_100011214924 [0,2,0,0,0,0|1,0,1]=4 15249 B16R0.303 CCCCCCCCCOCCCCCCF 7a_100000210712_100015922095 [0,2,0,0,0,0|1,0,1]=4 15250 B16R0.303 CCCCCCCCCOCCCCCCF 7a_100000732779_100000210328 [0,2,0,0,0,0|1,0,1]=4 15251 B16R0.303 CCCCCCCCCOCCCCCCN 34a_100000686447_100011214924 [0,2,0,0,0,0|1,0,1]=4 15252 B16R0.303 CCCCCCCCCOCCCCCCO 34a_100000210712_100000766143 [0,2,0,0,0,0|0,0,2]=4 15253 B16R0.303 CCCCCCCCCOCCCCCCO 7a_100000210712_100000766143 [0,2,0,0,0,0|0,0,2]=4 15254 B16R0.303 CCCCCCCCCOCCCCCNC 34a_100000722520_100011214924 [0,2,0,0,0,0|1,0,1]=4 15255 B16R0.303 CCCCCCCCCOCCOCCCC 34a_100000210238_100011214924 [0,2,0,0,0,0|1,0,1]=4 15256 B16R0.303 CCCCCCCCCOCCOCCCC 34a_100000210712_100000743108 [0,2,0,0,0,0|1,0,1]=4 15257 B16R0.303 CCCCCCCCCOCCOCCCC 7a_100000210238_100000210328 [0,2,0,0,0,0|1,0,1]=4 15258 B16R0.303 CCCCCCCCCOCCOCCCC 7a_100000210712_100000743108 [0,2,0,0,0,0|1,0,1]=4 15259 B16R0.303 CCCCCCCCCOCCOCCNC 34a_100000228057_100011214924 [0,2,0,0,0,0|2,0,0]=4 15260 B16R0.303 CCCCCCCCCOCCOCCOC 34a_100000210712_100000695917 [0,2,0,0,0,0|2,0,0]=4 15261 B16R0.303 CCCCCCCCCOCCOCCOC 34a_100011215163_100011214924 [0,2,0,0,0,0|2,0,0]=4 15262 B16R0.303 CCCCCCCCCOCCOCCOC 7a_100000210712_100000695917 [0,2,0,0,0,0|2,0,0]=4 15263 B16R0.303 CCCCCCCCCOCCOCCOC 7a_100011215163_100000210328 [0,2,0,0,0,0|2,0,0]=4 15264 B16R0.303 CCCCCCCCCOCCSCCCC 34a_200000230436_100011214924 [0,2,0,0,0,0|1,0,1]=4 15265 B16R0.303 CCCCCCCCCOCCSCCCC 7a_200000230436_100000210328 [0,2,0,0,0,0|1,0,1]=4 15266 B16R0.303 CCCCCCCCCSCCCCCC#N 62a_100009813376_100000210670 [0,2,0,0,0,0|1,0,1]=4 15267 B16R0.303 CCCCCCCCCSCCCCCC=O 62a_100000139337_100000210670 [0,2,0,0,0,0|0,0,0]=2 15268 B16R0.303 CCCCCCCCCSCCCCCCO 62a_100000766143_100000210670 [0,2,0,0,0,0|0,0,2]=4 15269 B16R0.303 CCCCCCCCCSCCOCCCC 62a_100000743108_100000210670 [0,2,0,0,0,0|1,0,1]=4 15270 B16R0.303 CCCCCCCCCSCCOCCOC 62a_100000695917_100000210670 [0,2,0,0,0,0|2,0,0]=4 15271 B16R0.303 CCCCCCCCNCCCCCCC#N 2230a_100000229939_100009813337 [0,2,0,0,0,0|1,0,1]=4 15272 B16R0.303 CCCCCCCCNCCCCCCCC 2230a_100000229939_100000210759 [0,2,0,0,0,0|1,0,1]=4 15273 B16R0.303 CCCCCCCCNCCCCCCCC 34a_100000229939_100000210759 [0,2,0,0,0,0|1,0,1]=4 15274 B16R0.303 CCCCCCCCNCCCCCCCO 2230a_100000229939_100000760002 [0,2,0,0,0,0|0,0,2]=4 15275 B16R0.303 CCCCCCCCNCCCCCCCO 2230a_100011996573_100000210759 [0,2,0,0,0,0|0,0,2]=4 15276 B16R0.303 CCCCCCCCNCCCCCCCO 34a_100000229939_100000760002 [0,2,0,0,0,0|0,0,2]=4 15277 B16R0.303 CCCCCCCCNCCCCCCCO 34a_100011996573_100000210759 [0,2,0,0,0,0|0,0,2]=4 15278 B16R0.303 CCCCCCCCNCCCCCCOC 2230a_100000229939_100011998445 [0,2,0,0,0,0|0,0,2]=4 15279 B16R0.303 CCCCCCCCNCCCCCCOC 34a_100000229939_100011998445 [0,2,0,0,0,0|0,0,2]=4 15280 B16R0.303 CCCCCCCCNCCCOCCCC 2230a_200000211371_100000210759 [0,2,0,0,0,0|1,0,1]=4 15281 B16R0.303 CCCCCCCCNCCCOCCCC 34a_200000211371_100000210759 [0,2,0,0,0,0|1,0,1]=4 15282 B16R0.303 CCCCCCCCNCCCOCCCO 2230a_100011310245_100000210759 [0,2,0,0,0,0|0,0,2]=4 15283 B16R0.303 CCCCCCCCNCCCOCCCO 34a_100011310245_100000210759 [0,2,0,0,0,0|0,0,2]=4 15284 B16R0.303 CCCCCCCCNCCCOCCOC 2230a_100000206027_100000210759 [0,2,0,0,0,0|2,0,0]=4 15285 B16R0.303 CCCCCCCCNCCCOCCOC 2230a_100000229939_100011216529 [0,2,0,0,0,0|2,0,0]=4 15286 B16R0.303 CCCCCCCCNCCCOCCOC 34a_100000206027_100000210759 [0,2,0,0,0,0|2,0,0]=4 15287 B16R0.303 CCCCCCCCNCCCOCCOC 34a_100000229939_100011216529 [0,2,0,0,0,0|2,0,0]=4 15288 B16R0.303 CCCCCCCCOCCCCCCC#N 7a_100000210232_100009813337 [0,2,0,0,0,0|1,0,1]=4 15289 B16R0.303 CCCCCCCCOCCCCCCCBr 34a_100000760002_100000210759 [0,2,0,0,0,0|1,0,1]=4 15290 B16R0.303 CCCCCCCCOCCCCCCCBr 7a_100000760002_100000210759 [0,2,0,0,0,0|1,0,1]=4 15291 B16R0.303 CCCCCCCCOCCCCCCCC 34a_100000210232_100000210759 [0,2,0,0,0,0|1,0,1]=4 15292 B16R0.303 CCCCCCCCOCCCCCCCC 7a_100000210232_100000210759 [0,2,0,0,0,0|1,0,1]=4 15293 B16R0.303 CCCCCCCCOCCCCCCCN 34a_100011996573_100000210759 [0,2,0,0,0,0|1,0,1]=4 15294 B16R0.303 CCCCCCCCOCCCCCCCO 34a_100000210232_100000760002 [0,2,0,0,0,0|0,0,2]=4 15295 B16R0.303 CCCCCCCCOCCCCCCCO 7a_100000210232_100000760002 [0,2,0,0,0,0|0,0,2]=4 15296 B16R0.303 CCCCCCCCOCCCCCCOC 34a_100000210232_100011998445 [0,2,0,0,0,0|0,0,2]=4 15297 B16R0.303 CCCCCCCCOCCCCCCOC 34a_200012092642_100000210759 [0,2,0,0,0,0|0,0,2]=4 15298 B16R0.303 CCCCCCCCOCCCCCCOC 7a_100000210232_100011998445 [0,2,0,0,0,0|0,0,2]=4 15299 B16R0.303 CCCCCCCCOCCCCCCOC 7a_200012092642_100000210759 [0,2,0,0,0,0|0,0,2]=4 15300 B16R0.303 CCCCCCCCOCCCOCCCC 34a_200011215613_100000210759 [0,2,0,0,0,0|1,0,1]=4 15301 B16R0.303 CCCCCCCCOCCCOCCCC 7a_200011215613_100000210759 [0,2,0,0,0,0|1,0,1]=4 15302 B16R0.303 CCCCCCCCOCCCOCCCN 34a_100011310245_100000210759 [0,2,0,0,0,0|1,0,1]=4 15303 B16R0.303 CCCCCCCCOCCCOCCOC 34a_100000210232_100011216529 [0,2,0,0,0,0|2,0,0]=4 15304 B16R0.303 CCCCCCCCOCCCOCCOC 7a_100000210232_100011216529 [0,2,0,0,0,0|2,0,0]=4 15305 B16R0.303 CCCCCCCCOCCNCCCCC 34a_100000224656_100000210759 [0,2,0,0,0,0|1,0,1]=4 15306 B16R0.303 CCCCCCCCOCCOCCCCC 34a_100011215259_100000210759 [0,2,0,0,0,0|1,0,1]=4 15307 B16R0.303 CCCCCCCCOCCOCCCCC 7a_100011215259_100000210759 [0,2,0,0,0,0|1,0,1]=4 15308 B16R0.303 CCCCCCCCSCCCCCCC#N 62a_100000210759_100009813337 [0,2,0,0,0,0|1,0,1]=4 15309 B16R0.303 CCCCCCCCSCCCCCCC#N 62a_100009813337_100000210317 [0,2,0,0,0,0|1,0,1]=4 15310 B16R0.303 CCCCCCCCSCCCCCCCO 62a_100000210759_100000760002 [0,2,0,0,0,0|0,0,2]=4 15311 B16R0.303 CCCCCCCCSCCCCCCCO 62a_100000760002_100000210317 [0,2,0,0,0,0|0,0,2]=4 15312 B16R0.303 CCCCCCCCSCCCCCCOC 62a_100000210759_100011998445 [0,2,0,0,0,0|0,0,2]=4 15313 B16R0.303 CCCCCCCCSCCCCCCOC 62a_100011998445_100000210317 [0,2,0,0,0,0|0,0,2]=4 15314 B16R0.303 CCCCCCCCSCCCOCCOC 62a_100000210759_100011216529 [0,2,0,0,0,0|2,0,0]=4 15315 B16R0.303 CCCCCCCCSCCCOCCOC 62a_100011216529_100000210317 [0,2,0,0,0,0|2,0,0]=4 15316 B16R0.303 CCCCCCCNCCCCCCCCO 2230a_100000229938_100000033203 [0,2,0,0,0,0|0,0,2]=4 15317 B16R0.303 CCCCCCCNCCCCCCCCO 2230a_102515433106_100000210681 [0,2,0,0,0,0|0,0,2]=4 15318 B16R0.303 CCCCCCCNCCCCCCCCO 34a_102515433106_100000210614 [0,2,0,0,0,0|0,0,2]=4 15319 B16R0.303 CCCCCCCNCCCCCCN=[N+]=[N-] 2230a_200000049180_100000210681 [0,2,0,0,0,0|2,0,0]=4 15320 B16R0.303 CCCCCCCOCCCCCCCCBr 34a_100009813846_100000210614 [0,2,0,0,0,0|1,0,1]=4 15321 B16R0.303 CCCCCCCOCCCCCCCCBr 7a_100009813846_100000210614 [0,2,0,0,0,0|1,0,1]=4 15322 B16R0.303 CCCCCCCOCCCCCCCCCl 34a_100000033203_100000210614 [0,2,0,0,0,0|1,0,1]=4 15323 B16R0.303 CCCCCCCOCCCCCCCCCl 7a_100000033203_100000210614 [0,2,0,0,0,0|1,0,1]=4 15324 B16R0.303 CCCCCCCOCCCCCCCCN 34a_102515433106_100000210614 [0,2,0,0,0,0|1,0,1]=4 15325 B16R0.303 CCCCCCCOCCCCCCCCO 34a_100000210272_100000033203 [0,2,0,0,0,0|0,0,2]=4 15326 B16R0.303 CCCCCCCOCCCCCCCCO 7a_100000210272_100000033203 [0,2,0,0,0,0|0,0,2]=4 15327 B16R0.303 CCCCCCCOCCCCCNCCN 34a_103619048469_100000210614 [0,2,0,0,0,0|1,0,1]=4 15328 B16R0.303 CCCCCCCOCCCCNCCCC 34a_200011216965_100000210614 [0,2,0,0,0,0|1,0,1]=4 15329 B16R0.303 CCCCCCCOCCCCOCCCC 34a_200000760531_100000210614 [0,2,0,0,0,0|1,0,1]=4 15330 B16R0.303 CCCCCCCOCCCCOCCCC 7a_200000760531_100000210614 [0,2,0,0,0,0|1,0,1]=4 15331 B16R0.303 CCCCCCCOCCCOCCCOC 34a_200011215475_100000210614 [0,2,0,0,0,0|2,0,0]=4 15332 B16R0.303 CCCCCCCOCCCOCCCOC 7a_200011215475_100000210614 [0,2,0,0,0,0|2,0,0]=4 15333 B16R0.303 CCCCCCCOCCOCCCCCC 34a_100000691444_100000210614 [0,2,0,0,0,0|1,0,1]=4 15334 B16R0.303 CCCCCCCOCCOCCCCCC 7a_100000691444_100000210614 [0,2,0,0,0,0|1,0,1]=4 15335 B16R0.303 CCCCCCCSCCCCCCCCO 62a_100000033203_100000210316 [0,2,0,0,0,0|0,0,2]=4 15336 B16R0.303 CCCCCCCSCCCCCCCCO 62a_100000210614_100000033203 [0,2,0,0,0,0|0,0,2]=4 15337 B16R0.303 CCCCCCNCCCCCCCCCO 2230a_100000078944_100000210314 [0,2,0,0,0,0|0,0,2]=4 15338 B16R0.303 CCCCCCNCCCCCCCCCO 2230a_100000210581_100009813782 [0,2,0,0,0,0|0,0,2]=4 15339 B16R0.303 CCCCCCNCCCCCCCCCO 34a_100000078944_100000210314 [0,2,0,0,0,0|0,0,2]=4 15340 B16R0.303 CCCCCCOCCCCCCCCCBr 34a_100009813782_100000210314 [0,2,0,0,0,0|1,0,1]=4 15341 B16R0.303 CCCCCCOCCCCCCCCCBr 7a_100009813782_100000210314 [0,2,0,0,0,0|1,0,1]=4 15342 B16R0.303 CCCCCCOCCCCCCCCCCl 34a_100009868337_100000210314 [0,2,0,0,0,0|1,0,1]=4 15343 B16R0.303 CCCCCCOCCCCCCCCCCl 7a_100009868337_100000210314 [0,2,0,0,0,0|1,0,1]=4 15344 B16R0.303 CCCCCCOCCCCCCCCCN 34a_100000078944_100000210314 [0,2,0,0,0,0|1,0,1]=4 15345 B16R0.303 CCCCCCOCCCCCCCCCO 34a_100000210259_100009813782 [0,2,0,0,0,0|0,0,2]=4 15346 B16R0.303 CCCCCCOCCCCCCCCCO 7a_100000210259_100009813782 [0,2,0,0,0,0|0,0,2]=4 15347 B16R0.303 CCCCCCOCCOCCCCCC#N 7a_100000691444_100009813376 [0,2,0,0,0,0|1,0,1]=4 15348 B16R0.303 CCCCCCOCCOCCCCCC=O 7a_100000691444_100000139337 [0,2,0,0,0,0|0,0,0]=2 15349 B16R0.303 CCCCCCOCCOCCCCCCF 34a_100000691444_100015922095 [0,2,0,0,0,0|1,0,1]=4 15350 B16R0.303 CCCCCCOCCOCCCCCCF 7a_100000691444_100015922095 [0,2,0,0,0,0|1,0,1]=4 15351 B16R0.303 CCCCCCOCCOCCCCCCO 34a_100000691444_100000766143 [0,2,0,0,0,0|0,0,2]=4 15352 B16R0.303 CCCCCCOCCOCCCCCCO 7a_100000691444_100000766143 [0,2,0,0,0,0|0,0,2]=4 15353 B16R0.303 CCCCCCSCCCCCCCCCO 62a_100000210314_100009813782 [0,2,0,0,0,0|0,0,2]=4 15354 B16R0.303 CCCCCCSCCCCCCCCCO 62a_100009813782_100000210757 [0,2,0,0,0,0|0,0,2]=4 15355 B16R0.303 CCCCCNCCCCCCCCCCO 2230a_100000066964_100000210326 [0,2,0,0,0,0|0,0,2]=4 15356 B16R0.303 CCCCCNCCCCCCCCCCO 2230a_100000209983_100009813290 [0,2,0,0,0,0|0,0,2]=4 15357 B16R0.303 CCCCCNCCCCCCCCCCO 34a_100000066964_100000718602 [0,2,0,0,0,0|0,0,2]=4 15358 B16R0.303 CCCCCNCCOCCCCCCCO 34a_100000224656_100000760002 [0,2,0,0,0,0|0,0,2]=4 15359 B16R0.303 CCCCCNCCOCCCCCCOC 34a_100000224656_100011998445 [0,2,0,0,0,0|2,0,0]=4 15360 B16R0.303 CCCCCOCCCCCCCCCCBr 34a_100009813290_100000718602 [0,2,0,0,0,0|1,0,1]=4 15361 B16R0.303 CCCCCOCCCCCCCCCCBr 7a_100009813290_100000210326 [0,2,0,0,0,0|1,0,1]=4 15362 B16R0.303 CCCCCOCCCCCCCCCCCl 34a_200000033068_100000718602 [0,2,0,0,0,0|1,0,1]=4 15363 B16R0.303 CCCCCOCCCCCCCCCCCl 7a_200000033068_100000210326 [0,2,0,0,0,0|1,0,1]=4 15364 B16R0.303 CCCCCOCCCCCCCCCCN 34a_100000066964_100000718602 [0,2,0,0,0,0|1,0,1]=4 15365 B16R0.303 CCCCCOCCCCCCCCCCO 34a_100000210253_100009813290 [0,2,0,0,0,0|0,0,2]=4 15366 B16R0.303 CCCCCOCCCCCCCCCCO 7a_100000210253_100009813290 [0,2,0,0,0,0|0,0,2]=4 15367 B16R0.303 CCCCCOCCOCCCCCCC#N 7a_100011215259_100009813337 [0,2,0,0,0,0|1,0,1]=4 15368 B16R0.303 CCCCCOCCOCCCCCCCO 34a_100011215259_100000760002 [0,2,0,0,0,0|0,0,2]=4 15369 B16R0.303 CCCCCOCCOCCCCCCCO 7a_100011215259_100000760002 [0,2,0,0,0,0|0,0,2]=4 15370 B16R0.303 CCCCCOCCOCCCCCCOC 34a_100011215259_100011998445 [0,2,0,0,0,0|2,0,0]=4 15371 B16R0.303 CCCCCOCCOCCCCCCOC 7a_100011215259_100011998445 [0,2,0,0,0,0|2,0,0]=4 15372 B16R0.303 CCCCCSCCCCCCCCCCO 62a_100000210326_200000033068 [0,2,0,0,0,0|0,0,2]=4 15373 B16R0.303 CCCCCSCCCCCCCCCCO 62a_100009813290_100000210326 [0,2,0,0,0,0|0,0,2]=4 15374 B16R0.303 CCCCNCCCCCCCCCCCO 2230a_100000102301_100009812471 [0,2,0,0,0,0|0,0,2]=4 15375 B16R0.303 CCCCNCCCCCCCCCCCO 7a_106832991798_100009812471 [0,2,0,0,0,0|0,0,2]=4 15376 B16R0.303 CCCCNCCCCOCCCCCCF 34a_200011216965_100015922095 [0,2,0,0,0,0|1,0,1]=4 15377 B16R0.303 CCCCNCCCCOCCCCCCO 34a_200011216965_100000766143 [0,2,0,0,0,0|0,0,2]=4 15378 B16R0.303 CCCCOCCCCCCCCCCCBr 34a_100009812471_100000210210 [0,2,0,0,0,0|1,0,1]=4 15379 B16R0.303 CCCCOCCCCCCCCCCCBr 7a_100009812471_100000210211 [0,2,0,0,0,0|1,0,1]=4 15380 B16R0.303 CCCCOCCCCCCCCCCCO 34a_100000210227_100009812471 [0,2,0,0,0,0|0,0,2]=4 15381 B16R0.303 CCCCOCCCCCCCCCCCO 7a_100000210227_100009812471 [0,2,0,0,0,0|0,0,2]=4 15382 B16R0.303 CCCCOCCCCCCCCCOCC 34a_100009875440_100000210210 [0,2,0,0,0,0|1,0,1]=4 15383 B16R0.303 CCCCOCCCCCCCCCOCC 7a_100009875440_100000210211 [0,2,0,0,0,0|1,0,1]=4 15384 B16R0.303 CCCCOCCCCOCCCCCC#N 7a_200000760531_100009813376 [0,2,0,0,0,0|1,0,1]=4 15385 B16R0.303 CCCCOCCCCOCCCCCC=O 7a_200000760531_100000139337 [0,2,0,0,0,0|0,0,0]=2 15386 B16R0.303 CCCCOCCCCOCCCCCCF 34a_200000760531_100015922095 [0,2,0,0,0,0|1,0,1]=4 15387 B16R0.303 CCCCOCCCCOCCCCCCF 7a_200000760531_100015922095 [0,2,0,0,0,0|1,0,1]=4 15388 B16R0.303 CCCCOCCCCOCCCCCCO 34a_200000760531_100000766143 [0,2,0,0,0,0|0,0,2]=4 15389 B16R0.303 CCCCOCCCCOCCCCCCO 7a_200000760531_100000766143 [0,2,0,0,0,0|0,0,2]=4 15390 B16R0.303 CCCCOCCCNCCCCCCC#N 2230a_200000211371_100009813337 [0,2,0,0,0,0|1,0,1]=4 15391 B16R0.303 CCCCOCCCNCCCCCCCO 2230a_200000211371_100000760002 [0,2,0,0,0,0|0,0,2]=4 15392 B16R0.303 CCCCOCCCNCCCCCCCO 34a_200000211371_100000760002 [0,2,0,0,0,0|0,0,2]=4 15393 B16R0.303 CCCCOCCCNCCCCCCOC 2230a_200000211371_100011998445 [0,2,0,0,0,0|2,0,0]=4 15394 B16R0.303 CCCCOCCCNCCCCCCOC 34a_200000211371_100011998445 [0,2,0,0,0,0|2,0,0]=4 15395 B16R0.303 CCCCOCCCOCCCCCCC#N 7a_200011215613_100009813337 [0,2,0,0,0,0|1,0,1]=4 15396 B16R0.303 CCCCOCCCOCCCCCCCO 34a_200011215613_100000760002 [0,2,0,0,0,0|0,0,2]=4 15397 B16R0.303 CCCCOCCCOCCCCCCCO 7a_200011215613_100000760002 [0,2,0,0,0,0|0,0,2]=4 15398 B16R0.303 CCCCOCCCOCCCCCCOC 34a_200011215613_100011998445 [0,2,0,0,0,0|2,0,0]=4 15399 B16R0.303 CCCCOCCCOCCCCCCOC 7a_200011215613_100011998445 [0,2,0,0,0,0|2,0,0]=4 15400 B16R0.303 CCCCOCCNCCCCCCCCO 2230a_102515433106_100000743108 [0,2,0,0,0,0|0,0,2]=4 15401 B16R0.303 CCCCOCCNCCCCCCCCO 34a_102515433106_100000743108 [0,2,0,0,0,0|0,0,2]=4 15402 B16R0.303 CCCCOCCOCCCCCCCCBr 34a_100009813846_100000743108 [0,2,0,0,0,0|1,0,1]=4 15403 B16R0.303 CCCCOCCOCCCCCCCCBr 7a_100009813846_100000743108 [0,2,0,0,0,0|1,0,1]=4 15404 B16R0.303 CCCCOCCOCCCCCCCCCl 34a_100000033203_100000743108 [0,2,0,0,0,0|1,0,1]=4 15405 B16R0.303 CCCCOCCOCCCCCCCCCl 7a_100000033203_100000743108 [0,2,0,0,0,0|1,0,1]=4 15406 B16R0.303 CCCCOCCOCCCCCCCCN 34a_102515433106_100000743108 [0,2,0,0,0,0|1,0,1]=4 15407 B16R0.303 CCCCOCCOCCCCCCCCO 34a_100000210238_100000033203 [0,2,0,0,0,0|0,0,2]=4 15408 B16R0.303 CCCCOCCOCCCCCCCCO 7a_100000210238_100000033203 [0,2,0,0,0,0|0,0,2]=4 15409 B16R0.303 CCCCOCCOCCOCCCCC=O 7a_100011215186_100000139335 [0,2,0,0,0,0|1,0,0]=3 15410 B16R0.303 CCCCOCCOCCOCCOCC=O 34a_100000700218_200009817547 [0,2,0,0,0,0|2,0,0]=4 15411 B16R0.303 CCCCOCCOCCOCCOCC=O 7a_100000700218_200015260668 [0,2,0,0,0,0|2,0,0]=4 15412 B16R0.303 CCCCOCCSCCCCCCCCO 62a_100000033203_100000743108 [0,2,0,0,0,0|0,0,2]=4 15413 B16R0.303 CCCCOCCSCCCCCCCCO 62a_100000743108_100000033203 [0,2,0,0,0,0|0,0,2]=4 15414 B16R0.303 CCCCOCNCCCCCCCCCO 2230a_100000078944_100011995733 [0,2,0,0,0,0|0,0,2]=4 15415 B16R0.303 CCCCOCNCCCCCCCCCO 34a_100000078944_100011995733 [0,2,0,0,0,0|0,0,2]=4 15416 B16R0.303 CCCCOCOCCCCCCCCCBr 34a_100009813782_100011995733 [0,2,0,0,0,0|1,0,1]=4 15417 B16R0.303 CCCCOCOCCCCCCCCCCl 34a_100009868337_100011995733 [0,2,0,0,0,0|1,0,1]=4 15418 B16R0.303 CCCCOCOCCCCCCCCCN 34a_100000078944_100011995733 [0,2,0,0,0,0|1,0,1]=4 15419 B16R0.303 CCCCOCSCCCCCCCCCO 62a_100009813782_100011995733 [0,2,0,0,0,0|0,0,2]=4 15420 B16R0.303 CCCCOCSCCCCCCCCCO 62a_100011995733_100009813782 [0,2,0,0,0,0|0,0,2]=4 15421 B16R0.303 CCCCSCCCCCCCCCCCO 62a_100009812471_100000210210 [0,2,0,0,0,0|0,0,2]=4 15422 B16R0.303 CCCCSCCNCCCCCCCCO 2230a_100025743550_100000033203 [0,2,0,0,0,0|0,0,2]=4 15423 B16R0.303 CCCCSCCOCCCCCCCCO 34a_200000230436_100000033203 [0,2,0,0,0,0|0,0,2]=4 15424 B16R0.303 CCCCSCCOCCCCCCCCO 7a_200000230436_100000033203 [0,2,0,0,0,0|0,0,2]=4 15425 B16R0.303 CCCNCCCCCCCCCCCCO 2230a_100000066677_100000210303 [0,2,0,0,0,0|0,0,2]=4 15426 B16R0.303 CCCNCCCCCCCCCCCCO 34a_100000066677_100000210303 [0,2,0,0,0,0|0,0,2]=4 15427 B16R0.303 CCCOCCCCCCCCCCCCBr 34a_100009813331_100000210303 [0,2,0,0,0,0|1,0,1]=4 15428 B16R0.303 CCCOCCCCCCCCCCCCBr 7a_100009813331_100000210303 [0,2,0,0,0,0|1,0,1]=4 15429 B16R0.303 CCCOCCCCCCCCCCCCN 34a_100000066677_100000210303 [0,2,0,0,0,0|1,0,1]=4 15430 B16R0.303 CCCOCCCCCCCCCCCCO 34a_100000210258_100009813331 [0,2,0,0,0,0|0,0,2]=4 15431 B16R0.303 CCCOCCCCCCOCCCCCO 34a_100000210258_200132310570 [0,2,0,0,0,0|0,0,2]=4 15432 B16R0.303 CCCOCCCCCOCCCCCCCl 34a_200132310570_100000210303 [0,2,0,0,0,0|1,0,1]=4 15433 B16R0.303 CCCOCCCCCOCCCCCCCl 7a_200132310570_100000210303 [0,2,0,0,0,0|1,0,1]=4 15434 B16R0.303 CCCOCCCNCCCCCCCCO 2230a_100011217757_100000033203 [0,2,0,0,0,0|0,0,2]=4 15435 B16R0.303 CCCOCCCNCCCCCCCCO 34a_100011217757_100000033203 [0,2,0,0,0,0|0,0,2]=4 15436 B16R0.303 CCCOCCNCCCCCCCCCO 2230a_100000078944_100011215938 [0,2,0,0,0,0|0,0,2]=4 15437 B16R0.303 CCCOCCNCCCCCCCCCO 2230a_100161115042_100009813782 [0,2,0,0,0,0|0,0,2]=4 15438 B16R0.303 CCCOCCNCCCCCCCCCO 34a_100000078944_100011215938 [0,2,0,0,0,0|0,0,2]=4 15439 B16R0.303 CCCOCCNCCCCCCCCCO 34a_100161115042_100009813782 [0,2,0,0,0,0|0,0,2]=4 15440 B16R0.303 CCCOCCOCCCCCCCCCBr 34a_100009813782_100011215938 [0,2,0,0,0,0|1,0,1]=4 15441 B16R0.303 CCCOCCOCCCCCCCCCBr 7a_100009813782_100011215938 [0,2,0,0,0,0|1,0,1]=4 15442 B16R0.303 CCCOCCOCCCCCCCCCCl 34a_100009868337_100011215938 [0,2,0,0,0,0|1,0,1]=4 15443 B16R0.303 CCCOCCOCCCCCCCCCCl 7a_100009868337_100011215938 [0,2,0,0,0,0|1,0,1]=4 15444 B16R0.303 CCCOCCOCCCCCCCCCN 34a_100000078944_100011215938 [0,2,0,0,0,0|1,0,1]=4 15445 B16R0.303 CCCOCCOCCCCCCCCCO 34a_100000752267_100009813782 [0,2,0,0,0,0|0,0,2]=4 15446 B16R0.303 CCCOCCOCCCCCCCCCO 7a_100000752267_100009813782 [0,2,0,0,0,0|0,0,2]=4 15447 B16R0.303 CCCOCCOCCNCCCCCC=O 2230a_200011904461_100000139337 [0,2,0,0,0,0|1,0,0]=3 15448 B16R0.303 CCCOCCSCCCCCCCCCO 62a_100009813782_100011215938 [0,2,0,0,0,0|0,0,2]=4 15449 B16R0.303 CCCOCCSCCCCCCCCCO 62a_100011215938_100009813782 [0,2,0,0,0,0|0,0,2]=4 15450 B16R0.303 CCCSCCCCCCCCCCCCO 62a_100009813331_100000210303 [0,2,0,0,0,0|0,0,2]=4 15451 B16R0.303 CCCSCCCCCCOCCCCCO 62a_100000210303_200132310570 [0,2,0,0,0,0|0,0,2]=4 15452 B16R0.303 CCCSCCCCCCOCCCCCO 62a_200132310570_100000210303 [0,2,0,0,0,0|0,0,2]=4 15453 B16R0.303 CCCSCCNCCCCCCCCCO 2230a_100020603323_100009813782 [0,2,0,0,0,0|0,0,2]=4 15454 B16R0.303 CCCSCCOCCCCCCCCCO 34a_200000230433_100009813782 [0,2,0,0,0,0|0,0,2]=4 15455 B16R0.303 CCCSCCOCCCCCCCCCO 7a_200000230433_100009813782 [0,2,0,0,0,0|0,0,2]=4 15456 B16R0.303 CCNCCCCCCCCCCCCCO 2230a_100015525214_100009812470 [0,2,0,0,0,0|0,0,2]=4 15457 B16R0.303 CCOCCCCCCCCCCCCCBr 34a_100009812470_100000210202 [0,2,0,0,0,0|1,0,1]=4 15458 B16R0.303 CCOCCCCCCCCCCCCCBr 7a_100009812470_100000210202 [0,2,0,0,0,0|1,0,1]=4 15459 B16R0.303 CCOCCCCCCCCCCCCCO 34a_100121572206_100009812470 [0,2,0,0,0,0|0,0,2]=4 15460 B16R0.303 CCOCCCCCCCCCOCCC#N 7a_100009875440_100000184422 [0,2,0,0,0,0|1,0,1]=4 15461 B16R0.303 CCOCCCCCCCCCOCCCF 34a_100009875440_100011934791 [0,2,0,0,0,0|1,0,1]=4 15462 B16R0.303 CCOCCCCCCCCCOCCCF 7a_100009875440_100011934791 [0,2,0,0,0,0|1,0,1]=4 15463 B16R0.303 CCOCCCCCCCCCOCCCO 34a_100009875440_100000230001 [0,2,0,0,0,0|0,0,2]=4 15464 B16R0.303 CCOCCCCCCCCCOCCCO 7a_100009875440_100011215043 [0,2,0,0,0,0|0,0,2]=4 15465 B16R0.303 CCOCCCCCCCCCOCCOC 34a_100009875440_100011201679 [0,2,0,0,0,0|2,0,0]=4 15466 B16R0.303 CCOCCCCCCCCCOCCOC 7a_100009875440_100000233755 [0,2,0,0,0,0|2,0,0]=4 15467 B16R0.303 CCOCCCCCCCCCOCCSC 34a_100009875440_100000212216 [0,2,0,0,0,0|2,0,0]=4 15468 B16R0.303 CCOCCCCCCCCCOCCSC 7a_100009875440_100000212216 [0,2,0,0,0,0|2,0,0]=4 15469 B16R0.303 CCOCCCNCCCCCCCCCO 2230a_100000078944_100012232248 [0,2,0,0,0,0|0,0,2]=4 15470 B16R0.303 CCOCCCNCCCCCCCCCO 2230a_100000210961_100009813782 [0,2,0,0,0,0|0,0,2]=4 15471 B16R0.303 CCOCCCNCCCCCCCCCO 34a_100000078944_100012232248 [0,2,0,0,0,0|0,0,2]=4 15472 B16R0.303 CCOCCCNCCCCCCCCCO 34a_100000210961_100009813782 [0,2,0,0,0,0|0,0,2]=4 15473 B16R0.303 CCOCCCOCCCCCCCCCBr 34a_100009813782_100012232248 [0,2,0,0,0,0|1,0,1]=4 15474 B16R0.303 CCOCCCOCCCCCCCCCBr 7a_100009813782_100012232248 [0,2,0,0,0,0|1,0,1]=4 15475 B16R0.303 CCOCCCOCCCCCCCCCCl 34a_100009868337_100012232248 [0,2,0,0,0,0|1,0,1]=4 15476 B16R0.303 CCOCCCOCCCCCCCCCCl 7a_100009868337_100012232248 [0,2,0,0,0,0|1,0,1]=4 15477 B16R0.303 CCOCCCOCCCCCCCCCN 34a_100000078944_100012232248 [0,2,0,0,0,0|1,0,1]=4 15478 B16R0.303 CCOCCCOCCCCCCCCCO 34a_100000757476_100009813782 [0,2,0,0,0,0|0,0,2]=4 15479 B16R0.303 CCOCCCOCCCCCCCCCO 7a_100000757476_100009813782 [0,2,0,0,0,0|0,0,2]=4 15480 B16R0.303 CCOCCCSCCCCCCCCCO 62a_100009813782_100012232248 [0,2,0,0,0,0|0,0,2]=4 15481 B16R0.303 CCOCCCSCCCCCCCCCO 62a_100012232248_100009813782 [0,2,0,0,0,0|0,0,2]=4 15482 B16R0.303 CCOCCNCCCCCCCCCCO 2230a_100000066964_100011215890 [0,2,0,0,0,0|0,0,2]=4 15483 B16R0.303 CCOCCNCCCCCCCCCCO 2230a_102516460346_100009813290 [0,2,0,0,0,0|0,0,2]=4 15484 B16R0.303 CCOCCNCCCCCCCCCCO 34a_100000066964_100000210147 [0,2,0,0,0,0|0,0,2]=4 15485 B16R0.303 CCOCCNCCCCCCCCCCO 34a_102516460346_100009813290 [0,2,0,0,0,0|0,0,2]=4 15486 B16R0.303 CCOCCOCCCCCCCCCCBr 34a_100009813290_100000210147 [0,2,0,0,0,0|1,0,1]=4 15487 B16R0.303 CCOCCOCCCCCCCCCCBr 7a_100009813290_100011215890 [0,2,0,0,0,0|1,0,1]=4 15488 B16R0.303 CCOCCOCCCCCCCCCCCl 34a_200000033068_100000210147 [0,2,0,0,0,0|1,0,1]=4 15489 B16R0.303 CCOCCOCCCCCCCCCCCl 7a_200000033068_100011215890 [0,2,0,0,0,0|1,0,1]=4 15490 B16R0.303 CCOCCOCCCCCCCCCCN 34a_100000066964_100000210147 [0,2,0,0,0,0|1,0,1]=4 15491 B16R0.303 CCOCCOCCCCCCCCCCO 34a_100000210136_100009813290 [0,2,0,0,0,0|0,0,2]=4 15492 B16R0.303 CCOCCOCCCCCCCCCCO 7a_100000210136_100009813290 [0,2,0,0,0,0|0,0,2]=4 15493 B16R0.303 CCOCCOCCOCCNCCCC=O 2230a_100012282185_200011292268 [0,2,0,0,0,0|2,0,0]=4 15494 B16R0.303 CCOCCOCCOCCOCCCC=O 7a_100000033264_200011292268 [0,2,0,0,0,0|2,0,0]=4 15495 B16R0.303 CCOCCSCCCCCCCCCCO 62a_100000210147_200000033068 [0,2,0,0,0,0|0,0,2]=4 15496 B16R0.303 CCOCCSCCCCCCCCCCO 62a_100009813290_100011215890 [0,2,0,0,0,0|0,0,2]=4 15497 B16R0.303 CCOCSCCCCCCCCCCCO 62a_100009812471_100000739092 [0,2,0,0,0,0|0,0,2]=4 15498 B16R0.303 CCSCCCCCCCCCCCCCO 62a_100009812470_100000210202 [0,2,0,0,0,0|0,0,2]=4 15499 B16R0.303 CCSCCCOCCCCCCCCCO 34a_100011216438_100009813782 [0,2,0,0,0,0|0,0,2]=4 15500 B16R0.303 CCSCCCOCCCCCCCCCO 7a_100011216438_100009813782 [0,2,0,0,0,0|0,0,2]=4 15501 B16R0.303 CCSCCNCCCCCCCCCCO 2230a_100000066964_100000757381 [0,2,0,0,0,0|0,0,2]=4 15502 B16R0.303 CCSCCNCCCCCCCCCCO 2230a_100000106463_100009813290 [0,2,0,0,0,0|0,0,2]=4 15503 B16R0.303 CCSCCNCCCCCCCCCCO 34a_100000066964_100000757381 [0,2,0,0,0,0|0,0,2]=4 15504 B16R0.303 CCSCCOCCCCCCCCCCBr 34a_100009813290_100000757381 [0,2,0,0,0,0|1,0,1]=4 15505 B16R0.303 CCSCCOCCCCCCCCCCBr 7a_100009813290_100000757381 [0,2,0,0,0,0|1,0,1]=4 15506 B16R0.303 CCSCCOCCCCCCCCCCCl 34a_200000033068_100000757381 [0,2,0,0,0,0|1,0,1]=4 15507 B16R0.303 CCSCCOCCCCCCCCCCCl 7a_200000033068_100000757381 [0,2,0,0,0,0|1,0,1]=4 15508 B16R0.303 CCSCCOCCCCCCCCCCN 34a_100000066964_100000757381 [0,2,0,0,0,0|1,0,1]=4 15509 B16R0.303 CCSCCOCCCCCCCCCCO 34a_100000212035_100009813290 [0,2,0,0,0,0|0,0,2]=4 15510 B16R0.303 CCSCCOCCCCCCCCCCO 7a_100000212035_100009813290 [0,2,0,0,0,0|0,0,2]=4 15511 B16R0.303 CCSCCSCCCCCCCCCCO 62a_100000757381_200000033068 [0,2,0,0,0,0|0,0,2]=4 15512 B16R0.303 CCSCCSCCCCCCCCCCO 62a_100009813290_100000757381 [0,2,0,0,0,0|0,0,2]=4 15513 B16R0.303 CNCCCCCCCCCCCCCCO 2230a_106832991635_100009828009 [0,2,0,0,0,0|0,0,2]=4 15514 B16R0.303 CNCCCCCCCCCCCCCCO 34a_100102657272_100009828009 [0,2,0,0,0,0|0,0,2]=4 15515 B16R0.303 CNCCCCCCCCCCCCCCO 7a_106832991635_100009828009 [0,2,0,0,0,0|0,0,2]=4 15516 B16R0.303 CNCCCCCOCCCCCCCCO 34a_100000722520_100000033203 [0,2,0,0,0,0|0,0,2]=4 15517 B16R0.303 CNCCCOCCCCCCCCCCO 34a_100000213112_100009813290 [0,2,0,0,0,0|0,0,2]=4 15518 B16R0.303 COCCCCCCCCCCCCCCBr 34a_100009828009_200000210301 [0,2,0,0,0,0|0,0,2]=4 15519 B16R0.303 COCCCCCCCCCCCCCCBr 7a_100009828009_200000210301 [0,2,0,0,0,0|0,0,2]=4 15520 B16R0.303 COCCCCCCCCCCCCCCO 34a_100138415774_100009828009 [0,2,0,0,0,0|0,0,2]=4 15521 B16R0.303 COCCCCCCNCCCCCCCO 2230a_100011996573_100011998445 [0,2,0,0,0,0|0,0,2]=4 15522 B16R0.303 COCCCCCCNCCCCCCCO 34a_100011996573_100011998445 [0,2,0,0,0,0|0,0,2]=4 15523 B16R0.303 COCCCCCCOCCCCCCC#N 7a_200012092642_100009813337 [0,2,0,0,0,0|1,0,1]=4 15524 B16R0.303 COCCCCCCOCCCCCCCBr 34a_100000760002_100011998445 [0,2,0,0,0,0|1,0,1]=4 15525 B16R0.303 COCCCCCCOCCCCCCCBr 7a_100000760002_100011998445 [0,2,0,0,0,0|1,0,1]=4 15526 B16R0.303 COCCCCCCOCCCCCCCN 34a_100011996573_100011998445 [0,2,0,0,0,0|1,0,1]=4 15527 B16R0.303 COCCCCCCOCCCCCCCO 34a_200012092642_100000760002 [0,2,0,0,0,0|0,0,2]=4 15528 B16R0.303 COCCCCCCOCCCCCCCO 7a_200012092642_100000760002 [0,2,0,0,0,0|0,0,2]=4 15529 B16R0.303 COCCCCCCOCCCCCCOC 34a_200012092642_100011998445 [0,2,0,0,0,0|2,0,0]=4 15530 B16R0.303 COCCCCCCOCCCCCCOC 7a_200012092642_100011998445 [0,2,0,0,0,0|2,0,0]=4 15531 B16R0.303 COCCCCCCSCCCCCCC#N 62a_100009813337_100011998445 [0,2,0,0,0,0|1,0,1]=4 15532 B16R0.303 COCCCCCCSCCCCCCC#N 62a_100011998445_100009813337 [0,2,0,0,0,0|1,0,1]=4 15533 B16R0.303 COCCCCCCSCCCCCCCO 62a_100000760002_100011998445 [0,2,0,0,0,0|0,0,2]=4 15534 B16R0.303 COCCCCCCSCCCCCCCO 62a_100011998445_100000760002 [0,2,0,0,0,0|0,0,2]=4 15535 B16R0.303 COCCCCCCSCCCCCCOC 62a_100011998445_100011998445 [0,2,0,0,0,0|2,0,0]=4 15536 B16R0.303 COCCCCCNCCCCCCCCO 2230a_100000747528_100000033203 [0,2,0,0,0,0|0,0,2]=4 15537 B16R0.303 COCCCCCNCCCCCCCCO 34a_100000747528_100000033203 [0,2,0,0,0,0|0,0,2]=4 15538 B16R0.303 COCCCCNCCCCCCCCCO 2230a_100000078944_100000730899 [0,2,0,0,0,0|0,0,2]=4 15539 B16R0.303 COCCCCNCCCCCCCCCO 34a_100000078944_100000755781 [0,2,0,0,0,0|0,0,2]=4 15540 B16R0.303 COCCCCOCCCCCCCCCBr 34a_100009813782_100000755781 [0,2,0,0,0,0|1,0,1]=4 15541 B16R0.303 COCCCCOCCCCCCCCCBr 7a_100009813782_100000730899 [0,2,0,0,0,0|1,0,1]=4 15542 B16R0.303 COCCCCOCCCCCCCCCCl 34a_100009868337_100000755781 [0,2,0,0,0,0|1,0,1]=4 15543 B16R0.303 COCCCCOCCCCCCCCCCl 7a_100009868337_100000730899 [0,2,0,0,0,0|1,0,1]=4 15544 B16R0.303 COCCCCOCCCCCCCCCN 34a_100000078944_100000755781 [0,2,0,0,0,0|1,0,1]=4 15545 B16R0.303 COCCCCOCCCCCCCCCO 34a_100000740925_100009813782 [0,2,0,0,0,0|0,0,2]=4 15546 B16R0.303 COCCCCSCCCCCCCCCO 62a_100000730899_100009813782 [0,2,0,0,0,0|0,0,2]=4 15547 B16R0.303 COCCCCSCCCCCCCCCO 62a_100009813782_100000730899 [0,2,0,0,0,0|0,0,2]=4 15548 B16R0.303 COCCCNCCCCCCCCCCO 2230a_100000066964_100000740836 [0,2,0,0,0,0|0,0,2]=4 15549 B16R0.303 COCCCNCCCCCCCCCCO 34a_100000066964_100000740836 [0,2,0,0,0,0|0,0,2]=4 15550 B16R0.303 COCCCNCCCCCCCCCCO 34a_100150723488_100009813290 [0,2,0,0,0,0|0,0,2]=4 15551 B16R0.303 COCCCOCCCCCCCCCCBr 34a_100009813290_100000740836 [0,2,0,0,0,0|1,0,1]=4 15552 B16R0.303 COCCCOCCCCCCCCCCBr 7a_100009813290_100000740836 [0,2,0,0,0,0|1,0,1]=4 15553 B16R0.303 COCCCOCCCCCCCCCCCl 34a_200000033068_100000740836 [0,2,0,0,0,0|1,0,1]=4 15554 B16R0.303 COCCCOCCCCCCCCCCCl 7a_200000033068_100000740836 [0,2,0,0,0,0|1,0,1]=4 15555 B16R0.303 COCCCOCCCCCCCCCCN 34a_100000066964_100000740836 [0,2,0,0,0,0|1,0,1]=4 15556 B16R0.303 COCCCOCCCCCCCCCCO 34a_100000740835_100009813290 [0,2,0,0,0,0|0,0,2]=4 15557 B16R0.303 COCCCOCCCOCCCCCC=O 7a_200011215475_100000139337 [0,2,0,0,0,0|1,0,0]=3 15558 B16R0.303 COCCCSCCCCCCCCCCO 62a_100000709357_200000033068 [0,2,0,0,0,0|0,0,2]=4 15559 B16R0.303 COCCCSCCCCCCCCCCO 62a_100009813290_100000709357 [0,2,0,0,0,0|0,0,2]=4 15560 B16R0.303 COCCNCCCCCCCCCCCO 2230a_100000209980_100009812471 [0,2,0,0,0,0|0,0,2]=4 15561 B16R0.303 COCCOCCCCCCCCCCCBr 34a_100009812471_100011201679 [0,2,0,0,0,0|1,0,1]=4 15562 B16R0.303 COCCOCCCCCCCCCCCBr 7a_100009812471_100000233755 [0,2,0,0,0,0|1,0,1]=4 15563 B16R0.303 COCCOCCCCCCCCCCCO 34a_100000210237_100009812471 [0,2,0,0,0,0|0,0,2]=4 15564 B16R0.303 COCCOCCOCCNCCCCC=O 2230a_100012028300_100000139335 [0,2,0,0,0,0|2,0,0]=4 15565 B16R0.303 COCCOCCOCCOCCCCC=O 7a_100000688194_100000139335 [0,2,0,0,0,0|2,0,0]=4 15566 B16R0.303 COCCOCCOCCSCCCCC=O 62a_100000139335_100013367474 [0,2,0,0,0,0|2,0,0]=4 15567 B16R0.303 COCCOCCOCCSCCCCC=O 62a_100013367474_100000139335 [0,2,0,0,0,0|2,0,0]=4 15568 B16R0.303 COCCSCCCCCCCCCCCO 62a_100009812471_100000233755 [0,2,0,0,0,0|0,0,2]=4 15569 B16R0.303 COCNCCCCCCCCCCCCO 2230a_100000066677_100000766300 [0,2,0,0,0,0|0,0,2]=4 15570 B16R0.303 COCSCCCCCCCCCCCCO 62a_100009813331_100000766300 [0,2,0,0,0,0|0,0,2]=4 15571 B16R0.303 CSCCCCOCCCCCCCCCO 34a_100011217163_100009813782 [0,2,0,0,0,0|0,0,2]=4 15572 B16R0.303 CSCCCCOCCCCCCCCCO 7a_100011217163_100009813782 [0,2,0,0,0,0|0,0,2]=4 15573 B16R0.303 CSCCCNCCCCCCCCCCO 2230a_100000749238_100009813290 [0,2,0,0,0,0|0,0,2]=4 15574 B16R0.303 CSCCCOCCCCCCCCCCO 34a_100000690336_100009813290 [0,2,0,0,0,0|0,0,2]=4 15575 B16R0.303 CSCCCOCCCCCCCCCCO 7a_100000690336_100009813290 [0,2,0,0,0,0|0,0,2]=4 15576 B16R0.303 CSCCNCCCCCCCCCCCO 2230a_100020590264_100009812471 [0,2,0,0,0,0|0,0,2]=4 15577 B16R0.303 CSCCOCCCCCCCCCCCBr 34a_100009812471_100000212216 [0,2,0,0,0,0|1,0,1]=4 15578 B16R0.303 CSCCOCCCCCCCCCCCBr 7a_100009812471_100000212216 [0,2,0,0,0,0|1,0,1]=4 15579 B16R0.303 CSCCOCCCCCCCCCCCO 34a_100000230434_100009812471 [0,2,0,0,0,0|0,0,2]=4 15580 B16R0.303 CSCCOCCCCCCCCCCCO 7a_100000230434_100009812471 [0,2,0,0,0,0|0,0,2]=4 15581 B16R0.303 CSCCSCCCCCCCCCCCO 62a_100009812471_100000751147 [0,2,0,0,0,0|0,0,2]=4 15582 B16R0.303 CSCNCCCCCCCCCCCCO 2230a_100000066677_100011218213 [0,2,0,0,0,0|0,0,2]=4 15583 B16R0.303 CSCNCCCCCCCCCCCCO 34a_100000066677_100011218213 [0,2,0,0,0,0|0,0,2]=4 15584 B16R0.303 CSCOCCCCCCCCCCCCBr 34a_100009813331_100011218213 [0,2,0,0,0,0|1,0,1]=4 15585 B16R0.303 CSCOCCCCCCCCCCCCN 34a_100000066677_100011218213 [0,2,0,0,0,0|1,0,1]=4 15586 B16R0.303 CSCSCCCCCCCCCCCCO 62a_100009813331_100011218213 [0,2,0,0,0,0|0,0,2]=4 15587 B16R0.303 FCCCCCCOCCCCCCCCBr 34a_100009813846_100015922095 [0,2,0,0,0,0|1,0,1]=4 15588 B16R0.303 FCCCCCCOCCCCCCCCBr 7a_100009813846_100015922095 [0,2,0,0,0,0|1,0,1]=4 15589 B16R0.303 FCCCCCCOCCCCCCCCCl 34a_100000033203_100015922095 [0,2,0,0,0,0|1,0,1]=4 15590 B16R0.303 FCCCCCCOCCCCCCCCCl 7a_100000033203_100015922095 [0,2,0,0,0,0|1,0,1]=4 15591 B16R0.303 FCCCCCOCCCCCCCCCBr 34a_100009813782_100000729378 [0,2,0,0,0,0|1,0,1]=4 15592 B16R0.303 FCCCCCOCCCCCCCCCBr 7a_100009813782_100000729378 [0,2,0,0,0,0|1,0,1]=4 15593 B16R0.303 FCCCCCOCCCCCCCCCCl 34a_100009868337_100000729378 [0,2,0,0,0,0|1,0,1]=4 15594 B16R0.303 FCCCCCOCCCCCCCCCCl 7a_100009868337_100000729378 [0,2,0,0,0,0|1,0,1]=4 15595 B16R0.303 FCCCCOCCCCCCCCCCBr 34a_100009813290_100000729493 [0,2,0,0,0,0|1,0,1]=4 15596 B16R0.303 FCCCCOCCCCCCCCCCBr 7a_100009813290_100000729493 [0,2,0,0,0,0|1,0,1]=4 15597 B16R0.303 FCCCCOCCCCCCCCCCCl 34a_200000033068_100000729493 [0,2,0,0,0,0|1,0,1]=4 15598 B16R0.303 FCCCCOCCCCCCCCCCCl 7a_200000033068_100000729493 [0,2,0,0,0,0|1,0,1]=4 15599 B16R0.303 FCCCOCCCCCCCCCCCBr 34a_100009812471_100011934791 [0,2,0,0,0,0|1,0,1]=4 15600 B16R0.303 FCCCOCCCCCCCCCCCBr 7a_100009812471_100011934791 [0,2,0,0,0,0|1,0,1]=4 15601 B16R0.303 FCCOCCCCCCCCCCCCBr 34a_100009813331_100011217306 [0,2,0,0,0,0|1,0,1]=4 15602 B16R0.303 FCCOCCCCCCCCCCCCBr 7a_100009813331_100011217306 [0,2,0,0,0,0|1,0,1]=4 15603 B16R0.303 FCOCCCCCCCCCCCCCBr 34a_100009812470_100015361967 [0,2,0,0,0,0|1,0,1]=4 15604 B16R0.303 FCOCCCCCCCCCCCCCBr 7a_100009812470_100015361967 [0,2,0,0,0,0|1,0,1]=4 15605 B16R0.303 N#CCCCCCCNCCCCCCCO 2230a_100011996573_100009813337 [0,2,0,0,0,0|1,0,1]=4 15606 B16R0.303 N#CCCCCCCOCCCCCCCBr 7a_100000760002_100009813337 [0,2,0,0,0,0|1,0,1]=4 15607 B16R0.303 N#CCCCCCCSCCCCCCCO 62a_100000760002_100009813337 [0,2,0,0,0,0|1,0,1]=4 15608 B16R0.303 N#CCCCCCCSCCCCCCCO 62a_100009813337_100000760002 [0,2,0,0,0,0|1,0,1]=4 15609 B16R0.303 N#CCCCCCNCCCCCCCCO 2230a_102515433106_100009813376 [0,2,0,0,0,0|1,0,1]=4 15610 B16R0.303 N#CCCCCCOCCCCCCCCBr 7a_100009813846_100009813376 [0,2,0,0,0,0|1,0,1]=4 15611 B16R0.303 N#CCCCCCOCCCCCCCCCl 7a_100000033203_100009813376 [0,2,0,0,0,0|1,0,1]=4 15612 B16R0.303 N#CCCCCCSCCCCCCCCO 62a_100000033203_100009813376 [0,2,0,0,0,0|1,0,1]=4 15613 B16R0.303 N#CCCCCCSCCCCCCCCO 62a_100009813376_100000033203 [0,2,0,0,0,0|1,0,1]=4 15614 B16R0.303 N#CCCCCNCCCCCCCCCO 2230a_100000078944_100000211819 [0,2,0,0,0,0|1,0,1]=4 15615 B16R0.303 N#CCCCCOCCCCCCCCCBr 7a_100009813782_100000211819 [0,2,0,0,0,0|1,0,1]=4 15616 B16R0.303 N#CCCCCOCCCCCCCCCCl 7a_100009868337_100000211819 [0,2,0,0,0,0|1,0,1]=4 15617 B16R0.303 N#CCCCCSCCCCCCCCCO 62a_100009813782_100000211819 [0,2,0,0,0,0|1,0,1]=4 15618 B16R0.303 N#CCCCCSCCCCCCCCCO 62a_100011219923_100009813782 [0,2,0,0,0,0|1,0,1]=4 15619 B16R0.303 N#CCCCNCCCCCCCCCCO 2230a_100000066964_100000687738 [0,2,0,0,0,0|1,0,1]=4 15620 B16R0.303 N#CCCCOCCCCCCCCCCBr 7a_100009813290_100000687738 [0,2,0,0,0,0|1,0,1]=4 15621 B16R0.303 N#CCCCOCCCCCCCCCCCl 7a_200000033068_100000687738 [0,2,0,0,0,0|1,0,1]=4 15622 B16R0.303 N#CCCCSCCCCCCCCCCO 62a_100000687738_200000033068 [0,2,0,0,0,0|1,0,1]=4 15623 B16R0.303 N#CCCCSCCCCCCCCCCO 62a_100009813290_100000687738 [0,2,0,0,0,0|1,0,1]=4 15624 B16R0.303 N#CCCOCCCCCCCCCCCBr 7a_100009812471_100000184422 [0,2,0,0,0,0|1,0,1]=4 15625 B16R0.303 N#CCCSCCCCCCCCCCCO 62a_100009812471_100011215226 [0,2,0,0,0,0|1,0,1]=4 15626 B16R0.303 N#CCNCCCCCCCCCCCCO 2230a_100000066677_100011215382 [0,2,0,0,0,0|1,0,1]=4 15627 B16R0.303 N#CCOCCCCCCCCCCCCBr 7a_100009813331_100011215382 [0,2,0,0,0,0|1,0,1]=4 15628 B16R0.303 N#CCSCCCCCCCCCCCCO 62a_100009813331_100011215382 [0,2,0,0,0,0|1,0,1]=4 15629 B16R0.303 NCCCCCCCCCCCCOCC=O 34a_100000066677_200009817547 [0,2,0,0,0,0|0,0,0]=2 15630 B16R0.303 NCCCCCCCCCCCCOCCF 34a_100000066677_100011217306 [0,2,0,0,0,0|1,0,1]=4 15631 B16R0.303 NCCCCCCCCCCCCOCCO 34a_100000066677_100000211926 [0,2,0,0,0,0|0,0,2]=4 15632 B16R0.303 NCCCCCCCCCCOCCCCF 34a_100000066964_100000729493 [0,2,0,0,0,0|1,0,1]=4 15633 B16R0.303 NCCCCCCCCCCOCCCCO 34a_100000066964_100011216708 [0,2,0,0,0,0|0,0,2]=4 15634 B16R0.303 NCCCCCCCCCOCCCCCF 34a_100000078944_100000729378 [0,2,0,0,0,0|1,0,1]=4 15635 B16R0.303 NCCCCCCCCCOCCCCCO 34a_100000078944_100000746330 [0,2,0,0,0,0|0,0,2]=4 15636 B16R0.303 NCCCCCCCCOCCCCCCF 34a_102515433106_100015922095 [0,2,0,0,0,0|1,0,1]=4 15637 B16R0.303 NCCCCCCCCOCCCCCCO 34a_102515433106_100000766143 [0,2,0,0,0,0|0,0,2]=4 15638 B16R0.303 NCCCCCCCOCCCCCCCO 34a_100011996573_100000760002 [0,2,0,0,0,0|0,0,2]=4 15639 B16R0.303 NCCCCCCOCCCCCCCCO 34a_100000686447_100000033203 [0,2,0,0,0,0|0,0,2]=4 15640 B16R0.303 NCCCCCOCCCCCCCCCO 34a_100000762737_100009813782 [0,2,0,0,0,0|0,0,2]=4 15641 B16R0.303 NCCCCOCCCCCCCCCCO 34a_100000750430_100009813290 [0,2,0,0,0,0|0,0,2]=4 15642 B16R0.303 NCCCOCCCCCCCCCCCO 34a_100000182051_100009812471 [0,2,0,0,0,0|0,0,2]=4 15643 B16R0.303 NCCOCCCCCCCCCCCCO 34a_100000210304_100009813331 [0,2,0,0,0,0|0,0,2]=4 15644 B16R0.303 NOCCOCCCCCCCCCCCO 34a_100000700252_100009812471 [0,2,0,0,0,0|2,0,0]=4 15645 B16R0.303 O=CCCCCCNCCCCCCCCO 2230a_102515433106_100000139337 [0,2,0,0,0,0|0,0,0]=2 15646 B16R0.303 O=CCCCCCNCCOCCOCCO 2230a_100011998139_100000139337 [0,2,0,0,0,0|2,0,0]=4 15647 B16R0.303 O=CCCCCCOCCCCCCCCBr 7a_100009813846_100000139337 [0,2,0,0,0,0|0,0,0]=2 15648 B16R0.303 O=CCCCCCOCCCCCCCCCl 7a_100000033203_100000139337 [0,2,0,0,0,0|0,0,0]=2 15649 B16R0.303 O=CCCCCCOCCOCCOCCBr 7a_100010132937_100000139337 [0,2,0,0,0,0|2,0,0]=4 15650 B16R0.303 O=CCCCCCOCCOCCOCCCl 7a_100000032323_100000139337 [0,2,0,0,0,0|2,0,0]=4 15651 B16R0.303 O=CCCCCCSCCCCCCCCO 62a_100000033203_100000139337 [0,2,0,0,0,0|0,0,0]=2 15652 B16R0.303 O=CCCCCCSCCCCCCCCO 62a_100000139337_100000033203 [0,2,0,0,0,0|0,0,0]=2 15653 B16R0.303 O=CCCCCCSCCOCCOCCO 62a_100000032323_100000139337 [0,2,0,0,0,0|2,0,0]=4 15654 B16R0.303 O=CCCCCCSCCOCCOCCO 62a_100000139337_100000032323 [0,2,0,0,0,0|2,0,0]=4 15655 B16R0.303 O=CCCCCNCCCCCCCCCO 2230a_100000078944_100000139335 [0,2,0,0,0,0|0,0,0]=2 15656 B16R0.303 O=CCCCCNCCCOCCOCCO 2230a_100011996194_100000139335 [0,2,0,0,0,0|2,0,0]=4 15657 B16R0.303 O=CCCCCOCCCCCCCCCBr 7a_100009813782_100000139335 [0,2,0,0,0,0|0,0,0]=2 15658 B16R0.303 O=CCCCCOCCCCCCCCCCl 7a_100009868337_100000139335 [0,2,0,0,0,0|0,0,0]=2 15659 B16R0.303 O=CCCCCSCCCCCCCCCO 62a_100000139335_100009813782 [0,2,0,0,0,0|0,0,0]=2 15660 B16R0.303 O=CCCCCSCCCCCCCCCO 62a_100009813782_100000139335 [0,2,0,0,0,0|0,0,0]=2 15661 B16R0.303 O=CCCCNCCCCCCCCCCO 2230a_100000066964_200011292268 [0,2,0,0,0,0|0,0,0]=2 15662 B16R0.303 O=CCCCOCCCCCCCCCCBr 7a_100009813290_200011292268 [0,2,0,0,0,0|0,0,0]=2 15663 B16R0.303 O=CCCCOCCCCCCCCCCCl 7a_200000033068_200011292268 [0,2,0,0,0,0|0,0,0]=2 15664 B16R0.303 O=CCCCSCCCCCCCCCCO 62a_100009813290_200011292268 [0,2,0,0,0,0|0,0,0]=2 15665 B16R0.303 O=CCCCSCCCCCCCCCCO 62a_200011292268_200000033068 [0,2,0,0,0,0|0,0,0]=2 15666 B16R0.303 O=CCNCCCCCCCCCCCCO 2230a_100000066677_200015260668 [0,2,0,0,0,0|0,0,0]=2 15667 B16R0.303 O=CCNCCCCCCCCCCCCO 34a_100000066677_200009817547 [0,2,0,0,0,0|0,0,0]=2 15668 B16R0.303 O=CCOCCCCCCCCCCCCBr 34a_100009813331_200009817547 [0,2,0,0,0,0|0,0,0]=2 15669 B16R0.303 O=CCOCCCCCCCCCCCCBr 7a_100009813331_200015260668 [0,2,0,0,0,0|0,0,0]=2 15670 B16R0.303 O=CCOCCCCCOCCCCCCCl 34a_200132310570_200009817547 [0,2,0,0,0,0|1,0,0]=3 15671 B16R0.303 O=CCOCCCCCOCCCCCCCl 7a_200132310570_200015260668 [0,2,0,0,0,0|1,0,0]=3 15672 B16R0.303 O=CCSCCCCCCCCCCCCO 62a_100009813331_200015260668 [0,2,0,0,0,0|0,0,0]=2 15673 B16R0.303 O=CCSCCCCCCOCCCCCO 62a_200015260668_200132310570 [0,2,0,0,0,0|1,0,0]=3 15674 B16R0.303 O=CCSCCCCCCOCCCCCO 62a_200132310570_200015260668 [0,2,0,0,0,0|1,0,0]=3 15675 B16R0.303 OCCCCCCCCCCCCCSCF 62a_100009812470_100015361967 [0,2,0,0,0,0|0,0,2]=4 15676 B16R0.303 OCCCCCCCCCCCCNCCF 2230a_100000066677_100011217306 [0,2,0,0,0,0|0,0,2]=4 15677 B16R0.303 OCCCCCCCCCCCCNCCF 34a_100000066677_100011217306 [0,2,0,0,0,0|0,0,2]=4 15678 B16R0.303 OCCCCCCCCCCCCNCCF 34a_100000724931_100009813331 [0,2,0,0,0,0|0,0,2]=4 15679 B16R0.303 OCCCCCCCCCCCCNCCO 2230a_100000066677_100000211926 [0,2,0,0,0,0|0,0,2]=4 15680 B16R0.303 OCCCCCCCCCCCCNCCO 2230a_100016997473_100009813331 [0,2,0,0,0,0|0,0,2]=4 15681 B16R0.303 OCCCCCCCCCCCCNCCO 34a_100000066677_100000211926 [0,2,0,0,0,0|0,0,2]=4 15682 B16R0.303 OCCCCCCCCCCCCNCCO 34a_100016990907_100009813331 [0,2,0,0,0,0|0,0,2]=4 15683 B16R0.303 OCCCCCCCCCCCCOCCBr 34a_100000211926_100009813331 [0,2,0,0,0,0|0,0,2]=4 15684 B16R0.303 OCCCCCCCCCCCCSCCF 62a_100009813331_100011217306 [0,2,0,0,0,0|0,0,2]=4 15685 B16R0.303 OCCCCCCCCCCCCSCCO 62a_100009813331_100000211926 [0,2,0,0,0,0|0,0,2]=4 15686 B16R0.303 OCCCCCCCCCCCNCCCF 2230a_100015189416_100009812471 [0,2,0,0,0,0|0,0,2]=4 15687 B16R0.303 OCCCCCCCCCCCNCCCF 34a_100015189416_100009812471 [0,2,0,0,0,0|0,0,2]=4 15688 B16R0.303 OCCCCCCCCCCCOCCCBr 34a_100011217188_100009812471 [0,2,0,0,0,0|0,0,2]=4 15689 B16R0.303 OCCCCCCCCCCCOCCCCl 34a_100000230001_100009812471 [0,2,0,0,0,0|0,0,2]=4 15690 B16R0.303 OCCCCCCCCCCCOCCCF 34a_100000759539_100009812471 [0,2,0,0,0,0|0,0,2]=4 15691 B16R0.303 OCCCCCCCCCCCSCCCF 62a_100009812471_100011934791 [0,2,0,0,0,0|0,0,2]=4 15692 B16R0.303 OCCCCCCCCCCCSCCCO 62a_100009812471_100011215043 [0,2,0,0,0,0|0,0,2]=4 15693 B16R0.303 OCCCCCCCCCCNCCCCF 2230a_100000066964_100000729493 [0,2,0,0,0,0|0,0,2]=4 15694 B16R0.303 OCCCCCCCCCCNCCCCF 34a_100000066964_100000729493 [0,2,0,0,0,0|0,0,2]=4 15695 B16R0.303 OCCCCCCCCCCNCCCCO 2230a_100000066964_100000210776 [0,2,0,0,0,0|0,0,2]=4 15696 B16R0.303 OCCCCCCCCCCNCCCCO 2230a_100000750430_100009813290 [0,2,0,0,0,0|0,0,2]=4 15697 B16R0.303 OCCCCCCCCCCNCCCCO 34a_100000066964_100011216708 [0,2,0,0,0,0|0,0,2]=4 15698 B16R0.303 OCCCCCCCCCCNCCCCO 34a_100000750430_100009813290 [0,2,0,0,0,0|0,0,2]=4 15699 B16R0.303 OCCCCCCCCCCOCCCCBr 34a_100011216708_100009813290 [0,2,0,0,0,0|0,0,2]=4 15700 B16R0.303 OCCCCCCCCCCOCCCCCl 34a_100000210776_100009813290 [0,2,0,0,0,0|0,0,2]=4 15701 B16R0.303 OCCCCCCCCCCOCCCCCl 7a_100000210776_100009813290 [0,2,0,0,0,0|0,0,2]=4 15702 B16R0.303 OCCCCCCCCCCOCCCCF 34a_100011995726_100009813290 [0,2,0,0,0,0|0,0,2]=4 15703 B16R0.303 OCCCCCCCCCCOCCCCF 7a_100011995726_100009813290 [0,2,0,0,0,0|0,0,2]=4 15704 B16R0.303 OCCCCCCCCCCOCCCCI 34a_200012148704_100009813290 [0,2,0,0,0,0|0,0,2]=4 15705 B16R0.303 OCCCCCCCCCCSCCCCF 62a_100000729493_200000033068 [0,2,0,0,0,0|0,0,2]=4 15706 B16R0.303 OCCCCCCCCCCSCCCCF 62a_100009813290_100000729493 [0,2,0,0,0,0|0,0,2]=4 15707 B16R0.303 OCCCCCCCCCCSCCCCO 62a_100000210776_200000033068 [0,2,0,0,0,0|0,0,2]=4 15708 B16R0.303 OCCCCCCCCCCSCCCCO 62a_100009813290_100000210776 [0,2,0,0,0,0|0,0,2]=4 15709 B16R0.303 OCCCCCCCCCNCCCCCF 2230a_100000078944_100000729378 [0,2,0,0,0,0|0,0,2]=4 15710 B16R0.303 OCCCCCCCCCNCCCCCF 34a_100000078944_100000729378 [0,2,0,0,0,0|0,0,2]=4 15711 B16R0.303 OCCCCCCCCCNCCCCCO 2230a_100000078944_100000746330 [0,2,0,0,0,0|0,0,2]=4 15712 B16R0.303 OCCCCCCCCCNCCCCCO 2230a_100000762737_100009813782 [0,2,0,0,0,0|0,0,2]=4 15713 B16R0.303 OCCCCCCCCCNCCCCCO 34a_100000078944_100000746330 [0,2,0,0,0,0|0,0,2]=4 15714 B16R0.303 OCCCCCCCCCNCCCCCO 34a_100000762737_100009813782 [0,2,0,0,0,0|0,0,2]=4 15715 B16R0.303 OCCCCCCCCCOCCCCCBr 34a_100000746331_100009813782 [0,2,0,0,0,0|0,0,2]=4 15716 B16R0.303 OCCCCCCCCCOCCCCCBr 7a_100000746331_100009813782 [0,2,0,0,0,0|0,0,2]=4 15717 B16R0.303 OCCCCCCCCCOCCCCCCl 34a_100000746330_100009813782 [0,2,0,0,0,0|0,0,2]=4 15718 B16R0.303 OCCCCCCCCCOCCCCCCl 7a_100000746330_100009813782 [0,2,0,0,0,0|0,0,2]=4 15719 B16R0.303 OCCCCCCCCCOCCCCCI 34a_200012148887_100009813782 [0,2,0,0,0,0|0,0,2]=4 15720 B16R0.303 OCCCCCCCCCOCCCCCI 7a_200012148887_100009813782 [0,2,0,0,0,0|0,0,2]=4 15721 B16R0.303 OCCCCCCCCCSCCCCCF 62a_100000729378_100009813782 [0,2,0,0,0,0|0,0,2]=4 15722 B16R0.303 OCCCCCCCCCSCCCCCF 62a_100009813782_100000729378 [0,2,0,0,0,0|0,0,2]=4 15723 B16R0.303 OCCCCCCCCCSCCCCCO 62a_100000746330_100009813782 [0,2,0,0,0,0|0,0,2]=4 15724 B16R0.303 OCCCCCCCCCSCCCCCO 62a_100009813782_100000746330 [0,2,0,0,0,0|0,0,2]=4 15725 B16R0.303 OCCCCCCCCNCCCCCCF 2230a_102515433106_100015922095 [0,2,0,0,0,0|0,0,2]=4 15726 B16R0.303 OCCCCCCCCNCCCCCCF 34a_102515433106_100015922095 [0,2,0,0,0,0|0,0,2]=4 15727 B16R0.303 OCCCCCCCCNCCCCCCO 2230a_100000686447_100000033203 [0,2,0,0,0,0|0,0,2]=4 15728 B16R0.303 OCCCCCCCCNCCCCCCO 2230a_102515433106_100000766143 [0,2,0,0,0,0|0,0,2]=4 15729 B16R0.303 OCCCCCCCCNCCCCCCO 34a_100000686447_100000033203 [0,2,0,0,0,0|0,0,2]=4 15730 B16R0.303 OCCCCCCCCNCCCCCCO 34a_102515433106_100000766143 [0,2,0,0,0,0|0,0,2]=4 15731 B16R0.303 OCCCCCCCCOCCCCCCBr 34a_100011215345_100000033203 [0,2,0,0,0,0|0,0,2]=4 15732 B16R0.303 OCCCCCCCCOCCCCCCBr 7a_100011215345_100000033203 [0,2,0,0,0,0|0,0,2]=4 15733 B16R0.303 OCCCCCCCCOCCCCCCCl 34a_100000766143_100000033203 [0,2,0,0,0,0|0,0,2]=4 15734 B16R0.303 OCCCCCCCCOCCCCCCCl 7a_100000766143_100000033203 [0,2,0,0,0,0|0,0,2]=4 15735 B16R0.303 OCCCCCCCCOCCCCCCF 34a_100000732779_100000033203 [0,2,0,0,0,0|0,0,2]=4 15736 B16R0.303 OCCCCCCCCOCCCCCCF 7a_100000732779_100000033203 [0,2,0,0,0,0|0,0,2]=4 15737 B16R0.303 OCCCCCCCCSCCCCCCF 62a_100000033203_100015922095 [0,2,0,0,0,0|0,0,2]=4 15738 B16R0.303 OCCCCCCCCSCCCCCCF 62a_100015922095_100000033203 [0,2,0,0,0,0|0,0,2]=4 15739 B16R0.303 OCCCCCCCCSCCCCCCO 62a_100000033203_100000766143 [0,2,0,0,0,0|0,0,2]=4 15740 B16R0.303 OCCCCCCCCSCCCCCCO 62a_100000766143_100000033203 [0,2,0,0,0,0|0,0,2]=4 15741 B16R0.303 OCCCCCCCNCCCCCCCO 2230a_100011996573_100000760002 [0,2,0,0,0,0|0,0,2]=4 15742 B16R0.303 OCCCCCCCNCCCCCCCO 34a_100011996573_100000760002 [0,2,0,0,0,0|0,0,2]=4 15743 B16R0.303 OCCCCCCCOCCCCCCCBr 34a_100000760002_100000760002 [0,2,0,0,0,0|0,0,2]=4 15744 B16R0.303 OCCCCCCCOCCCCCCCBr 7a_100000760002_100000760002 [0,2,0,0,0,0|0,0,2]=4 15745 B16R0.303 OCCCCCCCSCCCCCCCO 62a_100000760002_100000760002 [0,2,0,0,0,0|0,0,2]=4 15746 B16R0.303 OCCCCCCOCCCCCCCCBr 34a_100009813846_100000766143 [0,2,0,0,0,0|0,0,2]=4 15747 B16R0.303 OCCCCCCOCCCCCCCCBr 7a_100009813846_100000766143 [0,2,0,0,0,0|0,0,2]=4 15748 B16R0.303 OCCCCCCOCCCCCCCCCl 34a_100000033203_100000766143 [0,2,0,0,0,0|0,0,2]=4 15749 B16R0.303 OCCCCCCOCCCCCCCCCl 7a_100000033203_100000766143 [0,2,0,0,0,0|0,0,2]=4 15750 B16R0.303 OCCCCCOCCCCCCCCCBr 34a_100009813782_100000746330 [0,2,0,0,0,0|0,0,2]=4 15751 B16R0.303 OCCCCCOCCCCCCCCCBr 7a_100009813782_100000746330 [0,2,0,0,0,0|0,0,2]=4 15752 B16R0.303 OCCCCCOCCCCCCCCCCl 34a_100009868337_100000746330 [0,2,0,0,0,0|0,0,2]=4 15753 B16R0.303 OCCCCCOCCCCCCCCCCl 7a_100009868337_100000746330 [0,2,0,0,0,0|0,0,2]=4 15754 B16R0.303 OCCCCOCCCCCCCCCCBr 34a_100009813290_100011216708 [0,2,0,0,0,0|0,0,2]=4 15755 B16R0.303 OCCCCOCCCCCCCCCCBr 7a_100009813290_100000210776 [0,2,0,0,0,0|0,0,2]=4 15756 B16R0.303 OCCCCOCCCCCCCCCCCl 34a_200000033068_100011216708 [0,2,0,0,0,0|0,0,2]=4 15757 B16R0.303 OCCCCOCCCCCCCCCCCl 7a_200000033068_100000210776 [0,2,0,0,0,0|0,0,2]=4 15758 B16R0.303 OCCCOCCCCCCCCCCCBr 34a_100009812471_100000230001 [0,2,0,0,0,0|0,0,2]=4 15759 B16R0.303 OCCCOCCCCCCCCCCCBr 7a_100009812471_100011215043 [0,2,0,0,0,0|0,0,2]=4 15760 B16R0.303 OCCOCCCCCCCCCCCCBr 34a_100009813331_100000211926 [0,2,0,0,0,0|0,0,2]=4 15761 B16R0.303 OCCOCCCCCCCCCCCCBr 7a_100009813331_100000211926 [0,2,0,0,0,0|0,0,2]=4 15762 B16R0.303 [13CH3]OCCCCCCCCCCCCCCBr 34a_100009828009_200025704644 [0,2,0,0,0,0|0,0,2]=4 15763 B16R0.303 [13CH3]OCCCCCCCCCCCCCCBr 7a_100009828009_200025704644 [0,2,0,0,0,0|0,0,2]=4 15764 B16R0.303 [N-]=[N+]=NCCCCCCNCCCCCC=O 2230a_200000049180_100000139337 [0,2,0,0,0,0|2,0,0]=4 15765 B16R0.661 C#CCCC(=O)CCCCCCCCCCC 1458a_100000210736_100000753159 [0,2,0,0,0,0|1,0,1]=4 15766 B16R0.661 C#CCCC(=O)CCCCCCCCCCC 1458a_100000692101_100011215454 [0,2,0,0,0,0|1,0,1]=4 15767 B16R0.661 C#CCCCCCCCCOC(C)CCCC 34a_100000065265_200011215066 [0,2,0,0,0,0|1,0,1]=4 15768 B16R0.661 C#CCCCCCCCCOC(C)CCCC 7a_100000065265_200011215066 [0,2,0,0,0,0|1,0,1]=4 15769 B16R0.661 C#CCCCCCCCOCC(C)CCCC 34a_100011995851_100153394163 [0,2,0,0,0,0|1,0,1]=4 15770 B16R0.661 C#CCCCCCCCOCC(C)CCCC 7a_100011995851_100153394163 [0,2,0,0,0,0|1,0,1]=4 15771 B16R0.661 C#CCCCCCCCOC[C@@H](N)CCCC 34a_100011934283_100153394163 [0,2,0,0,0,0|1,0,1]=4 15772 B16R0.661 C#CCCCCOCCCCC(C)CCCC 34a_200011021034_100010269958 [0,2,0,0,0,0|1,0,1]=4 15773 B16R0.661 C#CCCCCOCCCCC(C)CCCC 7a_200011021034_100010269958 [0,2,0,0,0,0|1,0,1]=4 15774 B16R0.661 C#CCOC(C)CCCCCCCCCCC 34a_100011217895_100000184674 [0,2,0,0,0,0|1,0,1]=4 15775 B16R0.661 C#CCOC(C)CCCCCCCCCCC 7a_100011217895_100000038162 [0,2,0,0,0,0|1,0,1]=4 15776 B16R0.661 C/C=C/CC(=O)CCCCCCCCCCC 1458a_100000210736_100102629194 [0,2,0,0,0,0|1,0,1]=4 15777 B16R0.661 C=CCCC(=O)CCCCCCCCCCC 1458a_100000210736_100000754431 [0,2,0,0,0,0|1,0,0]=3 15778 B16R0.661 C=CCCC(=O)CCCCCCCCCCC 1458a_100000749702_100011215454 [0,2,0,0,0,0|1,0,0]=3 15779 B16R0.661 C=CCCC(=O)CCCCCCCCCCO 1458a_100000749702_100009813290 [0,2,0,0,0,0|1,0,1]=4 15780 B16R0.661 C=CCCC(=O)NCCCCCCCCCC 11a_100000684558_100000749702 [0,2,0,0,0,0|1,0,1]=4 15781 B16R0.661 C=CCCC(=O)NCCCCCCCCCC 1626a_100000684558_100000749702 [0,2,0,0,0,0|1,0,1]=4 15782 B16R0.661 C=CCCC(=O)NCCCCCCCCCC 240690a_100000684558_100000749702 [0,2,0,0,0,0|1,0,1]=4 15783 B16R0.661 C=CCCC(=O)NCCCCCCCCCC 527a_100000684558_100000749702 [0,2,0,0,0,0|1,0,1]=4 15784 B16R0.661 C=CCCC(C)NCCCCCCCCCC 270004a_100000684558_100000762624 [0,2,0,0,0,0|1,0,0]=3 15785 B16R0.661 C=CCCC(C)NCCCCCCCCCO 270004a_100000078944_100000762624 [0,2,0,0,0,0|2,0,0]=4 15786 B16R0.661 C=CCCC(C)OCCCCCCCCCC 34a_100000765329_100000210320 [0,2,0,0,0,0|1,0,0]=3 15787 B16R0.661 C=CCCC(C)OCCCCCCCCCC 7a_100000765329_100000210320 [0,2,0,0,0,0|1,0,0]=3 15788 B16R0.661 C=CCCC(C)OCCCCCCCCCO 34a_100000765329_100009813782 [0,2,0,0,0,0|2,0,0]=4 15789 B16R0.661 C=CCCC(C)OCCCCCCCCCO 7a_100000765329_100009813782 [0,2,0,0,0,0|2,0,0]=4 15790 B16R0.661 C=CCCCCCCCCCC(=O)CCCC 1458a_100000210183_100009814027 [0,2,0,0,0,0|1,0,0]=3 15791 B16R0.661 C=CCCCCCCCCCC(=O)CCOC 1458a_100000749529_100009814027 [0,2,0,0,0,0|1,0,1]=4 15792 B16R0.661 C=CCCCCCCCCCC(=O)CCSC 1458a_100000174002_100009814027 [0,2,0,0,0,0|1,0,1]=4 15793 B16R0.661 C=CCCCCCCCCCC(=O)COCC 1458a_100000211967_100009814027 [0,2,0,0,0,0|1,0,1]=4 15794 B16R0.661 C=CCCCCCCCCCC(=O)CSCC 1458a_100000230394_100009814027 [0,2,0,0,0,0|1,0,1]=4 15795 B16R0.661 C=CCCCCCCCCCN(C)CCCC 2230a_100000207549_100009814027 [0,2,0,0,0,0|1,0,0]=3 15796 B16R0.661 C=CCCCCCCCCCN(C)CCCC 269982a_100000207549_100009814027 [0,2,0,0,0,0|1,0,0]=3 15797 B16R0.661 C=CCCCCCCCCCN(C)CCCO 2230a_100000213112_100009814027 [0,2,0,0,0,0|2,0,0]=4 15798 B16R0.661 C=CCCCCCCCCCN(C)CCCO 269982a_100000213112_100009814027 [0,2,0,0,0,0|2,0,0]=4 15799 B16R0.661 C=CCCCCCCCCCN(C)CCOC 2230a_100000743101_100009814027 [0,2,0,0,0,0|2,0,0]=4 15800 B16R0.661 C=CCCCCCCCCCN(C)CCOC 269982a_100000743101_100009814027 [0,2,0,0,0,0|2,0,0]=4 15801 B16R0.661 C=CCCCCCCCCCN(C)CCSC 2230a_100000686725_100009814027 [0,2,0,0,0,0|2,0,0]=4 15802 B16R0.661 C=CCCCCCCCCCN(C)CCSC 269982a_100000686725_100009814027 [0,2,0,0,0,0|2,0,0]=4 15803 B16R0.661 C=CCCCCCCCCNC(C)CCCC 2230a_100000126638_100011933949 [0,2,0,0,0,0|1,0,0]=3 15804 B16R0.661 C=CCCCCCCCCOC(C)CCCC 34a_100000687866_100011933949 [0,2,0,0,0,0|1,0,0]=3 15805 B16R0.661 C=CCCCCCCCCOC(C)CCCC 34a_100011215194_200011215066 [0,2,0,0,0,0|1,0,0]=3 15806 B16R0.661 C=CCCCCCCCCOC(C)CCCC 7a_100000687866_100011933949 [0,2,0,0,0,0|1,0,0]=3 15807 B16R0.661 C=CCCCCCCCCOC(C)CCCC 7a_100011215194_200011215066 [0,2,0,0,0,0|1,0,0]=3 15808 B16R0.661 C=CCCCCCCCCOC(C)CCCCl 34a_200000718107_100011933949 [0,2,0,0,0,0|2,0,0]=4 15809 B16R0.661 C=CCCCCCCCCOC(C)CCCCl 7a_200000718107_100011933949 [0,2,0,0,0,0|2,0,0]=4 15810 B16R0.661 C=CCCCCCCCCOC(C)COCC 34a_100000718985_100011933949 [0,2,0,0,0,0|2,0,0]=4 15811 B16R0.661 C=CCCCCCCCCOC(C)COCC 7a_100000718985_100011933949 [0,2,0,0,0,0|2,0,0]=4 15812 B16R0.661 C=CCCCCCCCNCC(C)OCCC 2230a_100015185124_100012355270 [0,2,0,0,0,0|2,0,0]=4 15813 B16R0.661 C=CCCCCCCCNCC(C)OCCC 34a_100015185124_100012355270 [0,2,0,0,0,0|2,0,0]=4 15814 B16R0.661 C=CCCCCCCCNCC(O)COCC 2230a_102515437182_100012355270 [0,2,0,0,0,0|2,0,0]=4 15815 B16R0.661 C=CCCCCCCCNCC(O)COCC 34a_102515437182_100012355270 [0,2,0,0,0,0|2,0,0]=4 15816 B16R0.661 C=CCCCCCCCNC[C@H](C)CCCO 2230a_100160569302_100012355270 [0,2,0,0,0,0|2,0,0]=4 15817 B16R0.661 C=CCCCCCCCNC[C@H](C)CCCO 34a_100160569302_100012355270 [0,2,0,0,0,0|2,0,0]=4 15818 B16R0.661 C=CCCCCCCCOCC(C)CCCC 34a_100011995851_100012355270 [0,2,0,0,0,0|1,0,0]=3 15819 B16R0.661 C=CCCCCCCCOCC(C)CCCC 7a_100011995851_100012355270 [0,2,0,0,0,0|1,0,0]=3 15820 B16R0.661 C=CCCCCCCCOC[C@@H](N)CCCC 34a_100011934283_100012355270 [0,2,0,0,0,0|1,0,0]=3 15821 B16R0.661 C=CCCCCCCCOC[C@@H](N)CCSC 34a_100011827619_100012355270 [0,2,0,0,0,0|2,0,0]=4 15822 B16R0.661 C=CCCCCOCCCCC(C)CCCC 34a_200011021034_100011215482 [0,2,0,0,0,0|1,0,0]=3 15823 B16R0.661 C=CCCCCOCCCCC(C)CCCC 7a_200011021034_100011215482 [0,2,0,0,0,0|1,0,0]=3 15824 B16R0.661 C=CCCN(C)CCCCCCCCCCC 2230a_100020639649_100011215454 [0,2,0,0,0,0|1,0,0]=3 15825 B16R0.661 C=CCCN(C)CCCCCCCCCCC 269982a_100020639649_100011215454 [0,2,0,0,0,0|1,0,0]=3 15826 B16R0.661 C=CCCN(C)CCCCCCCCCCO 2230a_100020639649_100009813290 [0,2,0,0,0,0|2,0,0]=4 15827 B16R0.661 C=CCCN(C)CCCCCCCCCCO 269982a_100020639649_100009813290 [0,2,0,0,0,0|2,0,0]=4 15828 B16R0.661 C=CCNC(=O)CCCCCCCCCCC 1626a_100020586998_100000210736 [0,2,0,0,0,0|1,0,1]=4 15829 B16R0.661 C=CCNC(=O)CCCCCCCCCCC 240690a_100020586998_100000210736 [0,2,0,0,0,0|1,0,1]=4 15830 B16R0.661 C=CCNC(C)CCCCCCCCCCC 270004a_100020586998_100011216755 [0,2,0,0,0,0|1,0,0]=3 15831 B16R0.661 C=CCOC(C)CCCCCCCCCCC 34a_100011217895_100015514636 [0,2,0,0,0,0|1,0,0]=3 15832 B16R0.661 C=CCOC(C)CCCCCCCCCCC 7a_100011217895_100015514636 [0,2,0,0,0,0|1,0,0]=3 15833 B16R0.661 CC=CCC(=O)CCCCCCCCCCC 1458a_100000210736_100000070051 [0,2,0,0,0,0|1,0,1]=4 15834 B16R0.661 CC=CCC(=O)CCCCCCCCCCC 1458a_100121576822_100011215454 [0,2,0,0,0,0|1,0,1]=4 15835 B16R0.661 CCCCC(=O)CCCCCCCCCCO 1458a_100000210183_100009813290 [0,2,0,0,0,0|0,0,2]=4 15836 B16R0.661 CCCCC(C)CCCCOCCCCC#N 7a_200011021034_100000211819 [0,2,0,0,0,0|1,0,1]=4 15837 B16R0.661 CCCCC(C)CCCCOCCCCC=O 7a_200011021034_100000139335 [0,2,0,0,0,0|0,0,0]=2 15838 B16R0.661 CCCCC(C)CCCCOCCCCCF 34a_200011021034_100000729378 [0,2,0,0,0,0|1,0,1]=4 15839 B16R0.661 CCCCC(C)CCCCOCCCCCF 7a_200011021034_100000729378 [0,2,0,0,0,0|1,0,1]=4 15840 B16R0.661 CCCCC(C)CCCCOCCCCCO 34a_200011021034_100000746330 [0,2,0,0,0,0|0,0,2]=4 15841 B16R0.661 CCCCC(C)CCCCOCCCCCO 7a_200011021034_100000746330 [0,2,0,0,0,0|0,0,2]=4 15842 B16R0.661 CCCCC(C)CCCCOCCCCOC 34a_200011021034_100000755781 [0,2,0,0,0,0|2,0,0]=4 15843 B16R0.661 CCCCC(C)CCCCOCCCCOC 7a_200011021034_100000730899 [0,2,0,0,0,0|2,0,0]=4 15844 B16R0.661 CCCCC(C)COCCCCCCCCO 34a_100011995851_100000033203 [0,2,0,0,0,0|0,0,2]=4 15845 B16R0.661 CCCCC(C)COCCCCCCCCO 7a_100011995851_100000033203 [0,2,0,0,0,0|0,0,2]=4 15846 B16R0.661 CCCCC(C)NCCCCCCCCCO 2230a_100000078944_200011215066 [0,2,0,0,0,0|0,0,2]=4 15847 B16R0.661 CCCCC(C)NCCCCCCCCCO 2230a_100000126638_100009813782 [0,2,0,0,0,0|0,0,2]=4 15848 B16R0.661 CCCCC(C)NCCCCCCCCCO 270004a_100000078944_100000210087 [0,2,0,0,0,0|0,0,2]=4 15849 B16R0.661 CCCCC(C)NCCCCCCCCCO 34a_100000078944_200011215066 [0,2,0,0,0,0|0,0,2]=4 15850 B16R0.661 CCCCC(C)OCCCCCCCCCBr 34a_100009813782_200011215066 [0,2,0,0,0,0|1,0,1]=4 15851 B16R0.661 CCCCC(C)OCCCCCCCCCBr 7a_100009813782_200011215066 [0,2,0,0,0,0|1,0,1]=4 15852 B16R0.661 CCCCC(C)OCCCCCCCCCCl 34a_100009868337_200011215066 [0,2,0,0,0,0|1,0,1]=4 15853 B16R0.661 CCCCC(C)OCCCCCCCCCCl 7a_100009868337_200011215066 [0,2,0,0,0,0|1,0,1]=4 15854 B16R0.661 CCCCC(C)OCCCCCCCCCN 34a_100000078944_200011215066 [0,2,0,0,0,0|1,0,1]=4 15855 B16R0.661 CCCCC(C)OCCCCCCCCCO 34a_100000687866_100009813782 [0,2,0,0,0,0|0,0,2]=4 15856 B16R0.661 CCCCC(C)OCCCCCCCCCO 7a_100000687866_100009813782 [0,2,0,0,0,0|0,0,2]=4 15857 B16R0.661 CCCCC(C)SCCCCCCCCCO 62a_100009813782_200011215066 [0,2,0,0,0,0|0,0,2]=4 15858 B16R0.661 CCCCC(C)SCCCCCCCCCO 62a_200011215066_100009813782 [0,2,0,0,0,0|0,0,2]=4 15859 B16R0.661 CCCCCCCCCCCC(=O)CCC#N 1458a_100000210736_100011215226 [0,2,0,0,0,0|1,0,1]=4 15860 B16R0.661 CCCCCCCCCCCC(=O)CCC#N 1458a_100011934036_100011215454 [0,2,0,0,0,0|1,0,1]=4 15861 B16R0.661 CCCCCCCCCCCC(=O)CCCC 1458a_100000210183_100011215454 [0,2,0,0,0,0|1,0,1]=4 15862 B16R0.661 CCCCCCCCCCCC(=O)CCCC 1458a_100000210736_100000210211 [0,2,0,0,0,0|1,0,1]=4 15863 B16R0.661 CCCCCCCCCCCC(=O)CCCF 1458a_100000210736_100011934791 [0,2,0,0,0,0|1,0,1]=4 15864 B16R0.661 CCCCCCCCCCCC(=O)CCCO 1458a_100000210736_100011215043 [0,2,0,0,0,0|0,0,2]=4 15865 B16R0.661 CCCCCCCCCCCC(=O)CCOC 1458a_100000210736_100000233755 [0,2,0,0,0,0|2,0,0]=4 15866 B16R0.661 CCCCCCCCCCCC(=O)CCOC 1458a_100000749529_100011215454 [0,2,0,0,0,0|2,0,0]=4 15867 B16R0.661 CCCCCCCCCCCC(=O)CCSC 1458a_100000174002_100011215454 [0,2,0,0,0,0|2,0,0]=4 15868 B16R0.661 CCCCCCCCCCCC(=O)CCSC 1458a_100000210736_100000751147 [0,2,0,0,0,0|2,0,0]=4 15869 B16R0.661 CCCCCCCCCCCC(C)NCCC 270004a_100020643023_100011216755 [0,2,0,0,0,0|1,0,1]=4 15870 B16R0.661 CCCCCCCCCCCC(C)NCCO 270004a_100000210304_100011216755 [0,2,0,0,0,0|0,0,2]=4 15871 B16R0.661 CCCCCCCCCCCC(C)OCC#N 7a_100011217895_100011215382 [0,2,0,0,0,0|1,0,1]=4 15872 B16R0.661 CCCCCCCCCCCC(C)OCC=O 34a_100011217895_200009817547 [0,2,0,0,0,0|0,0,0]=2 15873 B16R0.661 CCCCCCCCCCCC(C)OCC=O 7a_100011217895_200015260668 [0,2,0,0,0,0|0,0,0]=2 15874 B16R0.661 CCCCCCCCCCCC(C)OCCC 34a_100011217895_100000210303 [0,2,0,0,0,0|1,0,1]=4 15875 B16R0.661 CCCCCCCCCCCC(C)OCCC 7a_100011217895_100000210303 [0,2,0,0,0,0|1,0,1]=4 15876 B16R0.661 CCCCCCCCCCCC(C)OCCF 34a_100011217895_100011217306 [0,2,0,0,0,0|1,0,1]=4 15877 B16R0.661 CCCCCCCCCCCC(C)OCCF 7a_100011217895_100011217306 [0,2,0,0,0,0|1,0,1]=4 15878 B16R0.661 CCCCCCCCCCCC(C)OCCO 34a_100011217895_100000211926 [0,2,0,0,0,0|0,0,2]=4 15879 B16R0.661 CCCCCCCCCCCC(C)OCCO 7a_100011217895_100000211926 [0,2,0,0,0,0|0,0,2]=4 15880 B16R0.661 CCCCCCCCCCCC(C)OCSC 34a_100011217895_100011218213 [0,2,0,0,0,0|2,0,0]=4 15881 B16R0.661 CCCCCCCCCCCN(C)CCC#N 2230a_100000184479_100011215454 [0,2,0,0,0,0|1,0,1]=4 15882 B16R0.661 CCCCCCCCCCCN(C)CCCC 2230a_100000207549_100011215454 [0,2,0,0,0,0|1,0,1]=4 15883 B16R0.661 CCCCCCCCCCCN(C)CCCC 269982a_100000207549_100011215454 [0,2,0,0,0,0|1,0,1]=4 15884 B16R0.661 CCCCCCCCCCCN(C)CCCO 2230a_100000213112_100011215454 [0,2,0,0,0,0|0,0,2]=4 15885 B16R0.661 CCCCCCCCCCCN(C)CCCO 269982a_100000213112_100011215454 [0,2,0,0,0,0|0,0,2]=4 15886 B16R0.661 CCCCCCCCCCCN(C)CCOC 2230a_100000743101_100011215454 [0,2,0,0,0,0|2,0,0]=4 15887 B16R0.661 CCCCCCCCCCCN(C)CCOC 269982a_100000743101_100011215454 [0,2,0,0,0,0|2,0,0]=4 15888 B16R0.661 CCCCCCCCCCCN(C)CCSC 2230a_100000686725_100011215454 [0,2,0,0,0,0|2,0,0]=4 15889 B16R0.661 CCCCCCCCCCCN(C)CCSC 269982a_100000686725_100011215454 [0,2,0,0,0,0|2,0,0]=4 15890 B16R0.661 CCCCCCCCCCNC(C)CCCC 2230a_100000126638_100000210320 [0,2,0,0,0,0|1,0,1]=4 15891 B16R0.661 CCCCCCCCCCNC(C)CCCC 2230a_100000684558_200011215066 [0,2,0,0,0,0|1,0,1]=4 15892 B16R0.661 CCCCCCCCCCNC(C)CCCC 270004a_100000684558_100000210087 [0,2,0,0,0,0|1,0,1]=4 15893 B16R0.661 CCCCCCCCCCNC(C)CCCC 34a_100000684558_200011215066 [0,2,0,0,0,0|1,0,1]=4 15894 B16R0.661 CCCCCCCCCCNC(C)CCOC 270004a_100000684558_100000742357 [0,2,0,0,0,0|2,0,0]=4 15895 B16R0.661 CCCCCCCCCCNC(C)CCSC 270004a_100000684558_100011217047 [0,2,0,0,0,0|2,0,0]=4 15896 B16R0.661 CCCCCCCCCCOC(C)CCCC 34a_100000210711_200011215066 [0,2,0,0,0,0|1,0,1]=4 15897 B16R0.661 CCCCCCCCCCOC(C)CCCC 34a_100000687866_100000210320 [0,2,0,0,0,0|1,0,1]=4 15898 B16R0.661 CCCCCCCCCCOC(C)CCCC 7a_100000210711_200011215066 [0,2,0,0,0,0|1,0,1]=4 15899 B16R0.661 CCCCCCCCCCOC(C)CCCC 7a_100000687866_100000210320 [0,2,0,0,0,0|1,0,1]=4 15900 B16R0.661 CCCCCCCCCCOC(C)CCCCl 34a_200000718107_100000210320 [0,2,0,0,0,0|1,0,1]=4 15901 B16R0.661 CCCCCCCCCCOC(C)CCCCl 7a_200000718107_100000210320 [0,2,0,0,0,0|1,0,1]=4 15902 B16R0.661 CCCCCCCCCNC[C@H](C)CCCO 2230a_100160569302_100011214924 [0,2,0,0,0,0|0,0,2]=4 15903 B16R0.661 CCCCCCCCCNC[C@H](C)CCCO 34a_100160569302_100011214924 [0,2,0,0,0,0|0,0,2]=4 15904 B16R0.661 CCCCCCCCCOCC(C)CCCC 34a_100011995851_100011214924 [0,2,0,0,0,0|1,0,1]=4 15905 B16R0.661 CCCCCCCCCOCC(C)CCCC 7a_100011995851_100000210328 [0,2,0,0,0,0|1,0,1]=4 15906 B16R0.661 CCCCCCCCCOC[C@@H](N)CCCC 34a_100011934283_100011214924 [0,2,0,0,0,0|1,0,1]=4 15907 B16R0.661 CCCCCCCCCOC[C@@H](N)CCSC 34a_100011827619_100011214924 [0,2,0,0,0,0|2,0,0]=4 15908 B16R0.661 CCCCCCOCCCCC(C)CCCC 34a_200011021034_100000210314 [0,2,0,0,0,0|1,0,1]=4 15909 B16R0.661 CCCCCCOCCCCC(C)CCCC 7a_200011021034_100000210314 [0,2,0,0,0,0|1,0,1]=4 15910 B16R0.661 CCCCN(C)CCCCCCCCCCO 2230a_100000207549_100009813290 [0,2,0,0,0,0|0,0,2]=4 15911 B16R0.661 CCCCN(C)CCCCCCCCCCO 269982a_100000207549_100009813290 [0,2,0,0,0,0|0,0,2]=4 15912 B16R0.661 CCCC[C@H](N)COCCCCCCCCO 34a_100011934283_100000033203 [0,2,0,0,0,0|0,0,2]=4 15913 B16R0.661 CCCNC(=O)CCCSCCCCCC=O 62a_100000139337_100011194427 [0,2,0,0,0,0|1,0,1]=4 15914 B16R0.661 CCCNC(=O)CCCSCCCCCC=O 62a_100011194427_100000139337 [0,2,0,0,0,0|1,0,1]=4 15915 B16R0.6603 C#CCCCCC(=O)CCCCCCCCC 1458a_100000210558_100010269958 [0,2,0,0,0,0|1,0,1]=4 15916 B16R0.6603 C#CCCCCC(=O)CCCCCCCCC 1458a_100000696528_100000210670 [0,2,0,0,0,0|1,0,1]=4 15917 B16R0.6603 C#CCCCCCCCC(=O)CCCCCC 1458a_100000087357_100000210757 [0,2,0,0,0,0|1,0,1]=4 15918 B16R0.6603 C#CCCCCCCCC(=O)CCCCCC 1458a_100102632555_100153394163 [0,2,0,0,0,0|1,0,1]=4 15919 B16R0.6603 C#CCCCCCCCN(C)CCCCCC 2230a_106256046315_100153394163 [0,2,0,0,0,0|1,0,1]=4 15920 B16R0.6603 C#CCCCCCCCN(C)CCCCCC 269982a_106256046315_100153394163 [0,2,0,0,0,0|1,0,1]=4 15921 B16R0.6603 C#CCCCCCCNC(C)CCCCCC 2230a_100000210919_100012276617 [0,2,0,0,0,0|1,0,1]=4 15922 B16R0.6603 C#CCCCCCCNC(C)CCCCCC 34a_100000210919_100012276617 [0,2,0,0,0,0|1,0,1]=4 15923 B16R0.6603 C#CCCCCCCOC(C)CCCCCC 34a_100000210265_100012276617 [0,2,0,0,0,0|1,0,1]=4 15924 B16R0.6603 C#CCCCCCCOC(C)CCCCCC 34a_100011217361_100011215978 [0,2,0,0,0,0|1,0,1]=4 15925 B16R0.6603 C#CCCCCCCOC(C)CCCCCC 7a_100000210265_100012276617 [0,2,0,0,0,0|1,0,1]=4 15926 B16R0.6603 C#CCCCCCCOC(C)CCCCCC 7a_100011217361_100011215978 [0,2,0,0,0,0|1,0,1]=4 15927 B16R0.6603 C#CCCCCCCSC(C)CCCCCC 62a_100011215978_100012276617 [0,2,0,0,0,0|1,0,1]=4 15928 B16R0.6603 C#CCCCCCCSC(C)CCCCCC 62a_100012276617_100011215978 [0,2,0,0,0,0|1,0,1]=4 15929 B16R0.6603 C#CCCCCN(C)CCCCCCCCC 2230a_100000232482_100010269958 [0,2,0,0,0,0|1,0,1]=4 15930 B16R0.6603 C#CCCCCN(C)CCCCCCCCC 269982a_100000232482_100010269958 [0,2,0,0,0,0|1,0,1]=4 15931 B16R0.6603 C#CCCCCOCCC(C)CCCCCC 34a_200011024964_100010269958 [0,2,0,0,0,0|1,0,1]=4 15932 B16R0.6603 C#CCCCCOCCC(C)CCCCCC 7a_200011024964_100010269958 [0,2,0,0,0,0|1,0,1]=4 15933 B16R0.6603 C#CCCCNC(C)CCCCCCCCC 270004a_100000718082_100011215753 [0,2,0,0,0,0|1,0,1]=4 15934 B16R0.6603 C#CCCCOC(C)CCCCCCCCC 34a_100011218016_100000695029 [0,2,0,0,0,0|1,0,1]=4 15935 B16R0.6603 C#CCCCOC(C)CCCCCCCCC 7a_100011218016_100011215417 [0,2,0,0,0,0|1,0,1]=4 15936 B16R0.6603 C=CCCCCC(=O)CCCCCCCCC 1458a_100000210558_100011215482 [0,2,0,0,0,0|1,0,0]=3 15937 B16R0.6603 C=CCCCCC(=O)CCCCCCCCC 1458a_100011215552_100000210670 [0,2,0,0,0,0|1,0,0]=3 15938 B16R0.6603 C=CCCCCC(=O)CCCCCCCCO 1458a_100011215552_100000033203 [0,2,0,0,0,0|1,0,1]=4 15939 B16R0.6603 C=CCCCCC(=O)NCCCCCCCC 11a_100000229939_100011215552 [0,2,0,0,0,0|1,0,1]=4 15940 B16R0.6603 C=CCCCCC(=O)NCCCCCCCC 1626a_100000229939_100011215552 [0,2,0,0,0,0|1,0,1]=4 15941 B16R0.6603 C=CCCCCC(=O)NCCCCCCCC 240690a_100000229939_100011215552 [0,2,0,0,0,0|1,0,1]=4 15942 B16R0.6603 C=CCCCCC(=O)NCCCCCCCC 527a_100000229939_100011215552 [0,2,0,0,0,0|1,0,1]=4 15943 B16R0.6603 C=CCCCCCCCC(=O)CCCCCC 1458a_100011216160_100000210757 [0,2,0,0,0,0|1,0,0]=3 15944 B16R0.6603 C=CCCCCCCCC(=O)CCCCCC 1458a_100102632555_100012355270 [0,2,0,0,0,0|1,0,0]=3 15945 B16R0.6603 C=CCCCCCCCC(=O)CCCCCF 1458a_100011216160_100000729378 [0,2,0,0,0,0|1,0,1]=4 15946 B16R0.6603 C=CCCCCCCCC(=O)CCCCCO 1458a_100011216160_100000746330 [0,2,0,0,0,0|1,0,1]=4 15947 B16R0.6603 C=CCCCCCCCC(=O)CCCCCO 1458a_100102619762_100012355270 [0,2,0,0,0,0|1,0,1]=4 15948 B16R0.6603 C=CCCCCCCCC(=O)CCCCOC 1458a_100011216160_100000755781 [0,2,0,0,0,0|1,0,1]=4 15949 B16R0.6603 C=CCCCCCCCC(=O)CCCOCC 1458a_100011216160_100012232248 [0,2,0,0,0,0|1,0,1]=4 15950 B16R0.6603 C=CCCCCCCCC(=O)CCOCCC 1458a_100011216160_100011215938 [0,2,0,0,0,0|1,0,1]=4 15951 B16R0.6603 C=CCCCCCCCC(=O)COCCCC 1458a_100000757543_100012355270 [0,2,0,0,0,0|1,0,1]=4 15952 B16R0.6603 C=CCCCCCCCC(=O)COCCCC 1458a_100011216160_100011995733 [0,2,0,0,0,0|1,0,1]=4 15953 B16R0.6603 C=CCCCCCCCC(=O)CSCCCC 1458a_100000191162_100012355270 [0,2,0,0,0,0|1,0,1]=4 15954 B16R0.6603 C=CCCCCCCCC(=O)NCCCCC 11a_100000209983_100011216160 [0,2,0,0,0,0|1,0,1]=4 15955 B16R0.6603 C=CCCCCCCCC(=O)NCCCCC 1626a_100000209983_100011216160 [0,2,0,0,0,0|1,0,1]=4 15956 B16R0.6603 C=CCCCCCCCC(=O)NCCCCC 240690a_100000209983_100011216160 [0,2,0,0,0,0|1,0,1]=4 15957 B16R0.6603 C=CCCCCCCCC(=O)NCCCCC 527a_100000209983_100011216160 [0,2,0,0,0,0|1,0,1]=4 15958 B16R0.6603 C=CCCCCCCCN(C)CCCCCC 2230a_106256046315_100012355270 [0,2,0,0,0,0|1,0,0]=3 15959 B16R0.6603 C=CCCCCCCCN(C)CCCCCC 269982a_106256046315_100012355270 [0,2,0,0,0,0|1,0,0]=3 15960 B16R0.6603 C=CCCCCCCCN(C)CCCCCO 2230a_100000722520_100012355270 [0,2,0,0,0,0|2,0,0]=4 15961 B16R0.6603 C=CCCCCCCCN(C)CCCCCO 269982a_100000722520_100012355270 [0,2,0,0,0,0|2,0,0]=4 15962 B16R0.6603 C=CCCCCCCNC(C)CCCCCC 2230a_100000210919_100011215473 [0,2,0,0,0,0|1,0,0]=3 15963 B16R0.6603 C=CCCCCCCNC(C)CCCCCC 34a_100000210919_100011215473 [0,2,0,0,0,0|1,0,0]=3 15964 B16R0.6603 C=CCCCCCCOC(C)CCCCCC 34a_100000210265_100011215473 [0,2,0,0,0,0|1,0,0]=3 15965 B16R0.6603 C=CCCCCCCOC(C)CCCCCC 34a_200011216477_100011215978 [0,2,0,0,0,0|1,0,0]=3 15966 B16R0.6603 C=CCCCCCCOC(C)CCCCCC 7a_100000210265_100011215473 [0,2,0,0,0,0|1,0,0]=3 15967 B16R0.6603 C=CCCCCCCOC(C)CCCCCC 7a_200011216477_100011215978 [0,2,0,0,0,0|1,0,0]=3 15968 B16R0.6603 C=CCCCCCCOC(C)COCCCC 34a_100011217071_100011215473 [0,2,0,0,0,0|2,0,0]=4 15969 B16R0.6603 C=CCCCCCCOC(C)COCCCC 7a_100011217071_100011215473 [0,2,0,0,0,0|2,0,0]=4 15970 B16R0.6603 C=CCCCCN(C)CCCCCCCCC 2230a_100000232482_100011215482 [0,2,0,0,0,0|1,0,0]=3 15971 B16R0.6603 C=CCCCCN(C)CCCCCCCCC 2230a_100012000471_100011214924 [0,2,0,0,0,0|1,0,0]=3 15972 B16R0.6603 C=CCCCCN(C)CCCCCCCCC 269982a_100000232482_100011215482 [0,2,0,0,0,0|1,0,0]=3 15973 B16R0.6603 C=CCCCCN(C)CCCCCCCCC 269982a_100012000471_100000210670 [0,2,0,0,0,0|1,0,0]=3 15974 B16R0.6603 C=CCCCCN(C)CCCCCCCCO 2230a_100012000471_100000033203 [0,2,0,0,0,0|2,0,0]=4 15975 B16R0.6603 C=CCCCCN(C)CCCCCCCCO 269982a_100012000471_100000033203 [0,2,0,0,0,0|2,0,0]=4 15976 B16R0.6603 C=CCCCCOCCC(C)CCCCCC 34a_200011024964_100011215482 [0,2,0,0,0,0|1,0,0]=3 15977 B16R0.6603 C=CCCCCOCCC(C)CCCCCC 7a_200011024964_100011215482 [0,2,0,0,0,0|1,0,0]=3 15978 B16R0.6603 C=CCCCNC(=O)CCCCCCCCC 11a_100000700776_100000210558 [0,2,0,0,0,0|1,0,1]=4 15979 B16R0.6603 C=CCCCNC(=O)CCCCCCCCC 1626a_100000700776_100000210558 [0,2,0,0,0,0|1,0,1]=4 15980 B16R0.6603 C=CCCCNC(=O)CCCCCCCCC 240690a_100000700776_100000210558 [0,2,0,0,0,0|1,0,1]=4 15981 B16R0.6603 C=CCCCNC(=O)CCCCCCCCC 527a_100000700776_100000210558 [0,2,0,0,0,0|1,0,1]=4 15982 B16R0.6603 C=CCCCNC(C)CCCCCCCCC 270004a_100000700776_100011215753 [0,2,0,0,0,0|1,0,0]=3 15983 B16R0.6603 C=CCCCOC(C)CCCCCCCCC 34a_100011218016_100000757094 [0,2,0,0,0,0|1,0,0]=3 15984 B16R0.6603 C=CCCCOC(C)CCCCCCCCC 7a_100011218016_100000757094 [0,2,0,0,0,0|1,0,0]=3 15985 B16R0.6603 C=CCCNCC(C)CCCCCCCCC 270004a_100015191253_200011218516 [0,2,0,0,0,0|1,0,0]=3 15986 B16R0.6603 C=CCOCCC(=O)CCCCCCCCC 1458a_200011217002_100000210670 [0,2,0,0,0,0|1,0,1]=4 15987 B16R0.6603 C=COCCOC(C)CCCCCCCCC 34a_100011218016_100000039644 [0,2,0,0,0,0|2,0,0]=4 15988 B16R0.6603 C=COCCOC(C)CCCCCCCCC 7a_100011218016_100000039644 [0,2,0,0,0,0|2,0,0]=4 15989 B16R0.6603 CCCCCCC(=O)CCCCCCCCO 1458a_100102632555_100000033203 [0,2,0,0,0,0|0,0,2]=4 15990 B16R0.6603 CCCCCCC(C)CCOCCCCC#N 7a_200011024964_100000211819 [0,2,0,0,0,0|1,0,1]=4 15991 B16R0.6603 CCCCCCC(C)CCOCCCCC=O 7a_200011024964_100000139335 [0,2,0,0,0,0|0,0,0]=2 15992 B16R0.6603 CCCCCCC(C)CCOCCCCCF 34a_200011024964_100000729378 [0,2,0,0,0,0|1,0,1]=4 15993 B16R0.6603 CCCCCCC(C)CCOCCCCCF 7a_200011024964_100000729378 [0,2,0,0,0,0|1,0,1]=4 15994 B16R0.6603 CCCCCCC(C)CCOCCCCCO 34a_200011024964_100000746330 [0,2,0,0,0,0|0,0,2]=4 15995 B16R0.6603 CCCCCCC(C)CCOCCCCCO 7a_200011024964_100000746330 [0,2,0,0,0,0|0,0,2]=4 15996 B16R0.6603 CCCCCCC(C)CCOCCCCOC 34a_200011024964_100000755781 [0,2,0,0,0,0|2,0,0]=4 15997 B16R0.6603 CCCCCCC(C)CCOCCCCOC 7a_200011024964_100000730899 [0,2,0,0,0,0|2,0,0]=4 15998 B16R0.6603 CCCCCCC(C)NCCCCCCC#N 2230a_100000210919_100009813337 [0,2,0,0,0,0|1,0,1]=4 15999 B16R0.6603 CCCCCCC(C)NCCCCCCCO 2230a_100000210919_100000760002 [0,2,0,0,0,0|0,0,2]=4 16000 B16R0.6603 CCCCCCC(C)NCCCCCCCO 2230a_100011996573_100011215978 [0,2,0,0,0,0|0,0,2]=4 16001 B16R0.6603 CCCCCCC(C)NCCCCCCCO 270004a_100011996573_100000210826 [0,2,0,0,0,0|0,0,2]=4 16002 B16R0.6603 CCCCCCC(C)NCCCCCCCO 34a_100000210919_100000760002 [0,2,0,0,0,0|0,0,2]=4 16003 B16R0.6603 CCCCCCC(C)NCCCCCCCO 34a_100011996573_100011215978 [0,2,0,0,0,0|0,0,2]=4 16004 B16R0.6603 CCCCCCC(C)NCCCCCCOC 2230a_100000210919_100011998445 [0,2,0,0,0,0|2,0,0]=4 16005 B16R0.6603 CCCCCCC(C)NCCCCCCOC 34a_100000210919_100011998445 [0,2,0,0,0,0|2,0,0]=4 16006 B16R0.6603 CCCCCCC(C)OCCCCCCC#N 7a_100000210265_100009813337 [0,2,0,0,0,0|1,0,1]=4 16007 B16R0.6603 CCCCCCC(C)OCCCCCCCBr 34a_100000760002_100011215978 [0,2,0,0,0,0|1,0,1]=4 16008 B16R0.6603 CCCCCCC(C)OCCCCCCCBr 7a_100000760002_100011215978 [0,2,0,0,0,0|1,0,1]=4 16009 B16R0.6603 CCCCCCC(C)OCCCCCCCN 34a_100011996573_100011215978 [0,2,0,0,0,0|1,0,1]=4 16010 B16R0.6603 CCCCCCC(C)OCCCCCCCO 34a_100000210265_100000760002 [0,2,0,0,0,0|0,0,2]=4 16011 B16R0.6603 CCCCCCC(C)OCCCCCCCO 7a_100000210265_100000760002 [0,2,0,0,0,0|0,0,2]=4 16012 B16R0.6603 CCCCCCC(C)OCCCCCCOC 34a_100000210265_100011998445 [0,2,0,0,0,0|2,0,0]=4 16013 B16R0.6603 CCCCCCC(C)OCCCCCCOC 34a_200012092642_100011215978 [0,2,0,0,0,0|2,0,0]=4 16014 B16R0.6603 CCCCCCC(C)OCCCCCCOC 7a_100000210265_100011998445 [0,2,0,0,0,0|2,0,0]=4 16015 B16R0.6603 CCCCCCC(C)OCCCCCCOC 7a_200012092642_100011215978 [0,2,0,0,0,0|2,0,0]=4 16016 B16R0.6603 CCCCCCC(C)SCCCCCCC#N 62a_100009813337_100011215978 [0,2,0,0,0,0|1,0,1]=4 16017 B16R0.6603 CCCCCCC(C)SCCCCCCC#N 62a_100011215978_100009813337 [0,2,0,0,0,0|1,0,1]=4 16018 B16R0.6603 CCCCCCC(C)SCCCCCCCO 62a_100000760002_100011215978 [0,2,0,0,0,0|0,0,2]=4 16019 B16R0.6603 CCCCCCC(C)SCCCCCCCO 62a_100011215978_100000760002 [0,2,0,0,0,0|0,0,2]=4 16020 B16R0.6603 CCCCCCC(C)SCCCCCCOC 62a_100011215978_100011998445 [0,2,0,0,0,0|2,0,0]=4 16021 B16R0.6603 CCCCCCC(C)SCCCCCCOC 62a_100011998445_100011215978 [0,2,0,0,0,0|2,0,0]=4 16022 B16R0.6603 CCCCCCCCCC(=O)CCCCC#N 1458a_100000210558_100000211819 [0,2,0,0,0,0|1,0,1]=4 16023 B16R0.6603 CCCCCCCCCC(=O)CCCCCC 1458a_100000210558_100000210757 [0,2,0,0,0,0|1,0,1]=4 16024 B16R0.6603 CCCCCCCCCC(=O)CCCCCC 1458a_100102632555_100000210670 [0,2,0,0,0,0|1,0,1]=4 16025 B16R0.6603 CCCCCCCCCC(=O)CCCCCF 1458a_100000210558_100000729378 [0,2,0,0,0,0|1,0,1]=4 16026 B16R0.6603 CCCCCCCCCC(=O)CCCCCO 1458a_100000210558_100000746330 [0,2,0,0,0,0|0,0,2]=4 16027 B16R0.6603 CCCCCCCCCC(=O)CCCCCO 1458a_100102619762_100000210670 [0,2,0,0,0,0|0,0,2]=4 16028 B16R0.6603 CCCCCCCCCC(=O)CCCCOC 1458a_100000210558_100000755781 [0,2,0,0,0,0|2,0,0]=4 16029 B16R0.6603 CCCCCCCCCC(=O)OCSCC=O 62a_200015260668_200010990708 [0,2,0,0,0,0|1,0,1]=4 16030 B16R0.6603 CCCCCCCCCC(C)CNCCC#N 270004a_100000720768_200011218516 [0,2,0,0,0,0|1,0,1]=4 16031 B16R0.6603 CCCCCCCCCC(C)CNCCCC 270004a_100000102301_200011218516 [0,2,0,0,0,0|1,0,1]=4 16032 B16R0.6603 CCCCCCCCCC(C)CNCCCF 270004a_100015189416_200011218516 [0,2,0,0,0,0|1,0,1]=4 16033 B16R0.6603 CCCCCCCCCC(C)CNCCCO 270004a_100000182051_200011218516 [0,2,0,0,0,0|0,0,2]=4 16034 B16R0.6603 CCCCCCCCCC(C)CNCCOC 270004a_100000209980_200011218516 [0,2,0,0,0,0|2,0,0]=4 16035 B16R0.6603 CCCCCCCCCC(C)CNCCSC 270004a_100020590264_200011218516 [0,2,0,0,0,0|2,0,0]=4 16036 B16R0.6603 CCCCCCCCCC(C)NCCCCC 270004a_100000209983_100011215753 [0,2,0,0,0,0|1,0,1]=4 16037 B16R0.6603 CCCCCCCCCC(C)NCCCCO 270004a_100000750430_100011215753 [0,2,0,0,0,0|0,0,2]=4 16038 B16R0.6603 CCCCCCCCCC(C)NCCCOC 270004a_100150723488_100011215753 [0,2,0,0,0,0|2,0,0]=4 16039 B16R0.6603 CCCCCCCCCC(C)NCCCSC 270004a_100000749238_100011215753 [0,2,0,0,0,0|2,0,0]=4 16040 B16R0.6603 CCCCCCCCCC(C)OCCCC#N 7a_100011218016_100000687738 [0,2,0,0,0,0|1,0,1]=4 16041 B16R0.6603 CCCCCCCCCC(C)OCCCC=O 7a_100011218016_200011292268 [0,2,0,0,0,0|0,0,0]=2 16042 B16R0.6603 CCCCCCCCCC(C)OCCCCC 34a_100011218016_100000718602 [0,2,0,0,0,0|1,0,1]=4 16043 B16R0.6603 CCCCCCCCCC(C)OCCCCC 7a_100011218016_100000210326 [0,2,0,0,0,0|1,0,1]=4 16044 B16R0.6603 CCCCCCCCCC(C)OCCCCF 34a_100011218016_100000729493 [0,2,0,0,0,0|1,0,1]=4 16045 B16R0.6603 CCCCCCCCCC(C)OCCCCF 7a_100011218016_100000729493 [0,2,0,0,0,0|1,0,1]=4 16046 B16R0.6603 CCCCCCCCCC(C)OCCCCO 34a_100011218016_100011216708 [0,2,0,0,0,0|0,0,2]=4 16047 B16R0.6603 CCCCCCCCCC(C)OCCCCO 7a_100011218016_100000210776 [0,2,0,0,0,0|0,0,2]=4 16048 B16R0.6603 CCCCCCCCCC(C)OCCCOC 34a_100011218016_100000740836 [0,2,0,0,0,0|2,0,0]=4 16049 B16R0.6603 CCCCCCCCCC(C)OCCCOC 7a_100011218016_100000740836 [0,2,0,0,0,0|2,0,0]=4 16050 B16R0.6603 CCCCCCCCCN(C)CCCCC#N 2230a_100000232482_100000211819 [0,2,0,0,0,0|1,0,1]=4 16051 B16R0.6603 CCCCCCCCCN(C)CCCCC#N 269982a_100000232482_100011219923 [0,2,0,0,0,0|1,0,1]=4 16052 B16R0.6603 CCCCCCCCCN(C)CCCCC=O 2230a_100000232482_100000139335 [0,2,0,0,0,0|0,0,0]=2 16053 B16R0.6603 CCCCCCCCCN(C)CCCCC=O 269982a_100000232482_100000139335 [0,2,0,0,0,0|0,0,0]=2 16054 B16R0.6603 CCCCCCCCCN(C)CCCCCC 2230a_100000232482_100000210314 [0,2,0,0,0,0|1,0,1]=4 16055 B16R0.6603 CCCCCCCCCN(C)CCCCCC 2230a_106256046315_100011214924 [0,2,0,0,0,0|1,0,1]=4 16056 B16R0.6603 CCCCCCCCCN(C)CCCCCC 269982a_100000232482_100000210757 [0,2,0,0,0,0|1,0,1]=4 16057 B16R0.6603 CCCCCCCCCN(C)CCCCCC 269982a_106256046315_100000210670 [0,2,0,0,0,0|1,0,1]=4 16058 B16R0.6603 CCCCCCCCCN(C)CCCCCF 2230a_100000232482_100000729378 [0,2,0,0,0,0|1,0,1]=4 16059 B16R0.6603 CCCCCCCCCN(C)CCCCCF 269982a_100000232482_100000729378 [0,2,0,0,0,0|1,0,1]=4 16060 B16R0.6603 CCCCCCCCCN(C)CCCCCO 2230a_100000232482_100000746330 [0,2,0,0,0,0|0,0,2]=4 16061 B16R0.6603 CCCCCCCCCN(C)CCCCCO 2230a_100000722520_100011214924 [0,2,0,0,0,0|0,0,2]=4 16062 B16R0.6603 CCCCCCCCCN(C)CCCCCO 269982a_100000232482_100000746330 [0,2,0,0,0,0|0,0,2]=4 16063 B16R0.6603 CCCCCCCCCN(C)CCCCCO 269982a_100000722520_100000210670 [0,2,0,0,0,0|0,0,2]=4 16064 B16R0.6603 CCCCCCCCCN(C)CCCCOC 2230a_100000232482_100000730899 [0,2,0,0,0,0|2,0,0]=4 16065 B16R0.6603 CCCCCCCCCN(C)CCCCOC 269982a_100000232482_100000730899 [0,2,0,0,0,0|2,0,0]=4 16066 B16R0.6603 CCCCCCCCNC(C)CCCCCC 2230a_100000210919_100000210759 [0,2,0,0,0,0|1,0,1]=4 16067 B16R0.6603 CCCCCCCCNC(C)CCCCCC 2230a_100000229939_100011215978 [0,2,0,0,0,0|1,0,1]=4 16068 B16R0.6603 CCCCCCCCNC(C)CCCCCC 270004a_100000229939_100000210826 [0,2,0,0,0,0|1,0,1]=4 16069 B16R0.6603 CCCCCCCCNC(C)CCCCCC 34a_100000210919_100000210759 [0,2,0,0,0,0|1,0,1]=4 16070 B16R0.6603 CCCCCCCCNC(C)CCCCCC 34a_100000229939_100011215978 [0,2,0,0,0,0|1,0,1]=4 16071 B16R0.6603 CCCCCCCCOC(C)CCCCCC 34a_100000210232_100011215978 [0,2,0,0,0,0|1,0,1]=4 16072 B16R0.6603 CCCCCCCCOC(C)CCCCCC 34a_100000210265_100000210759 [0,2,0,0,0,0|1,0,1]=4 16073 B16R0.6603 CCCCCCCCOC(C)CCCCCC 7a_100000210232_100011215978 [0,2,0,0,0,0|1,0,1]=4 16074 B16R0.6603 CCCCCCCCOC(C)CCCCCC 7a_100000210265_100000210759 [0,2,0,0,0,0|1,0,1]=4 16075 B16R0.6603 CCCCCCN(C)CCCCCCCCO 2230a_106256046315_100000033203 [0,2,0,0,0,0|0,0,2]=4 16076 B16R0.6603 CCCCCCN(C)CCCCCCCCO 269982a_106256046315_100000033203 [0,2,0,0,0,0|0,0,2]=4 16077 B16R0.6603 CCCCCCOCCC(C)CCCCCC 34a_200011024964_100000210314 [0,2,0,0,0,0|1,0,1]=4 16078 B16R0.6603 CCCCCCOCCC(C)CCCCCC 7a_200011024964_100000210314 [0,2,0,0,0,0|1,0,1]=4 16079 B16R0.6603 CCCCCNC(=O)CSCCCCCC=O 62a_100000139337_100000230301 [0,2,0,0,0,0|1,0,1]=4 16080 B16R0.6603 CCCCCNC(=O)CSCCCCCC=O 62a_100000230301_100000139337 [0,2,0,0,0,0|1,0,1]=4 16081 B16R0.70 C=CC(C)C(=O)CCCCCCCCCCC 1458a_100011216780_100011215454 [0,2,0,0,0,0|1,0,1]=4 16082 B16R0.70 C=CCCCCCCCCCC(=O)C(C)CC 1458a_100011192722_100009814027 [0,2,0,0,0,0|1,0,1]=4 16083 B16R0.70 C=CCCCCCCCCCC(=O)C(O)CC 1458a_100011196387_100009814027 [0,2,0,0,0,0|1,0,1]=4 16084 B16R0.70 C=CCCCCCCCCCN(C)C(C)CC 2230a_100000741768_100009814027 [0,2,0,0,0,0|2,0,0]=4 16085 B16R0.70 C=CCCCCCCCCCN(C)C(C)CC 269982a_100000741768_100009814027 [0,2,0,0,0,0|2,0,0]=4 16086 B16R0.70 C=CCCCCCCCCOC(C)C(C)CC 7a_100011215189_100011933949 [0,2,0,0,0,0|2,0,0]=4 16087 B16R0.70 C=C[C@@H](C)[C@@H](C)OCCCCCCCCCC 34a_100015455354_100000210320 [0,2,0,0,0,0|2,0,0]=4 16088 B16R0.70 C=C[C@@H](C)[C@@H](C)OCCCCCCCCCC 7a_100015455354_100000210320 [0,2,0,0,0,0|2,0,0]=4 16089 B16R0.165 CCC(=O)CCCCCCCCCCC(=O)N 1458a_100000210414_200010167045 [0,2,0,0,0,0|0,0,1]=3 16090 B16R0.165 CCC(C)CCCCCOCCCCC(=O)C 7a_200000035636_100000735457 [0,2,0,0,0,0|1,0,0]=3 16091 B16R0.165 CCC(C)CCCCCOCCCOC(=O)C 7a_200000035636_100000042594 [0,2,0,0,0,0|2,0,0]=4 16092 B16R0.165 CCC(C)CCCCCOCCCSC(=O)C 7a_200000035636_100000038929 [0,2,0,0,0,0|2,0,0]=4 16093 B16R0.165 CCC(C)CCCCCOCCOCC(=O)N 7a_200000035636_100000076697 [0,2,0,0,0,0|2,0,0]=4 16094 B16R0.165 CCC(C)CCCOCCCCCOC(=O)C 7a_100011216074_100000033007 [0,2,0,0,0,0|2,0,0]=4 16095 B16R0.165 CCN(C)CCCCCCCCCCC(=O)N 2230a_100000225621_200010167045 [0,2,0,0,0,0|1,0,0]=3 16096 B16R0.165 CCN(C)CCCCCCCCCCC(=O)N 269982a_100000225621_200010167045 [0,2,0,0,0,0|1,0,0]=3 16097 B16R0.165 COC(=O)CCCCCCCCCCC(=O)C 1458a_100000070787_100009812566 [0,2,0,0,0,0|1,0,1]=4 16098 B16R0.165 COC(=O)CCCCCCCCCCC(=O)C 1458a_100016987261_200000210301 [0,2,0,0,0,0|1,0,1]=4 16099 B16R0.165 COC(=O)CCCCCCCCCCC(=O)[13CH3] 1458a_100016987261_200025704644 [0,2,0,0,0,0|1,0,1]=4 16100 B16R0.165 NC(=O)CCCCCCCCCCC(=O)CO 1458a_100000210174_200010167045 [0,2,0,0,0,0|1,0,1]=4 16101 B16R0.222 C#CC(CC)OCCCCCCCCCC=C 34a_100000758843_100009814027 [0,2,0,0,0,0|2,0,0]=4 16102 B16R0.222 C#CC(CC)OCCCCCCCCCC=C 7a_100000758843_100009814027 [0,2,0,0,0,0|2,0,0]=4 16103 B16R0.222 C=CC(C=C)OCCCCCCCCCCC 34a_100000033096_100011215454 [0,2,0,0,0,0|2,0,0]=4 16104 B16R0.222 C=CC(CC)OCCCCCCCCCCC 34a_100000766422_100011215454 [0,2,0,0,0,0|2,0,0]=4 16105 B16R0.222 C=CC(CC)OCCCCCCCCCCC 7a_100000766422_100011215454 [0,2,0,0,0,0|2,0,0]=4 16106 B16R0.222 C=CCCCCCCCCCCN(CC)CC 2230a_100000724800_100011093070 [0,2,0,0,0,0|2,0,0]=4 16107 B16R0.222 C=CCCCCCCCCCCN(CC)CC 269956a_100000042499_100011093070 [0,2,0,0,0,0|2,0,0]=4 16108 B16R0.222 C=CCCCCCCCCCCN(CC)CC 269982a_100000724800_100011093070 [0,2,0,0,0,0|2,0,0]=4 16109 B16R0.222 C=CCCCCCCCCCNC(CC)CC 2230a_100000199018_100009814027 [0,2,0,0,0,0|2,0,0]=4 16110 B16R0.222 C=CCCCCCCCCCNC(CC)CC 270004a_100000081888_100000210860 [0,2,0,0,0,0|2,0,0]=4 16111 B16R0.222 C=CCCCCCCCCCN[C@@H](CC)CO 2230a_100000709445_100009814027 [0,2,0,0,0,0|2,0,0]=4 16112 B16R0.222 C=CCCCCCCCCCOC(C=C)CC 34a_100000766422_100009814027 [0,2,0,0,0,0|2,0,0]=4 16113 B16R0.222 C=CCCCCCCCCCOC(C=C)CC 7a_100000766422_100009814027 [0,2,0,0,0,0|2,0,0]=4 16114 B16R0.222 C=CCCCCCCCCCOC(CC)CC 7a_100000038209_100000210505 [0,2,0,0,0,0|2,0,0]=4 16115 B16R0.222 C=CCCCCCCCCCOC(CC)CC 7a_100000688536_100009814027 [0,2,0,0,0,0|2,0,0]=4 16116 B16R0.222 C=CCCCCCCCCNCC(CC)CC 2230a_100102946423_100011933949 [0,2,0,0,0,0|2,0,0]=4 16117 B16R0.222 C=CCCCCCCCCOCC(CC)CC 34a_100011215194_100011215472 [0,2,0,0,0,0|2,0,0]=4 16118 B16R0.222 C=CCCCCCCCCOCC(CC)CC 7a_100000703878_100011933949 [0,2,0,0,0,0|2,0,0]=4 16119 B16R0.222 C=CCCCCCCCCOCC(CC)CC 7a_100011215194_100011215472 [0,2,0,0,0,0|2,0,0]=4 16120 B16R0.222 C=CCCCCCCCCOCC(CC)OC 34a_100011934954_100011933949 [0,2,0,0,0,0|2,0,0]=4 16121 B16R0.222 C=CCCCCCCCCOCC(CC)OC 7a_100011934954_100011933949 [0,2,0,0,0,0|2,0,0]=4 16122 B16R0.222 C=C[C@@H](CO)NCCCCCCCCCCC 2230a_100016989147_100011215454 [0,2,0,0,0,0|2,0,0]=4 16123 B16R0.222 C=C[C@@H](CO)NCCCCCCCCCCC 34a_100016989147_100011215454 [0,2,0,0,0,0|2,0,0]=4 16124 B16R0.222 CCCCCCCCCCCNC(C=O)C=O 2230a_200011215754_100000736813 [0,2,0,0,0,0|1,0,0]=3 16125 B16R0.222 CCCCCCCCCCCNC(C=O)C=O 34a_200011215754_100000736813 [0,2,0,0,0,0|1,0,0]=3 16126 B16R0.222 CCCCCCCCCCCOC(C=O)C=O 34a_100000210809_100000736813 [0,2,0,0,0,0|1,0,0]=3 16127 B16R0.222 CCCCCCCCCCCSC(C=O)C=O 62a_100000736813_100011215454 [0,2,0,0,0,0|1,0,0]=3 16128 B16R0.222 CCN(CC)CCCCCCOCCCC=O 7a_100011632896_200011292268 [0,2,0,0,0,0|2,0,0]=4 16129 B16R0.222 CCN(CC)CCCCCNCCCCC=O 2230a_100011491781_100000139335 [0,2,0,0,0,0|2,0,0]=4 16130 B16R0.222 CCN(CC)CCCCCOCCCCC=O 7a_200011629222_100000139335 [0,2,0,0,0,0|2,0,0]=4 16131 B16R0.222 CCN(CC)CCCCNCCCCCC=O 2230a_100000743895_100000139337 [0,2,0,0,0,0|2,0,0]=4 16132 B16R0.222 CCN(CC)CCCCOCCCCCC=O 7a_100011305530_100000139337 [0,2,0,0,0,0|2,0,0]=4 16133 B16R0.222 NCCCCCCCCCCOC(C=O)C=O 34a_100000066964_100000736813 [0,2,0,0,0,0|2,0,0]=4 16134 B16R0.222 O=CC(C=O)NCCCCCCCCCCO 2230a_100000066964_100000736813 [0,2,0,0,0,0|2,0,0]=4 16135 B16R0.222 O=CC(C=O)NCCCCCCCCCCO 34a_100000066964_100000736813 [0,2,0,0,0,0|2,0,0]=4 16136 B16R0.222 O=CC(C=O)OCCCCCCCCCCBr 34a_100009813290_100000736813 [0,2,0,0,0,0|2,0,0]=4 16137 B16R0.222 O=CC(C=O)OCCCCCCCCCCCl 34a_200000033068_100000736813 [0,2,0,0,0,0|2,0,0]=4 16138 B16R0.222 O=CC(C=O)SCCCCCCCCCCO 62a_100000736813_200000033068 [0,2,0,0,0,0|2,0,0]=4 16139 B16R0.222 O=CC(C=O)SCCCCCCCCCCO 62a_100009813290_100000736813 [0,2,0,0,0,0|2,0,0]=4 16140 B16R0.224 C=C(C)C(=O)CCCCCCCCCCCC 1458a_100000185857_100000759014 [0,2,0,0,0,0|1,0,1]=4 16141 B16R0.224 C=C(C)C(C)NCCCCCCCCCCC 269862a_200011215754_100011216138 [0,2,0,0,0,0|2,0,0]=4 16142 B16R0.224 C=CCCCCCCCCCCC(=O)C(C)C 1458a_100000210198_100011093070 [0,2,0,0,0,0|1,0,1]=4 16143 B16R0.224 C=CCCCCCCCCCCC(=O)C(C)F 1458a_100000062450_100011093070 [0,2,0,0,0,0|1,0,1]=4 16144 B16R0.224 C=CCCCCCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100011093070 [0,2,0,0,0,0|1,0,1]=4 16145 B16R0.224 C=CCCCCCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100011093070 [0,2,0,0,0,0|1,0,1]=4 16146 B16R0.224 C=CCCCCCCCCCCN(C)C(C)C 269982a_200000211004_100011093070 [0,2,0,0,0,0|2,0,0]=4 16147 B16R0.224 C=CCCCCCCCCCNC(C)C(C)C 2230a_100000211541_100009814027 [0,2,0,0,0,0|2,0,0]=4 16148 B16R0.224 C=CCCCCCCCCCOC(C)C(C)C 7a_100000748068_100009814027 [0,2,0,0,0,0|2,0,0]=4 16149 B16R0.224 C=CCCCCCCCCNCC(O)C(C)C 2230a_100000759067_100011933949 [0,2,0,0,0,0|2,0,0]=4 16150 B16R0.224 C=CCCCCCCCCNCC(O)C(C)C 34a_100000759067_100011933949 [0,2,0,0,0,0|2,0,0]=4 16151 B16R0.224 C=CCCCCCCCCOC[C@H](N)C(C)C 34a_100011830312_100011933949 [0,2,0,0,0,0|2,0,0]=4 16152 B16R0.224 C=CCCCCCCCOCCC(N)C(C)C 34a_100161115045_100012355270 [0,2,0,0,0,0|2,0,0]=4 16153 B16R0.224 CC(=O)C(C)COCCCCCCCCCO 34a_100000032740_100009813782 [0,2,0,0,0,0|2,0,0]=4 16154 B16R0.224 CC(=O)C(C)COCCCCCCCCCO 7a_100000032740_100009813782 [0,2,0,0,0,0|2,0,0]=4 16155 B16R0.224 CC(=O)C(C)NCCCCCCCCCCO 2230a_100000066964_100009814033 [0,2,0,0,0,0|2,0,0]=4 16156 B16R0.224 CC(=O)C(C)OCCCCCCCCCCBr 7a_100009813290_100000179758 [0,2,0,0,0,0|2,0,0]=4 16157 B16R0.224 CC(=O)C(C)OCCCCCCCCCCCl 7a_200000033068_100000179758 [0,2,0,0,0,0|2,0,0]=4 16158 B16R0.224 CC(=O)C(C)OCCCCCCCCCCO 34a_100000212229_100009813290 [0,2,0,0,0,0|2,0,0]=4 16159 B16R0.224 CC(=O)C(C)SCCCCCCCCCCO 62a_100009813290_100009814033 [0,2,0,0,0,0|2,0,0]=4 16160 B16R0.224 CC(=O)C(C)SCCCCCCCCCCO 62a_100009814033_200000033068 [0,2,0,0,0,0|2,0,0]=4 16161 B16R0.224 CC(CNCCCCCCCCCO)C(=O)O 269956a_100000749485_100009813782 [0,2,0,0,0,0|2,0,0]=4 16162 B16R0.224 CC(NCCCCCCCCCCO)C(=O)N 2230a_100000066964_100000702099 [0,2,0,0,0,0|2,0,0]=4 16163 B16R0.224 CC(NCCCCCCCCCCO)C(=O)N 34a_100000066964_100000702099 [0,2,0,0,0,0|2,0,0]=4 16164 B16R0.224 CC(OCCCCCCCCCCBr)C(=O)N 34a_100009813290_100000702099 [0,2,0,0,0,0|2,0,0]=4 16165 B16R0.224 CC(OCCCCCCCCCCBr)C(=O)N 7a_100009813290_100000702099 [0,2,0,0,0,0|2,0,0]=4 16166 B16R0.224 CC(OCCCCCCCCCCCl)C(=O)N 34a_200000033068_100000702099 [0,2,0,0,0,0|2,0,0]=4 16167 B16R0.224 CC(OCCCCCCCCCCCl)C(=O)N 7a_200000033068_100000702099 [0,2,0,0,0,0|2,0,0]=4 16168 B16R0.224 CC(OCCCCCCCCCCN)C(=O)N 34a_100000066964_100000702099 [0,2,0,0,0,0|2,0,0]=4 16169 B16R0.224 CC(SCCCCCCCCCCO)C(=O)N 62a_100000702099_200000033068 [0,2,0,0,0,0|2,0,0]=4 16170 B16R0.224 CC(SCCCCCCCCCCO)C(=O)N 62a_100009813290_100000702099 [0,2,0,0,0,0|2,0,0]=4 16171 B16R0.224 CCCCCCCCCCCCC(C)C(=O)C 1458a_100000070787_200011217028 [0,2,0,0,0,0|0,0,0]=2 16172 B16R0.224 CCCCCCCCCCCCC(C)N(C)C 2230a_100102631434_200011217028 [0,2,0,0,0,0|2,0,0]=4 16173 B16R0.224 CCCCCCCCCCCCC(C)N(C)C 269982a_100102631434_200011217028 [0,2,0,0,0,0|2,0,0]=4 16174 B16R0.224 CCCCCCCCCCCCC(C)N(C)C 270004a_100102631434_100011219199 [0,2,0,0,0,0|2,0,0]=4 16175 B16R0.224 CCCCCCCCCCCCN(C)C(=O)C 11a_100000227908_100015343762 [0,2,0,0,0,0|1,0,0]=3 16176 B16R0.224 CCCCCCCCCCCCN(C)C(=O)C 1626a_100000227908_100015343762 [0,2,0,0,0,0|1,0,0]=3 16177 B16R0.224 CCCCCCCCCCCCN(C)C(=O)C 240690a_100000227908_100015343762 [0,2,0,0,0,0|1,0,0]=3 16178 B16R0.224 CCCCCCCCCCCCN(C)C(=O)C 527a_100000227908_100103153847 [0,2,0,0,0,0|1,0,0]=3 16179 B16R0.224 CCCCCCCCCCCNC(=O)C(=O)N 240690a_200011215754_100011215815 [0,2,0,0,0,0|1,0,1]=4 16180 B16R0.224 CCCCCCCCCCCNC(C)C(=O)C 2230a_200011215754_100009814033 [0,2,0,0,0,0|1,0,0]=3 16181 B16R0.224 CCCCCCCCCCCNC(C)C(=O)N 2230a_200011215754_100000702099 [0,2,0,0,0,0|1,0,0]=3 16182 B16R0.224 CCCCCCCCCCCNC(C)C(=O)N 34a_200011215754_100000702099 [0,2,0,0,0,0|1,0,0]=3 16183 B16R0.224 CCCCCCCCCCCNC(F)C(=O)N 2230a_200011215754_100009813875 [0,2,0,0,0,0|1,0,0]=3 16184 B16R0.224 CCCCCCCCCCCNC(F)C(=O)N 34a_200011215754_100009813875 [0,2,0,0,0,0|1,0,0]=3 16185 B16R0.224 CCCCCCCCCCCNC(F)C(=O)[O-] 34a_200011215754_100020610796 [0,2,0,0,0,0|1,0,0]=3 16186 B16R0.224 CCCCCCCCCCCN[C@@H](C)C(=O)O 269956a_100000743915_100011215454 [0,2,0,0,0,0|1,0,0]=3 16187 B16R0.224 CCCCCCCCCCCN[C@H](C)C(=O)N 2230a_100000119354_100011215454 [0,2,0,0,0,0|1,0,0]=3 16188 B16R0.224 CCCCCCCCCCCN[C@H](C)C(=O)N 34a_100000119354_100011215454 [0,2,0,0,0,0|1,0,0]=3 16189 B16R0.224 CCCCCCCCCCCOC(C)C(=O)C 34a_100000212229_100011215454 [0,2,0,0,0,0|1,0,0]=3 16190 B16R0.224 CCCCCCCCCCCOC(C)C(=O)C 7a_100000210809_100000179758 [0,2,0,0,0,0|1,0,0]=3 16191 B16R0.224 CCCCCCCCCCCOC(C)C(=O)N 34a_100000210809_100000702099 [0,2,0,0,0,0|1,0,0]=3 16192 B16R0.224 CCCCCCCCCCCOC(C)C(=O)N 7a_100000210809_100000702099 [0,2,0,0,0,0|1,0,0]=3 16193 B16R0.224 CCCCCCCCCCCOC(F)C(=O)N 34a_100000210809_100009813875 [0,2,0,0,0,0|1,0,0]=3 16194 B16R0.224 CCCCCCCCCCCOC(F)C(=O)N 7a_100000210809_100009813875 [0,2,0,0,0,0|1,0,0]=3 16195 B16R0.224 CCCCCCCCCCCOC(F)C(=O)[O-] 34a_100000210809_100020610796 [0,2,0,0,0,0|1,0,0]=3 16196 B16R0.224 CCCCCCCCCCCO[C@@H](C)C(=O)[O-] 7a_217856618621_100011215454 [0,2,0,0,0,0|1,0,0]=3 16197 B16R0.224 CCCCCCCCCCCO[C@H](C)C(=O)N 34a_100000731257_100011215454 [0,2,0,0,0,0|1,0,0]=3 16198 B16R0.224 CCCCCCCCCCCO[C@H](C)C(=O)N 7a_100000731257_100011215454 [0,2,0,0,0,0|1,0,0]=3 16199 B16R0.224 CCCCCCCCCCCSC(C)C(=O)C 62a_100009814033_100011215454 [0,2,0,0,0,0|1,0,0]=3 16200 B16R0.224 CCCCCCCCCCCSC(C)C(=O)N 62a_100000702099_100011215454 [0,2,0,0,0,0|1,0,0]=3 16201 B16R0.224 CCCCCCCCCCCSC(F)C(=O)N 62a_100009813875_100011215454 [0,2,0,0,0,0|1,0,0]=3 16202 B16R0.224 CCCCCCCCCCCSC(F)C(=O)[O-] 62a_100020610796_100011215454 [0,2,0,0,0,0|1,0,0]=3 16203 B16R0.224 CCCCCCCCCCNCC(=O)C(=O)C 34a_100000684558_100011261029 [0,2,0,0,0,0|1,0,1]=4 16204 B16R0.224 CCCCCCCCCCNCC(C)C(=O)O 269956a_100000749485_100000210320 [0,2,0,0,0,0|1,0,0]=3 16205 B16R0.224 CCCCCCCCCCNCC(F)C(=O)O 269956a_100000084737_100000210320 [0,2,0,0,0,0|1,0,0]=3 16206 B16R0.224 CCCCCCCCCCOCC(=O)C(=O)C 34a_100000210711_100011261029 [0,2,0,0,0,0|1,0,1]=4 16207 B16R0.224 CCCCCCCCCCOCC(C)C(=O)C 34a_100000032740_100000210320 [0,2,0,0,0,0|1,0,0]=3 16208 B16R0.224 CCCCCCCCCCOCC(C)C(=O)C 7a_100000032740_100000210320 [0,2,0,0,0,0|1,0,0]=3 16209 B16R0.224 CCCCCCCCCCOCC(C)[N+](=O)[O-] 34a_100000039676_100000210320 [0,2,0,0,0,0|2,0,0]=4 16210 B16R0.224 CCCCCCCCCCOCC(C)[N+](=O)[O-] 7a_100000039676_100000210320 [0,2,0,0,0,0|2,0,0]=4 16211 B16R0.224 CCCCCCCCCCOC[C@H](N)C(=O)N 34a_100000729942_100000210320 [0,2,0,0,0,0|1,0,0]=3 16212 B16R0.224 CCCCCCCCCCSCC(=O)C(=O)C 62a_100011261029_100000210320 [0,2,0,0,0,0|1,0,1]=4 16213 B16R0.224 C[C@@H](NCCCCCCCCCCO)C(=O)N 2230a_100000119354_100009813290 [0,2,0,0,0,0|2,0,0]=4 16214 B16R0.224 C[C@@H](NCCCCCCCCCCO)C(=O)N 34a_100000119354_100009813290 [0,2,0,0,0,0|2,0,0]=4 16215 B16R0.224 C[C@@H](OCCCCCCCCCCO)C(=O)N 34a_100000731257_100009813290 [0,2,0,0,0,0|2,0,0]=4 16216 B16R0.224 C[C@@H](OCCCCCCCCCCO)C(=O)N 7a_100000731257_100009813290 [0,2,0,0,0,0|2,0,0]=4 16217 B16R0.224 C[C@H](NCCCCCCCCCCO)C(=O)O 269956a_100000743915_100009813290 [0,2,0,0,0,0|2,0,0]=4 16218 B16R0.224 C[C@H](OCCCCCCCCCCO)C(=O)[O-] 7a_217856618621_100009813290 [0,2,0,0,0,0|2,0,0]=4 16219 B16R0.224 NC(=O)C(F)NCCCCCCCCCCO 2230a_100000066964_100009813875 [0,2,0,0,0,0|2,0,0]=4 16220 B16R0.224 NC(=O)C(F)NCCCCCCCCCCO 34a_100000066964_100009813875 [0,2,0,0,0,0|2,0,0]=4 16221 B16R0.224 NC(=O)C(F)OCCCCCCCCCCBr 34a_100009813290_100009813875 [0,2,0,0,0,0|2,0,0]=4 16222 B16R0.224 NC(=O)C(F)OCCCCCCCCCCBr 7a_100009813290_100009813875 [0,2,0,0,0,0|2,0,0]=4 16223 B16R0.224 NC(=O)C(F)OCCCCCCCCCCCl 34a_200000033068_100009813875 [0,2,0,0,0,0|2,0,0]=4 16224 B16R0.224 NC(=O)C(F)OCCCCCCCCCCCl 7a_200000033068_100009813875 [0,2,0,0,0,0|2,0,0]=4 16225 B16R0.224 NC(=O)C(F)SCCCCCCCCCCO 62a_100009813290_100009813875 [0,2,0,0,0,0|2,0,0]=4 16226 B16R0.224 NC(=O)C(F)SCCCCCCCCCCO 62a_100009813875_200000033068 [0,2,0,0,0,0|2,0,0]=4 16227 B16R0.224 NC(=O)[C@@H](N)COCCCCCCCCCO 34a_100000729942_100009813782 [0,2,0,0,0,0|2,0,0]=4 16228 B16R0.224 NCCCCCCCCCCOC(F)C(=O)N 34a_100000066964_100009813875 [0,2,0,0,0,0|2,0,0]=4 16229 B16R0.224 NCCCCCCCCCCOC(F)C(=O)[O-] 34a_100000066964_100020610796 [0,2,0,0,0,0|2,0,0]=4 16230 B16R0.224 O=C(O)C(F)CNCCCCCCCCCO 269956a_100000084737_100009813782 [0,2,0,0,0,0|2,0,0]=4 16231 B16R0.224 O=C([O-])C(F)NCCCCCCCCCCO 34a_100000066964_100020610796 [0,2,0,0,0,0|2,0,0]=4 16232 B16R0.224 O=C([O-])C(F)OCCCCCCCCCCBr 34a_100009813290_100020610796 [0,2,0,0,0,0|2,0,0]=4 16233 B16R0.224 O=C([O-])C(F)OCCCCCCCCCCCl 34a_200000033068_100020610796 [0,2,0,0,0,0|2,0,0]=4 16234 B16R0.224 O=C([O-])C(F)SCCCCCCCCCCO 62a_100009813290_100020610796 [0,2,0,0,0,0|2,0,0]=4 16235 B16R0.224 O=C([O-])C(F)SCCCCCCCCCCO 62a_100020610796_200000033068 [0,2,0,0,0,0|2,0,0]=4 16236 B16R0.1182 C=CC(C)CC(=O)CCCCCCCCCC 1458a_100011934298_100000210319 [0,2,0,0,0,0|1,0,1]=4 16237 B16R0.1182 C=CC(O)CN(C)CCCCCCCCCC 2230a_100000207566_100000730141 [0,2,0,0,0,0|2,0,0]=4 16238 B16R0.1182 C=CCCCCCCCCC(=O)CC(C)CC 1458a_100000211349_100000748023 [0,2,0,0,0,0|1,0,1]=4 16239 B16R0.1182 C=CCCCCCCCCC(=O)CC(C)CC 1458a_100000708755_100011933949 [0,2,0,0,0,0|1,0,1]=4 16240 B16R0.1182 C=CCCCCCCCCC(=O)CC(O)CC 1458a_100000211349_100011218378 [0,2,0,0,0,0|1,0,1]=4 16241 B16R0.1182 C=CCCCCCCCCC(=O)CC(O)CC 1458a_100011667805_100011933949 [0,2,0,0,0,0|1,0,1]=4 16242 B16R0.1182 C=CCCCCCCCCC(=O)C[C@@H](C)CC 1458a_100000211349_100009816398 [0,2,0,0,0,0|1,0,1]=4 16243 B16R0.1182 C=CCCCCCCCCN(C)CC(C)CC 2230a_100000753921_100011933949 [0,2,0,0,0,0|2,0,0]=4 16244 B16R0.1182 C=CCCCCCCCCN(C)CC(C)CC 269982a_100000753921_100011933949 [0,2,0,0,0,0|2,0,0]=4 16245 B16R0.1182 C=CCCCCCCCNC(C)CC(C)CC 2230a_100000763565_100012355270 [0,2,0,0,0,0|2,0,0]=4 16246 B16R0.1817 C=CC(O)COCC(C)CCCCCCCC 34a_200012125181_100000730141 [0,2,0,0,0,0|2,0,0]=4 16247 B16R0.1817 C=CC(O)COCC(C)CCCCCCCC 7a_200012125181_100000730141 [0,2,0,0,0,0|2,0,0]=4 16248 B16R0.3292 C=CC(C)(C)OCCCCCCCCCCC 34a_100011215311_100011215454 [0,2,0,0,0,0|2,0,0]=4 16249 B16R0.3292 C=CC(C)(C)OCCCCCCCCCCC 7a_100011215311_100011215454 [0,2,0,0,0,0|2,0,0]=4 16250 B16R0.3292 C=CCCCCCCCCCNC(C)(C)CC 2230a_100000211385_100009814027 [0,2,0,0,0,0|2,0,0]=4 16251 B16R0.3292 C=CCCCCCCCCCOC(C)(C)CC 7a_100000038209_100000210677 [0,2,0,0,0,0|2,0,0]=4 16252 B16R0.3292 C=CCCCCCCCCCOC(C)(C)CC 7a_100000210230_100009814027 [0,2,0,0,0,0|2,0,0]=4 16253 B16R0.3292 C=CCCCCCCCCOCC(C)(C)CC 7a_100000765029_100011933949 [0,2,0,0,0,0|2,0,0]=4 16254 B16R0.6606 C=CC(O)COC(C)CCCCCCCCC 34a_100011218016_100000730141 [0,2,0,0,0,0|2,0,0]=4 16255 B16R0.6606 C=CC(O)COC(C)CCCCCCCCC 7a_100011218016_100000730141 [0,2,0,0,0,0|2,0,0]=4 16256 B16R0.6606 C=CCCCCCCCC(=O)CCC(C)CC 1458a_100000701222_100012355270 [0,2,0,0,0,0|1,0,1]=4 16257 B16R0.6606 C=CCCCCCCOC(C)CCC(C)CC 7a_200011216552_100011215473 [0,2,0,0,0,0|2,0,0]=4 16258 B16R0.114 C=CCCCCCC(=O)CCCCCC(C)C 1458a_100000766313_100000700193 [0,2,0,0,0,0|1,0,1]=4 16259 B16R0.114 C=CCCCCCC(=O)CCCCCC(C)C 1458a_100011934241_100000210682 [0,2,0,0,0,0|1,0,1]=4 16260 B16R0.114 CCCCCCCC(=O)CCCCCC(=O)N 1458a_100000211969_100009817443 [0,2,0,0,0,0|0,0,1]=3 16261 B16R0.114 CCCCCCCC(=O)CCCCC[N+](=O)[O-] 1458a_100000043470_100000210614 [0,2,0,0,0,0|1,0,1]=4 16262 B16R0.114 CCCCCCCC(=O)CCCCOC(=O)C 1458a_100000211969_100000033659 [0,2,0,0,0,0|1,0,1]=4 16263 B16R0.114 CCCCCCCC(=O)CCCCSC(=O)C 1458a_100000211969_200010402107 [0,2,0,0,0,0|1,0,1]=4 16264 B16R0.114 CCCCCCCC(=O)NCCCCC(=O)N 11a_100000696515_100000211969 [0,2,0,0,0,0|1,0,1]=4 16265 B16R0.114 CCCCCCCC(=O)NCCCCC(=O)N 1626a_100000696515_100000211969 [0,2,0,0,0,0|1,0,1]=4 16266 B16R0.114 CCCCCCCC(=O)NCCCCC(=O)N 240690a_100000696515_100000211969 [0,2,0,0,0,0|1,0,1]=4 16267 B16R0.114 CCCCCCCC(=O)NCCCCC(=O)N 527a_100000696515_100000211969 [0,2,0,0,0,0|1,0,1]=4 16268 B16R0.114 CCCCCCCC(C)NCCCCC(=O)N 270004a_100000696515_100000210596 [0,2,0,0,0,0|1,0,0]=3 16269 B16R0.114 CCCCCCCC(C)NCCCCC(=O)N 34a_100000696515_200011218727 [0,2,0,0,0,0|1,0,0]=3 16270 B16R0.114 CCCCCCCC(C)NCCCNC(=O)C 270004a_100000736810_100000210596 [0,2,0,0,0,0|2,0,0]=4 16271 B16R0.114 CCCCCCCC(C)NCCCNC(=O)C 34a_100000736810_200011218727 [0,2,0,0,0,0|2,0,0]=4 16272 B16R0.114 CCCCCCCC(C)NCCOCC(=O)O 269956a_100000700818_200011218727 [0,2,0,0,0,0|2,0,0]=4 16273 B16R0.114 CCCCCCCC(C)OCCCCC(=O)C 34a_200011215852_100009817362 [0,2,0,0,0,0|1,0,0]=3 16274 B16R0.114 CCCCCCCC(C)OCCCCC(=O)C 7a_200011215852_100000735457 [0,2,0,0,0,0|1,0,0]=3 16275 B16R0.114 CCCCCCCC(C)OCCCCC(=O)N 34a_100012022536_200011218727 [0,2,0,0,0,0|1,0,0]=3 16276 B16R0.114 CCCCCCCC(C)OCCCCC(=O)N 7a_100012022536_200011218727 [0,2,0,0,0,0|1,0,0]=3 16277 B16R0.114 CCCCCCCC(C)OCCCC[N+](=O)[O-] 34a_200015379883_200011218727 [0,2,0,0,0,0|2,0,0]=4 16278 B16R0.114 CCCCCCCC(C)OCCCC[N+](=O)[O-] 7a_200015379883_200011218727 [0,2,0,0,0,0|2,0,0]=4 16279 B16R0.114 CCCCCCCC(C)OCCCNC(=O)C 34a_100000752032_200011218727 [0,2,0,0,0,0|2,0,0]=4 16280 B16R0.114 CCCCCCCC(C)OCCCOC(=O)C 34a_200011215852_100000042594 [0,2,0,0,0,0|2,0,0]=4 16281 B16R0.114 CCCCCCCC(C)OCCCOC(=O)C 7a_200011215852_100000042594 [0,2,0,0,0,0|2,0,0]=4 16282 B16R0.114 CCCCCCCC(C)OCCCSC(=O)C 34a_200011215852_100000038929 [0,2,0,0,0,0|2,0,0]=4 16283 B16R0.114 CCCCCCCC(C)OCCCSC(=O)C 7a_200011215852_100000038929 [0,2,0,0,0,0|2,0,0]=4 16284 B16R0.114 CCCCCCCC(C)OCCOCC(=O)N 34a_200011215852_100000076697 [0,2,0,0,0,0|2,0,0]=4 16285 B16R0.114 CCCCCCCC(C)OCCOCC(=O)N 7a_200011215852_100000076697 [0,2,0,0,0,0|2,0,0]=4 16286 B16R0.114 CCCCCCCC(C)SCCCCC(=O)C 62a_100000735457_200011218727 [0,2,0,0,0,0|1,0,0]=3 16287 B16R0.114 CCCCCCCC(C)SCCCCC(=O)C 62a_200011218727_100000735457 [0,2,0,0,0,0|1,0,0]=3 16288 B16R0.114 CCCCCCCC(C)SCCCOC(=O)C 62a_100000042594_200011218727 [0,2,0,0,0,0|2,0,0]=4 16289 B16R0.114 CCCCCCCC(C)SCCCOC(=O)C 62a_200011218727_100000042594 [0,2,0,0,0,0|2,0,0]=4 16290 B16R0.114 CCCCCCCC(C)SCCCSC(=O)C 62a_100000038929_200011218727 [0,2,0,0,0,0|2,0,0]=4 16291 B16R0.114 CCCCCCCC(C)SCCCSC(=O)C 62a_200011218727_100000038929 [0,2,0,0,0,0|2,0,0]=4 16292 B16R0.114 CCCCCCCC(C)SCCOCC(=O)N 62a_100000076697_200011218727 [0,2,0,0,0,0|2,0,0]=4 16293 B16R0.114 CCCCCCCC(C)SCCOCC(=O)N 62a_200011218727_100000076697 [0,2,0,0,0,0|2,0,0]=4 16294 B16R0.114 CCCCCCCN(C)CCCCCC(=O)N 2230a_100000228206_100009817443 [0,2,0,0,0,0|1,0,0]=3 16295 B16R0.114 CCCCCCCN(C)CCCCCC(=O)N 269982a_100000228206_100009817443 [0,2,0,0,0,0|1,0,0]=3 16296 B16R0.114 CCCCCCCN(C)CCCCOC(=O)C 269982a_100000228206_100000033659 [0,2,0,0,0,0|2,0,0]=4 16297 B16R0.114 CCCCCCCN(C)CCCCSC(=O)C 2230a_100000228206_200010402107 [0,2,0,0,0,0|2,0,0]=4 16298 B16R0.114 CCCCCCCN(C)CCCCSC(=O)C 269982a_100000228206_200010402107 [0,2,0,0,0,0|2,0,0]=4 16299 B16R0.114 COCCCCCC(=O)CCCCCC(=O)N 1458a_100011935119_100009817443 [0,2,0,0,0,0|1,0,1]=4 16300 B16R0.114 NC(=O)CCCCCC(=O)CCCCCCO 1458a_100011996774_100009817443 [0,2,0,0,0,0|1,0,1]=4 16301 B16R0.583 C=CCCCCC(=O)C(C)CCCCCCC 1458a_100011215552_200011218727 [0,2,0,0,0,0|1,0,1]=4 16302 B16R0.583 C=CCCCCCC(=O)C(C)CCCCCC 1458a_100011934241_100011215978 [0,2,0,0,0,0|1,0,1]=4 16303 B16R0.583 C=CCCCCCC(=O)C(O)CCCCCC 1458a_100011215828_100000700193 [0,2,0,0,0,0|1,0,1]=4 16304 B16R0.583 C=CCCCCN(C)C(C)CCCCCCC 2230a_100012000471_200011218727 [0,2,0,0,0,0|2,0,0]=4 16305 B16R0.583 C=CCCCCN(C)C(C)CCCCCCC 269982a_100012000471_200011218727 [0,2,0,0,0,0|2,0,0]=4 16306 B16R0.583 C=CCCCCN(C)C(C)CCCCCCC 270004a_100012000471_100000210596 [0,2,0,0,0,0|2,0,0]=4 16307 B16R0.789 C=CCCCCCC(=O)CCC(C)CCCC 1458a_100000033779_100000700193 [0,2,0,0,0,0|1,0,1]=4 16308 B16R0.1530 C=CC(CCCCCCC)OCCCCC=O 7a_200011934235_100000139335 [0,2,0,0,0,0|1,0,0]=3 16309 B16R0.1530 C=CCCCCCN(CC)CCCCCCC 2230a_100000228213_100000700193 [0,2,0,0,0,0|2,0,0]=4 16310 B16R0.1530 C=CCCCCCN(CC)CCCCCCC 269982a_100000228213_100000700193 [0,2,0,0,0,0|2,0,0]=4 16311 B16R0.1530 C=CCCCCNC(CC)CCCCCCC 270004a_100000703577_200011217162 [0,2,0,0,0,0|2,0,0]=4 16312 B16R0.1530 C=CCCCCOC(C=C)CCCCCCC 34a_200011934235_100011215482 [0,2,0,0,0,0|2,0,0]=4 16313 B16R0.1530 C=CCCCCOC(C=C)CCCCCCC 7a_200011934235_100011215482 [0,2,0,0,0,0|2,0,0]=4 16314 B16R0.1530 C=CCCCCOC(CC)CCCCCCC 34a_200011217053_100011215482 [0,2,0,0,0,0|2,0,0]=4 16315 B16R0.1530 C=CCCCCOC(CC)CCCCCCC 7a_200011217053_100011215482 [0,2,0,0,0,0|2,0,0]=4 16316 B16R0.1530 CCCCCCCC(CC)OCCCCC=O 7a_200011217053_100000139335 [0,2,0,0,0,0|1,0,0]=3 16317 B16R0.1530 CCCCCCCC(CCCCCCC)NC 270004a_106832991635_100000210598 [0,2,0,0,0,0|1,0,1]=4 16318 B16R0.1530 CCCCCCCC(CCCCCCC)OC 34a_100005940281_200000210301 [0,2,0,0,0,0|1,0,1]=4 16319 B16R0.1530 CCCCCCCC(CCCCCCC)OC 7a_100005940281_200000210301 [0,2,0,0,0,0|1,0,1]=4 16320 B16R0.1530 CCCCCCCC(CCCCCCC)O[13CH3] 34a_100005940281_200025704644 [0,2,0,0,0,0|1,0,1]=4 16321 B16R0.1530 CCCCCCCC(CCCCCCC)O[13CH3] 7a_100005940281_200025704644 [0,2,0,0,0,0|1,0,1]=4 16322 B16R0.1530 CCCCCCCN(CC)CCCCCC=O 2230a_100000228213_100000139337 [0,2,0,0,0,0|1,0,0]=3 16323 B16R0.1530 CCCCCCCN(CC)CCCCCC=O 269982a_100000228213_100000139337 [0,2,0,0,0,0|1,0,0]=3 16324 B16R0.5002 C=CCCCCNC(C)(C)CCCCCCC 34a_100000703577_200000046972 [0,2,0,0,0,0|2,0,0]=4 16325 B16R0.5002 C=CCCCCOC(C)(C)CCCCCCC 34a_100000766645_200000046972 [0,2,0,0,0,0|2,0,0]=4 16326 B16R0.5002 C=CCCCCOC(C)(C)CCCCCCC 7a_100000766645_200000046972 [0,2,0,0,0,0|2,0,0]=4 16327 B16R0.5002 CCCCCCCC(C)(C)SCCCCC=O 62a_100000139335_200000046972 [0,2,0,0,0,0|1,0,0]=3 16328 B16R0.5002 CCCCCCCC(C)(C)SCCCCC=O 62a_200000046972_100000139335 [0,2,0,0,0,0|1,0,0]=3 16329 B16R0.5998 C=CCCCC(=O)CC(O)CCCCCCC 1458a_200011667753_100000757094 [0,2,0,0,0,0|1,0,1]=4 16330 B16R0.177 C=CCCCCC(=O)CCCCCCC(C)C 1458a_100000040743_100011215482 [0,2,0,0,0,0|1,0,1]=4 16331 B16R0.177 CCCCCCC(=O)CCCCCNC(=O)C 1458a_100000183861_100000210757 [0,2,0,0,0,0|1,0,1]=4 16332 B16R0.177 CCCCCCC(=O)CCCCCOC(=O)C 1458a_100102632555_100000033007 [0,2,0,0,0,0|1,0,1]=4 16333 B16R0.177 CCCCCCC(C)CCOCCCC(=O)C 34a_200011024964_100000685027 [0,2,0,0,0,0|1,0,0]=3 16334 B16R0.177 CCCCCCC(C)CCOCCCC(=O)C 7a_200011024964_100011215641 [0,2,0,0,0,0|1,0,0]=3 16335 B16R0.177 CCCCCCC(C)CCOCCCC(=O)N 34a_200011024964_100102525003 [0,2,0,0,0,0|1,0,0]=3 16336 B16R0.177 CCCCCCC(C)CCOCCCC(=O)N 7a_200011024964_100102525003 [0,2,0,0,0,0|1,0,0]=3 16337 B16R0.177 CCCCCCC(C)CCOCCNC(=O)C 7a_200011024964_100000189650 [0,2,0,0,0,0|2,0,0]=4 16338 B16R0.177 CCCCCCC(C)CCOCCNC(=O)N 7a_200011024964_200000034859 [0,2,0,0,0,0|2,0,0]=4 16339 B16R0.177 CCCCCCC(C)CCOCCOC(=O)C 34a_200011024964_100009814007 [0,2,0,0,0,0|2,0,0]=4 16340 B16R0.177 CCCCCCC(C)CCOCCOC(=O)C 7a_200011024964_100009814007 [0,2,0,0,0,0|2,0,0]=4 16341 B16R0.177 CCCCCCC(C)CCOCCOC(=O)N 34a_200011024964_200011214921 [0,2,0,0,0,0|2,0,0]=4 16342 B16R0.177 CCCCCCC(C)CCOCCOC(=O)N 7a_200011024964_200011214921 [0,2,0,0,0,0|2,0,0]=4 16343 B16R0.177 CCCCCCC(C)NCCCCCC(=O)N 2230a_100000210919_100009817443 [0,2,0,0,0,0|1,0,0]=3 16344 B16R0.177 CCCCCCC(C)NCCCCCC(=O)N 34a_100000210919_100009817443 [0,2,0,0,0,0|1,0,0]=3 16345 B16R0.177 CCCCCCC(C)NCCCCNC(=O)C 2230a_200011368371_100011215978 [0,2,0,0,0,0|2,0,0]=4 16346 B16R0.177 CCCCCCC(C)NCCCCNC(=O)C 270004a_200011368371_100000210826 [0,2,0,0,0,0|2,0,0]=4 16347 B16R0.177 CCCCCCC(C)NCCCCNC(=O)C 34a_200011368371_100011215978 [0,2,0,0,0,0|2,0,0]=4 16348 B16R0.177 CCCCCCC(C)NCCCCOC(=O)C 34a_100000210919_100000033659 [0,2,0,0,0,0|2,0,0]=4 16349 B16R0.177 CCCCCCC(C)NCCCCSC(=O)C 2230a_100000210919_200010402107 [0,2,0,0,0,0|2,0,0]=4 16350 B16R0.177 CCCCCCC(C)NCCCCSC(=O)C 34a_100000210919_200010402107 [0,2,0,0,0,0|2,0,0]=4 16351 B16R0.177 CCCCCCC(C)OCCCCCC(=O)N 34a_100000123541_100011215978 [0,2,0,0,0,0|1,0,0]=3 16352 B16R0.177 CCCCCCC(C)OCCCCCC(=O)N 34a_100000210265_100009817443 [0,2,0,0,0,0|1,0,0]=3 16353 B16R0.177 CCCCCCC(C)OCCCCCC(=O)N 7a_100000123541_100011215978 [0,2,0,0,0,0|1,0,0]=3 16354 B16R0.177 CCCCCCC(C)OCCCCCC(=O)N 7a_100000210265_100009817443 [0,2,0,0,0,0|1,0,0]=3 16355 B16R0.177 CCCCCCC(C)OCCCCCC(=O)[O-] 7a_100102619762_100011215978 [0,2,0,0,0,0|1,0,0]=3 16356 B16R0.177 CCCCCCC(C)OCCCCOC(=O)C 34a_100000073216_100011215978 [0,2,0,0,0,0|2,0,0]=4 16357 B16R0.177 CCCCCCC(C)OCCCCOC(=O)C 34a_100000210265_100000033659 [0,2,0,0,0,0|2,0,0]=4 16358 B16R0.177 CCCCCCC(C)OCCCCOC(=O)C 7a_100000073216_100011215978 [0,2,0,0,0,0|2,0,0]=4 16359 B16R0.177 CCCCCCC(C)OCCCCOC(=O)C 7a_100000210265_100000033659 [0,2,0,0,0,0|2,0,0]=4 16360 B16R0.177 CCCCCCC(C)OCCCCSC(=O)C 34a_100000210265_200010402107 [0,2,0,0,0,0|2,0,0]=4 16361 B16R0.177 CCCCCCC(C)OCCCCSC(=O)C 7a_100000210265_200010402107 [0,2,0,0,0,0|2,0,0]=4 16362 B16R0.177 CCCCCCC(C)SCCCCCC(=O)N 62a_100009817443_100011215978 [0,2,0,0,0,0|1,0,0]=3 16363 B16R0.177 CCCCCCC(C)SCCCCCC(=O)N 62a_100011215978_100009817443 [0,2,0,0,0,0|1,0,0]=3 16364 B16R0.177 CCCCCCC(C)SCCCCOC(=O)C 62a_100000033659_100011215978 [0,2,0,0,0,0|2,0,0]=4 16365 B16R0.177 CCCCCCC(C)SCCCCOC(=O)C 62a_100011215978_100000033659 [0,2,0,0,0,0|2,0,0]=4 16366 B16R0.177 CCCCCCC(C)SCCCCSC(=O)C 62a_100011215978_200010402107 [0,2,0,0,0,0|2,0,0]=4 16367 B16R0.177 CCCCCCC(C)SCCCCSC(=O)C 62a_200010402107_100011215978 [0,2,0,0,0,0|2,0,0]=4 16368 B16R0.177 CCCCCCN(C)CCCCCOC(=O)C 2230a_106256046315_100009813381 [0,2,0,0,0,0|2,0,0]=4 16369 B16R0.177 CCCCCCN(C)CCCCCOC(=O)C 269982a_106256046315_100000033007 [0,2,0,0,0,0|2,0,0]=4 16370 B16R0.177 CCCCOCC(C)OCCCCCC(=O)N 34a_100011217071_100009817443 [0,2,0,0,0,0|2,0,0]=4 16371 B16R0.177 CCCCOCC(C)OCCCCCC(=O)N 7a_100011217071_100009817443 [0,2,0,0,0,0|2,0,0]=4 16372 B16R0.1095 C=CCCCCC(=O)CCC(C)CCCCC 1458a_100000034243_100011215482 [0,2,0,0,0,0|1,0,1]=4 16373 B16R0.1714 C=CCCCCCOC(C)(C)CCCCCC 7a_200011995690_100000700193 [0,2,0,0,0,0|2,0,0]=4 16374 B16R0.1714 CC(C)(CCCCCBr)OCCCCCC=O 7a_100010402123_100000139337 [0,2,0,0,0,0|2,0,0]=4 16375 B16R0.1714 CCCCCCC(C)(C)OCCCCCC=O 7a_200011995690_100000139337 [0,2,0,0,0,0|1,0,0]=3 16376 B16R0.1820 C=C(C)CCOCC(C)CCCCCCCC 34a_200012125181_100000730704 [0,2,0,0,0,0|2,0,0]=4 16377 B16R0.1820 C=C(C)CCOCC(C)CCCCCCCC 7a_200012125181_100000730704 [0,2,0,0,0,0|2,0,0]=4 16378 B16R0.1820 C=CCCCCCCC(=O)CCCCC(C)C 1458a_100011809334_100011216152 [0,2,0,0,0,0|1,0,1]=4 16379 B16R0.1820 C=CCCCCCCC(=O)CCCCC(C)C 1458a_100011933920_100011215473 [0,2,0,0,0,0|1,0,1]=4 16380 B16R0.1820 CC(=O)CCCCC(=O)CCCCCCCO 1458a_100011219782_100000735457 [0,2,0,0,0,0|1,0,1]=4 16381 B16R0.1820 CCCCCCCCC(=O)CCCCC(=O)C 1458a_100000210188_100000735457 [0,2,0,0,0,0|0,0,1]=3 16382 B16R0.1820 CCCCCCCCC(=O)CCCNC(=O)C 1458a_100000194741_100000210759 [0,2,0,0,0,0|1,0,1]=4 16383 B16R0.1820 CCCCCCCCC(=O)CCCOC(=O)C 1458a_100000210188_100000042594 [0,2,0,0,0,0|1,0,1]=4 16384 B16R0.1820 CCCCCCCCC(=O)CCCSC(=O)C 1458a_100000210188_100000038929 [0,2,0,0,0,0|1,0,1]=4 16385 B16R0.1820 CCCCCCCCC(=O)CCOCC(=O)N 1458a_100000210188_100000076697 [0,2,0,0,0,0|1,0,1]=4 16386 B16R0.1820 CCCCCCCCC(=O)CCSCC(=O)N 1458a_100000148550_100000210759 [0,2,0,0,0,0|1,0,1]=4 16387 B16R0.1820 CCCCCCCCC(=O)NCCCC(=O)N 240690a_100000739312_100000210188 [0,2,0,0,0,0|1,0,1]=4 16388 B16R0.1820 CCCCCCCCC(=O)NCCCC(=O)N 527a_100000739312_100000210188 [0,2,0,0,0,0|1,0,1]=4 16389 B16R0.1820 CCCCCCCCC(C)COCCC(=O)C 7a_200012125181_100000053229 [0,2,0,0,0,0|1,0,0]=3 16390 B16R0.1820 CCCCCCCCC(C)COCCC(=O)N 34a_200012125181_100000731001 [0,2,0,0,0,0|1,0,0]=3 16391 B16R0.1820 CCCCCCCCC(C)COCCC(=O)N 7a_200012125181_100000744528 [0,2,0,0,0,0|1,0,0]=3 16392 B16R0.1820 CCCCCCCCC(C)COCOC(=O)C 34a_200012125181_100009813279 [0,2,0,0,0,0|2,0,0]=4 16393 B16R0.1820 CCCCCCCCC(C)NCCCS(=O)C 270004a_200000753449_100011216694 [0,2,0,0,0,0|2,0,0]=4 16394 B16R0.1820 CCCCCCCCC(C)OCCCC(=O)C 34a_100000210740_100000685027 [0,2,0,0,0,0|1,0,0]=3 16395 B16R0.1820 CCCCCCCCC(C)OCCCC(=O)C 7a_100000210740_100011215641 [0,2,0,0,0,0|1,0,0]=3 16396 B16R0.1820 CCCCCCCCC(C)OCCCC(=O)N 34a_100000210740_100102525003 [0,2,0,0,0,0|1,0,0]=3 16397 B16R0.1820 CCCCCCCCC(C)OCCCC(=O)N 7a_100000210740_100102525003 [0,2,0,0,0,0|1,0,0]=3 16398 B16R0.1820 CCCCCCCCC(C)OCCNC(=O)C 7a_100000210740_100000189650 [0,2,0,0,0,0|2,0,0]=4 16399 B16R0.1820 CCCCCCCCC(C)OCCNC(=O)N 7a_100000210740_200000034859 [0,2,0,0,0,0|2,0,0]=4 16400 B16R0.1820 CCCCCCCCC(C)OCCOC(=O)C 34a_100000210740_100009814007 [0,2,0,0,0,0|2,0,0]=4 16401 B16R0.1820 CCCCCCCCC(C)OCCOC(=O)C 7a_100000210740_100009814007 [0,2,0,0,0,0|2,0,0]=4 16402 B16R0.1820 CCCCCCCCC(C)OCCOC(=O)N 34a_100000210740_200011214921 [0,2,0,0,0,0|2,0,0]=4 16403 B16R0.1820 CCCCCCCCC(C)OCCOC(=O)N 7a_100000210740_200011214921 [0,2,0,0,0,0|2,0,0]=4 16404 B16R0.1820 CCCCCCCCN(C)CCCCC(=O)C 269982a_100000207567_100000735457 [0,2,0,0,0,0|1,0,0]=3 16405 B16R0.1820 CCCCCCCCN(C)CCCOC(=O)C 269982a_100000207567_100000042594 [0,2,0,0,0,0|2,0,0]=4 16406 B16R0.1820 CCCCCCCCN(C)CCCSC(=O)C 2230a_100000207567_100000038929 [0,2,0,0,0,0|2,0,0]=4 16407 B16R0.1820 CCCCCCCCN(C)CCCSC(=O)C 269982a_100000207567_100000038929 [0,2,0,0,0,0|2,0,0]=4 16408 B16R0.1820 CCCCCCCCN(C)CCOCC(=O)N 2230a_100000207567_100000076697 [0,2,0,0,0,0|2,0,0]=4 16409 B16R0.1820 CCCCCCCCN(C)CCOCC(=O)N 269982a_100000207567_100000076697 [0,2,0,0,0,0|2,0,0]=4 16410 B16R0.3207 C=CCCN(C)CC(C)CCCCCCCC 270004a_100020639649_100011995885 [0,2,0,0,0,0|2,0,0]=4 16411 B16R0.4696 C=CCCCC(=O)C(O)CCCCCCCC 1458a_200011995895_100000757094 [0,2,0,0,0,0|1,0,1]=4 16412 B16R0.4696 C=CCCCCCCC(=O)C(C)CCCCC 1458a_100011215998_100011215473 [0,2,0,0,0,0|1,0,1]=4 16413 B16R0.4696 C=CCCCCCCC(=O)C(C)CCCCC 1458a_100011809334_200011218191 [0,2,0,0,0,0|1,0,1]=4 16414 B16R0.6401 C#CC(CCCCCBr)OCCCCCC=O 7a_200010408556_100000139337 [0,2,0,0,0,0|2,0,0]=4 16415 B16R0.6401 C=CC(CCCCCC)OCCCCCC=O 7a_200011215977_100000139337 [0,2,0,0,0,0|1,0,0]=3 16416 B16R0.6401 C=CCCCCCOC(C=C)CCCCCC 34a_200011215977_100000700193 [0,2,0,0,0,0|2,0,0]=4 16417 B16R0.6401 C=CCCCCCOC(C=C)CCCCCC 7a_200011215977_100000700193 [0,2,0,0,0,0|2,0,0]=4 16418 B16R0.6401 C=CCCCCCOC(CC)CCCCCC 34a_100011215785_100000700193 [0,2,0,0,0,0|2,0,0]=4 16419 B16R0.6401 C=CCCCCCOC(CC)CCCCCC 7a_100011215785_100000700193 [0,2,0,0,0,0|2,0,0]=4 16420 B16R0.6401 C=CCCCNC(CC)CCCCCCCC 270004a_100000700776_200011217995 [0,2,0,0,0,0|2,0,0]=4 16421 B16R0.6401 C=CCCCOC(CC)CCCCCCCC 34a_200011216270_100000757094 [0,2,0,0,0,0|2,0,0]=4 16422 B16R0.6401 C=CCCCOC(CC)CCCCCCCC 7a_200011216270_100000757094 [0,2,0,0,0,0|2,0,0]=4 16423 B16R0.6401 CCCCCCC(CC)OCCCCCC=O 7a_100011215785_100000139337 [0,2,0,0,0,0|1,0,0]=3 16424 B16R0.6401 CCCCCCCCC(CC)OCCCC=O 7a_200011216270_200011292268 [0,2,0,0,0,0|1,0,0]=3 16425 B16R0.6401 CCCCCCCCC(CCCCCC)NC 270004a_106832991635_200011290866 [0,2,0,0,0,0|1,0,1]=4 16426 B16R0.6401 CCCCCCCCC(CCCCCC)OC 34a_100005940298_200000210301 [0,2,0,0,0,0|1,0,1]=4 16427 B16R0.6401 CCCCCCCCC(CCCCCC)OC 7a_100005940298_200000210301 [0,2,0,0,0,0|1,0,1]=4 16428 B16R0.6401 CCCCCCCCC(CCCCCC)O[13CH3] 34a_100005940298_200025704644 [0,2,0,0,0,0|1,0,1]=4 16429 B16R0.6401 CCCCCCCCC(CCCCCC)O[13CH3] 7a_100005940298_200025704644 [0,2,0,0,0,0|1,0,1]=4 16430 B16R0.41 CCCC(C)CCCOCCCCCC(=O)N 34a_100011713154_100009817443 [0,2,0,0,0,0|1,0,0]=3 16431 B16R0.41 CCCC(C)CCCOCCCCCC(=O)N 7a_100011713154_100009817443 [0,2,0,0,0,0|1,0,0]=3 16432 B16R0.41 CCCC(C)CCCOCCCCOC(=O)C 34a_100011713154_100000033659 [0,2,0,0,0,0|2,0,0]=4 16433 B16R0.41 CCCC(C)CCCOCCCCOC(=O)C 7a_100011713154_100000033659 [0,2,0,0,0,0|2,0,0]=4 16434 B16R0.41 CCCC(C)CCCOCCCCSC(=O)C 34a_100011713154_200010402107 [0,2,0,0,0,0|2,0,0]=4 16435 B16R0.41 CCCC(C)CCCOCCCCSC(=O)C 7a_100011713154_200010402107 [0,2,0,0,0,0|2,0,0]=4 16436 B16R0.41 CCCC(C)CCOCCCCCOC(=O)C 34a_100011217855_100000033007 [0,2,0,0,0,0|2,0,0]=4 16437 B16R0.41 CCCC(C)CCOCCCCCOC(=O)C 7a_100011217855_100000033007 [0,2,0,0,0,0|2,0,0]=4 16438 B16R0.41 CCCC(C)CNCCCCCCNC(=O)C 2230a_200011996284_100011216630 [0,2,0,0,0,0|2,0,0]=4 16439 B16R0.41 CCCC(C)CNCCCCCCNC(=O)C 270004a_200011996284_100000243154 [0,2,0,0,0,0|2,0,0]=4 16440 B16R0.41 CCCC(C)CNCCCCCCNC(=O)C 34a_200011996284_100011216630 [0,2,0,0,0,0|2,0,0]=4 16441 B16R0.41 CCCC(C)CNCCCCCCSC(=O)C 270004a_100000704104_100000243154 [0,2,0,0,0,0|2,0,0]=4 16442 B16R0.41 CCC[C@H](N)CCOCCCCCOC(=O)C 34a_100015193777_100000033007 [0,2,0,0,0,0|2,0,0]=4 16443 B16R0.41 CCOC(=O)CCCCCCCCCC(=O)C 1458a_100000070787_100009828014 [0,2,0,0,0,0|1,0,1]=4 16444 B16R0.131 CCCCC(C)CCCCOCCCC(=O)C 34a_200011021034_100000685027 [0,2,0,0,0,0|1,0,0]=3 16445 B16R0.131 CCCCC(C)CCCCOCCCC(=O)C 7a_200011021034_100011215641 [0,2,0,0,0,0|1,0,0]=3 16446 B16R0.131 CCCCC(C)CCCCOCCCC(=O)N 34a_200011021034_100102525003 [0,2,0,0,0,0|1,0,0]=3 16447 B16R0.131 CCCCC(C)CCCCOCCCC(=O)N 7a_200011021034_100102525003 [0,2,0,0,0,0|1,0,0]=3 16448 B16R0.131 CCCCC(C)CCCCOCCNC(=O)C 7a_200011021034_100000189650 [0,2,0,0,0,0|2,0,0]=4 16449 B16R0.131 CCCCC(C)CCCCOCCNC(=O)N 7a_200011021034_200000034859 [0,2,0,0,0,0|2,0,0]=4 16450 B16R0.131 CCCCC(C)CCCCOCCOC(=O)C 34a_200011021034_100009814007 [0,2,0,0,0,0|2,0,0]=4 16451 B16R0.131 CCCCC(C)CCCCOCCOC(=O)C 7a_200011021034_100009814007 [0,2,0,0,0,0|2,0,0]=4 16452 B16R0.131 CCCCC(C)CCCCOCCOC(=O)N 34a_200011021034_200011214921 [0,2,0,0,0,0|2,0,0]=4 16453 B16R0.131 CCCCC(C)CCCCOCCOC(=O)N 7a_200011021034_200011214921 [0,2,0,0,0,0|2,0,0]=4 16454 B16R0.131 CCCCC(C)COCCCCCOC(=O)C 34a_100011995851_100000033007 [0,2,0,0,0,0|2,0,0]=4 16455 B16R0.131 CCCCC(C)COCCCCCOC(=O)C 7a_100011995851_100000033007 [0,2,0,0,0,0|2,0,0]=4 16456 B16R0.131 CCCCC(C)NCCCCCCNC(=O)C 2230a_200011996284_200011215066 [0,2,0,0,0,0|2,0,0]=4 16457 B16R0.131 CCCCC(C)NCCCCCCNC(=O)C 270004a_200011996284_100000210087 [0,2,0,0,0,0|2,0,0]=4 16458 B16R0.131 CCCCC(C)NCCCCCCNC(=O)C 34a_200011996284_200011215066 [0,2,0,0,0,0|2,0,0]=4 16459 B16R0.131 CCCCC(C)NCCCCCCSC(=O)C 270004a_100000704104_100000210087 [0,2,0,0,0,0|2,0,0]=4 16460 B16R0.131 CCCC[C@H](N)COCCCCCOC(=O)C 34a_100011934283_100000033007 [0,2,0,0,0,0|2,0,0]=4 16461 B16R0.297 C=C(C)CCOC(C)CCCCCCCCC 34a_100011218016_100000730704 [0,2,0,0,0,0|2,0,0]=4 16462 B16R0.297 C=C(C)CCOC(C)CCCCCCCCC 7a_100011218016_100000730704 [0,2,0,0,0,0|2,0,0]=4 16463 B16R0.297 C=CCCCCCCCC(=O)CCCC(C)C 1458a_100011216160_100011214892 [0,2,0,0,0,0|1,0,1]=4 16464 B16R0.297 C=CCCCCCCCC(=O)CCCC(C)C 1458a_100011216857_100012355270 [0,2,0,0,0,0|1,0,1]=4 16465 B16R0.297 C=CCCCCCCCC(=O)CCCC(C)O 1458a_100011216160_200000718107 [0,2,0,0,0,0|1,0,1]=4 16466 B16R0.297 C=CCCCCCCNC(C)CCCC(C)C 2230a_100000210607_100011215473 [0,2,0,0,0,0|2,0,0]=4 16467 B16R0.297 C=CCCCCCCOC(C)CCCC(C)C 34a_200011218570_100011215473 [0,2,0,0,0,0|2,0,0]=4 16468 B16R0.297 C=CCCCCCCOC(C)CCCC(C)C 7a_200011218570_100011215473 [0,2,0,0,0,0|2,0,0]=4 16469 B16R0.297 C=CCCCCNCCC(C)CCCC(C)C 2230a_100000703577_100009816328 [0,2,0,0,0,0|2,0,0]=4 16470 B16R0.297 C=CCCCCNCCC(C)CCCC(C)C 2230a_102516457229_100011215482 [0,2,0,0,0,0|2,0,0]=4 16471 B16R0.297 C=CCCCCNCCC(C)CCCC(C)C 34a_100000703577_100009816328 [0,2,0,0,0,0|2,0,0]=4 16472 B16R0.297 C=CCCCCOCCC(C)CCCC(C)C 34a_100000015991_100011215482 [0,2,0,0,0,0|2,0,0]=4 16473 B16R0.297 C=CCCCCOCCC(C)CCCC(C)C 34a_100000766645_100009816328 [0,2,0,0,0,0|2,0,0]=4 16474 B16R0.297 C=CCCCCOCCC(C)CCCC(C)C 7a_100000015991_100011215482 [0,2,0,0,0,0|2,0,0]=4 16475 B16R0.297 C=CCCCCOCCC(C)CCCC(C)C 7a_100000766645_100009816328 [0,2,0,0,0,0|2,0,0]=4 16476 B16R0.297 C=CCCCCSCCC(C)CCCC(C)C 62a_100009816328_100011215482 [0,2,0,0,0,0|2,0,0]=4 16477 B16R0.297 C=CCCCCSCCC(C)CCCC(C)C 62a_100011215482_100009816328 [0,2,0,0,0,0|2,0,0]=4 16478 B16R0.297 CC(C)CCCC(C)CCNCCCCC=O 2230a_102516457229_100000139335 [0,2,0,0,0,0|1,0,0]=3 16479 B16R0.297 CC(C)CCCC(C)CCOCCCCC=O 7a_100000015991_100000139335 [0,2,0,0,0,0|1,0,0]=3 16480 B16R0.297 CC(C)CCCC(C)CCSCCCCC=O 62a_100000139335_100009816328 [0,2,0,0,0,0|1,0,0]=3 16481 B16R0.297 CC(C)CCCC(C)CCSCCCCC=O 62a_100009816328_100000139335 [0,2,0,0,0,0|1,0,0]=3 16482 B16R0.297 CC(CCCC(=O)[O-])OCCCCCCCO 7a_100000761597_100000760002 [0,2,0,0,0,0|2,0,0]=4 16483 B16R0.297 CCCCCCCCCC(=O)CCCC(=O)C 1458a_100000210558_100011215641 [0,2,0,0,0,0|0,0,1]=3 16484 B16R0.297 CCCCCCCCCC(=O)CCCC(=O)N 1458a_100000210558_100102525003 [0,2,0,0,0,0|0,0,1]=3 16485 B16R0.297 CCCCCCCCCC(=O)CCC[N+](=O)[O-] 1458a_100016109205_100000210670 [0,2,0,0,0,0|1,0,1]=4 16486 B16R0.297 CCCCCCCCCC(=O)CCNC(=O)C 1458a_100000183196_100000210670 [0,2,0,0,0,0|1,0,1]=4 16487 B16R0.297 CCCCCCCCCC(=O)CCNC(=O)C 1458a_100000210558_100000189650 [0,2,0,0,0,0|1,0,1]=4 16488 B16R0.297 CCCCCCCCCC(=O)CCNC(=O)N 1458a_100000181464_100000210670 [0,2,0,0,0,0|1,0,1]=4 16489 B16R0.297 CCCCCCCCCC(=O)CCNC(=O)N 1458a_100000210558_200000034859 [0,2,0,0,0,0|1,0,1]=4 16490 B16R0.297 CCCCCCCCCC(=O)CCOC(=O)C 1458a_100000210558_100009814007 [0,2,0,0,0,0|1,0,1]=4 16491 B16R0.297 CCCCCCCCCC(=O)CCOC(=O)N 1458a_100000210558_200011214921 [0,2,0,0,0,0|1,0,1]=4 16492 B16R0.297 CCCCCCCCCC(=O)CCSC(=O)C 1458a_100000048949_100000210670 [0,2,0,0,0,0|1,0,1]=4 16493 B16R0.297 CCCCCCCCCC(=O)COCC(=O)N 1458a_100011219004_100000210670 [0,2,0,0,0,0|1,0,1]=4 16494 B16R0.297 CCCCCCCCCC(=O)NCCC(=O)N 11a_100000740010_100000210558 [0,2,0,0,0,0|1,0,1]=4 16495 B16R0.297 CCCCCCCCCC(=O)NCCC(=O)N 240690a_100000740010_100000210558 [0,2,0,0,0,0|1,0,1]=4 16496 B16R0.297 CCCCCCCCCC(=O)NCCC(=O)N 527a_100000740010_100000210558 [0,2,0,0,0,0|1,0,1]=4 16497 B16R0.297 CCCCCCCCCC(C)OCCC(=O)C 7a_100011218016_100000053229 [0,2,0,0,0,0|1,0,0]=3 16498 B16R0.297 CCCCCCCCCC(C)OCCC(=O)N 34a_100011218016_100000731001 [0,2,0,0,0,0|1,0,0]=3 16499 B16R0.297 CCCCCCCCCC(C)OCCC(=O)N 7a_100011218016_100000744528 [0,2,0,0,0,0|1,0,0]=3 16500 B16R0.297 CCCCCCCCCC(C)OCOC(=O)C 34a_100011218016_100009813279 [0,2,0,0,0,0|2,0,0]=4 16501 B16R0.297 CCCCCCCCCN(C)CCCC(=O)C 269982a_100000232482_100011215641 [0,2,0,0,0,0|1,0,0]=3 16502 B16R0.297 CCCCCCCCCN(C)CCCC(=O)N 269982a_100000232482_100102525003 [0,2,0,0,0,0|1,0,0]=3 16503 B16R0.297 CCCCCCCCCN(C)CCCC(=O)O 269956a_100000719178_100000210670 [0,2,0,0,0,0|1,0,0]=3 16504 B16R0.297 CCCCCCCCCN(C)CCNC(=O)C 2230a_100000232482_100000189650 [0,2,0,0,0,0|2,0,0]=4 16505 B16R0.297 CCCCCCCCCN(C)CCNC(=O)C 269982a_100000232482_100000189650 [0,2,0,0,0,0|2,0,0]=4 16506 B16R0.297 CCCCCCCCCN(C)CCNC(=O)N 2230a_100000232482_200000034859 [0,2,0,0,0,0|2,0,0]=4 16507 B16R0.297 CCCCCCCCCN(C)CCNC(=O)N 269982a_100000232482_200000034859 [0,2,0,0,0,0|2,0,0]=4 16508 B16R0.297 CCCCCCCCCN(C)CCOC(=O)C 269982a_100000232482_100009814007 [0,2,0,0,0,0|2,0,0]=4 16509 B16R0.297 CCCCCCCCCN(C)CCOC(=O)N 269982a_100000232482_200011214921 [0,2,0,0,0,0|2,0,0]=4 16510 B16R0.297 CCCCCCCCOC(C)CCCC(=O)[O-] 7a_100000761597_100000210759 [0,2,0,0,0,0|1,0,0]=3 16511 B16R0.297 CN(CCCCCCCCO)CCCC(=O)O 269956a_100000719178_100000033203 [0,2,0,0,0,0|2,0,0]=4 16512 B16R0.297 COCCCCCCOC(C)CCCC(=O)[O-] 7a_100000761597_100011998445 [0,2,0,0,0,0|2,0,0]=4 16513 B16R0.302 C=C(C)CC(=O)CCCCCCCCCCC 1458a_100000210736_100000748629 [0,2,0,0,0,0|1,0,1]=4 16514 B16R0.302 C=C(C)CN(C)CCCCCCCCCCC 2230a_100000225649_100011215454 [0,2,0,0,0,0|2,0,0]=4 16515 B16R0.302 C=C(C)CN(C)CCCCCCCCCCC 269982a_100000225649_100011215454 [0,2,0,0,0,0|2,0,0]=4 16516 B16R0.302 C=C(F)CC(=O)CCCCCCCCCCC 1458a_100000210736_100009893438 [0,2,0,0,0,0|1,0,1]=4 16517 B16R0.302 C=CCCCCCCCCCC(=O)CC(C)C 1458a_100000210554_100009814027 [0,2,0,0,0,0|1,0,1]=4 16518 B16R0.302 C=CCCCCCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100009814027 [0,2,0,0,0,0|1,0,1]=4 16519 B16R0.302 C=CCCCCCCCCCN(C)CC(C)C 2230a_100000747067_100009814027 [0,2,0,0,0,0|2,0,0]=4 16520 B16R0.302 C=CCCCCCCCCCN(C)CC(C)C 269982a_100000747067_100009814027 [0,2,0,0,0,0|2,0,0]=4 16521 B16R0.302 C=CCCCCCCCCCN(C)CC(C)O 2230a_100000227577_100009814027 [0,2,0,0,0,0|2,0,0]=4 16522 B16R0.302 C=CCCCCCCCCCN(C)CC(C)O 269982a_100000227577_100009814027 [0,2,0,0,0,0|2,0,0]=4 16523 B16R0.302 C=CCCCCCCCCNC(C)CC(C)C 2230a_100000692259_100011933949 [0,2,0,0,0,0|2,0,0]=4 16524 B16R0.302 C=CCCCCCCCCOC(C)CC(C)C 34a_100000211805_100011933949 [0,2,0,0,0,0|2,0,0]=4 16525 B16R0.302 C=CCCCCCCCCOC(C)CC(C)C 34a_100011215194_100000731052 [0,2,0,0,0,0|2,0,0]=4 16526 B16R0.302 C=CCCCCCCCCOC(C)CC(C)C 7a_100000211805_100011933949 [0,2,0,0,0,0|2,0,0]=4 16527 B16R0.302 C=CCCCCCCCCOC(C)CC(C)C 7a_100011215194_100000731052 [0,2,0,0,0,0|2,0,0]=4 16528 B16R0.302 C=CCCCCCCCOC[C@@H](N)CC(C)C 34a_100011830311_100012355270 [0,2,0,0,0,0|2,0,0]=4 16529 B16R0.302 C=CCCCCCCOCC[C@@H](N)CC(C)C 34a_100161151251_100011215473 [0,2,0,0,0,0|2,0,0]=4 16530 B16R0.302 CCCCCCCCCCCC(=O)CC(=O)N 1458a_100000210736_100000187820 [0,2,0,0,0,0|0,0,1]=3 16531 B16R0.302 CCCCCCCCCCCC(=O)CC(=O)N 1458a_100134613110_100011215454 [0,2,0,0,0,0|0,0,1]=3 16532 B16R0.302 CCCCCCCCCCCC(=O)CC(=O)[O-] 1458a_100000210736_100020667443 [0,2,0,0,0,0|0,0,1]=3 16533 B16R0.302 CCCCCCCCCCCC(=O)C[N+](=O)[O-] 1458a_100000210736_100000761209 [0,2,0,0,0,0|1,0,1]=4 16534 B16R0.302 CCCCCCCCCCCN(C)CC(=O)N 2230a_100000739694_100011215454 [0,2,0,0,0,0|1,0,0]=3 16535 B16R0.302 CCCCCCCCCCCN(C)CC(=O)O 269956a_100000746989_100011215454 [0,2,0,0,0,0|1,0,0]=3 16536 B16R0.302 CCCCCCCCCCNC(=O)CC(=O)N 240690a_100000684558_100134613110 [0,2,0,0,0,0|1,0,1]=4 16537 B16R0.302 CCCCCCCCCCNC(=O)CC(=O)N 527a_100000684558_100134613110 [0,2,0,0,0,0|1,0,1]=4 16538 B16R0.302 CCCCCCCCCCOC(=O)CC(=O)C 1458a_100000070787_100000210668 [0,2,0,0,0,0|1,0,1]=4 16539 B16R0.302 CCCCCCCCCCSC(C)OC(=O)C 62a_100009818208_100000210320 [0,2,0,0,0,0|2,0,0]=4 16540 B16R0.302 CCCCCCCCCNCC(O)CC(=O)O 269956a_100011218706_100000210670 [0,2,0,0,0,0|1,0,0]=3 16541 B16R0.302 CN(CCCCCCCCCCO)CC(=O)N 2230a_100000739694_100009813290 [0,2,0,0,0,0|2,0,0]=4 16542 B16R0.302 CN(CCCCCCCCCCO)CC(=O)O 269956a_100000746989_100009813290 [0,2,0,0,0,0|2,0,0]=4 16543 B16R0.302 NC(=O)CC(=O)CCCCCCCCCCO 1458a_100134613110_100009813290 [0,2,0,0,0,0|1,0,1]=4 16544 B16R0.302 O=C(O)CC(O)CNCCCCCCCCO 269956a_100011218706_100000033203 [0,2,0,0,0,0|2,0,0]=4 16545 B16R0.1188 C=CCCCCCCCCCCNC(C)(C)C 2230a_100000715429_100011093070 [0,2,0,0,0,0|2,0,0]=4 16546 B16R0.1188 C=CCCCCCCCCCCOC(C)(C)C 34a_100015890283_100011093070 [0,2,0,0,0,0|2,0,0]=4 16547 B16R0.1188 C=CCCCCCCCCCCOC(C)(C)C 7a_100015890283_100011093070 [0,2,0,0,0,0|2,0,0]=4 16548 B16R0.1188 C=CCCCCCCCCCNCC(C)(C)C 2230a_100000743828_100009814027 [0,2,0,0,0,0|2,0,0]=4 16549 B16R0.1188 C=CCCCCCCCCCNCC(C)(C)C 270004a_100000081888_100011204126 [0,2,0,0,0,0|2,0,0]=4 16550 B16R0.1188 C=CCCCCCCCCCNCC(C)(C)C 34a_100000081888_100011219605 [0,2,0,0,0,0|2,0,0]=4 16551 B16R0.1188 C=CCCCCCCCCCNCC(C)(C)F 2230a_100020643315_100009814027 [0,2,0,0,0,0|2,0,0]=4 16552 B16R0.1188 C=CCCCCCCCCCNCC(C)(C)F 34a_100000081888_100011997219 [0,2,0,0,0,0|2,0,0]=4 16553 B16R0.1188 C=CCCCCCCCCCNCC(C)(C)O 2230a_100000751335_100009814027 [0,2,0,0,0,0|2,0,0]=4 16554 B16R0.1188 C=CCCCCCCCCCNCC(C)(C)O 34a_100000081888_100000764493 [0,2,0,0,0,0|2,0,0]=4 16555 B16R0.1188 C=CCCCCCCCCCOCC(C)(C)C 34a_100000038209_100011219605 [0,2,0,0,0,0|2,0,0]=4 16556 B16R0.1188 C=CCCCCCCCCCOCC(C)(C)F 34a_100000038209_100011997219 [0,2,0,0,0,0|2,0,0]=4 16557 B16R0.1188 C=CCCCCCCCCCOCC(C)(C)F 34a_100000716592_100009814027 [0,2,0,0,0,0|2,0,0]=4 16558 B16R0.1188 C=CCCCCCCCCCOCC(C)(C)O 34a_100000038209_100000764493 [0,2,0,0,0,0|2,0,0]=4 16559 B16R0.1188 C=CCCCCCCCCCOCC(C)(C)O 7a_100000038209_100000764493 [0,2,0,0,0,0|2,0,0]=4 16560 B16R0.1188 C=CCCCCCCCCCOCC(C)(F)F 34a_100000068830_100009814027 [0,2,0,0,0,0|2,0,0]=4 16561 B16R0.1188 C=CCCCCCCCCCSCC(C)(C)F 62a_100009814027_100011997219 [0,2,0,0,0,0|2,0,0]=4 16562 B16R0.1188 C=CCCCCCCCCCSCC(C)(C)F 62a_100011997219_100009814027 [0,2,0,0,0,0|2,0,0]=4 16563 B16R0.1188 C=CCCCCCCCCCSCC(C)(C)O 62a_100000764493_100009814027 [0,2,0,0,0,0|2,0,0]=4 16564 B16R0.1188 C=CCCCCCCCCCSCC(C)(C)O 62a_100009814027_100000764493 [0,2,0,0,0,0|2,0,0]=4 16565 B16R0.1188 C=CCCCCCCCCNCCC(C)(C)C 2230a_100000738805_100011933949 [0,2,0,0,0,0|2,0,0]=4 16566 B16R0.1188 C=CCCCCCCCCNCCC(C)(C)F 2230a_100016253952_100011933949 [0,2,0,0,0,0|2,0,0]=4 16567 B16R0.1188 C=CCCCCCCCCOCCC(C)(C)C 34a_100011215194_100000755188 [0,2,0,0,0,0|2,0,0]=4 16568 B16R0.1188 C=CCCCCCCCCOCCC(C)(C)C 7a_100000765024_100011933949 [0,2,0,0,0,0|2,0,0]=4 16569 B16R0.1188 C=CCCCCCCCCOCCC(C)(C)C 7a_100011215194_100000755188 [0,2,0,0,0,0|2,0,0]=4 16570 B16R0.1188 C=CCCCCCCCCOCCC(C)(C)O 34a_100011215194_100000702414 [0,2,0,0,0,0|2,0,0]=4 16571 B16R0.1188 C=CCCCCCCCCOCCC(C)(C)O 7a_100011215194_100000702414 [0,2,0,0,0,0|2,0,0]=4 16572 B16R0.1188 C=CCCCCCCCCSCCC(C)(C)O 62a_100000702414_100011933949 [0,2,0,0,0,0|2,0,0]=4 16573 B16R0.1188 C=CCCCCCCCCSCCC(C)(C)O 62a_100011933949_100000702414 [0,2,0,0,0,0|2,0,0]=4 16574 B16R0.1188 C=CCCCCCCCOCCCC(C)(C)O 34a_100000730831_100009888830 [0,2,0,0,0,0|2,0,0]=4 16575 B16R0.1188 C=CCCCCCCCOCCCC(C)(C)O 7a_100000730831_100009888830 [0,2,0,0,0,0|2,0,0]=4 16576 B16R0.1188 C=CCCCCCCCSCCCC(C)(C)O 62a_100009888830_100012355270 [0,2,0,0,0,0|2,0,0]=4 16577 B16R0.1188 C=CCCCCCCCSCCCC(C)(C)O 62a_100012355270_100009888830 [0,2,0,0,0,0|2,0,0]=4 16578 B16R0.1188 C=CCCCCCOCCCCCC(C)(C)O 34a_100011216702_100010402123 [0,2,0,0,0,0|2,0,0]=4 16579 B16R0.1188 C=CCCCCCOCCCCCC(C)(C)O 7a_100011216702_100010402123 [0,2,0,0,0,0|2,0,0]=4 16580 B16R0.1188 C=CCCCCCSCCCCCC(C)(C)O 62a_100000700193_100010402123 [0,2,0,0,0,0|2,0,0]=4 16581 B16R0.1188 C=CCCCCCSCCCCCC(C)(C)O 62a_100010402123_100000700193 [0,2,0,0,0,0|2,0,0]=4 16582 B16R0.1188 CC(C)(O)CCCCCSCCCCCC=O 62a_100000139337_100010402123 [0,2,0,0,0,0|1,0,0]=3 16583 B16R0.1188 CC(C)(O)CCCCCSCCCCCC=O 62a_100010402123_100000139337 [0,2,0,0,0,0|1,0,0]=3 16584 B16R0.1188 CCCCCCCCCCCCNS(=O)(=O)C 40a_100000210451_100000738038 [0,2,0,0,0,0|2,0,0]=4 16585 B16R0.1188 CCCCCCCCCCCNCS(=O)(=O)[O-] 34a_200011215754_100009817235 [0,2,0,0,0,0|2,0,0]=4 16586 B16R0.1188 CCCCCCCCCCCOCS(=O)(=O)[O-] 34a_100000210809_100009817235 [0,2,0,0,0,0|2,0,0]=4 16587 B16R0.1188 CCCCCCCCCCCSCS(=O)(=O)N 62a_100000741382_100011215454 [0,2,0,0,0,0|2,0,0]=4 16588 B16R0.1188 CCCCCCCCCCCSCS(=O)(=O)[O-] 62a_100009817235_100011215454 [0,2,0,0,0,0|2,0,0]=4 16589 B16R0.1188 CCCCCCCCCCNCCS(=O)(=O)C 2230a_100000684558_100000731031 [0,2,0,0,0,0|2,0,0]=4 16590 B16R0.1188 CCCCCCCCCCNCCS(=O)(=O)C 2230a_100000740961_100000210320 [0,2,0,0,0,0|2,0,0]=4 16591 B16R0.1188 CCCCCCCCCCNCCS(=O)(=O)C 34a_100000684558_100000731031 [0,2,0,0,0,0|2,0,0]=4 16592 B16R0.1188 CCCCCCCCCCNCCS(=O)(=O)C 34a_100000740961_100000210320 [0,2,0,0,0,0|2,0,0]=4 16593 B16R0.1188 CCCCCCCCCCNCCS(=O)(=O)N 2230a_100000738205_100000210320 [0,2,0,0,0,0|2,0,0]=4 16594 B16R0.1188 CCCCCCCCCCNCCS(=O)(=O)N 34a_100000738205_100000210320 [0,2,0,0,0,0|2,0,0]=4 16595 B16R0.1188 CCCCCCCCCCNCCS(=O)(=O)[O-] 2230a_100000684558_100000737633 [0,2,0,0,0,0|2,0,0]=4 16596 B16R0.1188 CCCCCCCCCCNCCS(=O)(=O)[O-] 34a_100000684558_100000762736 [0,2,0,0,0,0|2,0,0]=4 16597 B16R0.1188 CCCCCCCCCCOCCS(=O)(=O)C 34a_100000210711_100000731031 [0,2,0,0,0,0|2,0,0]=4 16598 B16R0.1188 CCCCCCCCCCOCCS(=O)(=O)C 34a_100000211924_100000210320 [0,2,0,0,0,0|2,0,0]=4 16599 B16R0.1188 CCCCCCCCCCOCCS(=O)(=O)C 7a_100000210711_100000230027 [0,2,0,0,0,0|2,0,0]=4 16600 B16R0.1188 CCCCCCCCCCOCCS(=O)(=O)C 7a_100000211924_100000210320 [0,2,0,0,0,0|2,0,0]=4 16601 B16R0.1188 CCCCCCCCCCOCCS(=O)(=O)N 34a_100012334274_100000210320 [0,2,0,0,0,0|2,0,0]=4 16602 B16R0.1188 CCCCCCCCCCOCCS(=O)(=O)[O-] 34a_100000210711_100000762736 [0,2,0,0,0,0|2,0,0]=4 16603 B16R0.1188 CCCCCCCCCCSCCS(=O)(=O)C 62a_100000731031_100000210320 [0,2,0,0,0,0|2,0,0]=4 16604 B16R0.1188 CCCCCCCCCCSCCS(=O)(=O)[O-] 62a_100000762736_100000210320 [0,2,0,0,0,0|2,0,0]=4 16605 B16R0.1188 CCCCCCCCCNCCCS(=O)(=O)C 2230a_100000212291_100000754308 [0,2,0,0,0,0|2,0,0]=4 16606 B16R0.1188 CCCCCCCCCNCCCS(=O)(=O)C 2230a_100000742409_100011214924 [0,2,0,0,0,0|2,0,0]=4 16607 B16R0.1188 CCCCCCCCCNCCCS(=O)(=O)C 34a_100000212291_100000754308 [0,2,0,0,0,0|2,0,0]=4 16608 B16R0.1188 CCCCCCCCCNCCCS(=O)(=O)C 34a_100000742409_100011214924 [0,2,0,0,0,0|2,0,0]=4 16609 B16R0.1188 CCCCCCCCCNCCCS(=O)(=O)N 2230a_100000212291_100000750626 [0,2,0,0,0,0|2,0,0]=4 16610 B16R0.1188 CCCCCCCCCNCCCS(=O)(=O)N 34a_100000212291_100000750626 [0,2,0,0,0,0|2,0,0]=4 16611 B16R0.1188 CCCCCCCCCNCCCS(=O)(=O)[O-] 34a_100000212291_100009813499 [0,2,0,0,0,0|2,0,0]=4 16612 B16R0.1188 CCCCCCCCCOCCCS(=O)(=O)C 34a_100000210712_100000754308 [0,2,0,0,0,0|2,0,0]=4 16613 B16R0.1188 CCCCCCCCCOCCCS(=O)(=O)C 34a_100000689940_100011214924 [0,2,0,0,0,0|2,0,0]=4 16614 B16R0.1188 CCCCCCCCCOCCCS(=O)(=O)C 7a_100000210712_100000754308 [0,2,0,0,0,0|2,0,0]=4 16615 B16R0.1188 CCCCCCCCCOCCCS(=O)(=O)C 7a_100000689940_100000210328 [0,2,0,0,0,0|2,0,0]=4 16616 B16R0.1188 CCCCCCCCCOCCCS(=O)(=O)N 34a_100000210712_100000750626 [0,2,0,0,0,0|2,0,0]=4 16617 B16R0.1188 CCCCCCCCCOCCCS(=O)(=O)N 7a_100000210712_100000750626 [0,2,0,0,0,0|2,0,0]=4 16618 B16R0.1188 CCCCCCCCCOCCCS(=O)(=O)[O-] 34a_100000210712_100009813499 [0,2,0,0,0,0|2,0,0]=4 16619 B16R0.1188 CCCCCCCCCSCCCS(=O)(=O)C 62a_100000754308_100000210670 [0,2,0,0,0,0|2,0,0]=4 16620 B16R0.1188 CCCCCCCCCSCCCS(=O)(=O)N 62a_100000750626_100000210670 [0,2,0,0,0,0|2,0,0]=4 16621 B16R0.1188 CCCCCCCCCSCCCS(=O)(=O)[O-] 62a_100009813499_100000210670 [0,2,0,0,0,0|2,0,0]=4 16622 B16R0.1188 C[N+](C)(C)CCCCCCSCCCCC=O 62a_100000139335_100009996864 [0,2,0,0,0,0|2,0,0]=4 16623 B16R0.1188 C[N+](C)(C)CCCCCCSCCCCC=O 62a_100009996864_100000139335 [0,2,0,0,0,0|2,0,0]=4 16624 B16R0.1188 C[N+](C)(C)CCCCCSCCCCCC=O 62a_100000139337_100009813293 [0,2,0,0,0,0|2,0,0]=4 16625 B16R0.1188 C[N+](C)(C)CCCCCSCCCCCC=O 62a_100009813293_100000139337 [0,2,0,0,0,0|2,0,0]=4 16626 B16R0.1188 O=CCCCCCSCCCCCC(F)(F)F 62a_100000139337_100010187589 [0,2,0,0,0,0|2,0,0]=4 16627 B16R0.1188 O=CCCCCCSCCCCCC(F)(F)F 62a_100010187589_100000139337 [0,2,0,0,0,0|2,0,0]=4 16628 B16R0.1188 O=CCSCCCCCCCCCC(F)(F)F 62a_200015260668_200041927475 [0,2,0,0,0,0|2,0,0]=4 16629 B16R0.1188 O=CCSCCCCCCCCCC(F)(F)F 62a_200041927475_200015260668 [0,2,0,0,0,0|2,0,0]=4 16630 B16R0.1469 CCCCCC(=O)COCCCCCC(=O)N 34a_100000123541_200012276598 [0,2,0,0,0,0|1,0,1]=4 16631 B16R0.1469 CCCCCC(=O)COCCCCCC(=O)N 7a_100000123541_200012276598 [0,2,0,0,0,0|1,0,1]=4 16632 B16R0.1469 CCCCCC(=O)COCCCCCC(=O)[O-] 7a_100102619762_200012276598 [0,2,0,0,0,0|1,0,1]=4 16633 B16R0.1469 CCCCCC(=O)CSCCCCCC(=O)N 62a_100009817443_200012276598 [0,2,0,0,0,0|1,0,1]=4 16634 B16R0.1469 CCCCCC(=O)CSCCCCCC(=O)N 62a_200012276598_100009817443 [0,2,0,0,0,0|1,0,1]=4 16635 B16R0.1469 CCCCCC(C)NCCCCCNC(=O)C 2230a_200012022750_200011218191 [0,2,0,0,0,0|2,0,0]=4 16636 B16R0.1469 CCCCCC(C)NCCCCCNC(=O)C 270004a_200012022750_100000211708 [0,2,0,0,0,0|2,0,0]=4 16637 B16R0.1469 CCCCCC(C)NCCCCCNC(=O)C 34a_200012022750_200011218191 [0,2,0,0,0,0|2,0,0]=4 16638 B16R0.1469 CCCCCC(C)NCCCCCOC(=O)C 2230a_100000211957_100009813381 [0,2,0,0,0,0|2,0,0]=4 16639 B16R0.1469 CCCCCC(C)OCCCCCOC(=O)C 34a_100011215632_100000033007 [0,2,0,0,0,0|2,0,0]=4 16640 B16R0.1469 CCCCCC(C)OCCCCCOC(=O)C 7a_100011215632_100000033007 [0,2,0,0,0,0|2,0,0]=4 16641 B16R0.1469 CCCCCC(C)SCCCCCOC(=O)C 62a_100000033007_200011218191 [0,2,0,0,0,0|2,0,0]=4 16642 B16R0.1469 CCCCCC(C)SCCCCCOC(=O)C 62a_200011218191_100000033007 [0,2,0,0,0,0|2,0,0]=4 16643 B16R0.1469 NCCCC[C@H](N)COCCCCCC(=O)N 34a_100016993712_100009817443 [0,2,0,0,0,0|2,0,0]=4 16644 B16R0.3183 C=C(C)CCC(=O)CCCCCCCCCC 1458a_100000210375_100000730704 [0,2,0,0,0,0|1,0,1]=4 16645 B16R0.3183 C=C(C)CCC(=O)CCCCCCCCCC 1458a_200000688413_100000210319 [0,2,0,0,0,0|1,0,1]=4 16646 B16R0.3183 C=C(C)CCC(C)NCCCCCCCCC 270004a_100000212291_100011215600 [0,2,0,0,0,0|2,0,0]=4 16647 B16R0.3183 C=C(C)CCN(C)CCCCCCCCCC 2230a_100000207566_100000730704 [0,2,0,0,0,0|2,0,0]=4 16648 B16R0.3183 C=C(C)CCN(C)CCCCCCCCCC 269982a_100000207566_100000730704 [0,2,0,0,0,0|2,0,0]=4 16649 B16R0.3183 C=C(C)COC(C)CCCCCCCCCC 34a_100011215000_100000748629 [0,2,0,0,0,0|2,0,0]=4 16650 B16R0.3183 C=C(C)COC(C)CCCCCCCCCC 7a_100011215000_100000748629 [0,2,0,0,0,0|2,0,0]=4 16651 B16R0.3183 C=C(F)COC(C)CCCCCCCCCC 34a_100011215000_100009893438 [0,2,0,0,0,0|2,0,0]=4 16652 B16R0.3183 C=C(F)COC(C)CCCCCCCCCC 7a_100011215000_100000042424 [0,2,0,0,0,0|2,0,0]=4 16653 B16R0.3183 C=CCCCCCCCCC(=O)CCC(C)C 1458a_100000181311_100011933949 [0,2,0,0,0,0|1,0,1]=4 16654 B16R0.3183 C=CCCCCCCCCC(=O)CCC(C)C 1458a_100000211349_100000210312 [0,2,0,0,0,0|1,0,1]=4 16655 B16R0.3183 C=CCCCCCCCCC(=O)CCC(C)O 1458a_100000211349_100012276601 [0,2,0,0,0,0|1,0,1]=4 16656 B16R0.3183 C=CCCCCCCCCN(C)CCC(C)C 2230a_100000742789_100011933949 [0,2,0,0,0,0|2,0,0]=4 16657 B16R0.3183 C=CCCCCCCCCN(C)CCC(C)C 269982a_100000742789_100011933949 [0,2,0,0,0,0|2,0,0]=4 16658 B16R0.3183 C=CCCCCCCCNC(C)CCC(C)C 2230a_100138410893_100012355270 [0,2,0,0,0,0|2,0,0]=4 16659 B16R0.3183 C=CCCCCCCCOC(C)CCC(C)C 34a_100000730831_100011261404 [0,2,0,0,0,0|2,0,0]=4 16660 B16R0.3183 C=CCCCCCCCOC(C)CCC(C)C 34a_100011215350_100012355270 [0,2,0,0,0,0|2,0,0]=4 16661 B16R0.3183 C=CCCCCCCCOC(C)CCC(C)C 7a_100011215350_100012355270 [0,2,0,0,0,0|2,0,0]=4 16662 B16R0.3183 CCCCCCCCCCC(=O)CCC(=O)N 1458a_100011215257_100000210319 [0,2,0,0,0,0|0,0,1]=3 16663 B16R0.3183 CCCCCCCCCCC(=O)CC[N+](=O)[O-] 1458a_200000064761_100000210319 [0,2,0,0,0,0|1,0,1]=4 16664 B16R0.3183 CCCCCCCCCCC(=O)CNC(=O)C 1458a_100000194580_100000210319 [0,2,0,0,0,0|1,0,1]=4 16665 B16R0.3183 CCCCCCCCCCC(=O)CNC(=O)N 1458a_100000184981_100000210319 [0,2,0,0,0,0|1,0,1]=4 16666 B16R0.3183 CCCCCCCCCCC(=O)COC(=O)C 1458a_100000183556_100000210319 [0,2,0,0,0,0|1,0,1]=4 16667 B16R0.3183 CCCCCCCCCCC(=O)CSC(=O)C 1458a_100000049016_100000210319 [0,2,0,0,0,0|1,0,1]=4 16668 B16R0.3183 CCCCCCCCCCC(=O)NCC(=O)N 11a_100000711301_100000210375 [0,2,0,0,0,0|1,0,1]=4 16669 B16R0.3183 CCCCCCCCCCC(=O)NCC(=O)N 240690a_100000711301_100000210375 [0,2,0,0,0,0|1,0,1]=4 16670 B16R0.3183 CCCCCCCCCCC(C)OCC(=O)N 34a_100011215000_100000187820 [0,2,0,0,0,0|1,0,0]=3 16671 B16R0.3183 CCCCCCCCCCC(C)OCC(=O)N 7a_100011215000_100000187820 [0,2,0,0,0,0|1,0,0]=3 16672 B16R0.3183 CCCCCCCCCCC(C)OCC(=O)[O-] 34a_100011215000_100020667443 [0,2,0,0,0,0|1,0,0]=3 16673 B16R0.3183 CCCCCCCCCCC(C)OC[N+](=O)[O-] 34a_100011215000_100000761209 [0,2,0,0,0,0|2,0,0]=4 16674 B16R0.3183 CCCCCCCCCCN(C)CCC(=O)C 269982a_100000207566_100000053229 [0,2,0,0,0,0|1,0,0]=3 16675 B16R0.3183 CCCCCCCCCCN(C)CCC(=O)N 2230a_100000207566_100000744528 [0,2,0,0,0,0|1,0,0]=3 16676 B16R0.3183 CCCCCCCCCCN(C)CCC(=O)N 2230a_100000730477_100000210320 [0,2,0,0,0,0|1,0,0]=3 16677 B16R0.3183 CCCCCCCCCCN(C)CCC(=O)N 269982a_100000207566_100000744528 [0,2,0,0,0,0|1,0,0]=3 16678 B16R0.3183 CCCCCCCCCCN(C)COC(=O)C 269982a_100000207566_100000076356 [0,2,0,0,0,0|2,0,0]=4 16679 B16R0.3183 CCCCCCCCCNC(=O)CCC(=O)N 240690a_100000212291_100011215257 [0,2,0,0,0,0|1,0,1]=4 16680 B16R0.3183 CCCCCCCCCNC(=O)CCC(=O)N 527a_100000212291_100011215257 [0,2,0,0,0,0|1,0,1]=4 16681 B16R0.3183 CCCCCCCCCNC(C)COC(=O)C 270004a_100000212291_100000000629 [0,2,0,0,0,0|2,0,0]=4 16682 B16R0.3183 CCCCCCCCNCC(C)CSC(=O)C 2230a_100000229939_200000116872 [0,2,0,0,0,0|2,0,0]=4 16683 B16R0.3183 CCCCCCCCNCC(C)CSC(=O)C 34a_100000229939_200000116872 [0,2,0,0,0,0|2,0,0]=4 16684 B16R0.3183 CCCCCCCCNCC(O)COC(=O)C 34a_100000229939_200000139349 [0,2,0,0,0,0|2,0,0]=4 16685 B16R0.3183 CCCCCCCCOCC(C)CSC(=O)C 34a_100000210232_200000116872 [0,2,0,0,0,0|2,0,0]=4 16686 B16R0.3183 CCCCCCCCOCC(C)CSC(=O)C 7a_100000210232_200000116872 [0,2,0,0,0,0|2,0,0]=4 16687 B16R0.3183 CCCCCCCCOCC(O)COC(=O)C 34a_100000210232_200000139349 [0,2,0,0,0,0|2,0,0]=4 16688 B16R0.3183 CCCCCCCCOCC(O)COC(=O)C 7a_100000210232_200000139349 [0,2,0,0,0,0|2,0,0]=4 16689 B16R0.3183 CCCCCCCCSCC(C)CSC(=O)C 62a_100000210759_200000116872 [0,2,0,0,0,0|2,0,0]=4 16690 B16R0.3183 CCCCCCCCSCC(C)CSC(=O)C 62a_200000116872_100000210317 [0,2,0,0,0,0|2,0,0]=4 16691 B16R0.3183 CCCCCCCCSCC(O)COC(=O)C 62a_100000210759_200000139349 [0,2,0,0,0,0|2,0,0]=4 16692 B16R0.3183 CCCCCCCCSCC(O)COC(=O)C 62a_200000139349_100000210317 [0,2,0,0,0,0|2,0,0]=4 16693 B16R0.3183 CN(CCCCCCCCCO)CCC(=O)N 2230a_100000730477_100009813782 [0,2,0,0,0,0|2,0,0]=4 16694 B16R0.3183 NC(=O)CCC(=O)CCCCCCCCCO 1458a_100011215257_100009813782 [0,2,0,0,0,0|1,0,1]=4 16695 B16R0.3288 CC(=O)CCCCNCCCCCCC(C)C 34a_100000211014_100009817362 [0,2,0,0,0,0|1,0,0]=3 16696 B16R0.3288 CC(=O)CCCCOCCCCCNC(C)C 34a_100011629493_100009817362 [0,2,0,0,0,0|2,0,0]=4 16697 B16R0.3288 CC(=O)CCCOCCCCCCCC(C)C 34a_200000210741_100000685027 [0,2,0,0,0,0|1,0,0]=3 16698 B16R0.3288 CC(=O)CCCOCCCCCCCC(C)C 7a_200000210741_100011215641 [0,2,0,0,0,0|1,0,0]=3 16699 B16R0.3288 CC(=O)NCCCCCCNCCCC(C)C 2230a_200011996284_100011214892 [0,2,0,0,0,0|2,0,0]=4 16700 B16R0.3288 CC(=O)NCCCCCCNCCCC(C)C 34a_200011996284_100011214892 [0,2,0,0,0,0|2,0,0]=4 16701 B16R0.3288 CC(=O)NCCCCCCNCCCC(C)O 2230a_200011996284_200000718107 [0,2,0,0,0,0|2,0,0]=4 16702 B16R0.3288 CC(=O)NCCCCCCNCCCC(C)O 34a_200011996284_200000718107 [0,2,0,0,0,0|2,0,0]=4 16703 B16R0.3288 CC(=O)NCCCCCNCCCCC(C)C 2230a_200012022750_100011216152 [0,2,0,0,0,0|2,0,0]=4 16704 B16R0.3288 CC(=O)NCCCCCNCCCCC(C)C 34a_200012022750_100011216152 [0,2,0,0,0,0|2,0,0]=4 16705 B16R0.3288 CC(=O)NCCCCNCCCCCC(C)C 2230a_200011368371_100000210682 [0,2,0,0,0,0|2,0,0]=4 16706 B16R0.3288 CC(=O)NCCCCNCCCCCC(C)C 34a_200011368371_100000210682 [0,2,0,0,0,0|2,0,0]=4 16707 B16R0.3288 CC(=O)NCCOCCCCCCCC(C)C 7a_200000210741_100000189650 [0,2,0,0,0,0|2,0,0]=4 16708 B16R0.3288 CC(=O)OCCCCCOCCCCC(C)C 34a_100011214890_100000033007 [0,2,0,0,0,0|2,0,0]=4 16709 B16R0.3288 CC(=O)OCCCCCOCCCCC(C)C 7a_100011214890_100000033007 [0,2,0,0,0,0|2,0,0]=4 16710 B16R0.3288 CC(=O)OCCCCCSCCCCC(C)C 62a_100000033007_100011216152 [0,2,0,0,0,0|2,0,0]=4 16711 B16R0.3288 CC(=O)OCCCCCSCCCCC(C)C 62a_100011216152_100000033007 [0,2,0,0,0,0|2,0,0]=4 16712 B16R0.3288 CC(=O)OCCCCNCCCCCC(C)C 34a_100011290863_100000033659 [0,2,0,0,0,0|2,0,0]=4 16713 B16R0.3288 CC(=O)OCCCCOCCCCCC(C)C 34a_100000073216_100000210682 [0,2,0,0,0,0|2,0,0]=4 16714 B16R0.3288 CC(=O)OCCCCOCCCCCC(C)C 34a_100011995859_100000033659 [0,2,0,0,0,0|2,0,0]=4 16715 B16R0.3288 CC(=O)OCCCCOCCCCCC(C)C 7a_100000073216_100000210682 [0,2,0,0,0,0|2,0,0]=4 16716 B16R0.3288 CC(=O)OCCCCOCCCCCC(C)C 7a_100011995859_100000033659 [0,2,0,0,0,0|2,0,0]=4 16717 B16R0.3288 CC(=O)OCCCCSCCCCCC(C)C 62a_100000033659_100000210682 [0,2,0,0,0,0|2,0,0]=4 16718 B16R0.3288 CC(=O)OCCCCSCCCCCC(C)C 62a_100000210682_100000033659 [0,2,0,0,0,0|2,0,0]=4 16719 B16R0.3288 CC(=O)OCCCNCCCCCCC(C)C 34a_100000211014_100000042594 [0,2,0,0,0,0|2,0,0]=4 16720 B16R0.3288 CC(=O)OCCOCCCCCCCC(C)C 34a_200000210741_100009814007 [0,2,0,0,0,0|2,0,0]=4 16721 B16R0.3288 CC(=O)OCCOCCCCCCCC(C)C 7a_200000210741_100009814007 [0,2,0,0,0,0|2,0,0]=4 16722 B16R0.3288 CC(=O)SCCCCNCCCCCC(C)C 2230a_100011290863_200010402107 [0,2,0,0,0,0|2,0,0]=4 16723 B16R0.3288 CC(=O)SCCCCNCCCCCC(C)C 34a_100011290863_200010402107 [0,2,0,0,0,0|2,0,0]=4 16724 B16R0.3288 CC(=O)SCCCCOCCCCCC(C)C 34a_100011995859_200010402107 [0,2,0,0,0,0|2,0,0]=4 16725 B16R0.3288 CC(=O)SCCCCOCCCCCC(C)C 7a_100011995859_200010402107 [0,2,0,0,0,0|2,0,0]=4 16726 B16R0.3288 CC(=O)SCCCCSCCCCCC(C)C 62a_100000210682_200010402107 [0,2,0,0,0,0|2,0,0]=4 16727 B16R0.3288 CC(=O)SCCCCSCCCCCC(C)C 62a_200010402107_100000210682 [0,2,0,0,0,0|2,0,0]=4 16728 B16R0.3288 CC(=O)SCCCNCCCCCCC(C)C 2230a_100000211014_100000038929 [0,2,0,0,0,0|2,0,0]=4 16729 B16R0.3288 CC(=O)SCCCNCCCCCCC(C)C 34a_100000211014_100000038929 [0,2,0,0,0,0|2,0,0]=4 16730 B16R0.3288 CC(C)CCCCCCCOCCCC(=O)N 34a_200000210741_100102525003 [0,2,0,0,0,0|1,0,0]=3 16731 B16R0.3288 CC(C)CCCCCCCOCCCC(=O)N 7a_200000210741_100102525003 [0,2,0,0,0,0|1,0,0]=3 16732 B16R0.3288 CC(C)CCCCCCCOCCNC(=O)N 7a_200000210741_200000034859 [0,2,0,0,0,0|2,0,0]=4 16733 B16R0.3288 CC(C)CCCCCCCOCCOC(=O)N 34a_200000210741_200011214921 [0,2,0,0,0,0|2,0,0]=4 16734 B16R0.3288 CC(C)CCCCCCCOCCOC(=O)N 7a_200000210741_200011214921 [0,2,0,0,0,0|2,0,0]=4 16735 B16R0.3288 CC(C)CCCCCCNCCOCC(=O)N 2230a_100000211014_100000076697 [0,2,0,0,0,0|2,0,0]=4 16736 B16R0.3288 CC(C)CCCCCCNCCOCC(=O)N 34a_100000211014_100000076697 [0,2,0,0,0,0|2,0,0]=4 16737 B16R0.3288 CC(C)CCCCCNCCCCCC(=O)N 2230a_100011290863_100009817443 [0,2,0,0,0,0|1,0,0]=3 16738 B16R0.3288 CC(C)CCCCCNCCCCCC(=O)N 34a_100011290863_100009817443 [0,2,0,0,0,0|1,0,0]=3 16739 B16R0.3288 CC(C)CCCCCOCCCCCC(=O)N 34a_100000123541_100000210682 [0,2,0,0,0,0|1,0,0]=3 16740 B16R0.3288 CC(C)CCCCCOCCCCCC(=O)N 34a_100011995859_100009817443 [0,2,0,0,0,0|1,0,0]=3 16741 B16R0.3288 CC(C)CCCCCOCCCCCC(=O)N 7a_100000123541_100000210682 [0,2,0,0,0,0|1,0,0]=3 16742 B16R0.3288 CC(C)CCCCCOCCCCCC(=O)N 7a_100011995859_100009817443 [0,2,0,0,0,0|1,0,0]=3 16743 B16R0.3288 CC(C)CCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210682 [0,2,0,0,0,0|1,0,0]=3 16744 B16R0.3288 CC(C)CCCCCSCCCCCC(=O)N 62a_100000210682_100009817443 [0,2,0,0,0,0|1,0,0]=3 16745 B16R0.3288 CC(C)CCCCCSCCCCCC(=O)N 62a_100009817443_100000210682 [0,2,0,0,0,0|1,0,0]=3 16746 B16R0.3288 CC(C)COCCCNCCCCCC(=O)N 2230a_100000205972_100009817443 [0,2,0,0,0,0|2,0,0]=4 16747 B16R0.3288 CC(C)COCCCNCCCCCC(=O)N 34a_100000205972_100009817443 [0,2,0,0,0,0|2,0,0]=4 16748 B16R0.3288 CC(C)NCCCCCCCCCCC(=O)N 2230a_100138425928_200010167045 [0,2,0,0,0,0|1,0,0]=3 16749 B16R0.3288 CC(C)NCCCCCCCCCCC(=O)N 34a_100138425928_200010167045 [0,2,0,0,0,0|1,0,0]=3 16750 B16R0.3288 CC(C)NCCCCOCCCCCC(=O)N 34a_100011521146_100009817443 [0,2,0,0,0,0|2,0,0]=4 16751 B16R0.3288 CC(C)OCCCCCCCCCCC(=O)N 34a_100000212225_200010167045 [0,2,0,0,0,0|1,0,0]=3 16752 B16R0.3288 CC(C)SCCCCCCCCCCC(=O)N 62a_100000210206_200010167045 [0,2,0,0,0,0|1,0,0]=3 16753 B16R0.3288 CC(C)SCCCCCCCCCCC(=O)N 62a_200010167045_100000210206 [0,2,0,0,0,0|1,0,0]=3 16754 B16R0.154 C=CCCCCCCCC(=O)CC(C)CCC 1458a_100000748435_100012355270 [0,2,0,0,0,0|1,0,1]=4 16755 B16R0.154 C=CCCCCCCCC(=O)CC(C)CCC 1458a_100011216160_100011216630 [0,2,0,0,0,0|1,0,1]=4 16756 B16R0.154 C=CCN(C)CC(C)CCCCCCCCC 270004a_100000225617_200011218516 [0,2,0,0,0,0|2,0,0]=4 16757 B16R0.1186 C#CC(CCCCC)OCCCCCCC=C 34a_100011216489_100011215473 [0,2,0,0,0,0|2,0,0]=4 16758 B16R0.1186 C#CC(CCCCC)OCCCCCCC=C 7a_100011216489_100011215473 [0,2,0,0,0,0|2,0,0]=4 16759 B16R0.1186 C=CCCCCCCOC(C=C)CCCCC 34a_100011216863_100011215473 [0,2,0,0,0,0|2,0,0]=4 16760 B16R0.1186 C=CCCCCCCOC(C=C)CCCCC 7a_100011216863_100011215473 [0,2,0,0,0,0|2,0,0]=4 16761 B16R0.1186 C=CCCCCCCOC(CC)CCCCC 34a_100011215405_100011215473 [0,2,0,0,0,0|2,0,0]=4 16762 B16R0.1186 C=CCCCCCCOC(CC)CCCCC 7a_100011215405_100011215473 [0,2,0,0,0,0|2,0,0]=4 16763 B16R0.6607 C=CCCC(C)N(C)CCCCCCCCC 270004a_100000232482_100000762624 [0,2,0,0,0,0|2,0,0]=4 16764 B16R0.6607 C=CCCCCCCCC(=O)C(C)CCCC 1458a_100000725509_100012355270 [0,2,0,0,0,0|1,0,1]=4 16765 B16R0.6607 C=CCCCCCCCC(=O)C(C)CCCC 1458a_100011216160_200011215066 [0,2,0,0,0,0|1,0,1]=4 16766 B16R0.6607 C=CCCCCCCCC(=O)C(O)CCCC 1458a_100000720857_100012355270 [0,2,0,0,0,0|1,0,1]=4 16767 B16R0.6607 C=CCCN(C)C(C)CCCCCCCCC 270004a_100020639649_100011215753 [0,2,0,0,0,0|2,0,0]=4 16768 B16R0.220 C#CC(CCC)OCCCCCCCCC=C 34a_200011217317_100011933949 [0,2,0,0,0,0|2,0,0]=4 16769 B16R0.220 C#CC(CCC)OCCCCCCCCC=C 7a_200011217317_100011933949 [0,2,0,0,0,0|2,0,0]=4 16770 B16R0.220 C=CCC(C=C)OCCCCCCCCCC 34a_100000038011_100000210320 [0,2,0,0,0,0|2,0,0]=4 16771 B16R0.220 C=CCC(C=C)OCCCCCCCCCC 7a_100000038011_100000210320 [0,2,0,0,0,0|2,0,0]=4 16772 B16R0.220 C=CCCCCCCCCCN(CC)CCC 2230a_100000226822_100009814027 [0,2,0,0,0,0|2,0,0]=4 16773 B16R0.220 C=CCCCCCCCCCN(CC)CCC 269982a_100000226822_100009814027 [0,2,0,0,0,0|2,0,0]=4 16774 B16R0.220 C=CCCCCCCCCNC(CC)CCC 2230a_100000747048_100011933949 [0,2,0,0,0,0|2,0,0]=4 16775 B16R0.220 C=CCCCCCCCCN[C@H](CO)CCC 2230a_100000732646_100011933949 [0,2,0,0,0,0|2,0,0]=4 16776 B16R0.220 C=CCCCCCCCCN[C@H](CO)CCC 34a_100000732646_100011933949 [0,2,0,0,0,0|2,0,0]=4 16777 B16R0.220 C=CCCCCCCCCOC(C#N)CCC 34a_100000686963_100011933949 [0,2,0,0,0,0|2,0,0]=4 16778 B16R0.220 C=CCCCCCCCCOC(C#N)CCC 7a_100000686963_100011933949 [0,2,0,0,0,0|2,0,0]=4 16779 B16R0.220 C=CCCCCCCCCOC(C=C)CCC 34a_100011216692_100011933949 [0,2,0,0,0,0|2,0,0]=4 16780 B16R0.220 C=CCCCCCCCCOC(C=C)CCC 7a_100011216692_100011933949 [0,2,0,0,0,0|2,0,0]=4 16781 B16R0.220 C=CCCCCCCCCOC(CC)CCC 34a_100000687864_100011933949 [0,2,0,0,0,0|2,0,0]=4 16782 B16R0.220 C=CCCCCCCCCOC(CC)CCC 7a_100000687864_100011933949 [0,2,0,0,0,0|2,0,0]=4 16783 B16R0.220 C=CCCCCCCCCOC(CC)CCC 7a_100011215194_100011219200 [0,2,0,0,0,0|2,0,0]=4 16784 B16R0.220 C=CCCCCCCOCCC(CCC)SC 34a_100000032865_100011215473 [0,2,0,0,0,0|2,0,0]=4 16785 B16R0.220 C=CCCCCCCOCCC(CCC)SC 7a_100000032865_100011215473 [0,2,0,0,0,0|2,0,0]=4 16786 B16R0.220 C=CC[C@H](CO)NCCCCCCCCCC 2230a_100020615467_100000210320 [0,2,0,0,0,0|2,0,0]=4 16787 B16R0.1183 C=CCC(C)C(=O)CCCCCCCCCC 1458a_100011216819_100000210319 [0,2,0,0,0,0|1,0,1]=4 16788 B16R0.1183 C=CCCCCCCCCC(=O)C(C)CCC 1458a_100000210906_100011933949 [0,2,0,0,0,0|1,0,1]=4 16789 B16R0.1183 C=CCCCCCCCCC(=O)C(C)CCC 1458a_100000211349_100000766640 [0,2,0,0,0,0|1,0,1]=4 16790 B16R0.1183 C=CCCCCCCCCC(=O)[C@@H](O)CCC 1458a_100009822183_100011933949 [0,2,0,0,0,0|1,0,1]=4 16791 B16R0.1183 C=CCCCCCCCOC(C)C(C)CCC 34a_100000708338_100012355270 [0,2,0,0,0,0|2,0,0]=4 16792 B16R0.1183 C=CCCCCCCCOC(C)C(C)CCC 7a_100000708338_100012355270 [0,2,0,0,0,0|2,0,0]=4 16793 B16R0.1183 C=CCN(C)C(C)CCCCCCCCCC 270004a_100000225617_200011219864 [0,2,0,0,0,0|2,0,0]=4 16794 B16R0.5308 C=CCC(C)(C)OCCCCCCCCCC 7a_100011995686_100000210320 [0,2,0,0,0,0|2,0,0]=4 16795 B16R0.5308 C=CCCCCCCCCOC(C)(C)CCC 7a_100000748436_100011933949 [0,2,0,0,0,0|2,0,0]=4 16796 B16R0.5308 C=CCCCCCCCOCC(C)(C)CCC 7a_100011995695_100012355270 [0,2,0,0,0,0|2,0,0]=4 16797 B16R0.1180 C#CC(CCCC)OCCCCCCCC=C 34a_200011217967_100012355270 [0,2,0,0,0,0|2,0,0]=4 16798 B16R0.1180 C#CC(CCCC)OCCCCCCCC=C 7a_200011217967_100012355270 [0,2,0,0,0,0|2,0,0]=4 16799 B16R0.1180 C=CCCCCCCCCN(CC)CCCC 2230a_100000207695_100011933949 [0,2,0,0,0,0|2,0,0]=4 16800 B16R0.1180 C=CCCCCCCCCN(CC)CCCC 269982a_100000207695_100011933949 [0,2,0,0,0,0|2,0,0]=4 16801 B16R0.1180 C=CCCCCCCCN[C@H](CO)CCCC 2230a_100011934283_100012355270 [0,2,0,0,0,0|2,0,0]=4 16802 B16R0.1180 C=CCCCCCCCN[C@H](CO)CCCC 34a_100011934283_100012355270 [0,2,0,0,0,0|2,0,0]=4 16803 B16R0.1180 C=CCCCCCCCOC(C=C)CCCC 34a_200011215037_100012355270 [0,2,0,0,0,0|2,0,0]=4 16804 B16R0.1180 C=CCCCCCCCOC(C=C)CCCC 7a_200011215037_100012355270 [0,2,0,0,0,0|2,0,0]=4 16805 B16R0.1180 C=CCCCCCCCOC(CC)CCCC 34a_100000730831_200011216223 [0,2,0,0,0,0|2,0,0]=4 16806 B16R0.1180 C=CCCCCCCCOC(CC)CCCC 34a_100011215227_100012355270 [0,2,0,0,0,0|2,0,0]=4 16807 B16R0.1180 C=CCCCCCCCOC(CC)CCCC 7a_100000730831_200011216223 [0,2,0,0,0,0|2,0,0]=4 16808 B16R0.1180 C=CCCCCCCCOC(CC)CCCC 7a_100011215227_100012355270 [0,2,0,0,0,0|2,0,0]=4 16809 B16R0.1180 C=CCCCCCCNCC(CC)CCCC 2230a_100000209976_100011215473 [0,2,0,0,0,0|2,0,0]=4 16810 B16R0.1180 C=CCCCCCCOCC(CC)CCCC 34a_100000210273_100011215473 [0,2,0,0,0,0|2,0,0]=4 16811 B16R0.1180 C=CCCCCCCOCC(CC)CCCC 34a_200011216477_100000211942 [0,2,0,0,0,0|2,0,0]=4 16812 B16R0.1180 C=CCCCCCCOCC(CC)CCCC 7a_100000210273_100011215473 [0,2,0,0,0,0|2,0,0]=4 16813 B16R0.1180 C=CCCCCCCOCC(CC)CCCC 7a_200011216477_100000211942 [0,2,0,0,0,0|2,0,0]=4 16814 B16R0.1180 C=CCCCNCCCCC(CC)CCCC 2230a_100000700776_200012094884 [0,2,0,0,0,0|2,0,0]=4 16815 B16R0.1180 C=CCCCNCCCCC(CC)CCCC 34a_100000700776_200012094884 [0,2,0,0,0,0|2,0,0]=4 16816 B16R0.1180 C=CCCCOCCCCC(CC)CCCC 34a_100000758997_200012094884 [0,2,0,0,0,0|2,0,0]=4 16817 B16R0.1180 C=CCCCOCCCCC(CC)CCCC 7a_100000758997_200012094884 [0,2,0,0,0,0|2,0,0]=4 16818 B16R0.1180 CCCCC(CC)CCCCSCCCC=O 62a_200011292268_200012094884 [0,2,0,0,0,0|1,0,0]=3 16819 B16R0.1180 CCCCC(CC)CCCCSCCCC=O 62a_200012094884_200011292268 [0,2,0,0,0,0|1,0,0]=3 16820 B16R0.1180 CCCCN(CC)CCNCCCCCC=O 2230a_200011208488_100000139337 [0,2,0,0,0,0|2,0,0]=4 16821 B16R0.1180 CCCCN(CCCCOCCCC=O)N=O 7a_200000034022_200011292268 [0,2,0,0,0,0|2,0,0]=4 16822 B16R0.8580 C=CCCCCCCCOC(C)(C)CCCC 7a_100011219641_100012355270 [0,2,0,0,0,0|2,0,0]=4 16823 B16R0.8580 C=CCCCCCCOCC(C)(C)CCCC 7a_200011995781_100011215473 [0,2,0,0,0,0|2,0,0]=4 16824 B14R1.40 BrCCCCCCCOC1CCCC1 34a_100000760002_100000179811 [1,0,0,1,0,0|2,0,0]=4 16825 B14R1.40 BrCCCCCCCOC1CCCC1 7a_100000760002_100000179811 [1,0,0,1,0,0|2,0,0]=4 16826 B14R1.40 BrCCCCCCOCC1CCCC1 34a_100011215345_100000740388 [1,0,0,1,0,0|2,0,0]=4 16827 B14R1.40 BrCCCCCCOCC1CCCC1 7a_100011215345_100000740388 [1,0,0,1,0,0|2,0,0]=4 16828 B14R1.40 BrCCCCCOCCC1CCCC1 34a_100000746331_100000760354 [1,0,0,1,0,0|2,0,0]=4 16829 B14R1.40 BrCCCCCOCCC1CCCC1 7a_100000746331_100000760354 [1,0,0,1,0,0|2,0,0]=4 16830 B14R1.40 BrCCCCOCCCC1CCCC1 34a_100011216708_100011713738 [1,0,0,1,0,0|2,0,0]=4 16831 B14R1.40 C=CCCCCCCCN1CCCC1 2230a_100000188435_100012355270 [1,0,0,1,0,0|1,0,1]=4 16832 B14R1.40 C=CCCCCCCCN1CCCC1 269982a_100000188435_100012355270 [1,0,0,1,0,0|1,0,1]=4 16833 B14R1.40 C=CCCCCCCNC1CCCC1 2230a_100000211070_100011215473 [1,0,0,1,0,0|1,0,1]=4 16834 B14R1.40 C=CCCCCCCNC1CCCC1 34a_100000211070_100011215473 [1,0,0,1,0,0|1,0,1]=4 16835 B14R1.40 C=CCCCCCCOC1CCCC1 34a_100000210269_100011215473 [1,0,0,1,0,0|1,0,1]=4 16836 B14R1.40 C=CCCCCCCOC1CCCC1 34a_200011216477_100000179811 [1,0,0,1,0,0|1,0,1]=4 16837 B14R1.40 C=CCCCCCCOC1CCCC1 7a_100000210269_100011215473 [1,0,0,1,0,0|1,0,1]=4 16838 B14R1.40 C=CCCCCCCOC1CCCC1 7a_200011216477_100000179811 [1,0,0,1,0,0|1,0,1]=4 16839 B14R1.40 C=CCCCCCCSC1CCCC1 62a_100011215473_100000179811 [1,0,0,1,0,0|1,0,1]=4 16840 B14R1.40 C=CCCCCCCSC1CCCC1 62a_100011217020_100011215473 [1,0,0,1,0,0|1,0,1]=4 16841 B14R1.40 C=CCCCCCNCC1CCCC1 2230a_100000737975_100000700193 [1,0,0,1,0,0|1,0,1]=4 16842 B14R1.40 C=CCCCCCNCC1CCCC1 34a_100000737975_100000700193 [1,0,0,1,0,0|1,0,1]=4 16843 B14R1.40 C=CCCCCCOCC1CCCC1 34a_100000742336_100000700193 [1,0,0,1,0,0|1,0,1]=4 16844 B14R1.40 C=CCCCCCOCC1CCCC1 34a_100011216702_100000740388 [1,0,0,1,0,0|1,0,1]=4 16845 B14R1.40 C=CCCCCCOCC1CCCC1 7a_100000742336_100000700193 [1,0,0,1,0,0|1,0,1]=4 16846 B14R1.40 C=CCCCCCOCC1CCCC1 7a_100011216702_100000740388 [1,0,0,1,0,0|1,0,1]=4 16847 B14R1.40 C=CCCCCCSCC1CCCC1 62a_100000700193_100000740388 [1,0,0,1,0,0|1,0,1]=4 16848 B14R1.40 C=CCCCCCSCC1CCCC1 62a_100000740388_100000700193 [1,0,0,1,0,0|1,0,1]=4 16849 B14R1.40 C=CCCCCNCCC1CCCC1 2230a_100000703577_100000760354 [1,0,0,1,0,0|1,0,1]=4 16850 B14R1.40 C=CCCCCNCCC1CCCC1 2230a_100000739158_100011215482 [1,0,0,1,0,0|1,0,1]=4 16851 B14R1.40 C=CCCCCNCCC1CCCC1 34a_100000703577_100000760354 [1,0,0,1,0,0|1,0,1]=4 16852 B14R1.40 C=CCCCCNCCC1CCCC1 34a_100000739158_100011215482 [1,0,0,1,0,0|1,0,1]=4 16853 B14R1.40 C=CCCCCOCCC1CCCC1 34a_100000749090_100011215482 [1,0,0,1,0,0|1,0,1]=4 16854 B14R1.40 C=CCCCCOCCC1CCCC1 34a_100000766645_100000760354 [1,0,0,1,0,0|1,0,1]=4 16855 B14R1.40 C=CCCCCOCCC1CCCC1 7a_100000749090_100011215482 [1,0,0,1,0,0|1,0,1]=4 16856 B14R1.40 C=CCCCCOCCC1CCCC1 7a_100000766645_100000760354 [1,0,0,1,0,0|1,0,1]=4 16857 B14R1.40 C=CCCCCSCCC1CCCC1 62a_100000760354_100011215482 [1,0,0,1,0,0|1,0,1]=4 16858 B14R1.40 C=CCCCCSCCC1CCCC1 62a_100011215482_100000760354 [1,0,0,1,0,0|1,0,1]=4 16859 B14R1.40 C=CCCCNCCCC1CCCC1 2230a_100000700776_100011713738 [1,0,0,1,0,0|1,0,1]=4 16860 B14R1.40 C=CCCCNCCCC1CCCC1 2230a_100000736752_100011713584 [1,0,0,1,0,0|1,0,1]=4 16861 B14R1.40 C=CCCCNCCCC1CCCC1 34a_100000700776_100011713738 [1,0,0,1,0,0|1,0,1]=4 16862 B14R1.40 C=CCCCNCCCC1CCCC1 34a_100000736752_100000757094 [1,0,0,1,0,0|1,0,1]=4 16863 B14R1.40 C=CCCCOCCCC1CCCC1 34a_100000758997_100011713738 [1,0,0,1,0,0|1,0,1]=4 16864 B14R1.40 C=CCCCOCCCC1CCCC1 34a_100011215328_100000757094 [1,0,0,1,0,0|1,0,1]=4 16865 B14R1.40 C=CCCCOCCCC1CCCC1 7a_100000758997_100011713738 [1,0,0,1,0,0|1,0,1]=4 16866 B14R1.40 C=CCCCOCCCC1CCCC1 7a_100011215328_100000757094 [1,0,0,1,0,0|1,0,1]=4 16867 B14R1.40 C=CCCCSCCCC1CCCC1 62a_100011713584_100011713738 [1,0,0,1,0,0|1,0,1]=4 16868 B14R1.40 C=CCCCSCCCC1CCCC1 62a_100011713738_100000757094 [1,0,0,1,0,0|1,0,1]=4 16869 B14R1.40 CCCCCCCCCN1CCCC1 2230a_100000188435_100011214924 [1,0,0,1,0,0|1,0,1]=4 16870 B14R1.40 CCCCCCCCCN1CCCC1 269982a_100000188435_100000210670 [1,0,0,1,0,0|1,0,1]=4 16871 B14R1.40 CCCCCCCCNC1CCCC1 2230a_100000211070_100000210759 [1,0,0,1,0,0|1,0,1]=4 16872 B14R1.40 CCCCCCCCNC1CCCC1 2230a_100000229939_100000179811 [1,0,0,1,0,0|1,0,1]=4 16873 B14R1.40 CCCCCCCCNC1CCCC1 270004a_100000229939_100000210133 [1,0,0,1,0,0|1,0,1]=4 16874 B14R1.40 CCCCCCCCNC1CCCC1 34a_100000211070_100000210759 [1,0,0,1,0,0|1,0,1]=4 16875 B14R1.40 CCCCCCCCNC1CCCC1 34a_100000229939_100000179811 [1,0,0,1,0,0|1,0,1]=4 16876 B14R1.40 CCCCCCCCOC1CCCC1 34a_100000210232_100000179811 [1,0,0,1,0,0|1,0,1]=4 16877 B14R1.40 CCCCCCCCOC1CCCC1 34a_100000210269_100000210759 [1,0,0,1,0,0|1,0,1]=4 16878 B14R1.40 CCCCCCCCOC1CCCC1 7a_100000210232_100000179811 [1,0,0,1,0,0|1,0,1]=4 16879 B14R1.40 CCCCCCCCOC1CCCC1 7a_100000210269_100000210759 [1,0,0,1,0,0|1,0,1]=4 16880 B14R1.40 CCCCCCCCOC1CCCO1 34a_100000085407_100000210759 [1,0,0,1,0,0|1,0,1]=4 16881 B14R1.40 CCCCCCCCSC1CCCC1 62a_100000210759_100000179811 [1,0,0,1,0,0|1,0,1]=4 16882 B14R1.40 CCCCCCCCSC1CCCC1 62a_100011217020_100000210317 [1,0,0,1,0,0|1,0,1]=4 16883 B14R1.40 CCCCCCCNCC1CCCC1 2230a_100000229938_100000740388 [1,0,0,1,0,0|1,0,1]=4 16884 B14R1.40 CCCCCCCNCC1CCCC1 2230a_100000737975_100000210681 [1,0,0,1,0,0|1,0,1]=4 16885 B14R1.40 CCCCCCCNCC1CCCC1 269862a_100000229938_100000746403 [1,0,0,1,0,0|1,0,1]=4 16886 B14R1.40 CCCCCCCNCC1CCCC1 34a_100000737975_100000210614 [1,0,0,1,0,0|1,0,1]=4 16887 B14R1.40 CCCCCCCNCC1CCCO1 2230a_100000229938_100000203698 [1,0,0,1,0,0|1,0,1]=4 16888 B14R1.40 CCCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210681 [1,0,0,1,0,0|1,0,1]=4 16889 B14R1.40 CCCCCCCNC[C@@H]1CCCO1 34a_100020590478_100000210614 [1,0,0,1,0,0|1,0,1]=4 16890 B14R1.40 CCCCCCCOCC1CCCC1 34a_100000210272_100000740388 [1,0,0,1,0,0|1,0,1]=4 16891 B14R1.40 CCCCCCCOCC1CCCC1 34a_100000742336_100000210614 [1,0,0,1,0,0|1,0,1]=4 16892 B14R1.40 CCCCCCCOCC1CCCC1 7a_100000210272_100000740388 [1,0,0,1,0,0|1,0,1]=4 16893 B14R1.40 CCCCCCCOCC1CCCC1 7a_100000742336_100000210614 [1,0,0,1,0,0|1,0,1]=4 16894 B14R1.40 CCCCCCCOCC1CCCO1 34a_100000210270_100000210614 [1,0,0,1,0,0|1,0,1]=4 16895 B14R1.40 CCCCCCCOCC1CCCO1 7a_100000210270_100000210614 [1,0,0,1,0,0|1,0,1]=4 16896 B14R1.40 CCCCCCCOCC1CCCO1 7a_100000210272_100000203698 [1,0,0,1,0,0|1,0,1]=4 16897 B14R1.40 CCCCCCCOC[C@H]1CCCN1 34a_100000745186_100000210614 [1,0,0,1,0,0|2,0,0]=4 16898 B14R1.40 CCCCCCCSCC1CCCC1 62a_100000210614_100000740388 [1,0,0,1,0,0|1,0,1]=4 16899 B14R1.40 CCCCCCCSCC1CCCC1 62a_100000740388_100000210316 [1,0,0,1,0,0|1,0,1]=4 16900 B14R1.40 CCCCCCCSCC1CCCO1 62a_100000203698_100000210316 [1,0,0,1,0,0|1,0,1]=4 16901 B14R1.40 CCCCCCCSCC1CCCO1 62a_100000210614_100000203698 [1,0,0,1,0,0|1,0,1]=4 16902 B14R1.40 CCCCCCNCCC1CCCC1 2230a_100000210581_100000760354 [1,0,0,1,0,0|1,0,1]=4 16903 B14R1.40 CCCCCCNCCC1CCCC1 2230a_100000739158_100000210314 [1,0,0,1,0,0|1,0,1]=4 16904 B14R1.40 CCCCCCNCCC1CCCC1 34a_100000739158_100000210314 [1,0,0,1,0,0|1,0,1]=4 16905 B14R1.40 CCCCCCOCCC1CCCC1 34a_100000210259_100000760354 [1,0,0,1,0,0|1,0,1]=4 16906 B14R1.40 CCCCCCOCCC1CCCC1 34a_100000749090_100000210314 [1,0,0,1,0,0|1,0,1]=4 16907 B14R1.40 CCCCCCOCCC1CCCC1 7a_100000210259_100000760354 [1,0,0,1,0,0|1,0,1]=4 16908 B14R1.40 CCCCCCOCCC1CCCC1 7a_100000749090_100000210314 [1,0,0,1,0,0|1,0,1]=4 16909 B14R1.40 CCCCCCSCCC1CCCC1 62a_100000210314_100000760354 [1,0,0,1,0,0|1,0,1]=4 16910 B14R1.40 CCCCCCSCCC1CCCC1 62a_100000760354_100000210757 [1,0,0,1,0,0|1,0,1]=4 16911 B14R1.40 CCCCCNCCCC1CCCC1 2230a_100000209983_100011713738 [1,0,0,1,0,0|1,0,1]=4 16912 B14R1.40 CCCCCNCCCC1CCCC1 2230a_100000736752_100000210326 [1,0,0,1,0,0|1,0,1]=4 16913 B14R1.40 CCCCCNCCCC1CCCC1 34a_100000736752_100000718602 [1,0,0,1,0,0|1,0,1]=4 16914 B14R1.40 CCCCCOCCCC1CCCC1 34a_100000210253_100011713738 [1,0,0,1,0,0|1,0,1]=4 16915 B14R1.40 CCCCCOCCCC1CCCC1 34a_100011215328_100000718602 [1,0,0,1,0,0|1,0,1]=4 16916 B14R1.40 CCCCCOCCCC1CCCC1 7a_100000210253_100011713738 [1,0,0,1,0,0|1,0,1]=4 16917 B14R1.40 CCCCCOCCCC1CCCC1 7a_100011215328_100000210326 [1,0,0,1,0,0|1,0,1]=4 16918 B14R1.40 CCCCCSCCCC1CCCC1 62a_100000210326_100011713738 [1,0,0,1,0,0|1,0,1]=4 16919 B14R1.40 CCCCCSCCCC1CCCC1 62a_100011713738_100000210326 [1,0,0,1,0,0|1,0,1]=4 16920 B14R1.40 ClCCCCCCOCC1CCCC1 34a_100000766143_100000740388 [1,0,0,1,0,0|2,0,0]=4 16921 B14R1.40 ClCCCCCCOCC1CCCC1 7a_100000766143_100000740388 [1,0,0,1,0,0|2,0,0]=4 16922 B14R1.40 ClCCCCCOCCC1CCCC1 34a_100000746330_100000760354 [1,0,0,1,0,0|2,0,0]=4 16923 B14R1.40 ClCCCCCOCCC1CCCC1 7a_100000746330_100000760354 [1,0,0,1,0,0|2,0,0]=4 16924 B14R1.40 ClCCCCOCCCC1CCCC1 34a_100000210776_100011713738 [1,0,0,1,0,0|2,0,0]=4 16925 B14R1.40 ClCCCCOCCCC1CCCC1 7a_100000210776_100011713738 [1,0,0,1,0,0|2,0,0]=4 16926 B14R1.40 FCCCCCCNCC1CCCC1 2230a_100000737975_100015922095 [1,0,0,1,0,0|2,0,0]=4 16927 B14R1.40 FCCCCCCNCC1CCCC1 34a_100000737975_100015922095 [1,0,0,1,0,0|2,0,0]=4 16928 B14R1.40 FCCCCCCOCC1CCCC1 34a_100000732779_100000740388 [1,0,0,1,0,0|2,0,0]=4 16929 B14R1.40 FCCCCCCOCC1CCCC1 34a_100000742336_100015922095 [1,0,0,1,0,0|2,0,0]=4 16930 B14R1.40 FCCCCCCOCC1CCCC1 7a_100000732779_100000740388 [1,0,0,1,0,0|2,0,0]=4 16931 B14R1.40 FCCCCCCOCC1CCCC1 7a_100000742336_100015922095 [1,0,0,1,0,0|2,0,0]=4 16932 B14R1.40 FCCCCCCSCC1CCCC1 62a_100000740388_100015922095 [1,0,0,1,0,0|2,0,0]=4 16933 B14R1.40 FCCCCCCSCC1CCCC1 62a_100015922095_100000740388 [1,0,0,1,0,0|2,0,0]=4 16934 B14R1.40 FCCCCCNCCC1CCCC1 2230a_100000739158_100000729378 [1,0,0,1,0,0|2,0,0]=4 16935 B14R1.40 FCCCCCNCCC1CCCC1 34a_100000739158_100000729378 [1,0,0,1,0,0|2,0,0]=4 16936 B14R1.40 FCCCCCOCCC1CCCC1 34a_100000749090_100000729378 [1,0,0,1,0,0|2,0,0]=4 16937 B14R1.40 FCCCCCOCCC1CCCC1 7a_100000749090_100000729378 [1,0,0,1,0,0|2,0,0]=4 16938 B14R1.40 FCCCCCSCCC1CCCC1 62a_100000729378_100000760354 [1,0,0,1,0,0|2,0,0]=4 16939 B14R1.40 FCCCCCSCCC1CCCC1 62a_100000760354_100000729378 [1,0,0,1,0,0|2,0,0]=4 16940 B14R1.40 FCCCCNCCCC1CCCC1 2230a_100000736752_100000729493 [1,0,0,1,0,0|2,0,0]=4 16941 B14R1.40 FCCCCNCCCC1CCCC1 34a_100000736752_100000729493 [1,0,0,1,0,0|2,0,0]=4 16942 B14R1.40 FCCCCOCCCC1CCCC1 34a_100011215328_100000729493 [1,0,0,1,0,0|2,0,0]=4 16943 B14R1.40 FCCCCOCCCC1CCCC1 34a_100011995726_100011713738 [1,0,0,1,0,0|2,0,0]=4 16944 B14R1.40 FCCCCOCCCC1CCCC1 7a_100011215328_100000729493 [1,0,0,1,0,0|2,0,0]=4 16945 B14R1.40 FCCCCOCCCC1CCCC1 7a_100011995726_100011713738 [1,0,0,1,0,0|2,0,0]=4 16946 B14R1.40 FCCCCSCCCC1CCCC1 62a_100000729493_100011713738 [1,0,0,1,0,0|2,0,0]=4 16947 B14R1.40 FCCCCSCCCC1CCCC1 62a_100011713738_100000729493 [1,0,0,1,0,0|2,0,0]=4 16948 B14R1.40 ICCCCCOCCC1CCCC1 34a_200012148887_100000760354 [1,0,0,1,0,0|2,0,0]=4 16949 B14R1.40 ICCCCCOCCC1CCCC1 7a_200012148887_100000760354 [1,0,0,1,0,0|2,0,0]=4 16950 B14R1.40 ICCCCOCCCC1CCCC1 34a_200012148704_100011713738 [1,0,0,1,0,0|2,0,0]=4 16951 B14R1.40 NCCCCCCCOC1CCCC1 34a_100011996573_100000179811 [1,0,0,1,0,0|2,0,0]=4 16952 B14R1.40 NCCCCCCOCC1CCCC1 34a_100000686447_100000740388 [1,0,0,1,0,0|2,0,0]=4 16953 B14R1.40 NCCCCCOCCC1CCCC1 34a_100000762737_100000760354 [1,0,0,1,0,0|2,0,0]=4 16954 B14R1.40 NCCCCOCCCC1CCCC1 34a_100000750430_100011713738 [1,0,0,1,0,0|2,0,0]=4 16955 B14R1.40 O=CCCCCCNCC1CCCC1 2230a_100000737975_100000139337 [1,0,0,1,0,0|1,0,0]=3 16956 B14R1.40 O=CCCCCCNCC1CCOC1 2230a_100000737293_100000139337 [1,0,0,1,0,0|2,0,0]=4 16957 B14R1.40 O=CCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000139337 [1,0,0,1,0,0|2,0,0]=4 16958 B14R1.40 O=CCCCCCOCC1CCCC1 7a_100000742336_100000139337 [1,0,0,1,0,0|1,0,0]=3 16959 B14R1.40 O=CCCCCCOCC1CCCO1 7a_100000210270_100000139337 [1,0,0,1,0,0|2,0,0]=4 16960 B14R1.40 O=CCCCCCSCC1CCCC1 62a_100000139337_100000740388 [1,0,0,1,0,0|1,0,0]=3 16961 B14R1.40 O=CCCCCCSCC1CCCC1 62a_100000740388_100000139337 [1,0,0,1,0,0|1,0,0]=3 16962 B14R1.40 O=CCCCCCSCC1CCCO1 62a_100000139337_100000203698 [1,0,0,1,0,0|2,0,0]=4 16963 B14R1.40 O=CCCCCCSCC1CCCO1 62a_100000203698_100000139337 [1,0,0,1,0,0|2,0,0]=4 16964 B14R1.40 O=CCCCCCSCC1CCOC1 62a_100000139337_100000702531 [1,0,0,1,0,0|2,0,0]=4 16965 B14R1.40 O=CCCCCCSCC1CCOC1 62a_100000702531_100000139337 [1,0,0,1,0,0|2,0,0]=4 16966 B14R1.40 O=CCCCCNCCC1CCCC1 2230a_100000739158_100000139335 [1,0,0,1,0,0|1,0,0]=3 16967 B14R1.40 O=CCCCCOCCC1CCCC1 7a_100000749090_100000139335 [1,0,0,1,0,0|1,0,0]=3 16968 B14R1.40 O=CCCCCSCCC1CCCC1 62a_100000139335_100000760354 [1,0,0,1,0,0|1,0,0]=3 16969 B14R1.40 O=CCCCCSCCC1CCCC1 62a_100000760354_100000139335 [1,0,0,1,0,0|1,0,0]=3 16970 B14R1.40 O=CCCCCSCCN1CCCC1 62a_100000139335_100000004467 [1,0,0,1,0,0|2,0,0]=4 16971 B14R1.40 O=CCCCCSCCN1CCCC1 62a_100000700749_100000139335 [1,0,0,1,0,0|2,0,0]=4 16972 B14R1.40 O=CCCCNCCCC1CCCC1 2230a_100000736752_200011292268 [1,0,0,1,0,0|1,0,0]=3 16973 B14R1.40 O=CCCCOCCCC1CCCC1 7a_100011215328_200011292268 [1,0,0,1,0,0|1,0,0]=3 16974 B14R1.40 O=CCCCOCCOC1CCCC1 7a_100000738311_200011292268 [1,0,0,1,0,0|2,0,0]=4 16975 B14R1.40 O=CCCCSCCCC1CCCC1 62a_100011713738_200011292268 [1,0,0,1,0,0|1,0,0]=3 16976 B14R1.40 O=CCCCSCCCC1CCCC1 62a_200011292268_100011713738 [1,0,0,1,0,0|1,0,0]=3 16977 B14R1.40 O=CCCCSCCCN1CCCC1 62a_100016991639_200011292268 [1,0,0,1,0,0|2,0,0]=4 16978 B14R1.40 O=CCCCSCCCN1CCCC1 62a_200011292268_100011445909 [1,0,0,1,0,0|2,0,0]=4 16979 B14R1.40 OCCCCCCCCN1CCCC1 2230a_100000188435_100000033203 [1,0,0,1,0,0|1,0,1]=4 16980 B14R1.40 OCCCCCCCCN1CCCC1 269982a_100000188435_100000033203 [1,0,0,1,0,0|1,0,1]=4 16981 B14R1.40 OCCCCCCCNC1CCCC1 2230a_100000211070_100000760002 [1,0,0,1,0,0|1,0,1]=4 16982 B14R1.40 OCCCCCCCNC1CCCC1 2230a_100011996573_100000179811 [1,0,0,1,0,0|1,0,1]=4 16983 B14R1.40 OCCCCCCCNC1CCCC1 270004a_100011996573_100000210133 [1,0,0,1,0,0|1,0,1]=4 16984 B14R1.40 OCCCCCCCNC1CCCC1 34a_100000211070_100000760002 [1,0,0,1,0,0|1,0,1]=4 16985 B14R1.40 OCCCCCCCNC1CCCC1 34a_100011996573_100000179811 [1,0,0,1,0,0|1,0,1]=4 16986 B14R1.40 OCCCCCCCOC1CCCC1 34a_100000210269_100000760002 [1,0,0,1,0,0|1,0,1]=4 16987 B14R1.40 OCCCCCCCOC1CCCC1 7a_100000210269_100000760002 [1,0,0,1,0,0|1,0,1]=4 16988 B14R1.40 OCCCCCCCSC1CCCC1 62a_100000760002_100000179811 [1,0,0,1,0,0|1,0,1]=4 16989 B14R1.40 OCCCCCCCSC1CCCC1 62a_100011217020_100000760002 [1,0,0,1,0,0|1,0,1]=4 16990 B14R1.40 OCCCCCCNCC1CCCC1 2230a_100000686447_100000740388 [1,0,0,1,0,0|1,0,1]=4 16991 B14R1.40 OCCCCCCNCC1CCCC1 2230a_100000737975_100000766143 [1,0,0,1,0,0|1,0,1]=4 16992 B14R1.40 OCCCCCCNCC1CCCC1 269862a_100000686447_100000746403 [1,0,0,1,0,0|1,0,1]=4 16993 B14R1.40 OCCCCCCNCC1CCCC1 34a_100000686447_100000740388 [1,0,0,1,0,0|1,0,1]=4 16994 B14R1.40 OCCCCCCNCC1CCCC1 34a_100000737975_100000766143 [1,0,0,1,0,0|1,0,1]=4 16995 B14R1.40 OCCCCCCOCC1CCCC1 34a_100000742336_100000766143 [1,0,0,1,0,0|1,0,1]=4 16996 B14R1.40 OCCCCCCOCC1CCCC1 7a_100000742336_100000766143 [1,0,0,1,0,0|1,0,1]=4 16997 B14R1.40 OCCCCCCSCC1CCCC1 62a_100000740388_100000766143 [1,0,0,1,0,0|1,0,1]=4 16998 B14R1.40 OCCCCCCSCC1CCCC1 62a_100000766143_100000740388 [1,0,0,1,0,0|1,0,1]=4 16999 B14R1.40 OCCCCCNCCC1CCCC1 2230a_100000739158_100000746330 [1,0,0,1,0,0|1,0,1]=4 17000 B14R1.40 OCCCCCNCCC1CCCC1 2230a_100000762737_100000760354 [1,0,0,1,0,0|1,0,1]=4 17001 B14R1.40 OCCCCCNCCC1CCCC1 34a_100000739158_100000746330 [1,0,0,1,0,0|1,0,1]=4 17002 B14R1.40 OCCCCCNCCC1CCCC1 34a_100000762737_100000760354 [1,0,0,1,0,0|1,0,1]=4 17003 B14R1.40 OCCCCCOCCC1CCCC1 34a_100000749090_100000746330 [1,0,0,1,0,0|1,0,1]=4 17004 B14R1.40 OCCCCCOCCC1CCCC1 7a_100000749090_100000746330 [1,0,0,1,0,0|1,0,1]=4 17005 B14R1.40 OCCCCCSCCC1CCCC1 62a_100000746330_100000760354 [1,0,0,1,0,0|1,0,1]=4 17006 B14R1.40 OCCCCCSCCC1CCCC1 62a_100000760354_100000746330 [1,0,0,1,0,0|1,0,1]=4 17007 B14R1.40 OCCCCNCCCC1CCCC1 2230a_100000736752_100000210776 [1,0,0,1,0,0|1,0,1]=4 17008 B14R1.40 OCCCCNCCCC1CCCC1 2230a_100000750430_100011713738 [1,0,0,1,0,0|1,0,1]=4 17009 B14R1.40 OCCCCNCCCC1CCCC1 34a_100000736752_100011216708 [1,0,0,1,0,0|1,0,1]=4 17010 B14R1.40 OCCCCNCCCC1CCCC1 34a_100000750430_100011713738 [1,0,0,1,0,0|1,0,1]=4 17011 B14R1.40 OCCCCOCCCC1CCCC1 34a_100011215328_100011216708 [1,0,0,1,0,0|1,0,1]=4 17012 B14R1.40 OCCCCOCCCC1CCCC1 7a_100011215328_100000210776 [1,0,0,1,0,0|1,0,1]=4 17013 B14R1.40 OCCCCSCCCC1CCCC1 62a_100000210776_100011713738 [1,0,0,1,0,0|1,0,1]=4 17014 B14R1.40 OCCCCSCCCC1CCCC1 62a_100011713738_100000210776 [1,0,0,1,0,0|1,0,1]=4 17015 B14R1.62 C=CCCCCCN1CCCC1CC 2230a_100000754278_100000700193 [1,0,0,1,0,0|1,0,1]=4 17016 B14R1.62 C=CCCCCCN1CCCC1CC 269982a_100000754278_100000700193 [1,0,0,1,0,0|1,0,1]=4 17017 B14R1.62 C=CCCCCCN1CCCC1CC 34a_100000754278_100000700193 [1,0,0,1,0,0|1,0,1]=4 17018 B14R1.62 C=CCCCCNC1CCCC1CC 269862a_100000703577_100000749056 [1,0,0,1,0,0|1,0,1]=4 17019 B14R1.62 C=CCCCCNC1CCCC1CC 270004a_100000703577_100000749056 [1,0,0,1,0,0|1,0,1]=4 17020 B14R1.62 CCC1CCCC1NCCCCCO 269862a_100000762737_100000749056 [1,0,0,1,0,0|1,0,1]=4 17021 B14R1.62 CCC1CCCC1NCCCCCO 270004a_100000762737_100000749056 [1,0,0,1,0,0|1,0,1]=4 17022 B14R1.62 CCC1CCCN1CCCCCC=O 2230a_100000754278_100000139337 [1,0,0,1,0,0|1,0,0]=3 17023 B14R1.62 CCC1CCCN1CCCCCC=O 269982a_100000754278_100000139337 [1,0,0,1,0,0|1,0,0]=3 17024 B14R1.62 CCC1CCCN1CCCCCCF 2230a_100000754278_100015922095 [1,0,0,1,0,0|2,0,0]=4 17025 B14R1.62 CCC1CCCN1CCCCCCF 269982a_100000754278_100015922095 [1,0,0,1,0,0|2,0,0]=4 17026 B14R1.62 CCC1CCCN1CCCCCCF 34a_100000754278_100015922095 [1,0,0,1,0,0|2,0,0]=4 17027 B14R1.62 CCC1CCCN1CCCCCCO 2230a_100000754278_100000766143 [1,0,0,1,0,0|1,0,1]=4 17028 B14R1.62 CCC1CCCN1CCCCCCO 269982a_100000754278_100000766143 [1,0,0,1,0,0|1,0,1]=4 17029 B14R1.62 CCC1CCCN1CCCCCCO 34a_100000754278_100000766143 [1,0,0,1,0,0|1,0,1]=4 17030 B14R1.62 CCCCCCCC1CCCC1NC 269862a_106832991636_200011216720 [1,0,0,1,0,0|1,0,1]=4 17031 B14R1.62 CCCCCCCC1CCCC1NC 270004a_106832991635_200011216720 [1,0,0,1,0,0|1,0,1]=4 17032 B14R1.62 CCCCCCCN1CCCC1CC 2230a_100000754278_100000210681 [1,0,0,1,0,0|1,0,1]=4 17033 B14R1.62 CCCCCCCN1CCCC1CC 269982a_100000754278_100000210681 [1,0,0,1,0,0|1,0,1]=4 17034 B14R1.62 CCCCCCCN1CCCC1CC 34a_100000754278_100000210614 [1,0,0,1,0,0|1,0,1]=4 17035 B14R1.62 CCCCCCCN1CCC[C@@H]1CO 2230a_100000745186_100000210681 [1,0,0,1,0,0|1,0,1]=4 17036 B14R1.62 CCCCCCCN1CCC[C@@H]1CO 269982a_100000745186_100000210681 [1,0,0,1,0,0|1,0,1]=4 17037 B14R1.62 CCCCCCCN1CCC[C@@H]1CO 34a_100000745186_100000210614 [1,0,0,1,0,0|1,0,1]=4 17038 B14R1.62 CCCCCCNC1CCCC1CC 269862a_100000210581_100000749056 [1,0,0,1,0,0|1,0,1]=4 17039 B14R1.62 CCCCCCNC1CCCC1CC 270004a_100000210581_100000749056 [1,0,0,1,0,0|1,0,1]=4 17040 B14R1.62 CCN1CCCC1CNCCCC=O 2230a_100000211693_200011292268 [1,0,0,1,0,0|2,0,0]=4 17041 B14R1.62 CCN1CCC[C@@H]1COCCCC=O 7a_100011739246_200011292268 [1,0,0,1,0,0|2,0,0]=4 17042 B14R1.62 O=CCCCCCN1CCC[C@@H]1CO 2230a_100000745186_100000139337 [1,0,0,1,0,0|2,0,0]=4 17043 B14R1.62 O=CCCCCCN1CCC[C@@H]1CO 269982a_100000745186_100000139337 [1,0,0,1,0,0|2,0,0]=4 17044 B14R1.123 BrCCCCCCOC1CCCCC1 34a_100011215345_100000210327 [1,0,0,1,0,0|2,0,0]=4 17045 B14R1.123 BrCCCCCCOC1CCCCC1 7a_100011215345_100000210327 [1,0,0,1,0,0|2,0,0]=4 17046 B14R1.123 BrCCCCCOCC1CCCCC1 34a_100000746331_100000211423 [1,0,0,1,0,0|2,0,0]=4 17047 B14R1.123 BrCCCCCOCC1CCCCC1 7a_100000746331_100000211423 [1,0,0,1,0,0|2,0,0]=4 17048 B14R1.123 BrCCCCOCCC1CCCCC1 34a_100011216708_100011209188 [1,0,0,1,0,0|2,0,0]=4 17049 B14R1.123 BrCCCOCCCC1CCCCC1 34a_100011217188_100011713725 [1,0,0,1,0,0|2,0,0]=4 17050 B14R1.123 C=CCCCCCNC1CCCCC1 2230a_100000182618_100000700193 [1,0,0,1,0,0|1,0,1]=4 17051 B14R1.123 C=CCCCCCNC1CCCCC1 34a_100000182618_100000700193 [1,0,0,1,0,0|1,0,1]=4 17052 B14R1.123 C=CCCCCCOC1CCCCC1 34a_100000210231_100000700193 [1,0,0,1,0,0|1,0,1]=4 17053 B14R1.123 C=CCCCCCOC1CCCCC1 34a_100011216702_100000210327 [1,0,0,1,0,0|1,0,1]=4 17054 B14R1.123 C=CCCCCCOC1CCCCC1 7a_100000210231_100000700193 [1,0,0,1,0,0|1,0,1]=4 17055 B14R1.123 C=CCCCCCOC1CCCCC1 7a_100011216702_100000210327 [1,0,0,1,0,0|1,0,1]=4 17056 B14R1.123 C=CCCCCCSC1CCCCC1 62a_100000210327_100000700193 [1,0,0,1,0,0|1,0,1]=4 17057 B14R1.123 C=CCCCCCSC1CCCCC1 62a_100000700193_100000210327 [1,0,0,1,0,0|1,0,1]=4 17058 B14R1.123 C=CCCCCNCC1CCCCC1 2230a_100000210473_100011215482 [1,0,0,1,0,0|1,0,1]=4 17059 B14R1.123 C=CCCCCNCC1CCCCC1 2230a_100000703577_100000211423 [1,0,0,1,0,0|1,0,1]=4 17060 B14R1.123 C=CCCCCNCC1CCCCC1 269862a_100000703577_100000211278 [1,0,0,1,0,0|1,0,1]=4 17061 B14R1.123 C=CCCCCNCC1CCCCC1 34a_100000210473_100011215482 [1,0,0,1,0,0|1,0,1]=4 17062 B14R1.123 C=CCCCCNCC1CCCCC1 34a_100000703577_100000211423 [1,0,0,1,0,0|1,0,1]=4 17063 B14R1.123 C=CCCCCOCC1CCCCC1 34a_100000212181_100011215482 [1,0,0,1,0,0|1,0,1]=4 17064 B14R1.123 C=CCCCCOCC1CCCCC1 34a_100000766645_100000211423 [1,0,0,1,0,0|1,0,1]=4 17065 B14R1.123 C=CCCCCOCC1CCCCC1 7a_100000212181_100011215482 [1,0,0,1,0,0|1,0,1]=4 17066 B14R1.123 C=CCCCCOCC1CCCCC1 7a_100000766645_100000211423 [1,0,0,1,0,0|1,0,1]=4 17067 B14R1.123 C=CCCCCSCC1CCCCC1 62a_100000211423_100011215482 [1,0,0,1,0,0|1,0,1]=4 17068 B14R1.123 C=CCCCCSCC1CCCCC1 62a_100011215482_100000211423 [1,0,0,1,0,0|1,0,1]=4 17069 B14R1.123 C=CCCCNCCC1CCCCC1 2230a_100000700776_100012355289 [1,0,0,1,0,0|1,0,1]=4 17070 B14R1.123 C=CCCCNCCC1CCCCC1 2230a_100000738074_100011713584 [1,0,0,1,0,0|1,0,1]=4 17071 B14R1.123 C=CCCCNCCC1CCCCC1 270004a_100000700776_100011713444 [1,0,0,1,0,0|1,0,1]=4 17072 B14R1.123 C=CCCCNCCC1CCCCC1 34a_100000700776_100011209188 [1,0,0,1,0,0|1,0,1]=4 17073 B14R1.123 C=CCCCNCCC1CCCCC1 34a_100000738074_100000757094 [1,0,0,1,0,0|1,0,1]=4 17074 B14R1.123 C=CCCCOCCC1CCCCC1 34a_100000758997_100011209188 [1,0,0,1,0,0|1,0,1]=4 17075 B14R1.123 C=CCCCOCCC1CCCCC1 34a_100011217863_100000757094 [1,0,0,1,0,0|1,0,1]=4 17076 B14R1.123 C=CCCCOCCC1CCCCC1 7a_100000758997_100011273959 [1,0,0,1,0,0|1,0,1]=4 17077 B14R1.123 C=CCCCOCCC1CCCCC1 7a_100011217863_100000757094 [1,0,0,1,0,0|1,0,1]=4 17078 B14R1.123 C=CCCCSCCC1CCCCC1 62a_100011713584_100012355289 [1,0,0,1,0,0|1,0,1]=4 17079 B14R1.123 C=CCCCSCCC1CCCCC1 62a_100012355289_100000757094 [1,0,0,1,0,0|1,0,1]=4 17080 B14R1.123 C=CCCNCCCC1CCCCC1 2230a_100011211642_100000754431 [1,0,0,1,0,0|1,0,1]=4 17081 B14R1.123 C=CCCNCCCC1CCCCC1 2230a_100015191253_100011713725 [1,0,0,1,0,0|1,0,1]=4 17082 B14R1.123 C=CCCNCCCC1CCCCC1 34a_100011211642_100000754431 [1,0,0,1,0,0|1,0,1]=4 17083 B14R1.123 C=CCCOCCCC1CCCCC1 34a_100000198086_100000754431 [1,0,0,1,0,0|1,0,1]=4 17084 B14R1.123 C=CCCOCCCC1CCCCC1 34a_100011205117_100011713725 [1,0,0,1,0,0|1,0,1]=4 17085 B14R1.123 C=CCCOCCCC1CCCCC1 7a_100000198086_100000754431 [1,0,0,1,0,0|1,0,1]=4 17086 B14R1.123 C=CCCSCCCC1CCCCC1 62a_100000754431_100011713725 [1,0,0,1,0,0|1,0,1]=4 17087 B14R1.123 C=CCCSCCCC1CCCCC1 62a_100011713725_100000754431 [1,0,0,1,0,0|1,0,1]=4 17088 B14R1.123 C=CCOCCCCC1CCCCC1 34a_100011215267_100015514636 [1,0,0,1,0,0|1,0,1]=4 17089 B14R1.123 C=CCOCCCCC1CCCCC1 7a_100011215267_100015514636 [1,0,0,1,0,0|1,0,1]=4 17090 B14R1.123 CCCCCCCNC1C=CCCC1 2230a_100000229938_100000751183 [1,0,0,1,0,0|1,0,1]=4 17091 B14R1.123 CCCCCCCNC1CCCCC1 2230a_100000182618_100000210681 [1,0,0,1,0,0|1,0,1]=4 17092 B14R1.123 CCCCCCCNC1CCCCC1 270004a_100000229938_100000210434 [1,0,0,1,0,0|1,0,1]=4 17093 B14R1.123 CCCCCCCNC1CCCCC1 34a_100000182618_100000210614 [1,0,0,1,0,0|1,0,1]=4 17094 B14R1.123 CCCCCCCOC1C=CCCC1 34a_100011215024_100000210614 [1,0,0,1,0,0|1,0,1]=4 17095 B14R1.123 CCCCCCCOC1C=CCCC1 7a_100000210272_100000751183 [1,0,0,1,0,0|1,0,1]=4 17096 B14R1.123 CCCCCCCOC1CCCCC1 34a_100000210231_100000210614 [1,0,0,1,0,0|1,0,1]=4 17097 B14R1.123 CCCCCCCOC1CCCCC1 34a_100000210272_100000210327 [1,0,0,1,0,0|1,0,1]=4 17098 B14R1.123 CCCCCCCOC1CCCCC1 7a_100000210231_100000210614 [1,0,0,1,0,0|1,0,1]=4 17099 B14R1.123 CCCCCCCOC1CCCCC1 7a_100000210272_100000210327 [1,0,0,1,0,0|1,0,1]=4 17100 B14R1.123 CCCCCCCOC1CCCCO1 34a_100000033831_100000210614 [1,0,0,1,0,0|1,0,1]=4 17101 B14R1.123 CCCCCCCSC1C=CCCC1 62a_100000210614_100000751183 [1,0,0,1,0,0|1,0,1]=4 17102 B14R1.123 CCCCCCCSC1C=CCCC1 62a_100000751183_100000210316 [1,0,0,1,0,0|1,0,1]=4 17103 B14R1.123 CCCCCCCSC1CCCCC1 62a_100000210327_100000210316 [1,0,0,1,0,0|1,0,1]=4 17104 B14R1.123 CCCCCCCSC1CCCCC1 62a_100000210614_100000210327 [1,0,0,1,0,0|1,0,1]=4 17105 B14R1.123 CCCCCCNCC1CCCCC1 2230a_100000210473_100000210314 [1,0,0,1,0,0|1,0,1]=4 17106 B14R1.123 CCCCCCNCC1CCCCC1 2230a_100000210581_100000211423 [1,0,0,1,0,0|1,0,1]=4 17107 B14R1.123 CCCCCCNCC1CCCCC1 269862a_100000210581_100000211278 [1,0,0,1,0,0|1,0,1]=4 17108 B14R1.123 CCCCCCNCC1CCCCC1 34a_100000210473_100000210314 [1,0,0,1,0,0|1,0,1]=4 17109 B14R1.123 CCCCCCNCC1CCCCO1 2230a_100000174945_100000210314 [1,0,0,1,0,0|1,0,1]=4 17110 B14R1.123 CCCCCCNCC1CCCCO1 2230a_100000210581_100000211543 [1,0,0,1,0,0|1,0,1]=4 17111 B14R1.123 CCCCCCNCC1CCCCO1 34a_100000174945_100000210314 [1,0,0,1,0,0|1,0,1]=4 17112 B14R1.123 CCCCCCOCC1CCCCC1 34a_100000210259_100000211423 [1,0,0,1,0,0|1,0,1]=4 17113 B14R1.123 CCCCCCOCC1CCCCC1 34a_100000212181_100000210314 [1,0,0,1,0,0|1,0,1]=4 17114 B14R1.123 CCCCCCOCC1CCCCC1 7a_100000210259_100000211423 [1,0,0,1,0,0|1,0,1]=4 17115 B14R1.123 CCCCCCOCC1CCCCC1 7a_100000212181_100000210314 [1,0,0,1,0,0|1,0,1]=4 17116 B14R1.123 CCCCCCOCC1CCCCN1 34a_100000210821_100000210314 [1,0,0,1,0,0|2,0,0]=4 17117 B14R1.123 CCCCCCOCC1CCCCO1 34a_100000210259_100000211543 [1,0,0,1,0,0|1,0,1]=4 17118 B14R1.123 CCCCCCOCC1CCCCO1 34a_100000211370_100000210314 [1,0,0,1,0,0|1,0,1]=4 17119 B14R1.123 CCCCCCOCC1CCCCO1 7a_100000210259_100000211543 [1,0,0,1,0,0|1,0,1]=4 17120 B14R1.123 CCCCCCOCC1CCCCO1 7a_100000211370_100000210314 [1,0,0,1,0,0|1,0,1]=4 17121 B14R1.123 CCCCCCSCC1CCCCC1 62a_100000210314_100000211423 [1,0,0,1,0,0|1,0,1]=4 17122 B14R1.123 CCCCCCSCC1CCCCC1 62a_100000211423_100000210757 [1,0,0,1,0,0|1,0,1]=4 17123 B14R1.123 CCCCCCSCC1CCCCO1 62a_100000210314_100000211543 [1,0,0,1,0,0|1,0,1]=4 17124 B14R1.123 CCCCCCSCC1CCCCO1 62a_100000211543_100000210757 [1,0,0,1,0,0|1,0,1]=4 17125 B14R1.123 CCCCCNCCC1=CCCCC1 2230a_100000212019_100000210326 [1,0,0,1,0,0|1,0,1]=4 17126 B14R1.123 CCCCCNCCC1=CCCCC1 34a_100000212019_100000718602 [1,0,0,1,0,0|1,0,1]=4 17127 B14R1.123 CCCCCNCCC1CCCCC1 2230a_100000209983_100012355289 [1,0,0,1,0,0|1,0,1]=4 17128 B14R1.123 CCCCCNCCC1CCCCC1 2230a_100000738074_100000210326 [1,0,0,1,0,0|1,0,1]=4 17129 B14R1.123 CCCCCNCCC1CCCCC1 270004a_100000209983_100011713444 [1,0,0,1,0,0|1,0,1]=4 17130 B14R1.123 CCCCCNCCC1CCCCC1 34a_100000738074_100000718602 [1,0,0,1,0,0|1,0,1]=4 17131 B14R1.123 CCCCCNCCC1CCCCO1 2230a_100015183643_100000210326 [1,0,0,1,0,0|1,0,1]=4 17132 B14R1.123 CCCCCNCCC1CCCCO1 34a_100015183643_100000718602 [1,0,0,1,0,0|1,0,1]=4 17133 B14R1.123 CCCCCOCCC1CCCCC1 34a_100000210253_100011209188 [1,0,0,1,0,0|1,0,1]=4 17134 B14R1.123 CCCCCOCCC1CCCCC1 34a_100011217863_100000718602 [1,0,0,1,0,0|1,0,1]=4 17135 B14R1.123 CCCCCOCCC1CCCCC1 7a_100000210253_100011273959 [1,0,0,1,0,0|1,0,1]=4 17136 B14R1.123 CCCCCOCCC1CCCCC1 7a_100011217863_100000210326 [1,0,0,1,0,0|1,0,1]=4 17137 B14R1.123 CCCCCOCCC1CCCCN1 34a_100000211664_100000718602 [1,0,0,1,0,0|2,0,0]=4 17138 B14R1.123 CCCCCSCCC1CCCCC1 62a_100000210326_100012355289 [1,0,0,1,0,0|1,0,1]=4 17139 B14R1.123 CCCCCSCCC1CCCCC1 62a_100012355289_100000210326 [1,0,0,1,0,0|1,0,1]=4 17140 B14R1.123 CCCCNCCCC1CCCCC1 2230a_100000102301_100011713725 [1,0,0,1,0,0|1,0,1]=4 17141 B14R1.123 CCCCNCCCC1CCCCC1 2230a_100011211642_100000210211 [1,0,0,1,0,0|1,0,1]=4 17142 B14R1.123 CCCCNCCCC1CCCCC1 34a_100011211642_100000210210 [1,0,0,1,0,0|1,0,1]=4 17143 B14R1.123 CCCCNCCCC1CCCCC1 7a_106832991798_100011713725 [1,0,0,1,0,0|1,0,1]=4 17144 B14R1.123 CCCCOCCCC1CCCCC1 34a_100000198086_100000210210 [1,0,0,1,0,0|1,0,1]=4 17145 B14R1.123 CCCCOCCCC1CCCCC1 34a_100000210227_100011713725 [1,0,0,1,0,0|1,0,1]=4 17146 B14R1.123 CCCCOCCCC1CCCCC1 7a_100000198086_100000210211 [1,0,0,1,0,0|1,0,1]=4 17147 B14R1.123 CCCCOCCCC1CCCCC1 7a_100000210227_100011713725 [1,0,0,1,0,0|1,0,1]=4 17148 B14R1.123 CCCCOCCCC1CCCCN1 34a_100011934581_100000210210 [1,0,0,1,0,0|2,0,0]=4 17149 B14R1.123 CCCCSCCCC1CCCCC1 62a_100000210211_100011713725 [1,0,0,1,0,0|1,0,1]=4 17150 B14R1.123 CCCCSCCCC1CCCCC1 62a_100011713725_100000210210 [1,0,0,1,0,0|1,0,1]=4 17151 B14R1.123 CCCOCCCCC1CCCCC1 34a_100011215267_100000210303 [1,0,0,1,0,0|1,0,1]=4 17152 B14R1.123 CCCOCCCCC1CCCCC1 7a_100011215267_100000210303 [1,0,0,1,0,0|1,0,1]=4 17153 B14R1.123 ClCCCCCCOC1CCCCC1 34a_100000766143_100000210327 [1,0,0,1,0,0|2,0,0]=4 17154 B14R1.123 ClCCCCCCOC1CCCCC1 7a_100000766143_100000210327 [1,0,0,1,0,0|2,0,0]=4 17155 B14R1.123 ClCCCCCOCC1CCCCC1 34a_100000746330_100000211423 [1,0,0,1,0,0|2,0,0]=4 17156 B14R1.123 ClCCCCCOCC1CCCCC1 7a_100000746330_100000211423 [1,0,0,1,0,0|2,0,0]=4 17157 B14R1.123 ClCCCCOCCC1CCCCC1 34a_100000210776_100011209188 [1,0,0,1,0,0|2,0,0]=4 17158 B14R1.123 ClCCCCOCCC1CCCCC1 7a_100000210776_100011273959 [1,0,0,1,0,0|2,0,0]=4 17159 B14R1.123 ClCCCOCCCC1CCCCC1 34a_100000230001_100011713725 [1,0,0,1,0,0|2,0,0]=4 17160 B14R1.123 FCCCCCCNC1CCCCC1 2230a_100000182618_100015922095 [1,0,0,1,0,0|2,0,0]=4 17161 B14R1.123 FCCCCCCNC1CCCCC1 34a_100000182618_100015922095 [1,0,0,1,0,0|2,0,0]=4 17162 B14R1.123 FCCCCCCOC1CCCCC1 34a_100000210231_100015922095 [1,0,0,1,0,0|2,0,0]=4 17163 B14R1.123 FCCCCCCOC1CCCCC1 34a_100000732779_100000210327 [1,0,0,1,0,0|2,0,0]=4 17164 B14R1.123 FCCCCCCOC1CCCCC1 7a_100000210231_100015922095 [1,0,0,1,0,0|2,0,0]=4 17165 B14R1.123 FCCCCCCOC1CCCCC1 7a_100000732779_100000210327 [1,0,0,1,0,0|2,0,0]=4 17166 B14R1.123 FCCCCCCSC1CCCCC1 62a_100000210327_100015922095 [1,0,0,1,0,0|2,0,0]=4 17167 B14R1.123 FCCCCCCSC1CCCCC1 62a_100015922095_100000210327 [1,0,0,1,0,0|2,0,0]=4 17168 B14R1.123 FCCCCCNCC1CCCCC1 2230a_100000210473_100000729378 [1,0,0,1,0,0|2,0,0]=4 17169 B14R1.123 FCCCCCNCC1CCCCC1 34a_100000210473_100000729378 [1,0,0,1,0,0|2,0,0]=4 17170 B14R1.123 FCCCCCOCC1CCCCC1 34a_100000212181_100000729378 [1,0,0,1,0,0|2,0,0]=4 17171 B14R1.123 FCCCCCOCC1CCCCC1 7a_100000212181_100000729378 [1,0,0,1,0,0|2,0,0]=4 17172 B14R1.123 FCCCCCSCC1CCCCC1 62a_100000211423_100000729378 [1,0,0,1,0,0|2,0,0]=4 17173 B14R1.123 FCCCCCSCC1CCCCC1 62a_100000729378_100000211423 [1,0,0,1,0,0|2,0,0]=4 17174 B14R1.123 FCCCCNCCC1CCCCC1 2230a_100000738074_100000729493 [1,0,0,1,0,0|2,0,0]=4 17175 B14R1.123 FCCCCNCCC1CCCCC1 34a_100000738074_100000729493 [1,0,0,1,0,0|2,0,0]=4 17176 B14R1.123 FCCCCOCCC1CCCCC1 34a_100011217863_100000729493 [1,0,0,1,0,0|2,0,0]=4 17177 B14R1.123 FCCCCOCCC1CCCCC1 34a_100011995726_100011209188 [1,0,0,1,0,0|2,0,0]=4 17178 B14R1.123 FCCCCOCCC1CCCCC1 7a_100011217863_100000729493 [1,0,0,1,0,0|2,0,0]=4 17179 B14R1.123 FCCCCOCCC1CCCCC1 7a_100011995726_100011273959 [1,0,0,1,0,0|2,0,0]=4 17180 B14R1.123 FCCCCSCCC1CCCCC1 62a_100000729493_100012355289 [1,0,0,1,0,0|2,0,0]=4 17181 B14R1.123 FCCCCSCCC1CCCCC1 62a_100012355289_100000729493 [1,0,0,1,0,0|2,0,0]=4 17182 B14R1.123 FCCCNCCCC1CCCCC1 2230a_100011211642_100011934791 [1,0,0,1,0,0|2,0,0]=4 17183 B14R1.123 FCCCNCCCC1CCCCC1 2230a_100015189416_100011713725 [1,0,0,1,0,0|2,0,0]=4 17184 B14R1.123 FCCCNCCCC1CCCCC1 34a_100011211642_100011934791 [1,0,0,1,0,0|2,0,0]=4 17185 B14R1.123 FCCCNCCCC1CCCCC1 34a_100015189416_100011713725 [1,0,0,1,0,0|2,0,0]=4 17186 B14R1.123 FCCCOCCCC1CCCCC1 34a_100000198086_100011934791 [1,0,0,1,0,0|2,0,0]=4 17187 B14R1.123 FCCCOCCCC1CCCCC1 34a_100000759539_100011713725 [1,0,0,1,0,0|2,0,0]=4 17188 B14R1.123 FCCCOCCCC1CCCCC1 7a_100000198086_100011934791 [1,0,0,1,0,0|2,0,0]=4 17189 B14R1.123 FCCCSCCCC1CCCCC1 62a_100011713725_100011934791 [1,0,0,1,0,0|2,0,0]=4 17190 B14R1.123 FCCCSCCCC1CCCCC1 62a_100011934791_100011713725 [1,0,0,1,0,0|2,0,0]=4 17191 B14R1.123 FCCOCCCCC1CCCCC1 34a_100011215267_100011217306 [1,0,0,1,0,0|2,0,0]=4 17192 B14R1.123 FCCOCCCCC1CCCCC1 7a_100011215267_100011217306 [1,0,0,1,0,0|2,0,0]=4 17193 B14R1.123 ICCCCCOCC1CCCCC1 34a_200012148887_100000211423 [1,0,0,1,0,0|2,0,0]=4 17194 B14R1.123 ICCCCCOCC1CCCCC1 7a_200012148887_100000211423 [1,0,0,1,0,0|2,0,0]=4 17195 B14R1.123 ICCCCOCCC1CCCCC1 34a_200012148704_100011209188 [1,0,0,1,0,0|2,0,0]=4 17196 B14R1.123 NCCCCCCOC1CCCCC1 34a_100000686447_100000210327 [1,0,0,1,0,0|2,0,0]=4 17197 B14R1.123 NCCCCCOCC1CCCCC1 34a_100000762737_100000211423 [1,0,0,1,0,0|2,0,0]=4 17198 B14R1.123 NCCCCOCCC1CCCCC1 34a_100000750430_100011209188 [1,0,0,1,0,0|2,0,0]=4 17199 B14R1.123 NCCCOCCCC1CCCCC1 34a_100000182051_100011713725 [1,0,0,1,0,0|2,0,0]=4 17200 B14R1.123 O=CCCCCCNC1CCCCC1 2230a_100000182618_100000139337 [1,0,0,1,0,0|1,0,0]=3 17201 B14R1.123 O=CCCCCCNC1CCCOC1 2230a_100000719290_100000139337 [1,0,0,1,0,0|2,0,0]=4 17202 B14R1.123 O=CCCCCCNC1CCOCC1 2230a_100000741149_100000139337 [1,0,0,1,0,0|2,0,0]=4 17203 B14R1.123 O=CCCCCCNC1CCSCC1 2230a_100000748639_100000139337 [1,0,0,1,0,0|2,0,0]=4 17204 B14R1.123 O=CCCCCCOC1CCCCC1 7a_100000210231_100000139337 [1,0,0,1,0,0|1,0,0]=3 17205 B14R1.123 O=CCCCCCOC1CCCSC1 7a_100015962668_100000139337 [1,0,0,1,0,0|2,0,0]=4 17206 B14R1.123 O=CCCCCCOC1CCSCC1 7a_100000731022_100000139337 [1,0,0,1,0,0|2,0,0]=4 17207 B14R1.123 O=CCCCCCSC1CCCCC1 62a_100000139337_100000210327 [1,0,0,1,0,0|1,0,0]=3 17208 B14R1.123 O=CCCCCCSC1CCCCC1 62a_100000210327_100000139337 [1,0,0,1,0,0|1,0,0]=3 17209 B14R1.123 O=CCCCCCSC1CCCOC1 62a_100000139337_100000693364 [1,0,0,1,0,0|2,0,0]=4 17210 B14R1.123 O=CCCCCCSC1CCOCC1 62a_100000139337_100011324220 [1,0,0,1,0,0|2,0,0]=4 17211 B14R1.123 O=CCCCCCSC1CCSCC1 62a_100000139337_100000069128 [1,0,0,1,0,0|2,0,0]=4 17212 B14R1.123 O=CCCCCNCC1CCCCC1 2230a_100000210473_100000139335 [1,0,0,1,0,0|1,0,0]=3 17213 B14R1.123 O=CCCCCNCC1CCCCO1 2230a_100000174945_100000139335 [1,0,0,1,0,0|2,0,0]=4 17214 B14R1.123 O=CCCCCNCC1CCCOC1 2230a_100000720124_100000139335 [1,0,0,1,0,0|2,0,0]=4 17215 B14R1.123 O=CCCCCNCC1CCOCC1 2230a_100000746373_100000139335 [1,0,0,1,0,0|2,0,0]=4 17216 B14R1.123 O=CCCCCNCC1CCSCC1 2230a_100015188806_100000139335 [1,0,0,1,0,0|2,0,0]=4 17217 B14R1.123 O=CCCCCOCC1CCCCC1 7a_100000212181_100000139335 [1,0,0,1,0,0|1,0,0]=3 17218 B14R1.123 O=CCCCCOCC1CCCCO1 7a_100000211370_100000139335 [1,0,0,1,0,0|2,0,0]=4 17219 B14R1.123 O=CCCCCOCC1CCSCC1 7a_100000070558_100000139335 [1,0,0,1,0,0|2,0,0]=4 17220 B14R1.123 O=CCCCCSCC1CCCCC1 62a_100000139335_100000211423 [1,0,0,1,0,0|1,0,0]=3 17221 B14R1.123 O=CCCCCSCC1CCCCC1 62a_100000211423_100000139335 [1,0,0,1,0,0|1,0,0]=3 17222 B14R1.123 O=CCCCCSCC1CCCCO1 62a_100000139335_100000211543 [1,0,0,1,0,0|2,0,0]=4 17223 B14R1.123 O=CCCCCSCC1CCCCO1 62a_100000211543_100000139335 [1,0,0,1,0,0|2,0,0]=4 17224 B14R1.123 O=CCCCCSCC1CCCOC1 62a_100000139335_100000741521 [1,0,0,1,0,0|2,0,0]=4 17225 B14R1.123 O=CCCCCSCC1CCCOC1 62a_100000741521_100000139335 [1,0,0,1,0,0|2,0,0]=4 17226 B14R1.123 O=CCCCCSCC1CCOCC1 62a_100000139335_100000749018 [1,0,0,1,0,0|2,0,0]=4 17227 B14R1.123 O=CCCCCSCC1CCOCC1 62a_100000754603_100000139335 [1,0,0,1,0,0|2,0,0]=4 17228 B14R1.123 O=CCCCNCCC1CCCCC1 2230a_100000738074_200011292268 [1,0,0,1,0,0|1,0,0]=3 17229 B14R1.123 O=CCCCNCCC1CCCCO1 2230a_100015183643_200011292268 [1,0,0,1,0,0|2,0,0]=4 17230 B14R1.123 O=CCCCNCCC1CCOCC1 2230a_100000755988_200011292268 [1,0,0,1,0,0|2,0,0]=4 17231 B14R1.123 O=CCCCOCCC1CCCCC1 7a_100011217863_200011292268 [1,0,0,1,0,0|1,0,0]=3 17232 B14R1.123 O=CCCCOCCC1CCOCC1 7a_100011933979_200011292268 [1,0,0,1,0,0|2,0,0]=4 17233 B14R1.123 O=CCCCSCCC1CCCCC1 62a_100012355289_200011292268 [1,0,0,1,0,0|1,0,0]=3 17234 B14R1.123 O=CCCCSCCC1CCCCC1 62a_200011292268_100012355289 [1,0,0,1,0,0|1,0,0]=3 17235 B14R1.123 O=CCCCSCCC1CCOCC1 62a_100011934994_200011292268 [1,0,0,1,0,0|2,0,0]=4 17236 B14R1.123 O=CCCCSCCC1CCOCC1 62a_200011292268_100011934994 [1,0,0,1,0,0|2,0,0]=4 17237 B14R1.123 O=CCCCSCCN1CCCCC1 62a_100000739454_200011292268 [1,0,0,1,0,0|2,0,0]=4 17238 B14R1.123 O=CCCCSCCN1CCCCC1 62a_200011292268_100000739454 [1,0,0,1,0,0|2,0,0]=4 17239 B14R1.123 O=CCCCSCOC1CCCCC1 62a_100011935260_200011292268 [1,0,0,1,0,0|2,0,0]=4 17240 B14R1.123 O=CCCCSCOC1CCCCC1 62a_200011292268_100011935260 [1,0,0,1,0,0|2,0,0]=4 17241 B14R1.123 O=CCNCCCOC1CCCCC1 34a_100000205933_200009817547 [1,0,0,1,0,0|2,0,0]=4 17242 B14R1.123 O=CCOCCCCC1CCCCC1 34a_100011215267_200009817547 [1,0,0,1,0,0|1,0,0]=3 17243 B14R1.123 O=CCOCCCCC1CCCCC1 7a_100011215267_200015260668 [1,0,0,1,0,0|1,0,0]=3 17244 B14R1.123 O=CCOCCCCC1CCNCC1 34a_100016989291_200009817547 [1,0,0,1,0,0|2,0,0]=4 17245 B14R1.123 OCCCCCCNC1CCCCC1 2230a_100000182618_100000766143 [1,0,0,1,0,0|1,0,1]=4 17246 B14R1.123 OCCCCCCNC1CCCCC1 270004a_100000686447_100000210434 [1,0,0,1,0,0|1,0,1]=4 17247 B14R1.123 OCCCCCCNC1CCCCC1 34a_100000182618_100000766143 [1,0,0,1,0,0|1,0,1]=4 17248 B14R1.123 OCCCCCCNC1CCCCC1 34a_100000686447_100000210327 [1,0,0,1,0,0|1,0,1]=4 17249 B14R1.123 OCCCCCCOC1CCCCC1 34a_100000210231_100000766143 [1,0,0,1,0,0|1,0,1]=4 17250 B14R1.123 OCCCCCCOC1CCCCC1 7a_100000210231_100000766143 [1,0,0,1,0,0|1,0,1]=4 17251 B14R1.123 OCCCCCCSC1CCCCC1 62a_100000210327_100000766143 [1,0,0,1,0,0|1,0,1]=4 17252 B14R1.123 OCCCCCCSC1CCCCC1 62a_100000766143_100000210327 [1,0,0,1,0,0|1,0,1]=4 17253 B14R1.123 OCCCCCNCC1CCCCC1 2230a_100000210473_100000746330 [1,0,0,1,0,0|1,0,1]=4 17254 B14R1.123 OCCCCCNCC1CCCCC1 2230a_100000762737_100000211423 [1,0,0,1,0,0|1,0,1]=4 17255 B14R1.123 OCCCCCNCC1CCCCC1 269862a_100000762737_100000211278 [1,0,0,1,0,0|1,0,1]=4 17256 B14R1.123 OCCCCCNCC1CCCCC1 34a_100000210473_100000746330 [1,0,0,1,0,0|1,0,1]=4 17257 B14R1.123 OCCCCCNCC1CCCCC1 34a_100000762737_100000211423 [1,0,0,1,0,0|1,0,1]=4 17258 B14R1.123 OCCCCCOCC1CCCCC1 34a_100000212181_100000746330 [1,0,0,1,0,0|1,0,1]=4 17259 B14R1.123 OCCCCCOCC1CCCCC1 7a_100000212181_100000746330 [1,0,0,1,0,0|1,0,1]=4 17260 B14R1.123 OCCCCCSCC1CCCCC1 62a_100000211423_100000746330 [1,0,0,1,0,0|1,0,1]=4 17261 B14R1.123 OCCCCCSCC1CCCCC1 62a_100000746330_100000211423 [1,0,0,1,0,0|1,0,1]=4 17262 B14R1.123 OCCCCNCCC1CCCCC1 2230a_100000738074_100000210776 [1,0,0,1,0,0|1,0,1]=4 17263 B14R1.123 OCCCCNCCC1CCCCC1 2230a_100000750430_100012355289 [1,0,0,1,0,0|1,0,1]=4 17264 B14R1.123 OCCCCNCCC1CCCCC1 270004a_100000750430_100011713444 [1,0,0,1,0,0|1,0,1]=4 17265 B14R1.123 OCCCCNCCC1CCCCC1 34a_100000738074_100011216708 [1,0,0,1,0,0|1,0,1]=4 17266 B14R1.123 OCCCCNCCC1CCCCC1 34a_100000750430_100011209188 [1,0,0,1,0,0|1,0,1]=4 17267 B14R1.123 OCCCCOCCC1CCCCC1 34a_100011217863_100011216708 [1,0,0,1,0,0|1,0,1]=4 17268 B14R1.123 OCCCCOCCC1CCCCC1 7a_100011217863_100000210776 [1,0,0,1,0,0|1,0,1]=4 17269 B14R1.123 OCCCCSCCC1CCCCC1 62a_100000210776_100012355289 [1,0,0,1,0,0|1,0,1]=4 17270 B14R1.123 OCCCCSCCC1CCCCC1 62a_100012355289_100000210776 [1,0,0,1,0,0|1,0,1]=4 17271 B14R1.123 OCCCNCCCC1CCCCC1 2230a_100011211642_100000230001 [1,0,0,1,0,0|1,0,1]=4 17272 B14R1.123 OCCCNCCCC1CCCCC1 34a_100011211642_100000230001 [1,0,0,1,0,0|1,0,1]=4 17273 B14R1.123 OCCCOCCCC1CCCCC1 34a_100000198086_100000230001 [1,0,0,1,0,0|1,0,1]=4 17274 B14R1.123 OCCCOCCCC1CCCCC1 7a_100000198086_100011215043 [1,0,0,1,0,0|1,0,1]=4 17275 B14R1.123 OCCCSCCCC1CCCCC1 62a_100011215043_100011713725 [1,0,0,1,0,0|1,0,1]=4 17276 B14R1.123 OCCCSCCCC1CCCCC1 62a_100011713725_100011215043 [1,0,0,1,0,0|1,0,1]=4 17277 B14R1.123 OCCOCCCCC1CCCCC1 34a_100011215267_100000211926 [1,0,0,1,0,0|1,0,1]=4 17278 B14R1.123 OCCOCCCCC1CCCCC1 7a_100011215267_100000211926 [1,0,0,1,0,0|1,0,1]=4 17279 B14R1.138 CCCCCNC1CCCCNC1=O 2230a_100000209983_100000735217 [1,0,0,1,0,0|2,0,0]=4 17280 B14R1.138 CCCCCNC1CCCCNC1=O 2230a_100000698827_100000210326 [1,0,0,1,0,0|2,0,0]=4 17281 B14R1.138 CCCCCNC1CCCCNC1=O 34a_100000698827_100000718602 [1,0,0,1,0,0|2,0,0]=4 17282 B14R1.138 CCCCCOC1CCCCCC1=O 7a_100000210253_100000243696 [1,0,0,1,0,0|1,0,0]=3 17283 B14R1.138 CCCCCOC1CCCCNC1=O 7a_100000210253_100000735217 [1,0,0,1,0,0|2,0,0]=4 17284 B14R1.138 CCCCCSC1CCCCCC1=O 62a_100000210326_100000243696 [1,0,0,1,0,0|1,0,0]=3 17285 B14R1.138 CCCCCSC1CCCCCC1=O 62a_100000243696_100000210326 [1,0,0,1,0,0|1,0,0]=3 17286 B14R1.138 CCCCCSC1CCCCNC1=O 62a_100000210326_100000735217 [1,0,0,1,0,0|2,0,0]=4 17287 B14R1.138 CCCCCSC1CCCCNC1=O 62a_100000735217_100000210326 [1,0,0,1,0,0|2,0,0]=4 17288 B14R1.138 CCNCCCN1CCCCCC1=O 2230a_100000195386_100000210202 [1,0,0,1,0,0|2,0,0]=4 17289 B14R1.138 CCNCCCN1CCCCCC1=O 34a_100000195386_100000210202 [1,0,0,1,0,0|2,0,0]=4 17290 B14R1.138 CCOCCOC1CCCCCC1=O 7a_100000210136_100000243696 [1,0,0,1,0,0|2,0,0]=4 17291 B14R1.138 CCOCCSC1CCCCCC1=O 62a_100000210147_100000243696 [1,0,0,1,0,0|2,0,0]=4 17292 B14R1.138 CCOCCSC1CCCCCC1=O 62a_100000243696_100011215890 [1,0,0,1,0,0|2,0,0]=4 17293 B14R1.138 CCSCCOC1CCCCCC1=O 7a_100000212035_100000243696 [1,0,0,1,0,0|2,0,0]=4 17294 B14R1.138 CCSCCSC1CCCCCC1=O 62a_100000243696_100000757381 [1,0,0,1,0,0|2,0,0]=4 17295 B14R1.138 CCSCCSC1CCCCCC1=O 62a_100000757381_100000243696 [1,0,0,1,0,0|2,0,0]=4 17296 B14R1.138 COCCCSC1CCCCCC1=O 62a_100000243696_100000709357 [1,0,0,1,0,0|2,0,0]=4 17297 B14R1.138 COCCCSC1CCCCCC1=O 62a_100000709357_100000243696 [1,0,0,1,0,0|2,0,0]=4 17298 B14R1.138 CSCCCOC1CCCCCC1=O 7a_100000690336_100000243696 [1,0,0,1,0,0|2,0,0]=4 17299 B14R1.138 O=C1CCCCCC1OCCCCCl 7a_100000210776_100000243696 [1,0,0,1,0,0|2,0,0]=4 17300 B14R1.138 O=C1CCCCCC1OCCCCF 7a_100011995726_100000243696 [1,0,0,1,0,0|2,0,0]=4 17301 B14R1.138 O=C1CCCCCC1SCCCCF 62a_100000243696_100000729493 [1,0,0,1,0,0|2,0,0]=4 17302 B14R1.138 O=C1CCCCCC1SCCCCF 62a_100000729493_100000243696 [1,0,0,1,0,0|2,0,0]=4 17303 B14R1.138 O=C1CCCCCC1SCCCCO 62a_100000210776_100000243696 [1,0,0,1,0,0|2,0,0]=4 17304 B14R1.138 O=C1CCCCCC1SCCCCO 62a_100000243696_100000210776 [1,0,0,1,0,0|2,0,0]=4 17305 B14R1.216 C=CCCCCCCN1CCC[C@@H]1C 2230a_100020605311_100011215473 [1,0,0,1,0,0|1,0,1]=4 17306 B14R1.216 C=CCCCCCCN1CCC[C@@H]1C 269982a_100020605311_100011215473 [1,0,0,1,0,0|1,0,1]=4 17307 B14R1.216 C=CCCCCCCN1CCC[C@H]1C 2230a_100015189458_100011215473 [1,0,0,1,0,0|1,0,1]=4 17308 B14R1.216 C=CCCCCCCN1CCC[C@H]1C 269982a_100015189458_100011215473 [1,0,0,1,0,0|1,0,1]=4 17309 B14R1.216 C=CCCCCCCN1CCC[C@H]1C 34a_100015189458_100011215473 [1,0,0,1,0,0|1,0,1]=4 17310 B14R1.216 C=CCCCCCOC1CCCC1C 34a_100011216460_100000700193 [1,0,0,1,0,0|1,0,1]=4 17311 B14R1.216 C=CCCCCCOC1CCCC1C 7a_100011216460_100000700193 [1,0,0,1,0,0|1,0,1]=4 17312 B14R1.216 CC1CCCC1NCCCCCCO 269862a_100000686447_100000752053 [1,0,0,1,0,0|1,0,1]=4 17313 B14R1.216 CC1CCCC1OCCCCCC=O 7a_100011216460_100000139337 [1,0,0,1,0,0|1,0,0]=3 17314 B14R1.216 CC1CCCC1OCCCCCCF 34a_100011216460_100015922095 [1,0,0,1,0,0|2,0,0]=4 17315 B14R1.216 CC1CCCC1OCCCCCCF 7a_100011216460_100015922095 [1,0,0,1,0,0|2,0,0]=4 17316 B14R1.216 CC1CCCC1OCCCCCCO 34a_100011216460_100000766143 [1,0,0,1,0,0|1,0,1]=4 17317 B14R1.216 CC1CCCC1OCCCCCCO 7a_100011216460_100000766143 [1,0,0,1,0,0|1,0,1]=4 17318 B14R1.216 CCCCCCCCN1CCC[C@@H]1C 2230a_100020605311_100000210759 [1,0,0,1,0,0|1,0,1]=4 17319 B14R1.216 CCCCCCCCN1CCC[C@@H]1C 269982a_100020605311_100000210759 [1,0,0,1,0,0|1,0,1]=4 17320 B14R1.216 CCCCCCCCN1CCC[C@H]1C 2230a_100015189458_100000210759 [1,0,0,1,0,0|1,0,1]=4 17321 B14R1.216 CCCCCCCCN1CCC[C@H]1C 269982a_100015189458_100000210759 [1,0,0,1,0,0|1,0,1]=4 17322 B14R1.216 CCCCCCCCN1CCC[C@H]1C 34a_100015189458_100000210759 [1,0,0,1,0,0|1,0,1]=4 17323 B14R1.216 CCCCCCCNC1CCCC1=O 2230a_100000229938_100000211823 [1,0,0,1,0,0|1,0,0]=3 17324 B14R1.216 CCCCCCCNC1CCCC1C 269862a_100000229938_100000752053 [1,0,0,1,0,0|1,0,1]=4 17325 B14R1.216 CCCCCCCNC1CCNC1=O 2230a_100016995588_100000210681 [1,0,0,1,0,0|2,0,0]=4 17326 B14R1.216 CCCCCCCNC1CCNC1=O 34a_100016995588_100000210614 [1,0,0,1,0,0|2,0,0]=4 17327 B14R1.216 CCCCCCCNC1CCOC1=O 2230a_100000229938_100000211211 [1,0,0,1,0,0|2,0,0]=4 17328 B14R1.216 CCCCCCCOC1CCCC1=O 34a_100000210272_100000709159 [1,0,0,1,0,0|1,0,0]=3 17329 B14R1.216 CCCCCCCOC1CCCC1=O 34a_200000719330_100000210614 [1,0,0,1,0,0|1,0,0]=3 17330 B14R1.216 CCCCCCCOC1CCCC1=O 7a_100000210272_100000211823 [1,0,0,1,0,0|1,0,0]=3 17331 B14R1.216 CCCCCCCOC1CCCC1C 34a_100011216460_100000210614 [1,0,0,1,0,0|1,0,1]=4 17332 B14R1.216 CCCCCCCOC1CCCC1C 7a_100011216460_100000210614 [1,0,0,1,0,0|1,0,1]=4 17333 B14R1.216 CCCCCCCOC1CCOC1=O 34a_100000210272_100000211211 [1,0,0,1,0,0|2,0,0]=4 17334 B14R1.216 CCCCCCCOC1CCOC1=O 7a_100000210272_100000211211 [1,0,0,1,0,0|2,0,0]=4 17335 B14R1.216 CCCCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000210614 [1,0,0,1,0,0|2,0,0]=4 17336 B14R1.216 CCCCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000210614 [1,0,0,1,0,0|2,0,0]=4 17337 B14R1.216 CCCCCCCO[C@H]1CCNC1=O 34a_100000688343_100000210614 [1,0,0,1,0,0|2,0,0]=4 17338 B14R1.216 CCCCCCCSC1CCCC1=O 62a_100000210614_100000211823 [1,0,0,1,0,0|1,0,0]=3 17339 B14R1.216 CCCCCCCSC1CCCC1=O 62a_100000211823_100000210316 [1,0,0,1,0,0|1,0,0]=3 17340 B14R1.216 CCCCCCCSC1CCOC1=O 62a_100000210614_100000211211 [1,0,0,1,0,0|2,0,0]=4 17341 B14R1.216 CCCCCCCSC1CCOC1=O 62a_100000211211_100000210316 [1,0,0,1,0,0|2,0,0]=4 17342 B14R1.216 CCCCCCCS[C@@H]1CCC[C@H]1O 62a_100000210614_200016002552 [1,0,0,1,0,0|1,0,1]=4 17343 B14R1.216 CCCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000210316 [1,0,0,1,0,0|1,0,1]=4 17344 B14R1.216 CCCCCCOCC1CCNC1=O 34a_100000133458_100000210314 [1,0,0,1,0,0|2,0,0]=4 17345 B14R1.216 CCCCCCSCN1CCCC1=O 62a_100000026320_100000210757 [1,0,0,1,0,0|2,0,0]=4 17346 B14R1.216 CCCCCCSCN1CCCC1=O 62a_100000210314_100000026320 [1,0,0,1,0,0|2,0,0]=4 17347 B14R1.216 CCCCCNCCN1CCCC1=O 2230a_100000209983_100000739059 [1,0,0,1,0,0|2,0,0]=4 17348 B14R1.216 CCCCCNCCN1CCCC1=O 2230a_100011200922_100000210326 [1,0,0,1,0,0|2,0,0]=4 17349 B14R1.216 CCCCCOCCN1CCCC1=O 34a_100000210253_100000739059 [1,0,0,1,0,0|2,0,0]=4 17350 B14R1.216 CCCCCOCCN1CCCC1=O 34a_100000211209_100000718602 [1,0,0,1,0,0|2,0,0]=4 17351 B14R1.216 CCCCCOCCN1CCCC1=O 7a_100000210253_100000739059 [1,0,0,1,0,0|2,0,0]=4 17352 B14R1.216 CCCCCOCCN1CCCC1=O 7a_100000211209_100000210326 [1,0,0,1,0,0|2,0,0]=4 17353 B14R1.216 CCCCCSCCN1CCCC1=O 62a_100000210326_100000739059 [1,0,0,1,0,0|2,0,0]=4 17354 B14R1.216 CCCCCSCCN1CCCC1=O 62a_100000739059_100000210326 [1,0,0,1,0,0|2,0,0]=4 17355 B14R1.216 CCCCNCCCN1CCCC1=O 2230a_100000210347_100000210211 [1,0,0,1,0,0|2,0,0]=4 17356 B14R1.216 CCCCNCCCN1CCCC1=O 34a_100000210347_100000210210 [1,0,0,1,0,0|2,0,0]=4 17357 B14R1.216 CCCCOCCCN1CCCC1=O 34a_100011216539_100000210210 [1,0,0,1,0,0|2,0,0]=4 17358 B14R1.216 CCCCOCCCN1CCCC1=O 7a_100011216539_100000210211 [1,0,0,1,0,0|2,0,0]=4 17359 B14R1.216 CCCCOCCOC1CCCC1=O 34a_100000210238_100000709159 [1,0,0,1,0,0|2,0,0]=4 17360 B14R1.216 CCCCOCCOC1CCCC1=O 34a_200000719330_100000743108 [1,0,0,1,0,0|2,0,0]=4 17361 B14R1.216 CCCCOCCOC1CCCC1=O 7a_100000210238_100000211823 [1,0,0,1,0,0|2,0,0]=4 17362 B14R1.216 CCCCOCCSC1CCCC1=O 62a_100000211823_100000743108 [1,0,0,1,0,0|2,0,0]=4 17363 B14R1.216 CCCCOCCSC1CCCC1=O 62a_100000743108_100000211823 [1,0,0,1,0,0|2,0,0]=4 17364 B14R1.216 CCCCSCCNC1CCCC1=O 2230a_100025743550_100000211823 [1,0,0,1,0,0|2,0,0]=4 17365 B14R1.216 CCCCSCCOC1CCCC1=O 34a_200000230436_100000709159 [1,0,0,1,0,0|2,0,0]=4 17366 B14R1.216 CCCCSCCOC1CCCC1=O 7a_200000230436_100000211823 [1,0,0,1,0,0|2,0,0]=4 17367 B14R1.216 CCCOCCCNC1CCCC1=O 2230a_100011217757_100000211823 [1,0,0,1,0,0|2,0,0]=4 17368 B14R1.216 CCCOCCCNC1CCCC1=O 34a_100011217757_100000709159 [1,0,0,1,0,0|2,0,0]=4 17369 B14R1.216 CN1CCCC1CCOCCCC=O 7a_100011215177_200011292268 [1,0,0,1,0,0|2,0,0]=4 17370 B14R1.216 CN1CCCC1CCSCCCC=O 62a_100000005710_200011292268 [1,0,0,1,0,0|2,0,0]=4 17371 B14R1.216 CN1CCCC1CCSCCCC=O 62a_200011292268_100000005710 [1,0,0,1,0,0|2,0,0]=4 17372 B14R1.216 CNCCCCCOC1CCCC1=O 34a_100000722520_100000709159 [1,0,0,1,0,0|2,0,0]=4 17373 B14R1.216 COCCCCCNC1CCCC1=O 2230a_100000747528_100000211823 [1,0,0,1,0,0|2,0,0]=4 17374 B14R1.216 COCCCCCNC1CCCC1=O 34a_100000747528_100000709159 [1,0,0,1,0,0|2,0,0]=4 17375 B14R1.216 C[C@@H]1CCCN1CCCCCCCO 2230a_100015189458_100000760002 [1,0,0,1,0,0|1,0,1]=4 17376 B14R1.216 C[C@@H]1CCCN1CCCCCCCO 269982a_100015189458_100000760002 [1,0,0,1,0,0|1,0,1]=4 17377 B14R1.216 C[C@@H]1CCCN1CCCCCCCO 34a_100015189458_100000760002 [1,0,0,1,0,0|1,0,1]=4 17378 B14R1.216 C[C@H]1CCCN1CCCCCCCO 2230a_100020605311_100000760002 [1,0,0,1,0,0|1,0,1]=4 17379 B14R1.216 C[C@H]1CCCN1CCCCCCCO 269982a_100020605311_100000760002 [1,0,0,1,0,0|1,0,1]=4 17380 B14R1.216 NCCCCCCOC1CCCC1=O 34a_100000686447_100000709159 [1,0,0,1,0,0|2,0,0]=4 17381 B14R1.216 O=C1CCCC1NCCCCCCO 2230a_100000686447_100000211823 [1,0,0,1,0,0|2,0,0]=4 17382 B14R1.216 O=C1CCCC1NCCCCCCO 34a_100000686447_100000709159 [1,0,0,1,0,0|2,0,0]=4 17383 B14R1.216 O=C1CCCC1OCCCCCCBr 34a_100011215345_100000709159 [1,0,0,1,0,0|2,0,0]=4 17384 B14R1.216 O=C1CCCC1OCCCCCCBr 7a_100011215345_100000211823 [1,0,0,1,0,0|2,0,0]=4 17385 B14R1.216 O=C1CCCC1OCCCCCCCl 34a_100000766143_100000709159 [1,0,0,1,0,0|2,0,0]=4 17386 B14R1.216 O=C1CCCC1OCCCCCCCl 7a_100000766143_100000211823 [1,0,0,1,0,0|2,0,0]=4 17387 B14R1.216 O=C1CCCC1OCCCCCCF 34a_100000732779_100000709159 [1,0,0,1,0,0|2,0,0]=4 17388 B14R1.216 O=C1CCCC1OCCCCCCF 34a_200000719330_100015922095 [1,0,0,1,0,0|2,0,0]=4 17389 B14R1.216 O=C1CCCC1OCCCCCCF 7a_100000732779_100000211823 [1,0,0,1,0,0|2,0,0]=4 17390 B14R1.216 O=C1CCCC1OCCCCCCO 34a_200000719330_100000766143 [1,0,0,1,0,0|2,0,0]=4 17391 B14R1.216 O=C1CCCC1SCCCCCCF 62a_100000211823_100015922095 [1,0,0,1,0,0|2,0,0]=4 17392 B14R1.216 O=C1CCCC1SCCCCCCF 62a_100015922095_100000211823 [1,0,0,1,0,0|2,0,0]=4 17393 B14R1.216 O=C1CCCC1SCCCCCCO 62a_100000211823_100000766143 [1,0,0,1,0,0|2,0,0]=4 17394 B14R1.216 O=C1CCCC1SCCCCCCO 62a_100000766143_100000211823 [1,0,0,1,0,0|2,0,0]=4 17395 B14R1.216 O=CCCCCCS[C@@H]1CCC[C@H]1O 62a_100000139337_200016002552 [1,0,0,1,0,0|2,0,0]=4 17396 B14R1.216 O=CCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000139337 [1,0,0,1,0,0|2,0,0]=4 17397 B14R1.221 BrCCCCCCCCCOC1CC1 34a_100009813782_100000211595 [1,0,0,1,0,0|2,0,0]=4 17398 B14R1.221 BrCCCCCCCCOCC1CC1 34a_100009813846_100000742324 [1,0,0,1,0,0|2,0,0]=4 17399 B14R1.221 BrCCCCCCCCOCC1CC1 7a_100009813846_100000742324 [1,0,0,1,0,0|2,0,0]=4 17400 B14R1.221 BrCCCCCCCOCCC1CC1 34a_100000760002_100000694398 [1,0,0,1,0,0|2,0,0]=4 17401 B14R1.221 BrCCCCCCCOCCC1CC1 7a_100000760002_100000764125 [1,0,0,1,0,0|2,0,0]=4 17402 B14R1.221 C=CCCCCCCCCNC1CC1 34a_100000212008_100011933949 [1,0,0,1,0,0|1,0,1]=4 17403 B14R1.221 C=CCCCCCCCCOC1CC1 34a_100011215194_100000211595 [1,0,0,1,0,0|1,0,1]=4 17404 B14R1.221 C=CCCCCCCCCSC1CC1 62a_100011933949_100000211595 [1,0,0,1,0,0|1,0,1]=4 17405 B14R1.221 C=CCCCCCCCNCC1CC1 2230a_100000735609_100012355270 [1,0,0,1,0,0|1,0,1]=4 17406 B14R1.221 C=CCCCCCCCNCC1CC1 34a_100000735609_100012355270 [1,0,0,1,0,0|1,0,1]=4 17407 B14R1.221 C=CCCCCCCCOCC1CC1 34a_100000211283_100012355270 [1,0,0,1,0,0|1,0,1]=4 17408 B14R1.221 C=CCCCCCCCOCC1CC1 34a_100000730831_100000742324 [1,0,0,1,0,0|1,0,1]=4 17409 B14R1.221 C=CCCCCCCCOCC1CC1 7a_100000730831_100000742324 [1,0,0,1,0,0|1,0,1]=4 17410 B14R1.221 C=CCCCCCCCSCC1CC1 62a_100000756562_100012355270 [1,0,0,1,0,0|1,0,1]=4 17411 B14R1.221 C=CCCCCCCCSCC1CC1 62a_100012355270_100000742324 [1,0,0,1,0,0|1,0,1]=4 17412 B14R1.221 C=CCCCCCCNCCC1CC1 34a_100000764129_100011215473 [1,0,0,1,0,0|1,0,1]=4 17413 B14R1.221 C=CCCCCCCOCCC1CC1 34a_100000754188_100011215473 [1,0,0,1,0,0|1,0,1]=4 17414 B14R1.221 C=CCCCCCCOCCC1CC1 34a_200011216477_100000694398 [1,0,0,1,0,0|1,0,1]=4 17415 B14R1.221 C=CCCCCCCOCCC1CC1 7a_100000754188_100011215473 [1,0,0,1,0,0|1,0,1]=4 17416 B14R1.221 C=CCCCCCCOCCC1CC1 7a_200011216477_100000764125 [1,0,0,1,0,0|1,0,1]=4 17417 B14R1.221 C=CCCCCCCSCCC1CC1 62a_100000764125_100011215473 [1,0,0,1,0,0|1,0,1]=4 17418 B14R1.221 C=CCCCCCCSCCC1CC1 62a_100011215473_100000764125 [1,0,0,1,0,0|1,0,1]=4 17419 B14R1.221 CCCCCCCCCCNC1CC1 34a_100000212008_100000210320 [1,0,0,1,0,0|1,0,1]=4 17420 B14R1.221 CCCCCCCCCCNC1CC1 34a_100000684558_100000211595 [1,0,0,1,0,0|1,0,1]=4 17421 B14R1.221 CCCCCCCCCCOC1CC1 34a_100000210711_100000211595 [1,0,0,1,0,0|1,0,1]=4 17422 B14R1.221 CCCCCCCCCNCC1CC1 2230a_100000212291_100000742324 [1,0,0,1,0,0|1,0,1]=4 17423 B14R1.221 CCCCCCCCCNCC1CC1 2230a_100000735609_100011214924 [1,0,0,1,0,0|1,0,1]=4 17424 B14R1.221 CCCCCCCCCNCC1CC1 269862a_100000212291_100000741477 [1,0,0,1,0,0|1,0,1]=4 17425 B14R1.221 CCCCCCCCCNCC1CC1 34a_100000212291_100000742324 [1,0,0,1,0,0|1,0,1]=4 17426 B14R1.221 CCCCCCCCCNCC1CC1 34a_100000735609_100011214924 [1,0,0,1,0,0|1,0,1]=4 17427 B14R1.221 CCCCCCCCCNCC1CO1 2230a_100000212291_100011216344 [1,0,0,1,0,0|1,0,1]=4 17428 B14R1.221 CCCCCCCCCNCC1CO1 34a_100000212291_102125554688 [1,0,0,1,0,0|1,0,1]=4 17429 B14R1.221 CCCCCCCCCOCC1CC1 34a_100000210712_100000742324 [1,0,0,1,0,0|1,0,1]=4 17430 B14R1.221 CCCCCCCCCOCC1CC1 34a_100000211283_100011214924 [1,0,0,1,0,0|1,0,1]=4 17431 B14R1.221 CCCCCCCCCOCC1CC1 7a_100000210712_100000742324 [1,0,0,1,0,0|1,0,1]=4 17432 B14R1.221 CCCCCCCCCOCC1CO1 34a_100000210712_102125554688 [1,0,0,1,0,0|1,0,1]=4 17433 B14R1.221 CCCCCCCCCOCC1CO1 7a_100000210712_102125554688 [1,0,0,1,0,0|1,0,1]=4 17434 B14R1.221 CCCCCCCCCOCC1CS1 7a_100000210712_100000031435 [1,0,0,1,0,0|1,1,0]=4 17435 B14R1.221 CCCCCCCCCOC[C@@H]1CO1 34a_100000757423_100011214924 [1,0,0,1,0,0|1,0,1]=4 17436 B14R1.221 CCCCCCCCCOC[C@@H]1CO1 7a_100000210712_100000745022 [1,0,0,1,0,0|1,0,1]=4 17437 B14R1.221 CCCCCCCCCSCC1CC1 62a_100000756562_100000210670 [1,0,0,1,0,0|1,0,1]=4 17438 B14R1.221 CCCCCCCCCSCC1CO1 62a_102125554688_100000210670 [1,0,0,1,0,0|1,0,1]=4 17439 B14R1.221 CCCCCCCCCSCC1CS1 62a_100000031435_100000210670 [1,0,0,1,0,0|1,1,0]=4 17440 B14R1.221 CCCCCCCCCSC[C@@H]1CO1 62a_100000745022_100000210670 [1,0,0,1,0,0|1,0,1]=4 17441 B14R1.221 CCCCCCCCNCCC1CC1 2230a_100000229939_100000694398 [1,0,0,1,0,0|1,0,1]=4 17442 B14R1.221 CCCCCCCCNCCC1CC1 34a_100000229939_100000694398 [1,0,0,1,0,0|1,0,1]=4 17443 B14R1.221 CCCCCCCCNCCC1CC1 34a_100000764129_100000210759 [1,0,0,1,0,0|1,0,1]=4 17444 B14R1.221 CCCCCCCCNCCC1CO1 2230a_100000229939_100000732470 [1,0,0,1,0,0|1,0,1]=4 17445 B14R1.221 CCCCCCCCNCCC1CO1 34a_100000229939_100000732470 [1,0,0,1,0,0|1,0,1]=4 17446 B14R1.221 CCCCCCCCOCCC1CC1 34a_100000210232_100000694398 [1,0,0,1,0,0|1,0,1]=4 17447 B14R1.221 CCCCCCCCOCCC1CC1 34a_100000754188_100000210759 [1,0,0,1,0,0|1,0,1]=4 17448 B14R1.221 CCCCCCCCOCCC1CC1 7a_100000210232_100000764125 [1,0,0,1,0,0|1,0,1]=4 17449 B14R1.221 CCCCCCCCOCCC1CC1 7a_100000754188_100000210759 [1,0,0,1,0,0|1,0,1]=4 17450 B14R1.221 CCCCCCCCOCCC1CO1 34a_100000210232_100000732470 [1,0,0,1,0,0|1,0,1]=4 17451 B14R1.221 CCCCCCCCOCCC1CO1 7a_100000210232_100000732470 [1,0,0,1,0,0|1,0,1]=4 17452 B14R1.221 CCCCCCCCOCC[C@@H]1CO1 34a_100009820653_100000210759 [1,0,0,1,0,0|1,0,1]=4 17453 B14R1.221 CCCCCCCCSCCC1CC1 62a_100000210759_100000764125 [1,0,0,1,0,0|1,0,1]=4 17454 B14R1.221 CCCCCCCCSCCC1CC1 62a_100000764125_100000210317 [1,0,0,1,0,0|1,0,1]=4 17455 B14R1.221 CCCCCCCCSCCC1CO1 62a_100000210759_100000732470 [1,0,0,1,0,0|1,0,1]=4 17456 B14R1.221 CCCCCCCCSCCC1CO1 62a_100000732470_100000210317 [1,0,0,1,0,0|1,0,1]=4 17457 B14R1.221 CCCCCCCNCCCC1CO1 2230a_100000229938_100000733510 [1,0,0,1,0,0|1,0,1]=4 17458 B14R1.221 CCCCCCCOCCCC1CO1 34a_100000210272_100000733510 [1,0,0,1,0,0|1,0,1]=4 17459 B14R1.221 CCCCCCCOCCCC1CO1 7a_100000210272_100000733510 [1,0,0,1,0,0|1,0,1]=4 17460 B14R1.221 CCCCCCCSCCCC1CO1 62a_100000210614_100000733510 [1,0,0,1,0,0|1,0,1]=4 17461 B14R1.221 CCCCCCCSCCCC1CO1 62a_100000733510_100000210316 [1,0,0,1,0,0|1,0,1]=4 17462 B14R1.221 ClCCCCCCCCCOC1CC1 34a_100009868337_100000211595 [1,0,0,1,0,0|2,0,0]=4 17463 B14R1.221 ClCCCCCCCCOCC1CC1 34a_100000033203_100000742324 [1,0,0,1,0,0|2,0,0]=4 17464 B14R1.221 ClCCCCCCCCOCC1CC1 7a_100000033203_100000742324 [1,0,0,1,0,0|2,0,0]=4 17465 B14R1.221 NCCCCCCCCCOC1CC1 34a_100000078944_100000211595 [1,0,0,1,0,0|2,0,0]=4 17466 B14R1.221 NCCCCCCCCOCC1CC1 34a_102515433106_100000742324 [1,0,0,1,0,0|2,0,0]=4 17467 B14R1.221 NCCCCCCCOCCC1CC1 34a_100011996573_100000694398 [1,0,0,1,0,0|2,0,0]=4 17468 B14R1.221 O=CCCCCCSCCCC1CO1 62a_100000139337_100000733510 [1,0,0,1,0,0|2,0,0]=4 17469 B14R1.221 O=CCCCCCSCCCC1CO1 62a_100000733510_100000139337 [1,0,0,1,0,0|2,0,0]=4 17470 B14R1.221 OCCCCCCCCCNC1CC1 34a_100000078944_100000211595 [1,0,0,1,0,0|1,0,1]=4 17471 B14R1.221 OCCCCCCCCCNC1CC1 34a_100000212008_100009813782 [1,0,0,1,0,0|1,0,1]=4 17472 B14R1.221 OCCCCCCCCCSC1CC1 62a_100009813782_100000211595 [1,0,0,1,0,0|1,0,1]=4 17473 B14R1.221 OCCCCCCCCNCC1CC1 2230a_100000735609_100000033203 [1,0,0,1,0,0|1,0,1]=4 17474 B14R1.221 OCCCCCCCCNCC1CC1 2230a_102515433106_100000742324 [1,0,0,1,0,0|1,0,1]=4 17475 B14R1.221 OCCCCCCCCNCC1CC1 269862a_102515433106_100000741477 [1,0,0,1,0,0|1,0,1]=4 17476 B14R1.221 OCCCCCCCCNCC1CC1 34a_100000735609_100000033203 [1,0,0,1,0,0|1,0,1]=4 17477 B14R1.221 OCCCCCCCCNCC1CC1 34a_102515433106_100000742324 [1,0,0,1,0,0|1,0,1]=4 17478 B14R1.221 OCCCCCCCCOCC1CC1 34a_100000211283_100000033203 [1,0,0,1,0,0|1,0,1]=4 17479 B14R1.221 OCCCCCCCCSCC1CC1 62a_100000033203_100000742324 [1,0,0,1,0,0|1,0,1]=4 17480 B14R1.221 OCCCCCCCCSCC1CC1 62a_100000756562_100000033203 [1,0,0,1,0,0|1,0,1]=4 17481 B14R1.221 OCCCCCCCNCCC1CC1 2230a_100011996573_100000694398 [1,0,0,1,0,0|1,0,1]=4 17482 B14R1.221 OCCCCCCCNCCC1CC1 34a_100000764129_100000760002 [1,0,0,1,0,0|1,0,1]=4 17483 B14R1.221 OCCCCCCCNCCC1CC1 34a_100011996573_100000694398 [1,0,0,1,0,0|1,0,1]=4 17484 B14R1.221 OCCCCCCCOCCC1CC1 34a_100000754188_100000760002 [1,0,0,1,0,0|1,0,1]=4 17485 B14R1.221 OCCCCCCCOCCC1CC1 7a_100000754188_100000760002 [1,0,0,1,0,0|1,0,1]=4 17486 B14R1.221 OCCCCCCCSCCC1CC1 62a_100000760002_100000764125 [1,0,0,1,0,0|1,0,1]=4 17487 B14R1.221 OCCCCCCCSCCC1CC1 62a_100000764125_100000760002 [1,0,0,1,0,0|1,0,1]=4 17488 B14R1.229 C=CCCCCCCCN1CCC1C 269982a_100000755817_100012355270 [1,0,0,1,0,0|1,0,1]=4 17489 B14R1.229 C=CCCCCCCCN1CCC1C 34a_100000755817_100012355270 [1,0,0,1,0,0|1,0,1]=4 17490 B14R1.229 CC1CCN1CCCCCCCCO 269982a_100000755817_100000033203 [1,0,0,1,0,0|1,0,1]=4 17491 B14R1.229 CC1CCN1CCCCCCCCO 34a_100000755817_100000033203 [1,0,0,1,0,0|1,0,1]=4 17492 B14R1.229 CCCCCCCCCN1CCC1C 269982a_100000755817_100000210670 [1,0,0,1,0,0|1,0,1]=4 17493 B14R1.229 CCCCCCCCCN1CCC1C 34a_100000755817_100011214924 [1,0,0,1,0,0|1,0,1]=4 17494 B14R1.229 CCCCCCCCNC1CCC1=O 34a_100000229939_100009892977 [1,0,0,1,0,0|1,0,0]=3 17495 B14R1.229 CCCCCCCCOC1CCC1=O 34a_100000210232_100009892977 [1,0,0,1,0,0|1,0,0]=3 17496 B14R1.229 CCCCCCCCOC1CCC1=O 7a_100000210232_100009892977 [1,0,0,1,0,0|1,0,0]=3 17497 B14R1.229 CCCCCCCCSC1CCC1=O 62a_100000210759_100009892977 [1,0,0,1,0,0|1,0,0]=3 17498 B14R1.229 CCCCCCCCSC1CCC1=O 62a_100009892977_100000210317 [1,0,0,1,0,0|1,0,0]=3 17499 B14R1.229 CCCCCCNCCC1CCC1=O 2230a_100000210581_200016118888 [1,0,0,1,0,0|1,0,0]=3 17500 B14R1.229 CCCCCCOCCC1CCC1=O 7a_100000210259_200016118888 [1,0,0,1,0,0|1,0,0]=3 17501 B14R1.229 CCCCCCSCCC1CCC1=O 62a_100000210314_200016118888 [1,0,0,1,0,0|1,0,0]=3 17502 B14R1.229 CCCCCCSCCC1CCC1=O 62a_200016118888_100000210757 [1,0,0,1,0,0|1,0,0]=3 17503 B14R1.229 CCCCCNCCOC1CCC1=O 34a_100000224656_100009892977 [1,0,0,1,0,0|2,0,0]=4 17504 B14R1.229 CCCCCOCCOC1CCC1=O 34a_100011215259_100009892977 [1,0,0,1,0,0|2,0,0]=4 17505 B14R1.229 CCCCCOCCOC1CCC1=O 7a_100011215259_100009892977 [1,0,0,1,0,0|2,0,0]=4 17506 B14R1.229 CCCCOCCCNC1CCC1=O 34a_200000211371_100009892977 [1,0,0,1,0,0|2,0,0]=4 17507 B14R1.229 CCCCOCCCOC1CCC1=O 34a_200011215613_100009892977 [1,0,0,1,0,0|2,0,0]=4 17508 B14R1.229 CCCCOCCCOC1CCC1=O 7a_200011215613_100009892977 [1,0,0,1,0,0|2,0,0]=4 17509 B14R1.229 CCCCOCSCCC1CCC1=O 62a_100011995733_200016118888 [1,0,0,1,0,0|2,0,0]=4 17510 B14R1.229 CCCCOCSCCC1CCC1=O 62a_200016118888_100011995733 [1,0,0,1,0,0|2,0,0]=4 17511 B14R1.229 CCCOCCNCCC1CCC1=O 2230a_100161115042_200016118888 [1,0,0,1,0,0|2,0,0]=4 17512 B14R1.229 CCCOCCOCCC1CCC1=O 7a_100000752267_200016118888 [1,0,0,1,0,0|2,0,0]=4 17513 B14R1.229 CCCOCCSCCC1CCC1=O 62a_100011215938_200016118888 [1,0,0,1,0,0|2,0,0]=4 17514 B14R1.229 CCCOCCSCCC1CCC1=O 62a_200016118888_100011215938 [1,0,0,1,0,0|2,0,0]=4 17515 B14R1.229 CCCSCCNCCC1CCC1=O 2230a_100020603323_200016118888 [1,0,0,1,0,0|2,0,0]=4 17516 B14R1.229 CCCSCCOCCC1CCC1=O 7a_200000230433_200016118888 [1,0,0,1,0,0|2,0,0]=4 17517 B14R1.229 CCOCCCNCCC1CCC1=O 2230a_100000210961_200016118888 [1,0,0,1,0,0|2,0,0]=4 17518 B14R1.229 CCOCCCOCCC1CCC1=O 7a_100000757476_200016118888 [1,0,0,1,0,0|2,0,0]=4 17519 B14R1.229 CCOCCCSCCC1CCC1=O 62a_100012232248_200016118888 [1,0,0,1,0,0|2,0,0]=4 17520 B14R1.229 CCOCCCSCCC1CCC1=O 62a_200016118888_100012232248 [1,0,0,1,0,0|2,0,0]=4 17521 B14R1.229 CCSCCCOCCC1CCC1=O 7a_100011216438_200016118888 [1,0,0,1,0,0|2,0,0]=4 17522 B14R1.229 COCCCCCCOC1CCC1=O 34a_200012092642_100009892977 [1,0,0,1,0,0|2,0,0]=4 17523 B14R1.229 COCCCCCCOC1CCC1=O 7a_200012092642_100009892977 [1,0,0,1,0,0|2,0,0]=4 17524 B14R1.229 COCCCCCCSC1CCC1=O 62a_100009892977_100011998445 [1,0,0,1,0,0|2,0,0]=4 17525 B14R1.229 COCCCCCCSC1CCC1=O 62a_100011998445_100009892977 [1,0,0,1,0,0|2,0,0]=4 17526 B14R1.229 COCCCCSCCC1CCC1=O 62a_100000730899_200016118888 [1,0,0,1,0,0|2,0,0]=4 17527 B14R1.229 COCCCCSCCC1CCC1=O 62a_200016118888_100000730899 [1,0,0,1,0,0|2,0,0]=4 17528 B14R1.229 CSCCCCOCCC1CCC1=O 7a_100011217163_200016118888 [1,0,0,1,0,0|2,0,0]=4 17529 B14R1.229 NCCCCCCCOC1CCC1=O 34a_100011996573_100009892977 [1,0,0,1,0,0|2,0,0]=4 17530 B14R1.229 O=C1CCC1CCNCCCCCO 2230a_100000762737_200016118888 [1,0,0,1,0,0|2,0,0]=4 17531 B14R1.229 O=C1CCC1CCOCCCCCBr 7a_100000746331_200016118888 [1,0,0,1,0,0|2,0,0]=4 17532 B14R1.229 O=C1CCC1CCOCCCCCCl 7a_100000746330_200016118888 [1,0,0,1,0,0|2,0,0]=4 17533 B14R1.229 O=C1CCC1CCOCCCCCI 7a_200012148887_200016118888 [1,0,0,1,0,0|2,0,0]=4 17534 B14R1.229 O=C1CCC1CCSCCCCCF 62a_100000729378_200016118888 [1,0,0,1,0,0|2,0,0]=4 17535 B14R1.229 O=C1CCC1CCSCCCCCF 62a_200016118888_100000729378 [1,0,0,1,0,0|2,0,0]=4 17536 B14R1.229 O=C1CCC1CCSCCCCCO 62a_100000746330_200016118888 [1,0,0,1,0,0|2,0,0]=4 17537 B14R1.229 O=C1CCC1CCSCCCCCO 62a_200016118888_100000746330 [1,0,0,1,0,0|2,0,0]=4 17538 B14R1.229 O=C1CCC1NCCCCCCCO 34a_100011996573_100009892977 [1,0,0,1,0,0|2,0,0]=4 17539 B14R1.229 O=C1CCC1OCCCCCCCBr 34a_100000760002_100009892977 [1,0,0,1,0,0|2,0,0]=4 17540 B14R1.229 O=C1CCC1OCCCCCCCBr 7a_100000760002_100009892977 [1,0,0,1,0,0|2,0,0]=4 17541 B14R1.229 O=C1CCC1SCCCCCCCO 62a_100000760002_100009892977 [1,0,0,1,0,0|2,0,0]=4 17542 B14R1.229 O=C1CCC1SCCCCCCCO 62a_100009892977_100000760002 [1,0,0,1,0,0|2,0,0]=4 17543 B14R1.234 C=CCCCNC1CCCC1CCC 269862a_100000700776_100000723119 [1,0,0,1,0,0|1,0,1]=4 17544 B14R1.234 C=CCCCNC1CCCC1CCC 270004a_100000700776_100000723119 [1,0,0,1,0,0|1,0,1]=4 17545 B14R1.234 CCCC1CCCC1NCCCCO 269862a_100000750430_100000723119 [1,0,0,1,0,0|1,0,1]=4 17546 B14R1.234 CCCC1CCCC1NCCCCO 270004a_100000750430_100000723119 [1,0,0,1,0,0|1,0,1]=4 17547 B14R1.234 CCCCCCC1CCCC1NCC 269862a_100015525214_100000189428 [1,0,0,1,0,0|1,0,1]=4 17548 B14R1.234 CCCCCCC1CCCC1NCC 270004a_100015525214_100000189428 [1,0,0,1,0,0|1,0,1]=4 17549 B14R1.234 CCCCCNC1CCCC1CCC 269862a_100000209983_100000723119 [1,0,0,1,0,0|1,0,1]=4 17550 B14R1.234 CCCCCNC1CCCC1CCC 270004a_100000209983_100000723119 [1,0,0,1,0,0|1,0,1]=4 17551 B14R1.234 COC[C@@H]1CCCN1CCCCC=O 2230a_100020646714_100000139335 [1,0,0,1,0,0|2,0,0]=4 17552 B14R1.234 COC[C@@H]1CCCN1CCCCC=O 269982a_100020646714_100000139335 [1,0,0,1,0,0|2,0,0]=4 17553 B14R1.476 C=CCCCCN1CCCCC1CC 2230a_100000210034_100011215482 [1,0,0,1,0,0|1,0,1]=4 17554 B14R1.476 C=CCCCCN1CCCCC1CC 269982a_100000210034_100011215482 [1,0,0,1,0,0|1,0,1]=4 17555 B14R1.476 C=CCCCCN1CCCCC1CC 34a_100000210034_100011215482 [1,0,0,1,0,0|1,0,1]=4 17556 B14R1.476 C=CCCCNC1CCCCC1CC 269862a_100000700776_100000757040 [1,0,0,1,0,0|1,0,1]=4 17557 B14R1.476 C=CCCCNC1CCCCC1CC 270004a_100000700776_100000757040 [1,0,0,1,0,0|1,0,1]=4 17558 B14R1.476 C=CCCCOC1CCCCC1CC 34a_100000210738_100000757094 [1,0,0,1,0,0|1,0,1]=4 17559 B14R1.476 C=CCCCOC1CCCCC1CC 7a_100000210738_100000757094 [1,0,0,1,0,0|1,0,1]=4 17560 B14R1.476 CCC1CCCCC1NCCCCO 269862a_100000750430_100000757040 [1,0,0,1,0,0|1,0,1]=4 17561 B14R1.476 CCC1CCCCC1NCCCCO 270004a_100000750430_100000757040 [1,0,0,1,0,0|1,0,1]=4 17562 B14R1.476 CCC1CCCCC1OCCCC=O 7a_100000210738_200011292268 [1,0,0,1,0,0|1,0,0]=3 17563 B14R1.476 CCC1CCCCC1OCCCCF 34a_100000210738_100000729493 [1,0,0,1,0,0|2,0,0]=4 17564 B14R1.476 CCC1CCCCC1OCCCCF 7a_100000210738_100000729493 [1,0,0,1,0,0|2,0,0]=4 17565 B14R1.476 CCC1CCCCC1OCCCCO 34a_100000210738_100011216708 [1,0,0,1,0,0|1,0,1]=4 17566 B14R1.476 CCC1CCCCC1OCCCCO 7a_100000210738_100000210776 [1,0,0,1,0,0|1,0,1]=4 17567 B14R1.476 CCC1CCCCN1CCCCC=O 2230a_100000210034_100000139335 [1,0,0,1,0,0|1,0,0]=3 17568 B14R1.476 CCC1CCCCN1CCCCC=O 269982a_100000210034_100000139335 [1,0,0,1,0,0|1,0,0]=3 17569 B14R1.476 CCC1CCCCN1CCCCCF 2230a_100000210034_100000729378 [1,0,0,1,0,0|2,0,0]=4 17570 B14R1.476 CCC1CCCCN1CCCCCF 269982a_100000210034_100000729378 [1,0,0,1,0,0|2,0,0]=4 17571 B14R1.476 CCC1CCCCN1CCCCCF 34a_100000210034_100000729378 [1,0,0,1,0,0|2,0,0]=4 17572 B14R1.476 CCC1CCCCN1CCCCCO 2230a_100000210034_100000746330 [1,0,0,1,0,0|1,0,1]=4 17573 B14R1.476 CCC1CCCCN1CCCCCO 269982a_100000210034_100000746330 [1,0,0,1,0,0|1,0,1]=4 17574 B14R1.476 CCC1CCCCN1CCCCCO 34a_100000210034_100000746330 [1,0,0,1,0,0|1,0,1]=4 17575 B14R1.476 CCC1CCCCN1CCNCC=O 2230a_100000755458_200015260668 [1,0,0,1,0,0|2,0,0]=4 17576 B14R1.476 CCC1CCCCN1CCNCC=O 34a_100000755458_200009817547 [1,0,0,1,0,0|2,0,0]=4 17577 B14R1.476 CCCCCCN1CCCCC1CC 2230a_100000210034_100000210314 [1,0,0,1,0,0|1,0,1]=4 17578 B14R1.476 CCCCCCN1CCCCC1CC 269982a_100000210034_100000210757 [1,0,0,1,0,0|1,0,1]=4 17579 B14R1.476 CCCCCCN1CCCCC1CC 34a_100000210034_100000210314 [1,0,0,1,0,0|1,0,1]=4 17580 B14R1.476 CCCCCCN1CCCCC1CO 2230a_100000210821_100000210314 [1,0,0,1,0,0|1,0,1]=4 17581 B14R1.476 CCCCCCN1CCCCC1CO 269982a_100000210821_100000210757 [1,0,0,1,0,0|1,0,1]=4 17582 B14R1.476 CCCCCCN1CCCCC1CO 34a_100000210821_100000210314 [1,0,0,1,0,0|1,0,1]=4 17583 B14R1.476 CCCCCNC1CCCCC1CC 269862a_100000209983_100000757040 [1,0,0,1,0,0|1,0,1]=4 17584 B14R1.476 CCCCCNC1CCCCC1CC 270004a_100000209983_100000757040 [1,0,0,1,0,0|1,0,1]=4 17585 B14R1.476 CCCCCNC1CCCCC1CO 270004a_100000209983_100009861125 [1,0,0,1,0,0|1,0,1]=4 17586 B14R1.476 CCCCCOC1CCCCC1CC 34a_100000210738_100000718602 [1,0,0,1,0,0|1,0,1]=4 17587 B14R1.476 CCCCCOC1CCCCC1CC 7a_100000210738_100000210326 [1,0,0,1,0,0|1,0,1]=4 17588 B14R1.476 CCCCCOC1CCCCC1CN 34a_100011216029_100000718602 [1,0,0,1,0,0|2,0,0]=4 17589 B14R1.476 CC[C@H]1COCCN1CCCCC=O 2230a_100016988097_100000139335 [1,0,0,1,0,0|2,0,0]=4 17590 B14R1.476 CC[C@H]1COCCN1CCCCC=O 269982a_100016988097_100000139335 [1,0,0,1,0,0|2,0,0]=4 17591 B14R1.476 CO[C@H]1CCCC[C@@H]1OCCCC=O 7a_200009815850_200011292268 [1,0,0,1,0,0|2,0,0]=4 17592 B14R1.476 O=CCCCCN1CCCCC1CO 2230a_100000210821_100000139335 [1,0,0,1,0,0|2,0,0]=4 17593 B14R1.476 O=CCCCCN1CCCCC1CO 269982a_100000210821_100000139335 [1,0,0,1,0,0|2,0,0]=4 17594 B14R1.787 CCCCN1CCCCC1CCCO 2230a_100011934581_100000210211 [1,0,0,1,0,0|1,0,1]=4 17595 B14R1.787 CCCCN1CCCCC1CCCO 269982a_100011934581_100000210211 [1,0,0,1,0,0|1,0,1]=4 17596 B14R1.787 CCCCN1CCCCC1CCCO 34a_100011934581_100000210210 [1,0,0,1,0,0|1,0,1]=4 17597 B14R1.845 CNC1CCCCCCCCCCC1 2230a_100011194316_200000210301 [1,0,0,1,0,0|1,0,1]=4 17598 B14R1.845 CNC1CCCCCCCCCCC1 270004a_106832991635_100000210130 [1,0,0,1,0,0|1,0,1]=4 17599 B14R1.845 CNC1CCCCCCCCCCC1 34a_100011194316_200000210301 [1,0,0,1,0,0|1,0,1]=4 17600 B14R1.845 COC1CCCCCCCCCCC1 34a_100000211378_200000210301 [1,0,0,1,0,0|1,0,1]=4 17601 B14R1.845 COC1CCCCCCCCCCC1 7a_100000211378_200000210301 [1,0,0,1,0,0|1,0,1]=4 17602 B14R1.845 [13CH3]NC1CCCCCCCCCCC1 2230a_100011194316_200025704644 [1,0,0,1,0,0|1,0,1]=4 17603 B14R1.845 [13CH3]NC1CCCCCCCCCCC1 34a_100011194316_200025704644 [1,0,0,1,0,0|1,0,1]=4 17604 B14R1.845 [13CH3]OC1CCCCCCCCCCC1 34a_100000211378_200025704644 [1,0,0,1,0,0|1,0,1]=4 17605 B14R1.845 [13CH3]OC1CCCCCCCCCCC1 7a_100000211378_200025704644 [1,0,0,1,0,0|1,0,1]=4 17606 B14R1.882 C=CCCCCCN1CCCCC1C 2230a_100000211376_100000700193 [1,0,0,1,0,0|1,0,1]=4 17607 B14R1.882 C=CCCCCCN1CCCCC1C 269982a_100000211376_100000700193 [1,0,0,1,0,0|1,0,1]=4 17608 B14R1.882 C=CCCCCCN1CCCCC1C 34a_100000211376_100000700193 [1,0,0,1,0,0|1,0,1]=4 17609 B14R1.882 C=CCCCCNC1CCCCC1C 2230a_100000211402_100011215482 [1,0,0,1,0,0|1,0,1]=4 17610 B14R1.882 C=CCCCCNC1CCCCC1C 269862a_100000703577_100000210921 [1,0,0,1,0,0|1,0,1]=4 17611 B14R1.882 C=CCCCCNC1CCCCC1C 270004a_100000703577_100000210921 [1,0,0,1,0,0|1,0,1]=4 17612 B14R1.882 C=CCCCCNC1CCCCC1C 34a_100000211402_100011215482 [1,0,0,1,0,0|1,0,1]=4 17613 B14R1.882 C=CCCCCOC1CCCCC1C 34a_100000211207_100011215482 [1,0,0,1,0,0|1,0,1]=4 17614 B14R1.882 C=CCCCCOC1CCCCC1C 7a_100000211207_100011215482 [1,0,0,1,0,0|1,0,1]=4 17615 B14R1.882 CC1CCCCC1NCCCCC=O 2230a_100000211402_100000139335 [1,0,0,1,0,0|1,0,0]=3 17616 B14R1.882 CC1CCCCC1NCCCCCF 2230a_100000211402_100000729378 [1,0,0,1,0,0|2,0,0]=4 17617 B14R1.882 CC1CCCCC1NCCCCCF 34a_100000211402_100000729378 [1,0,0,1,0,0|2,0,0]=4 17618 B14R1.882 CC1CCCCC1NCCCCCO 2230a_100000211402_100000746330 [1,0,0,1,0,0|1,0,1]=4 17619 B14R1.882 CC1CCCCC1NCCCCCO 269862a_100000762737_100000210921 [1,0,0,1,0,0|1,0,1]=4 17620 B14R1.882 CC1CCCCC1NCCCCCO 270004a_100000762737_100000210921 [1,0,0,1,0,0|1,0,1]=4 17621 B14R1.882 CC1CCCCC1NCCCCCO 34a_100000211402_100000746330 [1,0,0,1,0,0|1,0,1]=4 17622 B14R1.882 CC1CCCCC1OCCCCC=O 7a_100000211207_100000139335 [1,0,0,1,0,0|1,0,0]=3 17623 B14R1.882 CC1CCCCC1OCCCCCF 34a_100000211207_100000729378 [1,0,0,1,0,0|2,0,0]=4 17624 B14R1.882 CC1CCCCC1OCCCCCF 7a_100000211207_100000729378 [1,0,0,1,0,0|2,0,0]=4 17625 B14R1.882 CC1CCCCC1OCCCCCO 34a_100000211207_100000746330 [1,0,0,1,0,0|1,0,1]=4 17626 B14R1.882 CC1CCCCC1OCCCCCO 7a_100000211207_100000746330 [1,0,0,1,0,0|1,0,1]=4 17627 B14R1.882 CC1CCCCN1CCCCCC=O 2230a_100000211376_100000139337 [1,0,0,1,0,0|1,0,0]=3 17628 B14R1.882 CC1CCCCN1CCCCCC=O 269982a_100000211376_100000139337 [1,0,0,1,0,0|1,0,0]=3 17629 B14R1.882 CC1CCCCN1CCCCCCF 2230a_100000211376_100015922095 [1,0,0,1,0,0|2,0,0]=4 17630 B14R1.882 CC1CCCCN1CCCCCCF 269982a_100000211376_100015922095 [1,0,0,1,0,0|2,0,0]=4 17631 B14R1.882 CC1CCCCN1CCCCCCF 34a_100000211376_100015922095 [1,0,0,1,0,0|2,0,0]=4 17632 B14R1.882 CC1CCCCN1CCCCCCO 2230a_100000211376_100000766143 [1,0,0,1,0,0|1,0,1]=4 17633 B14R1.882 CC1CCCCN1CCCCCCO 269982a_100000211376_100000766143 [1,0,0,1,0,0|1,0,1]=4 17634 B14R1.882 CC1CCCCN1CCCCCCO 34a_100000211376_100000766143 [1,0,0,1,0,0|1,0,1]=4 17635 B14R1.882 CC1CCCCN1CCCNCC=O 34a_100000212276_200009817547 [1,0,0,1,0,0|2,0,0]=4 17636 B14R1.882 CC1CCCCN1CCCOCC=O 34a_100000213889_200009817547 [1,0,0,1,0,0|2,0,0]=4 17637 B14R1.882 CC1CCCCN1CCCOCC=O 7a_100000213889_200015260668 [1,0,0,1,0,0|2,0,0]=4 17638 B14R1.882 CCCCCCCN1CCCCC1C 2230a_100000211376_100000210681 [1,0,0,1,0,0|1,0,1]=4 17639 B14R1.882 CCCCCCCN1CCCCC1C 269982a_100000211376_100000210681 [1,0,0,1,0,0|1,0,1]=4 17640 B14R1.882 CCCCCCCN1CCCCC1C 34a_100000211376_100000210614 [1,0,0,1,0,0|1,0,1]=4 17641 B14R1.882 CCCCCCNC1CCCCC1C 2230a_100000211402_100000210314 [1,0,0,1,0,0|1,0,1]=4 17642 B14R1.882 CCCCCCNC1CCCCC1C 269862a_100000210581_100000210921 [1,0,0,1,0,0|1,0,1]=4 17643 B14R1.882 CCCCCCNC1CCCCC1C 270004a_100000210581_100000210921 [1,0,0,1,0,0|1,0,1]=4 17644 B14R1.882 CCCCCCNC1CCCCC1C 34a_100000211402_100000210314 [1,0,0,1,0,0|1,0,1]=4 17645 B14R1.882 CCCCCCNC1CCCNC1=O 2230a_100000210581_100000687798 [1,0,0,1,0,0|2,0,0]=4 17646 B14R1.882 CCCCCCNC1CCCNC1=O 2230a_100000747585_100000210314 [1,0,0,1,0,0|2,0,0]=4 17647 B14R1.882 CCCCCCNC1CCCNC1=O 34a_100000747585_100000210314 [1,0,0,1,0,0|2,0,0]=4 17648 B14R1.882 CCCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000210314 [1,0,0,1,0,0|2,0,0]=4 17649 B14R1.882 CCCCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000210314 [1,0,0,1,0,0|2,0,0]=4 17650 B14R1.882 CCCCCCOC1CCCCC1=O 34a_100000210259_100000754470 [1,0,0,1,0,0|1,0,0]=3 17651 B14R1.882 CCCCCCOC1CCCCC1=O 34a_100011214950_100000210314 [1,0,0,1,0,0|1,0,0]=3 17652 B14R1.882 CCCCCCOC1CCCCC1=O 7a_100000210259_100000204591 [1,0,0,1,0,0|1,0,0]=3 17653 B14R1.882 CCCCCCOC1CCCCC1C 34a_100000211207_100000210314 [1,0,0,1,0,0|1,0,1]=4 17654 B14R1.882 CCCCCCOC1CCCCC1C 7a_100000211207_100000210314 [1,0,0,1,0,0|1,0,1]=4 17655 B14R1.882 CCCCCCOC1CCCCC1Cl 34a_100000038908_100000210314 [1,0,0,1,0,0|2,0,0]=4 17656 B14R1.882 CCCCCCOC1CCCCC1Cl 7a_100000038908_100000210314 [1,0,0,1,0,0|2,0,0]=4 17657 B14R1.882 CCCCCCOC1CCCCC1F 34a_100000210259_100015423560 [1,0,0,1,0,0|2,0,0]=4 17658 B14R1.882 CCCCCCOC1CCCCC1O 34a_100000210259_100000038908 [1,0,0,1,0,0|1,0,1]=4 17659 B14R1.882 CCCCCCOC1CCCNC1=O 34a_100000073722_100000210314 [1,0,0,1,0,0|2,0,0]=4 17660 B14R1.882 CCCCCCOC1CCCNC1=O 34a_100000210259_100000687798 [1,0,0,1,0,0|2,0,0]=4 17661 B14R1.882 CCCCCCOC1CCCNC1=O 7a_100000210259_100000687798 [1,0,0,1,0,0|2,0,0]=4 17662 B14R1.882 CCCCCCOC1COCCC1=O 34a_100000210259_100012180262 [1,0,0,1,0,0|2,0,0]=4 17663 B14R1.882 CCCCCCOC1COCCC1=O 7a_100000210259_100012180262 [1,0,0,1,0,0|2,0,0]=4 17664 B14R1.882 CCCCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000210314 [1,0,0,1,0,0|2,0,0]=4 17665 B14R1.882 CCCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000210314 [1,0,0,1,0,0|2,0,0]=4 17666 B14R1.882 CCCCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000210314 [1,0,0,1,0,0|2,0,0]=4 17667 B14R1.882 CCCCCCSC1CCCCC1=O 62a_100000204591_100000210757 [1,0,0,1,0,0|1,0,0]=3 17668 B14R1.882 CCCCCCSC1CCCCC1=O 62a_100000210314_100000204591 [1,0,0,1,0,0|1,0,0]=3 17669 B14R1.882 CCCCCCSC1CCCCC1F 62a_100000210314_100015423560 [1,0,0,1,0,0|2,0,0]=4 17670 B14R1.882 CCCCCCSC1CCCCC1F 62a_100015423560_100000210757 [1,0,0,1,0,0|2,0,0]=4 17671 B14R1.882 CCCCCCSC1CCCCC1O 62a_100000038908_100000210757 [1,0,0,1,0,0|1,0,1]=4 17672 B14R1.882 CCCCCCSC1CCCCC1O 62a_100000210314_100000038908 [1,0,0,1,0,0|1,0,1]=4 17673 B14R1.882 CCCCCCSC1CCCNC1=O 62a_100000210314_100000687798 [1,0,0,1,0,0|2,0,0]=4 17674 B14R1.882 CCCCCCSC1CCCNC1=O 62a_100000687798_100000210757 [1,0,0,1,0,0|2,0,0]=4 17675 B14R1.882 CCCCCCSC1COCCC1=O 62a_100000210314_100012180262 [1,0,0,1,0,0|2,0,0]=4 17676 B14R1.882 CCCCCCSC1COCCC1=O 62a_100012180262_100000210757 [1,0,0,1,0,0|2,0,0]=4 17677 B14R1.882 CCCCCNCC1CCCCC1O 34a_100011216029_100000718602 [1,0,0,1,0,0|1,0,1]=4 17678 B14R1.882 CCCCCOCC1CCCCC1=O 34a_100009861125_100000718602 [1,0,0,1,0,0|1,0,0]=3 17679 B14R1.882 CCCCCOCC1CCCCC1=O 7a_100009861125_100000210326 [1,0,0,1,0,0|1,0,0]=3 17680 B14R1.882 CCCCNCCN1CCCCC1=O 2230a_100160573077_100000210211 [1,0,0,1,0,0|2,0,0]=4 17681 B14R1.882 CCCCNCCN1CCCCC1=O 34a_100160573077_100000210210 [1,0,0,1,0,0|2,0,0]=4 17682 B14R1.882 CCCCOCOC1CCCCC1=O 34a_100011214950_100011995733 [1,0,0,1,0,0|2,0,0]=4 17683 B14R1.882 CCCCOCSC1CCCCC1=O 62a_100000204591_100011995733 [1,0,0,1,0,0|2,0,0]=4 17684 B14R1.882 CCCCOCSC1CCCCC1=O 62a_100011995733_100000204591 [1,0,0,1,0,0|2,0,0]=4 17685 B14R1.882 CCCOCCNC1CCCCC1=O 34a_100161115042_100000754470 [1,0,0,1,0,0|2,0,0]=4 17686 B14R1.882 CCCOCCOC1CCCCC1=O 34a_100000752267_100000754470 [1,0,0,1,0,0|2,0,0]=4 17687 B14R1.882 CCCOCCOC1CCCCC1=O 34a_100011214950_100011215938 [1,0,0,1,0,0|2,0,0]=4 17688 B14R1.882 CCCOCCOC1CCCCC1=O 7a_100000752267_100000204591 [1,0,0,1,0,0|2,0,0]=4 17689 B14R1.882 CCCOCCSC1CCCCC1=O 62a_100000204591_100011215938 [1,0,0,1,0,0|2,0,0]=4 17690 B14R1.882 CCCOCCSC1CCCCC1=O 62a_100011215938_100000204591 [1,0,0,1,0,0|2,0,0]=4 17691 B14R1.882 CCCSCCOC1CCCCC1=O 34a_200000230433_100000754470 [1,0,0,1,0,0|2,0,0]=4 17692 B14R1.882 CCCSCCOC1CCCCC1=O 7a_200000230433_100000204591 [1,0,0,1,0,0|2,0,0]=4 17693 B14R1.882 CCOCCCNC1CCCCC1=O 34a_100000210961_100000754470 [1,0,0,1,0,0|2,0,0]=4 17694 B14R1.882 CCOCCCOC1CCCCC1=O 34a_100000757476_100000754470 [1,0,0,1,0,0|2,0,0]=4 17695 B14R1.882 CCOCCCOC1CCCCC1=O 34a_100011214950_100012232248 [1,0,0,1,0,0|2,0,0]=4 17696 B14R1.882 CCOCCCOC1CCCCC1=O 7a_100000757476_100000204591 [1,0,0,1,0,0|2,0,0]=4 17697 B14R1.882 CCOCCCSC1CCCCC1=O 62a_100000204591_100012232248 [1,0,0,1,0,0|2,0,0]=4 17698 B14R1.882 CCOCCCSC1CCCCC1=O 62a_100012232248_100000204591 [1,0,0,1,0,0|2,0,0]=4 17699 B14R1.882 CCOCCOCC1CCCCC1=O 34a_100009861125_100000210147 [1,0,0,1,0,0|2,0,0]=4 17700 B14R1.882 CCOCCOCC1CCCCC1=O 7a_100009861125_100011215890 [1,0,0,1,0,0|2,0,0]=4 17701 B14R1.882 CCSCCCOC1CCCCC1=O 34a_100011216438_100000754470 [1,0,0,1,0,0|2,0,0]=4 17702 B14R1.882 CCSCCCOC1CCCCC1=O 7a_100011216438_100000204591 [1,0,0,1,0,0|2,0,0]=4 17703 B14R1.882 CCSCCOCC1CCCCC1=O 34a_100009861125_100000757381 [1,0,0,1,0,0|2,0,0]=4 17704 B14R1.882 CCSCCOCC1CCCCC1=O 7a_100009861125_100000757381 [1,0,0,1,0,0|2,0,0]=4 17705 B14R1.882 CN1CCCCC1CSCCCC=O 62a_100015185383_200011292268 [1,0,0,1,0,0|2,0,0]=4 17706 B14R1.882 CN1CCCCC1CSCCCC=O 62a_200011292268_100015185383 [1,0,0,1,0,0|2,0,0]=4 17707 B14R1.882 COCCCCOC1CCCCC1=O 34a_100000740925_100000754470 [1,0,0,1,0,0|2,0,0]=4 17708 B14R1.882 COCCCCOC1CCCCC1=O 34a_100011214950_100000755781 [1,0,0,1,0,0|2,0,0]=4 17709 B14R1.882 COCCCCSC1CCCCC1=O 62a_100000204591_100000730899 [1,0,0,1,0,0|2,0,0]=4 17710 B14R1.882 COCCCCSC1CCCCC1=O 62a_100000730899_100000204591 [1,0,0,1,0,0|2,0,0]=4 17711 B14R1.882 COCCCOCC1CCCCC1=O 34a_100009861125_100000740836 [1,0,0,1,0,0|2,0,0]=4 17712 B14R1.882 COCCCOCC1CCCCC1=O 7a_100009861125_100000740836 [1,0,0,1,0,0|2,0,0]=4 17713 B14R1.882 CSCCCCOC1CCCCC1=O 34a_100011217163_100000754470 [1,0,0,1,0,0|2,0,0]=4 17714 B14R1.882 CSCCCCOC1CCCCC1=O 7a_100011217163_100000204591 [1,0,0,1,0,0|2,0,0]=4 17715 B14R1.882 C[C@H]1COCCN1CCCCCC=O 2230a_100009815349_100000139337 [1,0,0,1,0,0|2,0,0]=4 17716 B14R1.882 C[C@H]1COCCN1CCCCCC=O 269982a_100009815349_100000139337 [1,0,0,1,0,0|2,0,0]=4 17717 B14R1.882 NCCCCCOC1CCCCC1=O 34a_100000762737_100000754470 [1,0,0,1,0,0|2,0,0]=4 17718 B14R1.882 O=C1CCCCC1COCCCCF 34a_100009861125_100000729493 [1,0,0,1,0,0|2,0,0]=4 17719 B14R1.882 O=C1CCCCC1COCCCCF 7a_100009861125_100000729493 [1,0,0,1,0,0|2,0,0]=4 17720 B14R1.882 O=C1CCCCC1COCCCCO 34a_100009861125_100011216708 [1,0,0,1,0,0|2,0,0]=4 17721 B14R1.882 O=C1CCCCC1COCCCCO 7a_100009861125_100000210776 [1,0,0,1,0,0|2,0,0]=4 17722 B14R1.882 O=C1CCCCC1NCCCCCO 34a_100000762737_100000754470 [1,0,0,1,0,0|2,0,0]=4 17723 B14R1.882 O=C1CCCCC1OCCCCCBr 34a_100000746331_100000754470 [1,0,0,1,0,0|2,0,0]=4 17724 B14R1.882 O=C1CCCCC1OCCCCCBr 7a_100000746331_100000204591 [1,0,0,1,0,0|2,0,0]=4 17725 B14R1.882 O=C1CCCCC1OCCCCCCl 34a_100000746330_100000754470 [1,0,0,1,0,0|2,0,0]=4 17726 B14R1.882 O=C1CCCCC1OCCCCCCl 7a_100000746330_100000204591 [1,0,0,1,0,0|2,0,0]=4 17727 B14R1.882 O=C1CCCCC1OCCCCCF 34a_100011214950_100000729378 [1,0,0,1,0,0|2,0,0]=4 17728 B14R1.882 O=C1CCCCC1OCCCCCI 34a_200012148887_100000754470 [1,0,0,1,0,0|2,0,0]=4 17729 B14R1.882 O=C1CCCCC1OCCCCCI 7a_200012148887_100000204591 [1,0,0,1,0,0|2,0,0]=4 17730 B14R1.882 O=C1CCCCC1OCCCCCO 34a_100011214950_100000746330 [1,0,0,1,0,0|2,0,0]=4 17731 B14R1.882 O=C1CCCCC1SCCCCCF 62a_100000204591_100000729378 [1,0,0,1,0,0|2,0,0]=4 17732 B14R1.882 O=C1CCCCC1SCCCCCF 62a_100000729378_100000204591 [1,0,0,1,0,0|2,0,0]=4 17733 B14R1.882 O=C1CCCCC1SCCCCCO 62a_100000204591_100000746330 [1,0,0,1,0,0|2,0,0]=4 17734 B14R1.882 O=C1CCCCC1SCCCCCO 62a_100000746330_100000204591 [1,0,0,1,0,0|2,0,0]=4 17735 B14R1.882 O=CCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000139335 [1,0,0,1,0,0|2,0,0]=4 17736 B14R1.882 O=CCCCCOC1CCCCC1Cl 7a_100000038908_100000139335 [1,0,0,1,0,0|2,0,0]=4 17737 B14R1.882 O=CCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000139335 [1,0,0,1,0,0|2,0,0]=4 17738 B14R1.882 O=CCCCCSC1CCCCC1F 62a_100000139335_100015423560 [1,0,0,1,0,0|2,0,0]=4 17739 B14R1.882 O=CCCCCSC1CCCCC1F 62a_100015423560_100000139335 [1,0,0,1,0,0|2,0,0]=4 17740 B14R1.882 O=CCCCCSC1CCCCC1O 62a_100000038908_100000139335 [1,0,0,1,0,0|2,0,0]=4 17741 B14R1.882 O=CCCCCSC1CCCCC1O 62a_100000139335_100000038908 [1,0,0,1,0,0|2,0,0]=4 17742 B14R1.890 C=CCCCCCCOCC1CC1C 34a_100000744939_100011215473 [1,0,0,1,0,0|1,0,1]=4 17743 B14R1.890 C=CCCCCCCOCC1CC1C 7a_100000744939_100011215473 [1,0,0,1,0,0|1,0,1]=4 17744 B14R1.890 CC1CC1COCCCCCCCO 34a_100000744939_100000760002 [1,0,0,1,0,0|1,0,1]=4 17745 B14R1.890 CC1CC1COCCCCCCCO 7a_100000744939_100000760002 [1,0,0,1,0,0|1,0,1]=4 17746 B14R1.890 CCCCCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100011214924 [1,0,0,1,0,0|2,0,0]=4 17747 B14R1.890 CCCCCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100011214924 [1,0,0,1,0,0|2,0,0]=4 17748 B14R1.890 CCCCCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100011214924 [1,0,0,1,0,0|2,0,0]=4 17749 B14R1.890 CCCCCCCCOCC1CC1C 34a_100000744939_100000210759 [1,0,0,1,0,0|1,0,1]=4 17750 B14R1.890 CCCCCCCCOCC1CC1C 7a_100000744939_100000210759 [1,0,0,1,0,0|1,0,1]=4 17751 B14R1.891 BrCCCCCCCCOC1CCC1 34a_100009813846_100000749161 [1,0,0,1,0,0|2,0,0]=4 17752 B14R1.891 BrCCCCCCCOCC1CCC1 34a_100000760002_100000763275 [1,0,0,1,0,0|2,0,0]=4 17753 B14R1.891 BrCCCCCCCOCC1CCC1 7a_100000760002_100000763275 [1,0,0,1,0,0|2,0,0]=4 17754 B14R1.891 C=CCCCCCCCCN1CCC1 269982a_100000754969_100011933949 [1,0,0,1,0,0|1,0,1]=4 17755 B14R1.891 C=CCCCCCCCNC1CCC1 2230a_100000749019_100012355270 [1,0,0,1,0,0|1,0,1]=4 17756 B14R1.891 C=CCCCCCCCNC1CCC1 34a_100000749019_100012355270 [1,0,0,1,0,0|1,0,1]=4 17757 B14R1.891 C=CCCCCCCCOC1CCC1 34a_100000730831_100000749161 [1,0,0,1,0,0|1,0,1]=4 17758 B14R1.891 C=CCCCCCCCOC1CCC1 34a_100000748187_100012355270 [1,0,0,1,0,0|1,0,1]=4 17759 B14R1.891 C=CCCCCCCCSC1CCC1 62a_100012355270_100000749161 [1,0,0,1,0,0|1,0,1]=4 17760 B14R1.891 C=CCCCCCCNCC1CCC1 2230a_100000738700_100011215473 [1,0,0,1,0,0|1,0,1]=4 17761 B14R1.891 C=CCCCCCCNCC1CCC1 34a_100000738700_100011215473 [1,0,0,1,0,0|1,0,1]=4 17762 B14R1.891 C=CCCCCCCOCC1CCC1 34a_100000760304_100011215473 [1,0,0,1,0,0|1,0,1]=4 17763 B14R1.891 C=CCCCCCCOCC1CCC1 34a_200011216477_100000763275 [1,0,0,1,0,0|1,0,1]=4 17764 B14R1.891 C=CCCCCCCOCC1CCC1 7a_200011216477_100000763275 [1,0,0,1,0,0|1,0,1]=4 17765 B14R1.891 C=CCCCCCCSCC1CCC1 62a_100000763275_100011215473 [1,0,0,1,0,0|1,0,1]=4 17766 B14R1.891 C=CCCCCCCSCC1CCC1 62a_100011215473_100000763275 [1,0,0,1,0,0|1,0,1]=4 17767 B14R1.891 CCCCCCCCCCN1CCC1 269982a_100000754969_100000210320 [1,0,0,1,0,0|1,0,1]=4 17768 B14R1.891 CCCCCCCCCNC1CCC1 2230a_100000749019_100011214924 [1,0,0,1,0,0|1,0,1]=4 17769 B14R1.891 CCCCCCCCCNC1CCC1 270004a_100000212291_100000241760 [1,0,0,1,0,0|1,0,1]=4 17770 B14R1.891 CCCCCCCCCNC1CCC1 34a_100000212291_100000749161 [1,0,0,1,0,0|1,0,1]=4 17771 B14R1.891 CCCCCCCCCNC1CCC1 34a_100000749019_100011214924 [1,0,0,1,0,0|1,0,1]=4 17772 B14R1.891 CCCCCCCCCOC1CCC1 34a_100000210712_100000749161 [1,0,0,1,0,0|1,0,1]=4 17773 B14R1.891 CCCCCCCCCOC1CCC1 34a_100000748187_100011214924 [1,0,0,1,0,0|1,0,1]=4 17774 B14R1.891 CCCCCCCCNCC1CCC1 2230a_100000229939_100000763275 [1,0,0,1,0,0|1,0,1]=4 17775 B14R1.891 CCCCCCCCNCC1CCC1 2230a_100000738700_100000210759 [1,0,0,1,0,0|1,0,1]=4 17776 B14R1.891 CCCCCCCCNCC1CCC1 269862a_100000229939_100000753134 [1,0,0,1,0,0|1,0,1]=4 17777 B14R1.891 CCCCCCCCNCC1CCC1 34a_100000229939_100000763275 [1,0,0,1,0,0|1,0,1]=4 17778 B14R1.891 CCCCCCCCNCC1CCC1 34a_100000738700_100000210759 [1,0,0,1,0,0|1,0,1]=4 17779 B14R1.891 CCCCCCCCNCC1CCO1 2230a_100000229939_100000103362 [1,0,0,1,0,0|1,0,1]=4 17780 B14R1.891 CCCCCCCCNCC1CCO1 34a_100000229939_100000103362 [1,0,0,1,0,0|1,0,1]=4 17781 B14R1.891 CCCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100000210759 [1,0,0,1,0,0|1,0,1]=4 17782 B14R1.891 CCCCCCCCNC[C@@H]1CCO1 34a_100020831831_100000210759 [1,0,0,1,0,0|1,0,1]=4 17783 B14R1.891 CCCCCCCCOCC1CCC1 34a_100000210232_100000763275 [1,0,0,1,0,0|1,0,1]=4 17784 B14R1.891 CCCCCCCCOCC1CCC1 34a_100000760304_100000210759 [1,0,0,1,0,0|1,0,1]=4 17785 B14R1.891 CCCCCCCCOCC1CCC1 7a_100000210232_100000763275 [1,0,0,1,0,0|1,0,1]=4 17786 B14R1.891 CCCCCCCCOCC1CCO1 34a_100000039022_100000210759 [1,0,0,1,0,0|1,0,1]=4 17787 B14R1.891 CCCCCCCCOCC1CCO1 34a_100000210232_100000103362 [1,0,0,1,0,0|1,0,1]=4 17788 B14R1.891 CCCCCCCCOCC1CCO1 7a_100000210232_100000103362 [1,0,0,1,0,0|1,0,1]=4 17789 B14R1.891 CCCCCCCCSCC1CCC1 62a_100000210759_100000763275 [1,0,0,1,0,0|1,0,1]=4 17790 B14R1.891 CCCCCCCCSCC1CCC1 62a_100000763275_100000210317 [1,0,0,1,0,0|1,0,1]=4 17791 B14R1.891 CCCCCCCCSCC1CCO1 62a_100000103362_100000210317 [1,0,0,1,0,0|1,0,1]=4 17792 B14R1.891 CCCCCCCCSCC1CCO1 62a_100000210759_100000103362 [1,0,0,1,0,0|1,0,1]=4 17793 B14R1.891 ClCCCCCCCCOC1CCC1 34a_100000033203_100000749161 [1,0,0,1,0,0|2,0,0]=4 17794 B14R1.891 NCCCCCCCCOC1CCC1 34a_102515433106_100000749161 [1,0,0,1,0,0|2,0,0]=4 17795 B14R1.891 NCCCCCCCOCC1CCC1 34a_100011996573_100000763275 [1,0,0,1,0,0|2,0,0]=4 17796 B14R1.891 OCCCCCCCCCN1CCC1 269982a_100000754969_100009813782 [1,0,0,1,0,0|1,0,1]=4 17797 B14R1.891 OCCCCCCCCNC1CCC1 2230a_100000749019_100000033203 [1,0,0,1,0,0|1,0,1]=4 17798 B14R1.891 OCCCCCCCCNC1CCC1 270004a_102515433106_100000241760 [1,0,0,1,0,0|1,0,1]=4 17799 B14R1.891 OCCCCCCCCNC1CCC1 34a_100000749019_100000033203 [1,0,0,1,0,0|1,0,1]=4 17800 B14R1.891 OCCCCCCCCNC1CCC1 34a_102515433106_100000749161 [1,0,0,1,0,0|1,0,1]=4 17801 B14R1.891 OCCCCCCCCOC1CCC1 34a_100000748187_100000033203 [1,0,0,1,0,0|1,0,1]=4 17802 B14R1.891 OCCCCCCCCSC1CCC1 62a_100000033203_100000749161 [1,0,0,1,0,0|1,0,1]=4 17803 B14R1.891 OCCCCCCCNCC1CCC1 2230a_100000738700_100000760002 [1,0,0,1,0,0|1,0,1]=4 17804 B14R1.891 OCCCCCCCNCC1CCC1 2230a_100011996573_100000763275 [1,0,0,1,0,0|1,0,1]=4 17805 B14R1.891 OCCCCCCCNCC1CCC1 269862a_100011996573_100000753134 [1,0,0,1,0,0|1,0,1]=4 17806 B14R1.891 OCCCCCCCNCC1CCC1 34a_100000738700_100000760002 [1,0,0,1,0,0|1,0,1]=4 17807 B14R1.891 OCCCCCCCNCC1CCC1 34a_100011996573_100000763275 [1,0,0,1,0,0|1,0,1]=4 17808 B14R1.891 OCCCCCCCOCC1CCC1 34a_100000760304_100000760002 [1,0,0,1,0,0|1,0,1]=4 17809 B14R1.891 OCCCCCCCSCC1CCC1 62a_100000760002_100000763275 [1,0,0,1,0,0|1,0,1]=4 17810 B14R1.891 OCCCCCCCSCC1CCC1 62a_100000763275_100000760002 [1,0,0,1,0,0|1,0,1]=4 17811 B14R1.904 C=CCC1CCCCC1NCCCC 269862a_100000102301_100011214939 [1,0,0,1,0,0|1,0,1]=4 17812 B14R1.904 C=CCC1CCCCC1NCCCC 270004a_100000102301_100011214939 [1,0,0,1,0,0|1,0,1]=4 17813 B14R1.904 C=CCCCN1CCCCC1CCC 2230a_100000701414_100011713584 [1,0,0,1,0,0|1,0,1]=4 17814 B14R1.904 C=CCCCN1CCCCC1CCC 269982a_100000701414_100000757094 [1,0,0,1,0,0|1,0,1]=4 17815 B14R1.904 C=CCCCN1CCCCC1CCC 34a_100000701414_100000757094 [1,0,0,1,0,0|1,0,1]=4 17816 B14R1.904 C=CCCNC1CCCCC1CCC 269862a_100015191253_100011218038 [1,0,0,1,0,0|1,0,1]=4 17817 B14R1.904 C=CCCNC1CCCCC1CCC 270004a_100015191253_100011218038 [1,0,0,1,0,0|1,0,1]=4 17818 B14R1.904 C=CCCOC1CCCCC1CCC 34a_100011217265_100000754431 [1,0,0,1,0,0|1,0,1]=4 17819 B14R1.904 C=CCCOC1CCCCC1CCC 7a_100011217265_100000754431 [1,0,0,1,0,0|1,0,1]=4 17820 B14R1.904 CCCC1CCCCC1NCCCF 269862a_100015189416_100011218038 [1,0,0,1,0,0|2,0,0]=4 17821 B14R1.904 CCCC1CCCCC1NCCCF 270004a_100015189416_100011218038 [1,0,0,1,0,0|2,0,0]=4 17822 B14R1.904 CCCC1CCCCC1NCCCO 269862a_100000182051_100011218038 [1,0,0,1,0,0|1,0,1]=4 17823 B14R1.904 CCCC1CCCCC1NCCCO 270004a_100000182051_100011218038 [1,0,0,1,0,0|1,0,1]=4 17824 B14R1.904 CCCC1CCCCC1OCCCF 34a_100011217265_100011934791 [1,0,0,1,0,0|2,0,0]=4 17825 B14R1.904 CCCC1CCCCC1OCCCF 7a_100011217265_100011934791 [1,0,0,1,0,0|2,0,0]=4 17826 B14R1.904 CCCC1CCCCC1OCCCO 34a_100011217265_100000230001 [1,0,0,1,0,0|1,0,1]=4 17827 B14R1.904 CCCC1CCCCC1OCCCO 7a_100011217265_100011215043 [1,0,0,1,0,0|1,0,1]=4 17828 B14R1.904 CCCC1CCCCN1CCCC=O 2230a_100000701414_200011292268 [1,0,0,1,0,0|1,0,0]=3 17829 B14R1.904 CCCC1CCCCN1CCCC=O 269982a_100000701414_200011292268 [1,0,0,1,0,0|1,0,0]=3 17830 B14R1.904 CCCC1CCCCN1CCCCF 2230a_100000701414_100000729493 [1,0,0,1,0,0|2,0,0]=4 17831 B14R1.904 CCCC1CCCCN1CCCCF 269982a_100000701414_100000729493 [1,0,0,1,0,0|2,0,0]=4 17832 B14R1.904 CCCC1CCCCN1CCCCF 34a_100000701414_100000729493 [1,0,0,1,0,0|2,0,0]=4 17833 B14R1.904 CCCC1CCCCN1CCCCO 2230a_100000701414_100000210776 [1,0,0,1,0,0|1,0,1]=4 17834 B14R1.904 CCCC1CCCCN1CCCCO 269982a_100000701414_100000210776 [1,0,0,1,0,0|1,0,1]=4 17835 B14R1.904 CCCC1CCCCN1CCCCO 34a_100000701414_100011216708 [1,0,0,1,0,0|1,0,1]=4 17836 B14R1.904 CCCC1COCCN1CCCC=O 2230a_102495339903_200011292268 [1,0,0,1,0,0|2,0,0]=4 17837 B14R1.904 CCCC1COCCN1CCCC=O 269982a_102495339903_200011292268 [1,0,0,1,0,0|2,0,0]=4 17838 B14R1.904 CCCCCN1CCCCC1CCC 2230a_100000701414_100000210326 [1,0,0,1,0,0|1,0,1]=4 17839 B14R1.904 CCCCCN1CCCCC1CCC 269982a_100000701414_100000210215 [1,0,0,1,0,0|1,0,1]=4 17840 B14R1.904 CCCCCN1CCCCC1CCC 34a_100000701414_100000718602 [1,0,0,1,0,0|1,0,1]=4 17841 B14R1.904 CCCCCN1CCCCC1CCO 2230a_100000211664_100000210326 [1,0,0,1,0,0|1,0,1]=4 17842 B14R1.904 CCCCCN1CCCCC1CCO 269982a_100000211664_100000210215 [1,0,0,1,0,0|1,0,1]=4 17843 B14R1.904 CCCCCN1CCCCC1CCO 34a_100000211664_100000718602 [1,0,0,1,0,0|1,0,1]=4 17844 B14R1.904 CCCCNC1CCCCC1CCC 269862a_100000102301_100011218038 [1,0,0,1,0,0|1,0,1]=4 17845 B14R1.904 CCCCNC1CCCCC1CCC 270004a_100000102301_100011218038 [1,0,0,1,0,0|1,0,1]=4 17846 B14R1.904 CCCCOC1CCCCC1CCC 34a_100011217265_100000210210 [1,0,0,1,0,0|1,0,1]=4 17847 B14R1.904 CCCCOC1CCCCC1CCC 7a_100011217265_100000210211 [1,0,0,1,0,0|1,0,1]=4 17848 B14R1.904 COCC1CCCCN1CCCC=O 2230a_100015184032_200011292268 [1,0,0,1,0,0|2,0,0]=4 17849 B14R1.904 COCC1CCCCN1CCCC=O 269982a_100015184032_200011292268 [1,0,0,1,0,0|2,0,0]=4 17850 B14R1.904 COCCCC1CCCCN1CC=O 2230a_100011804088_200015260668 [1,0,0,1,0,0|2,0,0]=4 17851 B14R1.904 COCCCC1CCCCN1CC=O 269982a_100011804088_200015260668 [1,0,0,1,0,0|2,0,0]=4 17852 B14R1.904 COCCCC1CCCCN1CC=O 34a_100011804088_200009817547 [1,0,0,1,0,0|2,0,0]=4 17853 B14R1.904 O=CCCCN1CCCCC1CCO 2230a_100000211664_200011292268 [1,0,0,1,0,0|2,0,0]=4 17854 B14R1.904 O=CCCCN1CCCCC1CCO 269982a_100000211664_200011292268 [1,0,0,1,0,0|2,0,0]=4 17855 B14R1.911 C=CCCNC1CCCC1CCCC 269862a_100015191253_100000750825 [1,0,0,1,0,0|1,0,1]=4 17856 B14R1.911 C=CCCNC1CCCC1CCCC 270004a_100015191253_100000750825 [1,0,0,1,0,0|1,0,1]=4 17857 B14R1.911 C=CCNC1CCCC1CCCCC 270004a_100020586998_200000198059 [1,0,0,1,0,0|1,0,1]=4 17858 B14R1.911 CCCCC1CCCC1NCCCF 269862a_100015189416_100000750825 [1,0,0,1,0,0|2,0,0]=4 17859 B14R1.911 CCCCC1CCCC1NCCCF 270004a_100015189416_100000750825 [1,0,0,1,0,0|2,0,0]=4 17860 B14R1.911 CCCCC1CCCC1NCCCO 269862a_100000182051_100000750825 [1,0,0,1,0,0|1,0,1]=4 17861 B14R1.911 CCCCC1CCCC1NCCCO 270004a_100000182051_100000750825 [1,0,0,1,0,0|1,0,1]=4 17862 B14R1.911 CCCCCC1CCCC1NCCC 269862a_100020643023_200000198059 [1,0,0,1,0,0|1,0,1]=4 17863 B14R1.911 CCCCCC1CCCC1NCCC 270004a_100020643023_200000198059 [1,0,0,1,0,0|1,0,1]=4 17864 B14R1.911 CCCCCC1CCCC1NCCF 269862a_100000724931_200000198059 [1,0,0,1,0,0|2,0,0]=4 17865 B14R1.911 CCCCCC1CCCC1NCCO 269862a_100000210304_200000198059 [1,0,0,1,0,0|1,0,1]=4 17866 B14R1.911 CCCCCC1CCCC1NCCO 270004a_100000210304_200000198059 [1,0,0,1,0,0|1,0,1]=4 17867 B14R1.911 CCCCNC1CCCC1CCCC 269862a_100000102301_100000750825 [1,0,0,1,0,0|1,0,1]=4 17868 B14R1.911 CCCCNC1CCCC1CCCC 270004a_100000102301_100000750825 [1,0,0,1,0,0|1,0,1]=4 17869 B14R1.1254 C=CCCCCN1CCCCCCC1 2230a_100000211400_100011215482 [1,0,0,1,0,0|1,0,1]=4 17870 B14R1.1254 C=CCCCCN1CCCCCCC1 269982a_100000211400_100011215482 [1,0,0,1,0,0|1,0,1]=4 17871 B14R1.1254 C=CCCCCN1CCCCCCC1 34a_100000211400_100011215482 [1,0,0,1,0,0|1,0,1]=4 17872 B14R1.1254 C=CCCCNC1CCCCCCC1 2230a_100000211152_100011713584 [1,0,0,1,0,0|1,0,1]=4 17873 B14R1.1254 C=CCCCNC1CCCCCCC1 270004a_100000700776_100000210524 [1,0,0,1,0,0|1,0,1]=4 17874 B14R1.1254 C=CCCCNC1CCCCCCC1 34a_100000211152_100000757094 [1,0,0,1,0,0|1,0,1]=4 17875 B14R1.1254 C=CCCCOC1CCCCCCC1 34a_100000210054_100000757094 [1,0,0,1,0,0|1,0,1]=4 17876 B14R1.1254 C=CCCCOC1CCCCCCC1 7a_100000210054_100000757094 [1,0,0,1,0,0|1,0,1]=4 17877 B14R1.1254 C=CCCOCC1CCCCCCC1 34a_100011216312_100000754431 [1,0,0,1,0,0|1,0,1]=4 17878 B14R1.1254 C=CCCOCC1CCCCCCC1 7a_100011216312_100000754431 [1,0,0,1,0,0|1,0,1]=4 17879 B14R1.1254 C=CCNCCC1CCCCCCC1 2230a_100011532352_100000210623 [1,0,0,1,0,0|1,0,1]=4 17880 B14R1.1254 C=CCNCCC1CCCCCCC1 34a_100011532352_100015514636 [1,0,0,1,0,0|1,0,1]=4 17881 B14R1.1254 CCCCCCN1CCCCCCC1 2230a_100000211400_100000210314 [1,0,0,1,0,0|1,0,1]=4 17882 B14R1.1254 CCCCCCN1CCCCCCC1 269982a_100000211400_100000210757 [1,0,0,1,0,0|1,0,1]=4 17883 B14R1.1254 CCCCCCN1CCCCCCC1 34a_100000211400_100000210314 [1,0,0,1,0,0|1,0,1]=4 17884 B14R1.1254 CCCCCNC1CCCCCCC1 2230a_100000211152_100000210326 [1,0,0,1,0,0|1,0,1]=4 17885 B14R1.1254 CCCCCNC1CCCCCCC1 270004a_100000209983_100000210524 [1,0,0,1,0,0|1,0,1]=4 17886 B14R1.1254 CCCCCNC1CCCCCCC1 34a_100000211152_100000718602 [1,0,0,1,0,0|1,0,1]=4 17887 B14R1.1254 CCCCCOC1C=CCCCCC1 34a_100000688657_100000718602 [1,0,0,1,0,0|1,0,1]=4 17888 B14R1.1254 CCCCCOC1CCCCCCC1 34a_100000210054_100000718602 [1,0,0,1,0,0|1,0,1]=4 17889 B14R1.1254 CCCCCOC1CCCCCCC1 7a_100000210054_100000210326 [1,0,0,1,0,0|1,0,1]=4 17890 B14R1.1254 CCCCOCC1CCCCCCC1 34a_100011216312_100000210210 [1,0,0,1,0,0|1,0,1]=4 17891 B14R1.1254 CCCCOCC1CCCCCCC1 7a_100011216312_100000210211 [1,0,0,1,0,0|1,0,1]=4 17892 B14R1.1254 CCCNCCC1CCCCCCC1 2230a_100011532352_100000210303 [1,0,0,1,0,0|1,0,1]=4 17893 B14R1.1254 CCCNCCC1CCCCCCC1 34a_100011532352_100000210303 [1,0,0,1,0,0|1,0,1]=4 17894 B14R1.1254 FCCCCCN1CCCCCCC1 2230a_100000211400_100000729378 [1,0,0,1,0,0|2,0,0]=4 17895 B14R1.1254 FCCCCCN1CCCCCCC1 269982a_100000211400_100000729378 [1,0,0,1,0,0|2,0,0]=4 17896 B14R1.1254 FCCCCCN1CCCCCCC1 34a_100000211400_100000729378 [1,0,0,1,0,0|2,0,0]=4 17897 B14R1.1254 FCCCCNC1CCCCCCC1 2230a_100000211152_100000729493 [1,0,0,1,0,0|2,0,0]=4 17898 B14R1.1254 FCCCCNC1CCCCCCC1 34a_100000211152_100000729493 [1,0,0,1,0,0|2,0,0]=4 17899 B14R1.1254 FCCCCOC1CCCCCCC1 34a_100000210054_100000729493 [1,0,0,1,0,0|2,0,0]=4 17900 B14R1.1254 FCCCCOC1CCCCCCC1 7a_100000210054_100000729493 [1,0,0,1,0,0|2,0,0]=4 17901 B14R1.1254 FCCCOCC1CCCCCCC1 34a_100011216312_100011934791 [1,0,0,1,0,0|2,0,0]=4 17902 B14R1.1254 FCCCOCC1CCCCCCC1 7a_100011216312_100011934791 [1,0,0,1,0,0|2,0,0]=4 17903 B14R1.1254 FCCNCCC1CCCCCCC1 2230a_100011532352_100011217306 [1,0,0,1,0,0|2,0,0]=4 17904 B14R1.1254 FCCNCCC1CCCCCCC1 34a_100011532352_100011217306 [1,0,0,1,0,0|2,0,0]=4 17905 B14R1.1254 O=CCCCCN1CCCCCCC1 2230a_100000211400_100000139335 [1,0,0,1,0,0|1,0,0]=3 17906 B14R1.1254 O=CCCCCN1CCCCCCC1 269982a_100000211400_100000139335 [1,0,0,1,0,0|1,0,0]=3 17907 B14R1.1254 O=CCCCNC1CCCCCCC1 2230a_100000211152_200011292268 [1,0,0,1,0,0|1,0,0]=3 17908 B14R1.1254 O=CCCCOC1CCCCCCC1 7a_100000210054_200011292268 [1,0,0,1,0,0|1,0,0]=3 17909 B14R1.1254 O=CCNCCC1CCCCCCC1 2230a_100011532352_200015260668 [1,0,0,1,0,0|1,0,0]=3 17910 B14R1.1254 O=CCNCCC1CCCCCCC1 34a_100011532352_200009817547 [1,0,0,1,0,0|1,0,0]=3 17911 B14R1.1254 OCCCCCN1CCCCCCC1 2230a_100000211400_100000746330 [1,0,0,1,0,0|1,0,1]=4 17912 B14R1.1254 OCCCCCN1CCCCCCC1 269982a_100000211400_100000746330 [1,0,0,1,0,0|1,0,1]=4 17913 B14R1.1254 OCCCCCN1CCCCCCC1 34a_100000211400_100000746330 [1,0,0,1,0,0|1,0,1]=4 17914 B14R1.1254 OCCCCNC1CCCCCCC1 2230a_100000211152_100000210776 [1,0,0,1,0,0|1,0,1]=4 17915 B14R1.1254 OCCCCNC1CCCCCCC1 270004a_100000750430_100000210524 [1,0,0,1,0,0|1,0,1]=4 17916 B14R1.1254 OCCCCNC1CCCCCCC1 34a_100000211152_100011216708 [1,0,0,1,0,0|1,0,1]=4 17917 B14R1.1254 OCCCCOC1CCCCCCC1 34a_100000210054_100011216708 [1,0,0,1,0,0|1,0,1]=4 17918 B14R1.1254 OCCCCOC1CCCCCCC1 7a_100000210054_100000210776 [1,0,0,1,0,0|1,0,1]=4 17919 B14R1.1254 OCCCOCC1CCCCCCC1 34a_100011216312_100000230001 [1,0,0,1,0,0|1,0,1]=4 17920 B14R1.1254 OCCCOCC1CCCCCCC1 7a_100011216312_100011215043 [1,0,0,1,0,0|1,0,1]=4 17921 B14R1.1254 OCCNCCC1CCCCCCC1 2230a_100011532352_100000211926 [1,0,0,1,0,0|1,0,1]=4 17922 B14R1.1254 OCCNCCC1CCCCCCC1 34a_100011532352_100000211926 [1,0,0,1,0,0|1,0,1]=4 17923 B14R1.2352 BrCCCCCOC1CCCCCC1 34a_100000746331_100011217769 [1,0,0,1,0,0|2,0,0]=4 17924 B14R1.2352 BrCCCCOCC1CCCCCC1 34a_100011216708_200000696569 [1,0,0,1,0,0|2,0,0]=4 17925 B14R1.2352 C=CCCCCCN1CCCCCC1 2230a_100000185865_100000700193 [1,0,0,1,0,0|1,0,1]=4 17926 B14R1.2352 C=CCCCCCN1CCCCCC1 269982a_100000185865_100000700193 [1,0,0,1,0,0|1,0,1]=4 17927 B14R1.2352 C=CCCCCCN1CCCCCC1 34a_100000185865_100000700193 [1,0,0,1,0,0|1,0,1]=4 17928 B14R1.2352 C=CCCCCNC1CCCCCC1 2230a_100000210984_100011215482 [1,0,0,1,0,0|1,0,1]=4 17929 B14R1.2352 C=CCCCCNC1CCCCCC1 270004a_100000703577_100000210131 [1,0,0,1,0,0|1,0,1]=4 17930 B14R1.2352 C=CCCCCNC1CCCCCC1 34a_100000210984_100011215482 [1,0,0,1,0,0|1,0,1]=4 17931 B14R1.2352 C=CCCCCNC1CCCCCC1 34a_100000703577_100011217769 [1,0,0,1,0,0|1,0,1]=4 17932 B14R1.2352 C=CCCCCOC1CCCCCC1 34a_100000210887_100011215482 [1,0,0,1,0,0|1,0,1]=4 17933 B14R1.2352 C=CCCCCOC1CCCCCC1 34a_100000766645_100011217769 [1,0,0,1,0,0|1,0,1]=4 17934 B14R1.2352 C=CCCCCOC1CCCCCC1 7a_100000210887_100011215482 [1,0,0,1,0,0|1,0,1]=4 17935 B14R1.2352 C=CCCCCSC1CCCCCC1 62a_100011215482_100011217769 [1,0,0,1,0,0|1,0,1]=4 17936 B14R1.2352 C=CCCCCSC1CCCCCC1 62a_100011217769_100011215482 [1,0,0,1,0,0|1,0,1]=4 17937 B14R1.2352 C=CCCCNCC1CCCCCC1 2230a_100000700776_200000696569 [1,0,0,1,0,0|1,0,1]=4 17938 B14R1.2352 C=CCCCNCC1CCCCCC1 2230a_100015204231_100011713584 [1,0,0,1,0,0|1,0,1]=4 17939 B14R1.2352 C=CCCCNCC1CCCCCC1 269862a_100000700776_200000763224 [1,0,0,1,0,0|1,0,1]=4 17940 B14R1.2352 C=CCCCNCC1CCCCCC1 34a_100000700776_200000696569 [1,0,0,1,0,0|1,0,1]=4 17941 B14R1.2352 C=CCCCNCC1CCCCCC1 34a_100015204231_100000757094 [1,0,0,1,0,0|1,0,1]=4 17942 B14R1.2352 C=CCCCOCC1CCCCCC1 34a_100000699130_100000757094 [1,0,0,1,0,0|1,0,1]=4 17943 B14R1.2352 C=CCCCOCC1CCCCCC1 34a_100000758997_200000696569 [1,0,0,1,0,0|1,0,1]=4 17944 B14R1.2352 C=CCCCOCC1CCCCCC1 7a_100000699130_100000757094 [1,0,0,1,0,0|1,0,1]=4 17945 B14R1.2352 C=CCCCOCC1CCCCCC1 7a_100000758997_200000696569 [1,0,0,1,0,0|1,0,1]=4 17946 B14R1.2352 C=CCCCSCC1CCCCCC1 62a_100011713584_200000696569 [1,0,0,1,0,0|1,0,1]=4 17947 B14R1.2352 C=CCCCSCC1CCCCCC1 62a_200000696569_100000757094 [1,0,0,1,0,0|1,0,1]=4 17948 B14R1.2352 C=CCCNCCC1CCCCCC1 2230a_100011532351_100000754431 [1,0,0,1,0,0|1,0,1]=4 17949 B14R1.2352 C=CCCNCCC1CCCCCC1 34a_100011532351_100000754431 [1,0,0,1,0,0|1,0,1]=4 17950 B14R1.2352 CCCCCCCN1CCCCCC1 2230a_100000185865_100000210681 [1,0,0,1,0,0|1,0,1]=4 17951 B14R1.2352 CCCCCCCN1CCCCCC1 269982a_100000185865_100000210681 [1,0,0,1,0,0|1,0,1]=4 17952 B14R1.2352 CCCCCCCN1CCCCCC1 34a_100000185865_100000210614 [1,0,0,1,0,0|1,0,1]=4 17953 B14R1.2352 CCCCCCNC1CCCCCC1 2230a_100000210984_100000210314 [1,0,0,1,0,0|1,0,1]=4 17954 B14R1.2352 CCCCCCNC1CCCCCC1 270004a_100000210581_100000210131 [1,0,0,1,0,0|1,0,1]=4 17955 B14R1.2352 CCCCCCNC1CCCCCC1 34a_100000210984_100000210314 [1,0,0,1,0,0|1,0,1]=4 17956 B14R1.2352 CCCCCCOC1CCCCCC1 34a_100000210259_100011217769 [1,0,0,1,0,0|1,0,1]=4 17957 B14R1.2352 CCCCCCOC1CCCCCC1 34a_100000210887_100000210314 [1,0,0,1,0,0|1,0,1]=4 17958 B14R1.2352 CCCCCCOC1CCCCCC1 7a_100000210887_100000210314 [1,0,0,1,0,0|1,0,1]=4 17959 B14R1.2352 CCCCCCSC1CCCCCC1 62a_100000210314_100011217769 [1,0,0,1,0,0|1,0,1]=4 17960 B14R1.2352 CCCCCCSC1CCCCCC1 62a_100011217769_100000210757 [1,0,0,1,0,0|1,0,1]=4 17961 B14R1.2352 CCCCCNCC1CCCCCC1 2230a_100000209983_200000696569 [1,0,0,1,0,0|1,0,1]=4 17962 B14R1.2352 CCCCCNCC1CCCCCC1 2230a_100015204231_100000210326 [1,0,0,1,0,0|1,0,1]=4 17963 B14R1.2352 CCCCCNCC1CCCCCC1 269862a_100000209983_200000763224 [1,0,0,1,0,0|1,0,1]=4 17964 B14R1.2352 CCCCCNCC1CCCCCC1 34a_100015204231_100000718602 [1,0,0,1,0,0|1,0,1]=4 17965 B14R1.2352 CCCCCOCC1CCCCCC1 34a_100000210253_200000696569 [1,0,0,1,0,0|1,0,1]=4 17966 B14R1.2352 CCCCCOCC1CCCCCC1 34a_100000699130_100000718602 [1,0,0,1,0,0|1,0,1]=4 17967 B14R1.2352 CCCCCOCC1CCCCCC1 7a_100000210253_200000696569 [1,0,0,1,0,0|1,0,1]=4 17968 B14R1.2352 CCCCCOCC1CCCCCC1 7a_100000699130_100000210326 [1,0,0,1,0,0|1,0,1]=4 17969 B14R1.2352 CCCCCSCC1CCCCCC1 62a_100000210326_200000696569 [1,0,0,1,0,0|1,0,1]=4 17970 B14R1.2352 CCCCCSCC1CCCCCC1 62a_200000696569_100000210326 [1,0,0,1,0,0|1,0,1]=4 17971 B14R1.2352 CCCCNCCC1CCCCCC1 2230a_100011532351_100000210211 [1,0,0,1,0,0|1,0,1]=4 17972 B14R1.2352 CCCCNCCC1CCCCCC1 34a_100011532351_100000210210 [1,0,0,1,0,0|1,0,1]=4 17973 B14R1.2352 ClCCCCCOC1CCCCCC1 34a_100000746330_100011217769 [1,0,0,1,0,0|2,0,0]=4 17974 B14R1.2352 ClCCCCOCC1CCCCCC1 34a_100000210776_200000696569 [1,0,0,1,0,0|2,0,0]=4 17975 B14R1.2352 ClCCCCOCC1CCCCCC1 7a_100000210776_200000696569 [1,0,0,1,0,0|2,0,0]=4 17976 B14R1.2352 FCCCCCCN1CCCCCC1 2230a_100000185865_100015922095 [1,0,0,1,0,0|2,0,0]=4 17977 B14R1.2352 FCCCCCCN1CCCCCC1 269982a_100000185865_100015922095 [1,0,0,1,0,0|2,0,0]=4 17978 B14R1.2352 FCCCCCCN1CCCCCC1 34a_100000185865_100015922095 [1,0,0,1,0,0|2,0,0]=4 17979 B14R1.2352 FCCCCCNC1CCCCCC1 2230a_100000210984_100000729378 [1,0,0,1,0,0|2,0,0]=4 17980 B14R1.2352 FCCCCCNC1CCCCCC1 34a_100000210984_100000729378 [1,0,0,1,0,0|2,0,0]=4 17981 B14R1.2352 FCCCCCOC1CCCCCC1 34a_100000210887_100000729378 [1,0,0,1,0,0|2,0,0]=4 17982 B14R1.2352 FCCCCCOC1CCCCCC1 7a_100000210887_100000729378 [1,0,0,1,0,0|2,0,0]=4 17983 B14R1.2352 FCCCCCSC1CCCCCC1 62a_100000729378_100011217769 [1,0,0,1,0,0|2,0,0]=4 17984 B14R1.2352 FCCCCCSC1CCCCCC1 62a_100011217769_100000729378 [1,0,0,1,0,0|2,0,0]=4 17985 B14R1.2352 FCCCCNCC1CCCCCC1 2230a_100015204231_100000729493 [1,0,0,1,0,0|2,0,0]=4 17986 B14R1.2352 FCCCCNCC1CCCCCC1 34a_100015204231_100000729493 [1,0,0,1,0,0|2,0,0]=4 17987 B14R1.2352 FCCCCOCC1CCCCCC1 34a_100000699130_100000729493 [1,0,0,1,0,0|2,0,0]=4 17988 B14R1.2352 FCCCCOCC1CCCCCC1 34a_100011995726_200000696569 [1,0,0,1,0,0|2,0,0]=4 17989 B14R1.2352 FCCCCOCC1CCCCCC1 7a_100000699130_100000729493 [1,0,0,1,0,0|2,0,0]=4 17990 B14R1.2352 FCCCCOCC1CCCCCC1 7a_100011995726_200000696569 [1,0,0,1,0,0|2,0,0]=4 17991 B14R1.2352 FCCCCSCC1CCCCCC1 62a_100000729493_200000696569 [1,0,0,1,0,0|2,0,0]=4 17992 B14R1.2352 FCCCCSCC1CCCCCC1 62a_200000696569_100000729493 [1,0,0,1,0,0|2,0,0]=4 17993 B14R1.2352 FCCCNCCC1CCCCCC1 2230a_100011532351_100011934791 [1,0,0,1,0,0|2,0,0]=4 17994 B14R1.2352 FCCCNCCC1CCCCCC1 34a_100011532351_100011934791 [1,0,0,1,0,0|2,0,0]=4 17995 B14R1.2352 ICCCCCOC1CCCCCC1 34a_200012148887_100011217769 [1,0,0,1,0,0|2,0,0]=4 17996 B14R1.2352 ICCCCOCC1CCCCCC1 34a_200012148704_200000696569 [1,0,0,1,0,0|2,0,0]=4 17997 B14R1.2352 NCCCCCOC1CCCCCC1 34a_100000762737_100011217769 [1,0,0,1,0,0|2,0,0]=4 17998 B14R1.2352 NCCCCOCC1CCCCCC1 34a_100000750430_200000696569 [1,0,0,1,0,0|2,0,0]=4 17999 B14R1.2352 O=CCCCCCN1CCCCCC1 2230a_100000185865_100000139337 [1,0,0,1,0,0|1,0,0]=3 18000 B14R1.2352 O=CCCCCCN1CCCCCC1 269982a_100000185865_100000139337 [1,0,0,1,0,0|1,0,0]=3 18001 B14R1.2352 O=CCCCCCN1CCCOCC1 2230a_100000685342_100000139337 [1,0,0,1,0,0|2,0,0]=4 18002 B14R1.2352 O=CCCCCCN1CCCOCC1 269982a_100000685342_100000139337 [1,0,0,1,0,0|2,0,0]=4 18003 B14R1.2352 O=CCCCCNC1CCCCCC1 2230a_100000210984_100000139335 [1,0,0,1,0,0|1,0,0]=3 18004 B14R1.2352 O=CCCCCOC1CCCCCC1 7a_100000210887_100000139335 [1,0,0,1,0,0|1,0,0]=3 18005 B14R1.2352 O=CCCCCSC1CCCCCC1 62a_100000139335_100011217769 [1,0,0,1,0,0|1,0,0]=3 18006 B14R1.2352 O=CCCCCSC1CCCCCC1 62a_100011217769_100000139335 [1,0,0,1,0,0|1,0,0]=3 18007 B14R1.2352 O=CCCCNCC1CCCCCC1 2230a_100015204231_200011292268 [1,0,0,1,0,0|1,0,0]=3 18008 B14R1.2352 O=CCCCOCC1CCCCCC1 7a_100000699130_200011292268 [1,0,0,1,0,0|1,0,0]=3 18009 B14R1.2352 O=CCCCSCC1CCCCCC1 62a_200000696569_200011292268 [1,0,0,1,0,0|1,0,0]=3 18010 B14R1.2352 O=CCCCSCC1CCCCCC1 62a_200011292268_200000696569 [1,0,0,1,0,0|1,0,0]=3 18011 B14R1.2352 O=CCOCCCN1CCCCCC1 34a_100102886287_200009817547 [1,0,0,1,0,0|2,0,0]=4 18012 B14R1.2352 O=CCOCCCN1CCCCCC1 7a_100102886287_200015260668 [1,0,0,1,0,0|2,0,0]=4 18013 B14R1.2352 OCCCCCCN1CCCCCC1 2230a_100000185865_100000766143 [1,0,0,1,0,0|1,0,1]=4 18014 B14R1.2352 OCCCCCCN1CCCCCC1 269982a_100000185865_100000766143 [1,0,0,1,0,0|1,0,1]=4 18015 B14R1.2352 OCCCCCCN1CCCCCC1 34a_100000185865_100000766143 [1,0,0,1,0,0|1,0,1]=4 18016 B14R1.2352 OCCCCCNC1CCCCCC1 2230a_100000210984_100000746330 [1,0,0,1,0,0|1,0,1]=4 18017 B14R1.2352 OCCCCCNC1CCCCCC1 270004a_100000762737_100000210131 [1,0,0,1,0,0|1,0,1]=4 18018 B14R1.2352 OCCCCCNC1CCCCCC1 34a_100000210984_100000746330 [1,0,0,1,0,0|1,0,1]=4 18019 B14R1.2352 OCCCCCNC1CCCCCC1 34a_100000762737_100011217769 [1,0,0,1,0,0|1,0,1]=4 18020 B14R1.2352 OCCCCCOC1CCCCCC1 34a_100000210887_100000746330 [1,0,0,1,0,0|1,0,1]=4 18021 B14R1.2352 OCCCCCOC1CCCCCC1 7a_100000210887_100000746330 [1,0,0,1,0,0|1,0,1]=4 18022 B14R1.2352 OCCCCCSC1CCCCCC1 62a_100000746330_100011217769 [1,0,0,1,0,0|1,0,1]=4 18023 B14R1.2352 OCCCCCSC1CCCCCC1 62a_100011217769_100000746330 [1,0,0,1,0,0|1,0,1]=4 18024 B14R1.2352 OCCCCNCC1CCCCCC1 2230a_100000750430_200000696569 [1,0,0,1,0,0|1,0,1]=4 18025 B14R1.2352 OCCCCNCC1CCCCCC1 2230a_100015204231_100000210776 [1,0,0,1,0,0|1,0,1]=4 18026 B14R1.2352 OCCCCNCC1CCCCCC1 269862a_100000750430_200000763224 [1,0,0,1,0,0|1,0,1]=4 18027 B14R1.2352 OCCCCNCC1CCCCCC1 34a_100000750430_200000696569 [1,0,0,1,0,0|1,0,1]=4 18028 B14R1.2352 OCCCCNCC1CCCCCC1 34a_100015204231_100011216708 [1,0,0,1,0,0|1,0,1]=4 18029 B14R1.2352 OCCCCOCC1CCCCCC1 34a_100000699130_100011216708 [1,0,0,1,0,0|1,0,1]=4 18030 B14R1.2352 OCCCCOCC1CCCCCC1 7a_100000699130_100000210776 [1,0,0,1,0,0|1,0,1]=4 18031 B14R1.2352 OCCCCSCC1CCCCCC1 62a_100000210776_200000696569 [1,0,0,1,0,0|1,0,1]=4 18032 B14R1.2352 OCCCCSCC1CCCCCC1 62a_200000696569_100000210776 [1,0,0,1,0,0|1,0,1]=4 18033 B14R1.2352 OCCCNCCC1CCCCCC1 2230a_100011532351_100000230001 [1,0,0,1,0,0|1,0,1]=4 18034 B14R1.2352 OCCCNCCC1CCCCCC1 34a_100011532351_100000230001 [1,0,0,1,0,0|1,0,1]=4 18035 B14R1.3128 COCC1CCN1CCCCCC=O 2230a_100015195929_100000139337 [1,0,0,1,0,0|2,0,0]=4 18036 B14R1.3128 COCC1CCN1CCCCCC=O 269982a_100015195929_100000139337 [1,0,0,1,0,0|2,0,0]=4 18037 B14R1.6533 C=CCCCN1CCCCCCCC1 2230a_100000039187_100011713584 [1,0,0,1,0,0|1,0,1]=4 18038 B14R1.6533 C=CCCCN1CCCCCCCC1 269982a_100000039187_100000757094 [1,0,0,1,0,0|1,0,1]=4 18039 B14R1.6533 C=CCCCN1CCCCCCCC1 34a_100000039187_100000757094 [1,0,0,1,0,0|1,0,1]=4 18040 B14R1.6533 C=CCCNC1CCCCCCCC1 270004a_100015191253_100000038600 [1,0,0,1,0,0|1,0,1]=4 18041 B14R1.6533 CCCCCN1CCCCCCCC1 2230a_100000039187_100000210326 [1,0,0,1,0,0|1,0,1]=4 18042 B14R1.6533 CCCCCN1CCCCCCCC1 269982a_100000039187_100000210215 [1,0,0,1,0,0|1,0,1]=4 18043 B14R1.6533 CCCCCN1CCCCCCCC1 34a_100000039187_100000718602 [1,0,0,1,0,0|1,0,1]=4 18044 B14R1.6533 CCCCNC1CCCCCCCC1 270004a_100000102301_100000038600 [1,0,0,1,0,0|1,0,1]=4 18045 B14R1.6533 FCCCCN1CCCCCCCC1 2230a_100000039187_100000729493 [1,0,0,1,0,0|2,0,0]=4 18046 B14R1.6533 FCCCCN1CCCCCCCC1 269982a_100000039187_100000729493 [1,0,0,1,0,0|2,0,0]=4 18047 B14R1.6533 FCCCCN1CCCCCCCC1 34a_100000039187_100000729493 [1,0,0,1,0,0|2,0,0]=4 18048 B14R1.6533 FCCCNC1CCCCCCCC1 270004a_100015189416_100000038600 [1,0,0,1,0,0|2,0,0]=4 18049 B14R1.6533 O=CCCCN1CCCCCCCC1 2230a_100000039187_200011292268 [1,0,0,1,0,0|1,0,0]=3 18050 B14R1.6533 O=CCCCN1CCCCCCCC1 269982a_100000039187_200011292268 [1,0,0,1,0,0|1,0,0]=3 18051 B14R1.6533 OCCCCN1CCCCCCCC1 2230a_100000039187_100000210776 [1,0,0,1,0,0|1,0,1]=4 18052 B14R1.6533 OCCCCN1CCCCCCCC1 269982a_100000039187_100000210776 [1,0,0,1,0,0|1,0,1]=4 18053 B14R1.6533 OCCCCN1CCCCCCCC1 34a_100000039187_100011216708 [1,0,0,1,0,0|1,0,1]=4 18054 B14R1.6533 OCCCNC1CCCCCCCC1 270004a_100000182051_100000038600 [1,0,0,1,0,0|1,0,1]=4 18055 B16R1.271 C=CCCCCN1CCCCC1CCCO 2230a_100011934581_100011215482 [0,1,0,1,0,0|2,0,0]=4 18056 B16R1.271 C=CCCCCN1CCCCC1CCCO 269982a_100011934581_100011215482 [0,1,0,1,0,0|2,0,0]=4 18057 B16R1.271 C=CCCCCN1CCCCC1CCCO 34a_100011934581_100011215482 [0,1,0,1,0,0|2,0,0]=4 18058 B16R1.271 C=CCCCCN1CCCCC1CCOC 2230a_100015186528_100011215482 [0,1,0,1,0,0|2,0,0]=4 18059 B16R1.271 C=CCCCCN1CCCCC1CCOC 269982a_100015186528_100011215482 [0,1,0,1,0,0|2,0,0]=4 18060 B16R1.271 C=CCCCCN1CCCCC1CCOC 34a_100015186528_100011215482 [0,1,0,1,0,0|2,0,0]=4 18061 B16R1.271 CCCCCCN1CCCCC1CCCO 2230a_100011934581_100000210314 [0,1,0,1,0,0|0,0,2]=4 18062 B16R1.271 CCCCCCN1CCCCC1CCCO 269982a_100011934581_100000210757 [0,1,0,1,0,0|0,0,2]=4 18063 B16R1.271 CCCCCCN1CCCCC1CCCO 34a_100011934581_100000210314 [0,1,0,1,0,0|0,0,2]=4 18064 B16R1.271 CCCCCCN1CCCCC1CCOC 2230a_100015186528_100000210314 [0,1,0,1,0,0|2,0,0]=4 18065 B16R1.271 CCCCCCN1CCCCC1CCOC 269982a_100015186528_100000210757 [0,1,0,1,0,0|2,0,0]=4 18066 B16R1.271 CCCCCCN1CCCCC1CCOC 34a_100015186528_100000210314 [0,1,0,1,0,0|2,0,0]=4 18067 B16R1.271 CCCCCNC1CCCCC1CCC#N 270004a_100000209983_100000034616 [0,1,0,1,0,0|1,0,1]=4 18068 B16R1.271 COCCC1CCCCN1CCCCC=O 2230a_100015186528_100000139335 [0,1,0,1,0,0|1,0,0]=3 18069 B16R1.271 COCCC1CCCCN1CCCCC=O 269982a_100015186528_100000139335 [0,1,0,1,0,0|1,0,0]=3 18070 B16R1.271 O=CCCCCN1CCCCC1CCCO 2230a_100011934581_100000139335 [0,1,0,1,0,0|1,0,0]=3 18071 B16R1.271 O=CCCCCN1CCCCC1CCCO 269982a_100011934581_100000139335 [0,1,0,1,0,0|1,0,0]=3 18072 B16R1.284 C#CCCCNC1CCCC1CCCCC 270004a_100000718082_200000198059 [0,1,0,1,0,0|1,0,1]=4 18073 B16R1.284 C=CCCCNC1CCCC1CCCCC 269862a_100000700776_200000198059 [0,1,0,1,0,0|1,0,0]=3 18074 B16R1.284 C=CCCCNC1CCCC1CCCCC 270004a_100000700776_200000198059 [0,1,0,1,0,0|1,0,0]=3 18075 B16R1.284 C=CCCNC1CCCC1CCCCCC 269862a_100015191253_100000189428 [0,1,0,1,0,0|1,0,0]=3 18076 B16R1.284 C=CCCNC1CCCC1CCCCCC 270004a_100015191253_100000189428 [0,1,0,1,0,0|1,0,0]=3 18077 B16R1.284 CCCCCC1CCCC1NCCCCO 269862a_100000750430_200000198059 [0,1,0,1,0,0|0,0,2]=4 18078 B16R1.284 CCCCCC1CCCC1NCCCCO 270004a_100000750430_200000198059 [0,1,0,1,0,0|0,0,2]=4 18079 B16R1.284 CCCCCC1CCCC1NCCCOC 269862a_100150723488_200000198059 [0,1,0,1,0,0|2,0,0]=4 18080 B16R1.284 CCCCCC1CCCC1NCCCOC 270004a_100150723488_200000198059 [0,1,0,1,0,0|2,0,0]=4 18081 B16R1.284 CCCCCC1CCCC1NCCCSC 269862a_100000749238_200000198059 [0,1,0,1,0,0|2,0,0]=4 18082 B16R1.284 CCCCCC1CCCC1NCCCSC 270004a_100000749238_200000198059 [0,1,0,1,0,0|2,0,0]=4 18083 B16R1.284 CCCCCCC1CCCC1NCCC#N 270004a_100000720768_100000189428 [0,1,0,1,0,0|1,0,1]=4 18084 B16R1.284 CCCCCCC1CCCC1NCCCC 269862a_100000102301_100000189428 [0,1,0,1,0,0|1,0,1]=4 18085 B16R1.284 CCCCCCC1CCCC1NCCCC 270004a_100000102301_100000189428 [0,1,0,1,0,0|1,0,1]=4 18086 B16R1.284 CCCCCCC1CCCC1NCCCF 269862a_100015189416_100000189428 [0,1,0,1,0,0|1,0,1]=4 18087 B16R1.284 CCCCCCC1CCCC1NCCCF 270004a_100015189416_100000189428 [0,1,0,1,0,0|1,0,1]=4 18088 B16R1.284 CCCCCCC1CCCC1NCCCO 269862a_100000182051_100000189428 [0,1,0,1,0,0|0,0,2]=4 18089 B16R1.284 CCCCCCC1CCCC1NCCCO 270004a_100000182051_100000189428 [0,1,0,1,0,0|0,0,2]=4 18090 B16R1.284 CCCCCCC1CCCC1NCCOC 269862a_100000209980_100000189428 [0,1,0,1,0,0|2,0,0]=4 18091 B16R1.284 CCCCCCC1CCCC1NCCOC 270004a_100000209980_100000189428 [0,1,0,1,0,0|2,0,0]=4 18092 B16R1.284 CCCCCCC1CCCC1NCCSC 269862a_100020590264_100000189428 [0,1,0,1,0,0|2,0,0]=4 18093 B16R1.284 CCCCCCC1CCCC1NCCSC 270004a_100020590264_100000189428 [0,1,0,1,0,0|2,0,0]=4 18094 B16R1.284 CCCCCNC1CCCC1CCCCC 269862a_100000209983_200000198059 [0,1,0,1,0,0|1,0,1]=4 18095 B16R1.284 CCCCCNC1CCCC1CCCCC 270004a_100000209983_200000198059 [0,1,0,1,0,0|1,0,1]=4 18096 B16R1.310 CCNC1CCCCCCCCCCC1=O 2230a_100015525214_200009990614 [0,1,0,1,0,0|0,0,0]=2 18097 B16R1.310 CCOC1CCCCCCCCCCC1=O 34a_100121572206_200009990614 [0,1,0,1,0,0|0,0,0]=2 18098 B16R1.310 CCSC1CCCCCCCCCCC1=O 62a_100000210202_200009990614 [0,1,0,1,0,0|0,0,0]=2 18099 B16R1.310 CCSC1CCCCCCCCCCC1=O 62a_200009990614_100000210202 [0,1,0,1,0,0|0,0,0]=2 18100 B16R1.310 O=C1CCCCCCCCCCC1SCF 62a_100015361967_200009990614 [0,1,0,1,0,0|1,0,0]=3 18101 B16R1.310 O=C1CCCCCCCCCCC1SCF 62a_200009990614_100015361967 [0,1,0,1,0,0|1,0,0]=3 18102 B16R1.643 BrCCCCCCCCOC1C=CCCC1 7a_100009813846_100000751183 [0,1,0,1,0,0|2,0,0]=4 18103 B16R1.643 BrCCCCCCCCOC1CCCCC1 34a_100009813846_100000210327 [0,1,0,1,0,0|1,0,1]=4 18104 B16R1.643 BrCCCCCCCCOC1CCCCC1 7a_100009813846_100000210327 [0,1,0,1,0,0|1,0,1]=4 18105 B16R1.643 BrCCCCCCCOCC1CCCCC1 34a_100000760002_100000211423 [0,1,0,1,0,0|1,0,1]=4 18106 B16R1.643 BrCCCCCCCOCC1CCCCC1 7a_100000760002_100000211423 [0,1,0,1,0,0|1,0,1]=4 18107 B16R1.643 BrCCCCCCOCCC1CCCCC1 34a_100011215345_100011209188 [0,1,0,1,0,0|1,0,1]=4 18108 B16R1.643 BrCCCCCCOCCC1CCCCC1 7a_100011215345_100011273959 [0,1,0,1,0,0|1,0,1]=4 18109 B16R1.643 BrCCCCCOCCCC1CCCCC1 34a_100000746331_100011713725 [0,1,0,1,0,0|1,0,1]=4 18110 B16R1.643 BrCCCCCOCCCC1CCCCC1 7a_100000746331_100011713725 [0,1,0,1,0,0|1,0,1]=4 18111 B16R1.643 C#CCCCCCCCNC1CCCCC1 2230a_100000182618_100153394163 [0,1,0,1,0,0|1,0,1]=4 18112 B16R1.643 C#CCCCCCCCNC1CCCCC1 34a_100000182618_100153394163 [0,1,0,1,0,0|1,0,1]=4 18113 B16R1.643 C#CCCCCCCCOC1CCCCC1 34a_100000054614_100000210327 [0,1,0,1,0,0|1,0,1]=4 18114 B16R1.643 C#CCCCCCCCOC1CCCCC1 34a_100000210231_100153394163 [0,1,0,1,0,0|1,0,1]=4 18115 B16R1.643 C#CCCCCCCCOC1CCCCC1 7a_100000054614_100000210327 [0,1,0,1,0,0|1,0,1]=4 18116 B16R1.643 C#CCCCCCCCOC1CCCCC1 7a_100000210231_100153394163 [0,1,0,1,0,0|1,0,1]=4 18117 B16R1.643 C#CCCCCCCCSC1CCCCC1 62a_100000210327_100153394163 [0,1,0,1,0,0|1,0,1]=4 18118 B16R1.643 C#CCCCCCCCSC1CCCCC1 62a_100153394163_100000210327 [0,1,0,1,0,0|1,0,1]=4 18119 B16R1.643 C#CCCCCCCNCC1CCCCC1 2230a_100000210473_100012276617 [0,1,0,1,0,0|1,0,1]=4 18120 B16R1.643 C#CCCCCCCNCC1CCCCC1 34a_100000210473_100012276617 [0,1,0,1,0,0|1,0,1]=4 18121 B16R1.643 C#CCCCCCCOCC1CCCCC1 34a_100000212181_100012276617 [0,1,0,1,0,0|1,0,1]=4 18122 B16R1.643 C#CCCCCCCOCC1CCCCC1 34a_100011217361_100000211423 [0,1,0,1,0,0|1,0,1]=4 18123 B16R1.643 C#CCCCCCCOCC1CCCCC1 7a_100000212181_100012276617 [0,1,0,1,0,0|1,0,1]=4 18124 B16R1.643 C#CCCCCCCOCC1CCCCC1 7a_100011217361_100000211423 [0,1,0,1,0,0|1,0,1]=4 18125 B16R1.643 C#CCCCCCCSCC1CCCCC1 62a_100000211423_100012276617 [0,1,0,1,0,0|1,0,1]=4 18126 B16R1.643 C#CCCCCCCSCC1CCCCC1 62a_100012276617_100000211423 [0,1,0,1,0,0|1,0,1]=4 18127 B16R1.643 C#CCCCCCNCCC1CCCCC1 2230a_100000738074_100012094781 [0,1,0,1,0,0|1,0,1]=4 18128 B16R1.643 C#CCCCCCNCCC1CCCCC1 34a_100000738074_100012094781 [0,1,0,1,0,0|1,0,1]=4 18129 B16R1.643 C#CCCCCCOCCC1CCCCC1 34a_100000766912_100011209188 [0,1,0,1,0,0|1,0,1]=4 18130 B16R1.643 C#CCCCCCOCCC1CCCCC1 34a_100011217863_100012094781 [0,1,0,1,0,0|1,0,1]=4 18131 B16R1.643 C#CCCCCCOCCC1CCCCC1 7a_100000766912_100011273959 [0,1,0,1,0,0|1,0,1]=4 18132 B16R1.643 C#CCCCCCOCCC1CCCCC1 7a_100011217863_100012094781 [0,1,0,1,0,0|1,0,1]=4 18133 B16R1.643 C#CCCCCCSCCC1CCCCC1 62a_100012094781_100012355289 [0,1,0,1,0,0|1,0,1]=4 18134 B16R1.643 C#CCCCCCSCCC1CCCCC1 62a_100012355289_100012094781 [0,1,0,1,0,0|1,0,1]=4 18135 B16R1.643 C#CCCCCNCCCC1CCCCC1 2230a_100000706060_100011713725 [0,1,0,1,0,0|1,0,1]=4 18136 B16R1.643 C#CCCCCNCCCC1CCCCC1 2230a_100011211642_100010269958 [0,1,0,1,0,0|1,0,1]=4 18137 B16R1.643 C#CCCCCNCCCC1CCCCC1 34a_100000706060_100011713725 [0,1,0,1,0,0|1,0,1]=4 18138 B16R1.643 C#CCCCCNCCCC1CCCCC1 34a_100011211642_100010269958 [0,1,0,1,0,0|1,0,1]=4 18139 B16R1.643 C#CCCCCOCCCC1CCCCC1 34a_100000198086_100010269958 [0,1,0,1,0,0|1,0,1]=4 18140 B16R1.643 C#CCCCCOCCCC1CCCCC1 34a_100000766709_100011713725 [0,1,0,1,0,0|1,0,1]=4 18141 B16R1.643 C#CCCCCOCCCC1CCCCC1 7a_100000198086_100010269958 [0,1,0,1,0,0|1,0,1]=4 18142 B16R1.643 C#CCCCCOCCCC1CCCCC1 7a_100000766709_100011713725 [0,1,0,1,0,0|1,0,1]=4 18143 B16R1.643 C#CCCCCSCCCC1CCCCC1 62a_100010269958_100011713725 [0,1,0,1,0,0|1,0,1]=4 18144 B16R1.643 C#CCCCCSCCCC1CCCCC1 62a_100011713725_100010269958 [0,1,0,1,0,0|1,0,1]=4 18145 B16R1.643 C#CCCCOCCCCC1CCCCC1 34a_100011215267_100000695029 [0,1,0,1,0,0|1,0,1]=4 18146 B16R1.643 C#CCCCOCCCCC1CCCCC1 7a_100011215267_100011215417 [0,1,0,1,0,0|1,0,1]=4 18147 B16R1.643 C=CCCCCCCCCN1CCCOC1 2230a_100000131196_100011933949 [0,1,0,1,0,0|2,0,0]=4 18148 B16R1.643 C=CCCCCCCCCN1CCCOC1 269982a_100000131196_100011933949 [0,1,0,1,0,0|2,0,0]=4 18149 B16R1.643 C=CCCCCCCCCN1CCCOC1 34a_100000131196_100011933949 [0,1,0,1,0,0|2,0,0]=4 18150 B16R1.643 C=CCCCCCCCCN1CCOCC1 2230a_100015191051_100011933949 [0,1,0,1,0,0|2,0,0]=4 18151 B16R1.643 C=CCCCCCCCCN1CCOCC1 269982a_100015191051_100011933949 [0,1,0,1,0,0|2,0,0]=4 18152 B16R1.643 C=CCCCCCCCCN1CCOCC1 34a_100015191051_100011933949 [0,1,0,1,0,0|2,0,0]=4 18153 B16R1.643 C=CCCCCCCCCN1CCSCC1 2230a_100000737611_100011933949 [0,1,0,1,0,0|2,0,0]=4 18154 B16R1.643 C=CCCCCCCCCN1CCSCC1 269982a_100000737611_100011933949 [0,1,0,1,0,0|2,0,0]=4 18155 B16R1.643 C=CCCCCCCCNC1CCCCC1 2230a_100000182618_100012355270 [0,1,0,1,0,0|1,0,0]=3 18156 B16R1.643 C=CCCCCCCCNC1CCCCC1 34a_100000182618_100012355270 [0,1,0,1,0,0|1,0,0]=3 18157 B16R1.643 C=CCCCCCCCNC1CCCOC1 2230a_100000719290_100012355270 [0,1,0,1,0,0|2,0,0]=4 18158 B16R1.643 C=CCCCCCCCNC1CCCOC1 34a_100000719290_100012355270 [0,1,0,1,0,0|2,0,0]=4 18159 B16R1.643 C=CCCCCCCCNC1CCOCC1 2230a_100000741149_100012355270 [0,1,0,1,0,0|2,0,0]=4 18160 B16R1.643 C=CCCCCCCCNC1CCOCC1 34a_100000741149_100012355270 [0,1,0,1,0,0|2,0,0]=4 18161 B16R1.643 C=CCCCCCCCNC1CCSCC1 2230a_100000748639_100012355270 [0,1,0,1,0,0|2,0,0]=4 18162 B16R1.643 C=CCCCCCCCNC1CCSCC1 34a_100000748639_100012355270 [0,1,0,1,0,0|2,0,0]=4 18163 B16R1.643 C=CCCCCCCCOC1CCCCC1 34a_100000210231_100012355270 [0,1,0,1,0,0|1,0,0]=3 18164 B16R1.643 C=CCCCCCCCOC1CCCCC1 34a_100000730831_100000210327 [0,1,0,1,0,0|1,0,0]=3 18165 B16R1.643 C=CCCCCCCCOC1CCCCC1 7a_100000210231_100012355270 [0,1,0,1,0,0|1,0,0]=3 18166 B16R1.643 C=CCCCCCCCOC1CCCCC1 7a_100000730831_100000210327 [0,1,0,1,0,0|1,0,0]=3 18167 B16R1.643 C=CCCCCCCCOC1CCCCO1 34a_100000033831_100012355270 [0,1,0,1,0,0|2,0,0]=4 18168 B16R1.643 C=CCCCCCCCOC1CCCOC1 34a_100000730831_100000693364 [0,1,0,1,0,0|2,0,0]=4 18169 B16R1.643 C=CCCCCCCCOC1CCCOC1 34a_100000754041_100012355270 [0,1,0,1,0,0|2,0,0]=4 18170 B16R1.643 C=CCCCCCCCOC1CCCOC1 7a_100000730831_100000693364 [0,1,0,1,0,0|2,0,0]=4 18171 B16R1.643 C=CCCCCCCCOC1CCCSC1 7a_100015962668_100012355270 [0,1,0,1,0,0|2,0,0]=4 18172 B16R1.643 C=CCCCCCCCOC1CCOCC1 34a_100000744328_100012355270 [0,1,0,1,0,0|2,0,0]=4 18173 B16R1.643 C=CCCCCCCCOC1CCOCC1 7a_100000730831_100000686592 [0,1,0,1,0,0|2,0,0]=4 18174 B16R1.643 C=CCCCCCCCOC1CCSCC1 34a_100000730831_100000069128 [0,1,0,1,0,0|2,0,0]=4 18175 B16R1.643 C=CCCCCCCCOC1CCSCC1 34a_100000731022_100012355270 [0,1,0,1,0,0|2,0,0]=4 18176 B16R1.643 C=CCCCCCCCOC1CCSCC1 7a_100000730831_100011500858 [0,1,0,1,0,0|2,0,0]=4 18177 B16R1.643 C=CCCCCCCCOC1CCSCC1 7a_100000731022_100012355270 [0,1,0,1,0,0|2,0,0]=4 18178 B16R1.643 C=CCCCCCCCSC1CCCCC1 62a_100000210327_100012355270 [0,1,0,1,0,0|1,0,0]=3 18179 B16R1.643 C=CCCCCCCCSC1CCCCC1 62a_100012355270_100000210327 [0,1,0,1,0,0|1,0,0]=3 18180 B16R1.643 C=CCCCCCCCSC1CCCOC1 62a_100012355270_100000693364 [0,1,0,1,0,0|2,0,0]=4 18181 B16R1.643 C=CCCCCCCCSC1CCOCC1 62a_100012355270_100011324220 [0,1,0,1,0,0|2,0,0]=4 18182 B16R1.643 C=CCCCCCCCSC1CCSCC1 62a_100012355270_100000069128 [0,1,0,1,0,0|2,0,0]=4 18183 B16R1.643 C=CCCCCCCNCC1CCCCC1 2230a_100000210473_100011215473 [0,1,0,1,0,0|1,0,0]=3 18184 B16R1.643 C=CCCCCCCNCC1CCCCC1 34a_100000210473_100011215473 [0,1,0,1,0,0|1,0,0]=3 18185 B16R1.643 C=CCCCCCCNCC1CCCCO1 2230a_100000174945_100011215473 [0,1,0,1,0,0|2,0,0]=4 18186 B16R1.643 C=CCCCCCCNCC1CCCCO1 34a_100000174945_100011215473 [0,1,0,1,0,0|2,0,0]=4 18187 B16R1.643 C=CCCCCCCNCC1CCCOC1 2230a_100000720124_100011215473 [0,1,0,1,0,0|2,0,0]=4 18188 B16R1.643 C=CCCCCCCNCC1CCCOC1 34a_100000720124_100011215473 [0,1,0,1,0,0|2,0,0]=4 18189 B16R1.643 C=CCCCCCCNCC1CCOCC1 2230a_100000746373_100011215473 [0,1,0,1,0,0|2,0,0]=4 18190 B16R1.643 C=CCCCCCCNCC1CCOCC1 34a_100000746373_100011215473 [0,1,0,1,0,0|2,0,0]=4 18191 B16R1.643 C=CCCCCCCNCC1CCSCC1 2230a_100015188806_100011215473 [0,1,0,1,0,0|2,0,0]=4 18192 B16R1.643 C=CCCCCCCNCC1CCSCC1 34a_100015188806_100011215473 [0,1,0,1,0,0|2,0,0]=4 18193 B16R1.643 C=CCCCCCCOCC1CCCCC1 34a_100000212181_100011215473 [0,1,0,1,0,0|1,0,0]=3 18194 B16R1.643 C=CCCCCCCOCC1CCCCC1 34a_200011216477_100000211423 [0,1,0,1,0,0|1,0,0]=3 18195 B16R1.643 C=CCCCCCCOCC1CCCCC1 7a_100000212181_100011215473 [0,1,0,1,0,0|1,0,0]=3 18196 B16R1.643 C=CCCCCCCOCC1CCCCC1 7a_200011216477_100000211423 [0,1,0,1,0,0|1,0,0]=3 18197 B16R1.643 C=CCCCCCCOCC1CCCCN1 34a_100000210821_100011215473 [0,1,0,1,0,0|2,0,0]=4 18198 B16R1.643 C=CCCCCCCOCC1CCCCO1 34a_100000211370_100011215473 [0,1,0,1,0,0|2,0,0]=4 18199 B16R1.643 C=CCCCCCCOCC1CCCCO1 34a_200011216477_100000211543 [0,1,0,1,0,0|2,0,0]=4 18200 B16R1.643 C=CCCCCCCOCC1CCCCO1 7a_100000211370_100011215473 [0,1,0,1,0,0|2,0,0]=4 18201 B16R1.643 C=CCCCCCCOCC1CCCCO1 7a_200011216477_100000211543 [0,1,0,1,0,0|2,0,0]=4 18202 B16R1.643 C=CCCCCCCOCC1CCCNC1 34a_100000211344_100011215473 [0,1,0,1,0,0|2,0,0]=4 18203 B16R1.643 C=CCCCCCCOCC1CCCOC1 34a_100000741520_100011215473 [0,1,0,1,0,0|2,0,0]=4 18204 B16R1.643 C=CCCCCCCOCC1CCCOC1 34a_200011216477_100000741521 [0,1,0,1,0,0|2,0,0]=4 18205 B16R1.643 C=CCCCCCCOCC1CCCOC1 7a_200011216477_100000741521 [0,1,0,1,0,0|2,0,0]=4 18206 B16R1.643 C=CCCCCCCOCC1CCNCC1 34a_100000738675_100011215473 [0,1,0,1,0,0|2,0,0]=4 18207 B16R1.643 C=CCCCCCCOCC1CCOCC1 34a_100000749013_100011215473 [0,1,0,1,0,0|2,0,0]=4 18208 B16R1.643 C=CCCCCCCOCC1CCOCC1 34a_200011216477_100000754603 [0,1,0,1,0,0|2,0,0]=4 18209 B16R1.643 C=CCCCCCCOCC1CCOCC1 7a_200011216477_100000754603 [0,1,0,1,0,0|2,0,0]=4 18210 B16R1.643 C=CCCCCCCOCC1CCSCC1 34a_100000070558_100011215473 [0,1,0,1,0,0|2,0,0]=4 18211 B16R1.643 C=CCCCCCCOCC1CCSCC1 7a_100000070558_100011215473 [0,1,0,1,0,0|2,0,0]=4 18212 B16R1.643 C=CCCCCCCSCC1CCCCC1 62a_100000211423_100011215473 [0,1,0,1,0,0|1,0,0]=3 18213 B16R1.643 C=CCCCCCCSCC1CCCCC1 62a_100011215473_100000211423 [0,1,0,1,0,0|1,0,0]=3 18214 B16R1.643 C=CCCCCCCSCC1CCCCO1 62a_100000211543_100011215473 [0,1,0,1,0,0|2,0,0]=4 18215 B16R1.643 C=CCCCCCCSCC1CCCCO1 62a_100011215473_100000211543 [0,1,0,1,0,0|2,0,0]=4 18216 B16R1.643 C=CCCCCCCSCC1CCCOC1 62a_100000741521_100011215473 [0,1,0,1,0,0|2,0,0]=4 18217 B16R1.643 C=CCCCCCCSCC1CCCOC1 62a_100011215473_100000741521 [0,1,0,1,0,0|2,0,0]=4 18218 B16R1.643 C=CCCCCCCSCC1CCOCC1 62a_100000754603_100011215473 [0,1,0,1,0,0|2,0,0]=4 18219 B16R1.643 C=CCCCCCCSCC1CCOCC1 62a_100011215473_100000749018 [0,1,0,1,0,0|2,0,0]=4 18220 B16R1.643 C=CCCCCCNCCC1CCCCC1 2230a_100000738074_100000700193 [0,1,0,1,0,0|1,0,0]=3 18221 B16R1.643 C=CCCCCCNCCC1CCCCC1 34a_100000738074_100000700193 [0,1,0,1,0,0|1,0,0]=3 18222 B16R1.643 C=CCCCCCNCCC1CCCCO1 2230a_100015183643_100000700193 [0,1,0,1,0,0|2,0,0]=4 18223 B16R1.643 C=CCCCCCNCCC1CCCCO1 34a_100015183643_100000700193 [0,1,0,1,0,0|2,0,0]=4 18224 B16R1.643 C=CCCCCCNCCC1CCOCC1 2230a_100000755988_100000700193 [0,1,0,1,0,0|2,0,0]=4 18225 B16R1.643 C=CCCCCCNCCC1CCOCC1 34a_100000755988_100000700193 [0,1,0,1,0,0|2,0,0]=4 18226 B16R1.643 C=CCCCCCOCCC1CCCCC1 34a_100011216702_100011209188 [0,1,0,1,0,0|1,0,0]=3 18227 B16R1.643 C=CCCCCCOCCC1CCCCC1 34a_100011217863_100000700193 [0,1,0,1,0,0|1,0,0]=3 18228 B16R1.643 C=CCCCCCOCCC1CCCCC1 7a_100011216702_100011273959 [0,1,0,1,0,0|1,0,0]=3 18229 B16R1.643 C=CCCCCCOCCC1CCCCC1 7a_100011217863_100000700193 [0,1,0,1,0,0|1,0,0]=3 18230 B16R1.643 C=CCCCCCOCCC1CCCCN1 34a_100000211664_100000700193 [0,1,0,1,0,0|2,0,0]=4 18231 B16R1.643 C=CCCCCCOCCC1CCCNC1 34a_100000752241_100000700193 [0,1,0,1,0,0|2,0,0]=4 18232 B16R1.643 C=CCCCCCOCCC1CCNCC1 34a_100015190746_100000700193 [0,1,0,1,0,0|2,0,0]=4 18233 B16R1.643 C=CCCCCCOCCC1CCOCC1 34a_100011216702_100011934994 [0,1,0,1,0,0|2,0,0]=4 18234 B16R1.643 C=CCCCCCOCCC1CCOCC1 34a_100011933979_100000700193 [0,1,0,1,0,0|2,0,0]=4 18235 B16R1.643 C=CCCCCCOCCC1CCOCC1 7a_100011216702_100011934994 [0,1,0,1,0,0|2,0,0]=4 18236 B16R1.643 C=CCCCCCOCCC1CCOCC1 7a_100011933979_100000700193 [0,1,0,1,0,0|2,0,0]=4 18237 B16R1.643 C=CCCCCCOCCN1CCCCC1 34a_100011216702_100000739454 [0,1,0,1,0,0|2,0,0]=4 18238 B16R1.643 C=CCCCCCOCCN1CCCCC1 7a_100011216702_100000739454 [0,1,0,1,0,0|2,0,0]=4 18239 B16R1.643 C=CCCCCCOCOC1CCCCC1 34a_100011216702_100011935260 [0,1,0,1,0,0|2,0,0]=4 18240 B16R1.643 C=CCCCCCOCOC1CCCCC1 7a_100011216702_100011935260 [0,1,0,1,0,0|2,0,0]=4 18241 B16R1.643 C=CCCCCCSCCC1CCCCC1 62a_100000700193_100012355289 [0,1,0,1,0,0|1,0,0]=3 18242 B16R1.643 C=CCCCCCSCCC1CCCCC1 62a_100012355289_100000700193 [0,1,0,1,0,0|1,0,0]=3 18243 B16R1.643 C=CCCCCCSCCC1CCOCC1 62a_100000700193_100011934994 [0,1,0,1,0,0|2,0,0]=4 18244 B16R1.643 C=CCCCCCSCCC1CCOCC1 62a_100011934994_100000700193 [0,1,0,1,0,0|2,0,0]=4 18245 B16R1.643 C=CCCCCCSCCN1CCCCC1 62a_100000700193_100000739454 [0,1,0,1,0,0|2,0,0]=4 18246 B16R1.643 C=CCCCCCSCCN1CCCCC1 62a_100000739454_100000700193 [0,1,0,1,0,0|2,0,0]=4 18247 B16R1.643 C=CCCCCCSCOC1CCCCC1 62a_100000700193_100011935260 [0,1,0,1,0,0|2,0,0]=4 18248 B16R1.643 C=CCCCCCSCOC1CCCCC1 62a_100011935260_100000700193 [0,1,0,1,0,0|2,0,0]=4 18249 B16R1.643 C=CCCCCNCCCC1CCCCC1 2230a_100000703577_100011713725 [0,1,0,1,0,0|1,0,0]=3 18250 B16R1.643 C=CCCCCNCCCC1CCCCC1 2230a_100011211642_100011215482 [0,1,0,1,0,0|1,0,0]=3 18251 B16R1.643 C=CCCCCNCCCC1CCCCC1 34a_100000703577_100011713725 [0,1,0,1,0,0|1,0,0]=3 18252 B16R1.643 C=CCCCCNCCCC1CCCCC1 34a_100011211642_100011215482 [0,1,0,1,0,0|1,0,0]=3 18253 B16R1.643 C=CCCCCNCCCN1CCCCC1 2230a_100000703577_100000690320 [0,1,0,1,0,0|2,0,0]=4 18254 B16R1.643 C=CCCCCNCCCN1CCCCC1 34a_100000703577_100000690320 [0,1,0,1,0,0|2,0,0]=4 18255 B16R1.643 C=CCCCCNCCOC1CCCCC1 2230a_100000703577_100011211530 [0,1,0,1,0,0|2,0,0]=4 18256 B16R1.643 C=CCCCCNCCOC1CCCCC1 34a_100000703577_100011211530 [0,1,0,1,0,0|2,0,0]=4 18257 B16R1.643 C=CCCCCNCCOC1CCCCC1 34a_100015206981_100011215482 [0,1,0,1,0,0|2,0,0]=4 18258 B16R1.643 C=CCCCCOCCCC1CCCCC1 34a_100000198086_100011215482 [0,1,0,1,0,0|1,0,0]=3 18259 B16R1.643 C=CCCCCOCCCC1CCCCC1 34a_100000766645_100011713725 [0,1,0,1,0,0|1,0,0]=3 18260 B16R1.643 C=CCCCCOCCCC1CCCCC1 7a_100000198086_100011215482 [0,1,0,1,0,0|1,0,0]=3 18261 B16R1.643 C=CCCCCOCCCC1CCCCC1 7a_100000766645_100011713725 [0,1,0,1,0,0|1,0,0]=3 18262 B16R1.643 C=CCCCCOCCCC1CCCCN1 34a_100011934581_100011215482 [0,1,0,1,0,0|2,0,0]=4 18263 B16R1.643 C=CCCCCOCCCC1CCCNC1 34a_100150707839_100011215482 [0,1,0,1,0,0|2,0,0]=4 18264 B16R1.643 C=CCCCCOCCCC1CCNCC1 34a_100016988962_100011215482 [0,1,0,1,0,0|2,0,0]=4 18265 B16R1.643 C=CCCCCOCCCN1CCCCC1 34a_100000212458_100011215482 [0,1,0,1,0,0|2,0,0]=4 18266 B16R1.643 C=CCCCCOCCCN1CCCCC1 34a_100000766645_100000690320 [0,1,0,1,0,0|2,0,0]=4 18267 B16R1.643 C=CCCCCOCCCN1CCCCC1 7a_100000766645_100000007876 [0,1,0,1,0,0|2,0,0]=4 18268 B16R1.643 C=CCCCCOCCNC1CCCCC1 34a_100000200466_100011215482 [0,1,0,1,0,0|2,0,0]=4 18269 B16R1.643 C=CCCCCOCCOC1CCCCC1 34a_100000766645_100011211530 [0,1,0,1,0,0|2,0,0]=4 18270 B16R1.643 C=CCCCCOCCOC1CCCCC1 34a_100011249652_100011215482 [0,1,0,1,0,0|2,0,0]=4 18271 B16R1.643 C=CCCCCOCCOC1CCCCC1 7a_100000766645_100011211530 [0,1,0,1,0,0|2,0,0]=4 18272 B16R1.643 C=CCCCCOCCOC1CCCCC1 7a_100011249652_100011215482 [0,1,0,1,0,0|2,0,0]=4 18273 B16R1.643 C=CCCCCSCCCC1CCCCC1 62a_100011215482_100011713725 [0,1,0,1,0,0|1,0,0]=3 18274 B16R1.643 C=CCCCCSCCCC1CCCCC1 62a_100011713725_100011215482 [0,1,0,1,0,0|1,0,0]=3 18275 B16R1.643 C=CCCCCSCCCN1CCCCC1 62a_100011215482_100000007876 [0,1,0,1,0,0|2,0,0]=4 18276 B16R1.643 C=CCCCCSCCCN1CCCCC1 62a_100132302099_100011215482 [0,1,0,1,0,0|2,0,0]=4 18277 B16R1.643 C=CCCCCSCCOC1CCCCC1 62a_100011211530_100011215482 [0,1,0,1,0,0|2,0,0]=4 18278 B16R1.643 C=CCCCCSCCOC1CCCCC1 62a_100011215482_100011211530 [0,1,0,1,0,0|2,0,0]=4 18279 B16R1.643 C=CCCCNCCCOC1CCCCC1 34a_100000205933_100000757094 [0,1,0,1,0,0|2,0,0]=4 18280 B16R1.643 C=CCCCOCCCCC1CCCCC1 34a_100011215267_100000757094 [0,1,0,1,0,0|1,0,0]=3 18281 B16R1.643 C=CCCCOCCCCC1CCCCC1 7a_100011215267_100000757094 [0,1,0,1,0,0|1,0,0]=3 18282 B16R1.643 C=CCCCOCCCCC1CCNCC1 34a_100016989291_100000757094 [0,1,0,1,0,0|2,0,0]=4 18283 B16R1.643 C=CCCOCCCCCN1CCCCC1 34a_100011216611_100000754431 [0,1,0,1,0,0|2,0,0]=4 18284 B16R1.643 C=CCCOCCCCCN1CCCCC1 7a_100011216611_100000754431 [0,1,0,1,0,0|2,0,0]=4 18285 B16R1.643 C=CCOCCOCCCC1CCCCC1 34a_100000037705_100011713725 [0,1,0,1,0,0|2,0,0]=4 18286 B16R1.643 C=CCOCCOCCCC1CCCCC1 7a_100000037705_100011713725 [0,1,0,1,0,0|2,0,0]=4 18287 B16R1.643 C=COCCCCOCCC1CCCCC1 34a_100000031558_100011209188 [0,1,0,1,0,0|2,0,0]=4 18288 B16R1.643 C=COCCCCOCCC1CCCCC1 7a_100000031558_100011273959 [0,1,0,1,0,0|2,0,0]=4 18289 B16R1.643 C=COCCCNCCCC1CCCCC1 2230a_100000210767_100011713725 [0,1,0,1,0,0|2,0,0]=4 18290 B16R1.643 C=COCCCNCCCC1CCCCC1 34a_100000210767_100011713725 [0,1,0,1,0,0|2,0,0]=4 18291 B16R1.643 C=COCCOCCCCC1CCCCC1 34a_100011215267_100000039644 [0,1,0,1,0,0|2,0,0]=4 18292 B16R1.643 C=COCCOCCCCC1CCCCC1 7a_100011215267_100000039644 [0,1,0,1,0,0|2,0,0]=4 18293 B16R1.643 CC=CCCCOCCCC1CCCCC1 34a_100020645299_100011713725 [0,1,0,1,0,0|1,0,1]=4 18294 B16R1.643 CCCCCCCCCCN1CC=CCC1 2230a_100000698166_100000210320 [0,1,0,1,0,0|1,0,1]=4 18295 B16R1.643 CCCCCCCCCCN1CC=CCC1 269982a_100000698166_100000210320 [0,1,0,1,0,0|1,0,1]=4 18296 B16R1.643 CCCCCCCCCCN1CC=CCC1 34a_100000698166_100000210320 [0,1,0,1,0,0|1,0,1]=4 18297 B16R1.643 CCCCCCCCCCN1CCCOC1 2230a_100000131196_100000210320 [0,1,0,1,0,0|2,0,0]=4 18298 B16R1.643 CCCCCCCCCCN1CCCOC1 269982a_100000131196_100000210320 [0,1,0,1,0,0|2,0,0]=4 18299 B16R1.643 CCCCCCCCCCN1CCCOC1 34a_100000131196_100000210320 [0,1,0,1,0,0|2,0,0]=4 18300 B16R1.643 CCCCCCCCCNC1C=CCCC1 2230a_100000212291_100000751183 [0,1,0,1,0,0|1,0,0]=3 18301 B16R1.643 CCCCCCCCCNC1CCCCC1 2230a_100000182618_100011214924 [0,1,0,1,0,0|1,0,1]=4 18302 B16R1.643 CCCCCCCCCNC1CCCCC1 270004a_100000212291_100000210434 [0,1,0,1,0,0|1,0,1]=4 18303 B16R1.643 CCCCCCCCCNC1CCCCC1 34a_100000182618_100011214924 [0,1,0,1,0,0|1,0,1]=4 18304 B16R1.643 CCCCCCCCCNC1CCCCC1 34a_100000212291_100000210327 [0,1,0,1,0,0|1,0,1]=4 18305 B16R1.643 CCCCCCCCCNC1CCCOC1 2230a_100000719290_100011214924 [0,1,0,1,0,0|2,0,0]=4 18306 B16R1.643 CCCCCCCCCNC1CCCOC1 270004a_100000212291_100000753404 [0,1,0,1,0,0|2,0,0]=4 18307 B16R1.643 CCCCCCCCCNC1CCCOC1 34a_100000212291_100000693364 [0,1,0,1,0,0|2,0,0]=4 18308 B16R1.643 CCCCCCCCCNC1CCCOC1 34a_100000719290_100011214924 [0,1,0,1,0,0|2,0,0]=4 18309 B16R1.643 CCCCCCCCCNC1CCCSC1 270004a_100000212291_100000057913 [0,1,0,1,0,0|2,0,0]=4 18310 B16R1.643 CCCCCCCCCOC1C=CCCC1 34a_100011215024_100011214924 [0,1,0,1,0,0|1,0,0]=3 18311 B16R1.643 CCCCCCCCCOC1C=CCCC1 7a_100000210712_100000751183 [0,1,0,1,0,0|1,0,0]=3 18312 B16R1.643 CCCCCCCCCOC1CC=CCC1 34a_100000073881_100011214924 [0,1,0,1,0,0|1,0,1]=4 18313 B16R1.643 CCCCCCCCCOC1CCCCC1 34a_100000210231_100011214924 [0,1,0,1,0,0|1,0,1]=4 18314 B16R1.643 CCCCCCCCCOC1CCCCC1 34a_100000210712_100000210327 [0,1,0,1,0,0|1,0,1]=4 18315 B16R1.643 CCCCCCCCCOC1CCCCC1 7a_100000210231_100000210328 [0,1,0,1,0,0|1,0,1]=4 18316 B16R1.643 CCCCCCCCCOC1CCCCC1 7a_100000210712_100000210327 [0,1,0,1,0,0|1,0,1]=4 18317 B16R1.643 CCCCCCCCCOC1CCCCO1 34a_100000033831_100011214924 [0,1,0,1,0,0|0,0,2]=4 18318 B16R1.643 CCCCCCCCCOC1CCCOC1 34a_100000210712_100000693364 [0,1,0,1,0,0|2,0,0]=4 18319 B16R1.643 CCCCCCCCCOC1CCCOC1 34a_100000754041_100011214924 [0,1,0,1,0,0|2,0,0]=4 18320 B16R1.643 CCCCCCCCCOC1CCCOC1 7a_100000210712_100000693364 [0,1,0,1,0,0|2,0,0]=4 18321 B16R1.643 CCCCCCCCCOC1CCCSC1 7a_100015962668_100000210328 [0,1,0,1,0,0|2,0,0]=4 18322 B16R1.643 CCCCCCCCCSC1C=CCCC1 62a_100000751183_100000210670 [0,1,0,1,0,0|1,0,0]=3 18323 B16R1.643 CCCCCCCCCSC1CCCCC1 62a_100000210327_100000210670 [0,1,0,1,0,0|1,0,1]=4 18324 B16R1.643 CCCCCCCCNCC1CC=CCC1 270004a_100000229939_100000189434 [0,1,0,1,0,0|1,0,1]=4 18325 B16R1.643 CCCCCCCCNCC1CCCCC1 2230a_100000210473_100000210759 [0,1,0,1,0,0|1,0,1]=4 18326 B16R1.643 CCCCCCCCNCC1CCCCC1 2230a_100000229939_100000211423 [0,1,0,1,0,0|1,0,1]=4 18327 B16R1.643 CCCCCCCCNCC1CCCCC1 269862a_100000229939_100000211278 [0,1,0,1,0,0|1,0,1]=4 18328 B16R1.643 CCCCCCCCNCC1CCCCC1 34a_100000210473_100000210759 [0,1,0,1,0,0|1,0,1]=4 18329 B16R1.643 CCCCCCCCNCC1CCCCC1 34a_100000229939_100000211423 [0,1,0,1,0,0|1,0,1]=4 18330 B16R1.643 CCCCCCCCNCC1CCCCO1 2230a_100000174945_100000210759 [0,1,0,1,0,0|0,0,2]=4 18331 B16R1.643 CCCCCCCCNCC1CCCCO1 2230a_100000229939_100000211543 [0,1,0,1,0,0|0,0,2]=4 18332 B16R1.643 CCCCCCCCNCC1CCCCO1 34a_100000174945_100000210759 [0,1,0,1,0,0|0,0,2]=4 18333 B16R1.643 CCCCCCCCNCC1CCCCO1 34a_100000229939_100000211543 [0,1,0,1,0,0|0,0,2]=4 18334 B16R1.643 CCCCCCCCNCC1CCCOC1 2230a_100000229939_100000741521 [0,1,0,1,0,0|2,0,0]=4 18335 B16R1.643 CCCCCCCCNCC1CCCOC1 2230a_100000720124_100000210759 [0,1,0,1,0,0|2,0,0]=4 18336 B16R1.643 CCCCCCCCNCC1CCCOC1 34a_100000229939_100000741521 [0,1,0,1,0,0|2,0,0]=4 18337 B16R1.643 CCCCCCCCNCC1CCCOC1 34a_100000720124_100000210759 [0,1,0,1,0,0|2,0,0]=4 18338 B16R1.643 CCCCCCCCOCC1CC=CCC1 34a_100000210713_100000210759 [0,1,0,1,0,0|1,0,1]=4 18339 B16R1.643 CCCCCCCCOCC1CCC=CO1 34a_100011217868_100000210759 [0,1,0,1,0,0|0,0,2]=4 18340 B16R1.643 CCCCCCCCOCC1CCCCC1 34a_100000210232_100000211423 [0,1,0,1,0,0|1,0,1]=4 18341 B16R1.643 CCCCCCCCOCC1CCCCC1 34a_100000212181_100000210759 [0,1,0,1,0,0|1,0,1]=4 18342 B16R1.643 CCCCCCCCOCC1CCCCC1 7a_100000210232_100000211423 [0,1,0,1,0,0|1,0,1]=4 18343 B16R1.643 CCCCCCCCOCC1CCCCC1 7a_100000212181_100000210759 [0,1,0,1,0,0|1,0,1]=4 18344 B16R1.643 CCCCCCCCOCC1CCCCN1 34a_100000210821_100000210759 [0,1,0,1,0,0|1,0,1]=4 18345 B16R1.643 CCCCCCCCOCC1CCCCO1 34a_100000210232_100000211543 [0,1,0,1,0,0|0,0,2]=4 18346 B16R1.643 CCCCCCCCOCC1CCCCO1 34a_100000211370_100000210759 [0,1,0,1,0,0|0,0,2]=4 18347 B16R1.643 CCCCCCCCOCC1CCCCO1 7a_100000210232_100000211543 [0,1,0,1,0,0|0,0,2]=4 18348 B16R1.643 CCCCCCCCOCC1CCCCO1 7a_100000211370_100000210759 [0,1,0,1,0,0|0,0,2]=4 18349 B16R1.643 CCCCCCCCOCC1CCCNC1 34a_100000211344_100000210759 [0,1,0,1,0,0|2,0,0]=4 18350 B16R1.643 CCCCCCCCOCC1CCCOC1 34a_100000210232_100000741521 [0,1,0,1,0,0|2,0,0]=4 18351 B16R1.643 CCCCCCCCOCC1CCCOC1 34a_100000741520_100000210759 [0,1,0,1,0,0|2,0,0]=4 18352 B16R1.643 CCCCCCCCOCC1CCCOC1 7a_100000210232_100000741521 [0,1,0,1,0,0|2,0,0]=4 18353 B16R1.643 CCCCCCCCSCC1CCCCC1 62a_100000210759_100000211423 [0,1,0,1,0,0|1,0,1]=4 18354 B16R1.643 CCCCCCCCSCC1CCCCC1 62a_100000211423_100000210317 [0,1,0,1,0,0|1,0,1]=4 18355 B16R1.643 CCCCCCCCSCC1CCCCO1 62a_100000210759_100000211543 [0,1,0,1,0,0|0,0,2]=4 18356 B16R1.643 CCCCCCCCSCC1CCCCO1 62a_100000211543_100000210317 [0,1,0,1,0,0|0,0,2]=4 18357 B16R1.643 CCCCCCCCSCC1CCCOC1 62a_100000210759_100000741521 [0,1,0,1,0,0|2,0,0]=4 18358 B16R1.643 CCCCCCCCSCC1CCCOC1 62a_100000741521_100000210317 [0,1,0,1,0,0|2,0,0]=4 18359 B16R1.643 CCCCCCCNCCC1CCCCC1 2230a_100000229938_100012355289 [0,1,0,1,0,0|1,0,1]=4 18360 B16R1.643 CCCCCCCNCCC1CCCCC1 2230a_100000738074_100000210681 [0,1,0,1,0,0|1,0,1]=4 18361 B16R1.643 CCCCCCCNCCC1CCCCC1 270004a_100000229938_100011713444 [0,1,0,1,0,0|1,0,1]=4 18362 B16R1.643 CCCCCCCNCCC1CCCCC1 34a_100000738074_100000210614 [0,1,0,1,0,0|1,0,1]=4 18363 B16R1.643 CCCCCCCNCCC1CCCCO1 2230a_100015183643_100000210681 [0,1,0,1,0,0|0,0,2]=4 18364 B16R1.643 CCCCCCCNCCC1CCCCO1 34a_100015183643_100000210614 [0,1,0,1,0,0|0,0,2]=4 18365 B16R1.643 CCCCCCCOCCC1CCCCC1 34a_100000210272_100011209188 [0,1,0,1,0,0|1,0,1]=4 18366 B16R1.643 CCCCCCCOCCC1CCCCC1 34a_100011217863_100000210614 [0,1,0,1,0,0|1,0,1]=4 18367 B16R1.643 CCCCCCCOCCC1CCCCC1 7a_100000210272_100011273959 [0,1,0,1,0,0|1,0,1]=4 18368 B16R1.643 CCCCCCCOCCC1CCCCC1 7a_100011217863_100000210614 [0,1,0,1,0,0|1,0,1]=4 18369 B16R1.643 CCCCCCCOCCC1CCCCN1 34a_100000211664_100000210614 [0,1,0,1,0,0|1,0,1]=4 18370 B16R1.643 CCCCCCCOCCC1CCCNC1 34a_100000752241_100000210614 [0,1,0,1,0,0|2,0,0]=4 18371 B16R1.643 CCCCCCCSCCC1CCCCC1 62a_100000210614_100012355289 [0,1,0,1,0,0|1,0,1]=4 18372 B16R1.643 CCCCCCCSCCC1CCCCC1 62a_100012355289_100000210316 [0,1,0,1,0,0|1,0,1]=4 18373 B16R1.643 CCCCCCNCCCC1CCCCC1 2230a_100000210581_100011713725 [0,1,0,1,0,0|1,0,1]=4 18374 B16R1.643 CCCCCCNCCCC1CCCCC1 2230a_100011211642_100000210314 [0,1,0,1,0,0|1,0,1]=4 18375 B16R1.643 CCCCCCNCCCC1CCCCC1 34a_100011211642_100000210314 [0,1,0,1,0,0|1,0,1]=4 18376 B16R1.643 CCCCCCOCCCC1CCCCC1 34a_100000198086_100000210314 [0,1,0,1,0,0|1,0,1]=4 18377 B16R1.643 CCCCCCOCCCC1CCCCC1 34a_100000210259_100011713725 [0,1,0,1,0,0|1,0,1]=4 18378 B16R1.643 CCCCCCOCCCC1CCCCC1 7a_100000198086_100000210314 [0,1,0,1,0,0|1,0,1]=4 18379 B16R1.643 CCCCCCOCCCC1CCCCC1 7a_100000210259_100011713725 [0,1,0,1,0,0|1,0,1]=4 18380 B16R1.643 CCCCCCOCCCC1CCCCN1 34a_100011934581_100000210314 [0,1,0,1,0,0|1,0,1]=4 18381 B16R1.643 CCCCCCOCCCC1CCCNC1 34a_100150707839_100000210314 [0,1,0,1,0,0|2,0,0]=4 18382 B16R1.643 CCCCCCOCCOC1C=CCCC1 7a_100000691444_100000751183 [0,1,0,1,0,0|2,0,0]=4 18383 B16R1.643 CCCCCCSCCCC1CCCCC1 62a_100000210314_100011713725 [0,1,0,1,0,0|1,0,1]=4 18384 B16R1.643 CCCCCCSCCCC1CCCCC1 62a_100011713725_100000210757 [0,1,0,1,0,0|1,0,1]=4 18385 B16R1.643 CCCCCOCCCCC1CCCCC1 34a_100011215267_100000718602 [0,1,0,1,0,0|1,0,1]=4 18386 B16R1.643 CCCCCOCCCCC1CCCCC1 7a_100011215267_100000210326 [0,1,0,1,0,0|1,0,1]=4 18387 B16R1.643 CCCCOCCCCOC1C=CCCC1 7a_200000760531_100000751183 [0,1,0,1,0,0|2,0,0]=4 18388 B16R1.643 CNCCCCCOCCC1CCCCC1 34a_100000722520_100011209188 [0,1,0,1,0,0|2,0,0]=4 18389 B16R1.643 COCCCCCCNCC1CCCCC1 2230a_100000210473_100011998445 [0,1,0,1,0,0|2,0,0]=4 18390 B16R1.643 COCCCCCCNCC1CCCCC1 34a_100000210473_100011998445 [0,1,0,1,0,0|2,0,0]=4 18391 B16R1.643 COCCCCCCOCC1CCCCC1 34a_100000212181_100011998445 [0,1,0,1,0,0|2,0,0]=4 18392 B16R1.643 COCCCCCCOCC1CCCCC1 34a_200012092642_100000211423 [0,1,0,1,0,0|2,0,0]=4 18393 B16R1.643 COCCCCCCOCC1CCCCC1 7a_100000212181_100011998445 [0,1,0,1,0,0|2,0,0]=4 18394 B16R1.643 COCCCCCCOCC1CCCCC1 7a_200012092642_100000211423 [0,1,0,1,0,0|2,0,0]=4 18395 B16R1.643 COCCCCCCSCC1CCCCC1 62a_100000211423_100011998445 [0,1,0,1,0,0|2,0,0]=4 18396 B16R1.643 COCCCCCCSCC1CCCCC1 62a_100011998445_100000211423 [0,1,0,1,0,0|2,0,0]=4 18397 B16R1.643 COCCCCCNCCC1CCCCC1 2230a_100000747528_100012355289 [0,1,0,1,0,0|2,0,0]=4 18398 B16R1.643 COCCCCCNCCC1CCCCC1 270004a_100000747528_100011713444 [0,1,0,1,0,0|2,0,0]=4 18399 B16R1.643 COCCCCCNCCC1CCCCC1 34a_100000747528_100011209188 [0,1,0,1,0,0|2,0,0]=4 18400 B16R1.643 COCCCCNCCCC1CCCCC1 2230a_100011211642_100000730899 [0,1,0,1,0,0|2,0,0]=4 18401 B16R1.643 COCCCCNCCCC1CCCCC1 34a_100011211642_100000755781 [0,1,0,1,0,0|2,0,0]=4 18402 B16R1.643 COCCCCOCCCC1CCCCC1 34a_100000198086_100000755781 [0,1,0,1,0,0|2,0,0]=4 18403 B16R1.643 COCCCCOCCCC1CCCCC1 34a_100000740925_100011713725 [0,1,0,1,0,0|2,0,0]=4 18404 B16R1.643 COCCCCOCCCC1CCCCC1 7a_100000198086_100000730899 [0,1,0,1,0,0|2,0,0]=4 18405 B16R1.643 COCCCCSCCCC1CCCCC1 62a_100000730899_100011713725 [0,1,0,1,0,0|2,0,0]=4 18406 B16R1.643 COCCCCSCCCC1CCCCC1 62a_100011713725_100000730899 [0,1,0,1,0,0|2,0,0]=4 18407 B16R1.643 COCCCOCCCCC1CCCCC1 34a_100011215267_100000740836 [0,1,0,1,0,0|2,0,0]=4 18408 B16R1.643 COCCCOCCCCC1CCCCC1 7a_100011215267_100000740836 [0,1,0,1,0,0|2,0,0]=4 18409 B16R1.643 CSCCCCOCCCC1CCCCC1 34a_100011217163_100011713725 [0,1,0,1,0,0|2,0,0]=4 18410 B16R1.643 CSCCCCOCCCC1CCCCC1 7a_100011217163_100011713725 [0,1,0,1,0,0|2,0,0]=4 18411 B16R1.643 ClCCCCCCCCOC1C=CCCC1 7a_100000033203_100000751183 [0,1,0,1,0,0|2,0,0]=4 18412 B16R1.643 ClCCCCCCCCOC1CCCCC1 34a_100000033203_100000210327 [0,1,0,1,0,0|1,0,1]=4 18413 B16R1.643 ClCCCCCCCCOC1CCCCC1 7a_100000033203_100000210327 [0,1,0,1,0,0|1,0,1]=4 18414 B16R1.643 ClCCCCCCOCCC1CCCCC1 34a_100000766143_100011209188 [0,1,0,1,0,0|1,0,1]=4 18415 B16R1.643 ClCCCCCCOCCC1CCCCC1 7a_100000766143_100011273959 [0,1,0,1,0,0|1,0,1]=4 18416 B16R1.643 ClCCCCCOCCCC1CCCCC1 34a_100000746330_100011713725 [0,1,0,1,0,0|1,0,1]=4 18417 B16R1.643 ClCCCCCOCCCC1CCCCC1 7a_100000746330_100011713725 [0,1,0,1,0,0|1,0,1]=4 18418 B16R1.643 FCCCCCCNCCC1CCCCC1 2230a_100000738074_100015922095 [0,1,0,1,0,0|1,0,1]=4 18419 B16R1.643 FCCCCCCNCCC1CCCCC1 34a_100000738074_100015922095 [0,1,0,1,0,0|1,0,1]=4 18420 B16R1.643 FCCCCCCOCCC1CCCCC1 34a_100000732779_100011209188 [0,1,0,1,0,0|1,0,1]=4 18421 B16R1.643 FCCCCCCOCCC1CCCCC1 34a_100011217863_100015922095 [0,1,0,1,0,0|1,0,1]=4 18422 B16R1.643 FCCCCCCOCCC1CCCCC1 7a_100000732779_100011273959 [0,1,0,1,0,0|1,0,1]=4 18423 B16R1.643 FCCCCCCOCCC1CCCCC1 7a_100011217863_100015922095 [0,1,0,1,0,0|1,0,1]=4 18424 B16R1.643 FCCCCCCSCCC1CCCCC1 62a_100012355289_100015922095 [0,1,0,1,0,0|1,0,1]=4 18425 B16R1.643 FCCCCCCSCCC1CCCCC1 62a_100015922095_100012355289 [0,1,0,1,0,0|1,0,1]=4 18426 B16R1.643 FCCCCCNCCCC1CCCCC1 2230a_100011211642_100000729378 [0,1,0,1,0,0|1,0,1]=4 18427 B16R1.643 FCCCCCNCCCC1CCCCC1 34a_100011211642_100000729378 [0,1,0,1,0,0|1,0,1]=4 18428 B16R1.643 FCCCCCOCCCC1CCCCC1 34a_100000198086_100000729378 [0,1,0,1,0,0|1,0,1]=4 18429 B16R1.643 FCCCCCOCCCC1CCCCC1 7a_100000198086_100000729378 [0,1,0,1,0,0|1,0,1]=4 18430 B16R1.643 FCCCCCSCCCC1CCCCC1 62a_100000729378_100011713725 [0,1,0,1,0,0|1,0,1]=4 18431 B16R1.643 FCCCCCSCCCC1CCCCC1 62a_100011713725_100000729378 [0,1,0,1,0,0|1,0,1]=4 18432 B16R1.643 FCCCCOCCCCC1CCCCC1 34a_100011215267_100000729493 [0,1,0,1,0,0|1,0,1]=4 18433 B16R1.643 FCCCCOCCCCC1CCCCC1 7a_100011215267_100000729493 [0,1,0,1,0,0|1,0,1]=4 18434 B16R1.643 ICCCCCOCCCC1CCCCC1 34a_200012148887_100011713725 [0,1,0,1,0,0|1,0,1]=4 18435 B16R1.643 ICCCCCOCCCC1CCCCC1 7a_200012148887_100011713725 [0,1,0,1,0,0|1,0,1]=4 18436 B16R1.643 N#CCCCCCCNCC1CCCCC1 2230a_100000210473_100009813337 [0,1,0,1,0,0|1,0,1]=4 18437 B16R1.643 N#CCCCCCCOCC1CCCCC1 7a_100000212181_100009813337 [0,1,0,1,0,0|1,0,1]=4 18438 B16R1.643 N#CCCCCCCSCC1CCCCC1 62a_100000211423_100009813337 [0,1,0,1,0,0|1,0,1]=4 18439 B16R1.643 N#CCCCCCCSCC1CCCCC1 62a_100009813337_100000211423 [0,1,0,1,0,0|1,0,1]=4 18440 B16R1.643 N#CCCCCCNCCC1CCCCC1 2230a_100000738074_100009813376 [0,1,0,1,0,0|1,0,1]=4 18441 B16R1.643 N#CCCCCCNCCC1CCCCC1 270004a_100000061152_100011713444 [0,1,0,1,0,0|1,0,1]=4 18442 B16R1.643 N#CCCCCCOCCC1CCCCC1 7a_100011217863_100009813376 [0,1,0,1,0,0|1,0,1]=4 18443 B16R1.643 N#CCCCCCSCCC1CCCCC1 62a_100009813376_100012355289 [0,1,0,1,0,0|1,0,1]=4 18444 B16R1.643 N#CCCCCCSCCC1CCCCC1 62a_100012355289_100009813376 [0,1,0,1,0,0|1,0,1]=4 18445 B16R1.643 N#CCCCCNCCCC1CCCCC1 2230a_100011211642_100000211819 [0,1,0,1,0,0|1,0,1]=4 18446 B16R1.643 N#CCCCCOCCCC1CCCCC1 7a_100000198086_100000211819 [0,1,0,1,0,0|1,0,1]=4 18447 B16R1.643 N#CCCCCSCCCC1CCCCC1 62a_100011219923_100011713725 [0,1,0,1,0,0|1,0,1]=4 18448 B16R1.643 N#CCCCCSCCCC1CCCCC1 62a_100011713725_100000211819 [0,1,0,1,0,0|1,0,1]=4 18449 B16R1.643 N#CCCCOCCCCC1CCCCC1 7a_100011215267_100000687738 [0,1,0,1,0,0|1,0,1]=4 18450 B16R1.643 NCCCCCCCCOC1CCCCC1 34a_102515433106_100000210327 [0,1,0,1,0,0|1,0,1]=4 18451 B16R1.643 NCCCCCCCOCC1CCCCC1 34a_100011996573_100000211423 [0,1,0,1,0,0|1,0,1]=4 18452 B16R1.643 NCCCCCCOCCC1CCCCC1 34a_100000686447_100011209188 [0,1,0,1,0,0|1,0,1]=4 18453 B16R1.643 NCCCCCOCCCC1CCCCC1 34a_100000762737_100011713725 [0,1,0,1,0,0|1,0,1]=4 18454 B16R1.643 O=CCCCCCNCCC1=CCCCC1 2230a_100000212019_100000139337 [0,1,0,1,0,0|0,0,2]=4 18455 B16R1.643 O=CCCCCCNCCC1CCCCC1 2230a_100000738074_100000139337 [0,1,0,1,0,0|0,0,0]=2 18456 B16R1.643 O=CCCCCCNCCC1CCCCO1 2230a_100015183643_100000139337 [0,1,0,1,0,0|1,0,0]=3 18457 B16R1.643 O=CCCCCCNCCC1CCOCC1 2230a_100000755988_100000139337 [0,1,0,1,0,0|1,0,0]=3 18458 B16R1.643 O=CCCCCCNCCN1CCSCC1 2230a_100000755026_100000139337 [0,1,0,1,0,0|2,0,0]=4 18459 B16R1.643 O=CCCCCCOCCC1CCCCC1 7a_100011217863_100000139337 [0,1,0,1,0,0|0,0,0]=2 18460 B16R1.643 O=CCCCCCOCCC1CCOCC1 7a_100011933979_100000139337 [0,1,0,1,0,0|1,0,0]=3 18461 B16R1.643 O=CCCCCCOCCC1SCCCS1 7a_200011025297_100000139337 [0,1,0,1,0,0|2,0,0]=4 18462 B16R1.643 O=CCCCCCOCCN1CCSCC1 7a_100000686052_100000139337 [0,1,0,1,0,0|2,0,0]=4 18463 B16R1.643 O=CCCCCCSCCC1CCCCC1 62a_100000139337_100012355289 [0,1,0,1,0,0|0,0,0]=2 18464 B16R1.643 O=CCCCCCSCCC1CCCCC1 62a_100012355289_100000139337 [0,1,0,1,0,0|0,0,0]=2 18465 B16R1.643 O=CCCCCCSCCC1CCOCC1 62a_100000139337_100011934994 [0,1,0,1,0,0|1,0,0]=3 18466 B16R1.643 O=CCCCCCSCCC1CCOCC1 62a_100011934994_100000139337 [0,1,0,1,0,0|1,0,0]=3 18467 B16R1.643 O=CCCCCCSCCC1OCCCO1 62a_100000139337_100000764188 [0,1,0,1,0,0|2,0,0]=4 18468 B16R1.643 O=CCCCCCSCCC1OCCCO1 62a_100000764188_100000139337 [0,1,0,1,0,0|2,0,0]=4 18469 B16R1.643 O=CCCCCCSCCN1CCCCC1 62a_100000139337_100000739454 [0,1,0,1,0,0|1,0,0]=3 18470 B16R1.643 O=CCCCCCSCCN1CCCCC1 62a_100000739454_100000139337 [0,1,0,1,0,0|1,0,0]=3 18471 B16R1.643 O=CCCCCCSCCN1CCOCC1 62a_100000139337_100000211760 [0,1,0,1,0,0|2,0,0]=4 18472 B16R1.643 O=CCCCCCSCOC1CCCCC1 62a_100000139337_100011935260 [0,1,0,1,0,0|1,0,0]=3 18473 B16R1.643 O=CCCCCCSCOC1CCCCC1 62a_100011935260_100000139337 [0,1,0,1,0,0|1,0,0]=3 18474 B16R1.643 O=CCCCCNCCCC1CCCCC1 2230a_100011211642_100000139335 [0,1,0,1,0,0|0,0,0]=2 18475 B16R1.643 O=CCCCCOCCCC1CCCCC1 7a_100000198086_100000139335 [0,1,0,1,0,0|0,0,0]=2 18476 B16R1.643 O=CCCCCOCCOC1CCCCC1 7a_100011249652_100000139335 [0,1,0,1,0,0|1,0,0]=3 18477 B16R1.643 O=CCCCCOCCOC1CCCCO1 7a_100000034223_100000139335 [0,1,0,1,0,0|2,0,0]=4 18478 B16R1.643 O=CCCCCSCCCC1CCCCC1 62a_100000139335_100011713725 [0,1,0,1,0,0|0,0,0]=2 18479 B16R1.643 O=CCCCCSCCCC1CCCCC1 62a_100011713725_100000139335 [0,1,0,1,0,0|0,0,0]=2 18480 B16R1.643 O=CCCCCSCCCN1CCCCC1 62a_100000139335_100000007876 [0,1,0,1,0,0|1,0,0]=3 18481 B16R1.643 O=CCCCCSCCCN1CCCCC1 62a_100132302099_100000139335 [0,1,0,1,0,0|1,0,0]=3 18482 B16R1.643 O=CCCCCSCCCN1CCOCC1 62a_100000139335_100000748698 [0,1,0,1,0,0|2,0,0]=4 18483 B16R1.643 O=CCCCCSCCOC1CCCCC1 62a_100000139335_100011211530 [0,1,0,1,0,0|1,0,0]=3 18484 B16R1.643 O=CCCCCSCCOC1CCCCC1 62a_100011211530_100000139335 [0,1,0,1,0,0|1,0,0]=3 18485 B16R1.643 O=CCCCCSCCOC1CCCCO1 62a_100000139335_100000744793 [0,1,0,1,0,0|2,0,0]=4 18486 B16R1.643 O=CCCCCSCCOC1CCCCO1 62a_100000744793_100000139335 [0,1,0,1,0,0|2,0,0]=4 18487 B16R1.643 O=CCCCOCCCCC1CCCCC1 7a_100011215267_200011292268 [0,1,0,1,0,0|0,0,0]=2 18488 B16R1.643 O=CCCCSCCCOC1CCCCO1 62a_100000700653_200011292268 [0,1,0,1,0,0|2,0,0]=4 18489 B16R1.643 O=CCCCSCCCOC1CCCCO1 62a_200011292268_100000700653 [0,1,0,1,0,0|2,0,0]=4 18490 B16R1.643 OCCCCCCCCNC1C=CCCC1 2230a_102515433106_100000751183 [0,1,0,1,0,0|2,0,0]=4 18491 B16R1.643 OCCCCCCCCNC1CCCCC1 2230a_100000182618_100000033203 [0,1,0,1,0,0|0,0,2]=4 18492 B16R1.643 OCCCCCCCCNC1CCCCC1 270004a_102515433106_100000210434 [0,1,0,1,0,0|0,0,2]=4 18493 B16R1.643 OCCCCCCCCNC1CCCCC1 34a_100000182618_100000033203 [0,1,0,1,0,0|0,0,2]=4 18494 B16R1.643 OCCCCCCCCNC1CCCCC1 34a_102515433106_100000210327 [0,1,0,1,0,0|0,0,2]=4 18495 B16R1.643 OCCCCCCCCOC1C=CCCC1 34a_100011215024_100000033203 [0,1,0,1,0,0|2,0,0]=4 18496 B16R1.643 OCCCCCCCCOC1CCCCC1 34a_100000210231_100000033203 [0,1,0,1,0,0|0,0,2]=4 18497 B16R1.643 OCCCCCCCCOC1CCCCC1 7a_100000210231_100000033203 [0,1,0,1,0,0|0,0,2]=4 18498 B16R1.643 OCCCCCCCCSC1C=CCCC1 62a_100000033203_100000751183 [0,1,0,1,0,0|2,0,0]=4 18499 B16R1.643 OCCCCCCCCSC1C=CCCC1 62a_100000751183_100000033203 [0,1,0,1,0,0|2,0,0]=4 18500 B16R1.643 OCCCCCCCCSC1CCCCC1 62a_100000033203_100000210327 [0,1,0,1,0,0|0,0,2]=4 18501 B16R1.643 OCCCCCCCCSC1CCCCC1 62a_100000210327_100000033203 [0,1,0,1,0,0|0,0,2]=4 18502 B16R1.643 OCCCCCCCNCC1CCCCC1 2230a_100000210473_100000760002 [0,1,0,1,0,0|0,0,2]=4 18503 B16R1.643 OCCCCCCCNCC1CCCCC1 2230a_100011996573_100000211423 [0,1,0,1,0,0|0,0,2]=4 18504 B16R1.643 OCCCCCCCNCC1CCCCC1 269862a_100011996573_100000211278 [0,1,0,1,0,0|0,0,2]=4 18505 B16R1.643 OCCCCCCCNCC1CCCCC1 34a_100000210473_100000760002 [0,1,0,1,0,0|0,0,2]=4 18506 B16R1.643 OCCCCCCCNCC1CCCCC1 34a_100011996573_100000211423 [0,1,0,1,0,0|0,0,2]=4 18507 B16R1.643 OCCCCCCCOCC1CCCCC1 34a_100000212181_100000760002 [0,1,0,1,0,0|0,0,2]=4 18508 B16R1.643 OCCCCCCCOCC1CCCCC1 7a_100000212181_100000760002 [0,1,0,1,0,0|0,0,2]=4 18509 B16R1.643 OCCCCCCCSCC1CCCCC1 62a_100000211423_100000760002 [0,1,0,1,0,0|0,0,2]=4 18510 B16R1.643 OCCCCCCCSCC1CCCCC1 62a_100000760002_100000211423 [0,1,0,1,0,0|0,0,2]=4 18511 B16R1.643 OCCCCCCNCCC1CCCCC1 2230a_100000686447_100012355289 [0,1,0,1,0,0|0,0,2]=4 18512 B16R1.643 OCCCCCCNCCC1CCCCC1 2230a_100000738074_100000766143 [0,1,0,1,0,0|0,0,2]=4 18513 B16R1.643 OCCCCCCNCCC1CCCCC1 270004a_100000686447_100011713444 [0,1,0,1,0,0|0,0,2]=4 18514 B16R1.643 OCCCCCCNCCC1CCCCC1 34a_100000686447_100011209188 [0,1,0,1,0,0|0,0,2]=4 18515 B16R1.643 OCCCCCCNCCC1CCCCC1 34a_100000738074_100000766143 [0,1,0,1,0,0|0,0,2]=4 18516 B16R1.643 OCCCCCCOCCC1CCCCC1 34a_100011217863_100000766143 [0,1,0,1,0,0|0,0,2]=4 18517 B16R1.643 OCCCCCCOCCC1CCCCC1 7a_100011217863_100000766143 [0,1,0,1,0,0|0,0,2]=4 18518 B16R1.643 OCCCCCCSCCC1CCCCC1 62a_100000766143_100012355289 [0,1,0,1,0,0|0,0,2]=4 18519 B16R1.643 OCCCCCCSCCC1CCCCC1 62a_100012355289_100000766143 [0,1,0,1,0,0|0,0,2]=4 18520 B16R1.643 OCCCCCNCCCC1CCCCC1 2230a_100000762737_100011713725 [0,1,0,1,0,0|0,0,2]=4 18521 B16R1.643 OCCCCCNCCCC1CCCCC1 2230a_100011211642_100000746330 [0,1,0,1,0,0|0,0,2]=4 18522 B16R1.643 OCCCCCNCCCC1CCCCC1 34a_100000762737_100011713725 [0,1,0,1,0,0|0,0,2]=4 18523 B16R1.643 OCCCCCNCCCC1CCCCC1 34a_100011211642_100000746330 [0,1,0,1,0,0|0,0,2]=4 18524 B16R1.643 OCCCCCOCCCC1CCCCC1 34a_100000198086_100000746330 [0,1,0,1,0,0|0,0,2]=4 18525 B16R1.643 OCCCCCOCCCC1CCCCC1 7a_100000198086_100000746330 [0,1,0,1,0,0|0,0,2]=4 18526 B16R1.643 OCCCCCSCCCC1CCCCC1 62a_100000746330_100011713725 [0,1,0,1,0,0|0,0,2]=4 18527 B16R1.643 OCCCCCSCCCC1CCCCC1 62a_100011713725_100000746330 [0,1,0,1,0,0|0,0,2]=4 18528 B16R1.643 OCCCCOCCCCC1CCCCC1 34a_100011215267_100011216708 [0,1,0,1,0,0|0,0,2]=4 18529 B16R1.643 OCCCCOCCCCC1CCCCC1 7a_100011215267_100000210776 [0,1,0,1,0,0|0,0,2]=4 18530 B16R1.662 C#CCCCCCOC1CCCCCC1=O 7a_100000766912_100000243696 [0,1,0,1,0,0|0,0,2]=4 18531 B16R1.662 C#CCCCCCSC1CCCCCC1=O 62a_100000243696_100012094781 [0,1,0,1,0,0|0,0,2]=4 18532 B16R1.662 C#CCCCCCSC1CCCCCC1=O 62a_100012094781_100000243696 [0,1,0,1,0,0|0,0,2]=4 18533 B16R1.662 C=CCCCCCOC1CCCCCC1=O 7a_100011216702_100000243696 [0,1,0,1,0,0|0,0,2]=4 18534 B16R1.662 C=CCCCCCSC1CCCCCC1=O 62a_100000243696_100000700193 [0,1,0,1,0,0|0,0,2]=4 18535 B16R1.662 C=CCCCCCSC1CCCCCC1=O 62a_100000700193_100000243696 [0,1,0,1,0,0|0,0,2]=4 18536 B16R1.662 CC/C=C/CCCOC1CCCCCC1=O 7a_100016287902_100000243696 [0,1,0,1,0,0|0,0,2]=4 18537 B16R1.662 CCCC#CCCOC1CCCCCC1=O 7a_100000042726_100000243696 [0,1,0,1,0,0|0,0,2]=4 18538 B16R1.662 CCCC/C=C/COC1CCCCCC1=O 7a_200016272032_100000243696 [0,1,0,1,0,0|0,0,2]=4 18539 B16R1.662 CCCCC#CCOC1CCCCCC1=O 7a_200000034558_100000243696 [0,1,0,1,0,0|0,0,2]=4 18540 B16R1.662 CCCCCCCNC1CCCCNC1=O 2230a_100000229938_100000735217 [0,1,0,1,0,0|1,0,0]=3 18541 B16R1.662 CCCCCCCNC1CCCCNC1=O 2230a_100000698827_100000210681 [0,1,0,1,0,0|1,0,0]=3 18542 B16R1.662 CCCCCCCNC1CCCCNC1=O 34a_100000698827_100000210614 [0,1,0,1,0,0|1,0,0]=3 18543 B16R1.662 CCCCCCCOC1CCCCCC1=O 7a_100000210272_100000243696 [0,1,0,1,0,0|0,0,0]=2 18544 B16R1.662 CCCCCCCOC1CCCCNC1=O 7a_100000210272_100000735217 [0,1,0,1,0,0|1,0,0]=3 18545 B16R1.662 CCCCCCCSC1CCCCCC1=O 62a_100000210614_100000243696 [0,1,0,1,0,0|0,0,0]=2 18546 B16R1.662 CCCCCCCSC1CCCCCC1=O 62a_100000243696_100000210316 [0,1,0,1,0,0|0,0,0]=2 18547 B16R1.662 CCCCCCCSC1CCCCNC1=O 62a_100000210614_100000735217 [0,1,0,1,0,0|1,0,0]=3 18548 B16R1.662 CCCCCCCSC1CCCCNC1=O 62a_100000735217_100000210316 [0,1,0,1,0,0|1,0,0]=3 18549 B16R1.662 CCCCNCCCN1CCCCCC1=O 2230a_100000195386_100000210211 [0,1,0,1,0,0|1,0,0]=3 18550 B16R1.662 CCCCNCCCN1CCCCCC1=O 34a_100000195386_100000210210 [0,1,0,1,0,0|1,0,0]=3 18551 B16R1.662 CCCCOCCNC1CCCCNC1=O 2230a_100000698827_100000743108 [0,1,0,1,0,0|2,0,0]=4 18552 B16R1.662 CCCCOCCNC1CCCCNC1=O 34a_100000698827_100000743108 [0,1,0,1,0,0|2,0,0]=4 18553 B16R1.662 CCCCOCCOC1CCCCCC1=O 7a_100000210238_100000243696 [0,1,0,1,0,0|1,0,0]=3 18554 B16R1.662 CCCCOCCOC1CCCCNC1=O 7a_100000210238_100000735217 [0,1,0,1,0,0|2,0,0]=4 18555 B16R1.662 CCCCOCCSC1CCCCCC1=O 62a_100000243696_100000743108 [0,1,0,1,0,0|1,0,0]=3 18556 B16R1.662 CCCCOCCSC1CCCCCC1=O 62a_100000743108_100000243696 [0,1,0,1,0,0|1,0,0]=3 18557 B16R1.662 CCCCOCCSC1CCCCNC1=O 62a_100000735217_100000743108 [0,1,0,1,0,0|2,0,0]=4 18558 B16R1.662 CCCCOCCSC1CCCCNC1=O 62a_100000743108_100000735217 [0,1,0,1,0,0|2,0,0]=4 18559 B16R1.662 CCCCSCCNC1CCCCNC1=O 2230a_100025743550_100000735217 [0,1,0,1,0,0|2,0,0]=4 18560 B16R1.662 CCCCSCCOC1CCCCCC1=O 7a_200000230436_100000243696 [0,1,0,1,0,0|1,0,0]=3 18561 B16R1.662 CCCCSCCOC1CCCCNC1=O 7a_200000230436_100000735217 [0,1,0,1,0,0|2,0,0]=4 18562 B16R1.662 CCCOCCCNC1CCCCNC1=O 2230a_100011217757_100000735217 [0,1,0,1,0,0|2,0,0]=4 18563 B16R1.662 COCCCCCNC1CCCCNC1=O 2230a_100000747528_100000735217 [0,1,0,1,0,0|2,0,0]=4 18564 B16R1.662 COCCNCCCN1CCCCCC1=O 2230a_100000195386_100011201679 [0,1,0,1,0,0|2,0,0]=4 18565 B16R1.662 COCCNCCCN1CCCCCC1=O 34a_100000195386_100011201679 [0,1,0,1,0,0|2,0,0]=4 18566 B16R1.662 COCCOCCOC1CCCCCC1=O 7a_100011215163_100000243696 [0,1,0,1,0,0|2,0,0]=4 18567 B16R1.662 COCCOCCSC1CCCCCC1=O 62a_100000243696_100000695917 [0,1,0,1,0,0|2,0,0]=4 18568 B16R1.662 COCCOCCSC1CCCCCC1=O 62a_100000695917_100000243696 [0,1,0,1,0,0|2,0,0]=4 18569 B16R1.662 CSCCNCCCN1CCCCCC1=O 2230a_100000195386_100000751147 [0,1,0,1,0,0|2,0,0]=4 18570 B16R1.662 CSCCNCCCN1CCCCCC1=O 34a_100000195386_100000212216 [0,1,0,1,0,0|2,0,0]=4 18571 B16R1.662 N#CCCCCCSC1CCCCCC1=O 62a_100000243696_100009813376 [0,1,0,1,0,0|1,0,1]=4 18572 B16R1.662 N#CCCCCCSC1CCCCCC1=O 62a_100009813376_100000243696 [0,1,0,1,0,0|1,0,1]=4 18573 B16R1.662 O=C1CCCCCC1OCCCCCCBr 7a_100011215345_100000243696 [0,1,0,1,0,0|1,0,0]=3 18574 B16R1.662 O=C1CCCCCC1OCCCCCCCl 7a_100000766143_100000243696 [0,1,0,1,0,0|1,0,0]=3 18575 B16R1.662 O=C1CCCCCC1OCCCCCCF 7a_100000732779_100000243696 [0,1,0,1,0,0|1,0,0]=3 18576 B16R1.662 O=C1CCCCCC1SCCCCCCF 62a_100000243696_100015922095 [0,1,0,1,0,0|1,0,0]=3 18577 B16R1.662 O=C1CCCCCC1SCCCCCCF 62a_100015922095_100000243696 [0,1,0,1,0,0|1,0,0]=3 18578 B16R1.662 O=C1CCCCCC1SCCCCCCO 62a_100000243696_100000766143 [0,1,0,1,0,0|1,0,0]=3 18579 B16R1.662 O=C1CCCCCC1SCCCCCCO 62a_100000766143_100000243696 [0,1,0,1,0,0|1,0,0]=3 18580 B16R1.662 O=C1CCCCCN1CCCNCCCF 2230a_100000195386_100011934791 [0,1,0,1,0,0|2,0,0]=4 18581 B16R1.662 O=C1CCCCCN1CCCNCCCF 34a_100000195386_100011934791 [0,1,0,1,0,0|2,0,0]=4 18582 B16R1.662 O=C1CCCCCN1CCCNCCCO 2230a_100000195386_100000230001 [0,1,0,1,0,0|2,0,0]=4 18583 B16R1.662 O=C1CCCCCN1CCCNCCCO 34a_100000195386_100000230001 [0,1,0,1,0,0|2,0,0]=4 18584 B16R1.662 O=C1NCCCCC1NCCCCCCF 2230a_100000698827_100015922095 [0,1,0,1,0,0|2,0,0]=4 18585 B16R1.662 O=C1NCCCCC1NCCCCCCF 34a_100000698827_100015922095 [0,1,0,1,0,0|2,0,0]=4 18586 B16R1.662 O=C1NCCCCC1NCCCCCCO 2230a_100000686447_100000735217 [0,1,0,1,0,0|2,0,0]=4 18587 B16R1.662 O=C1NCCCCC1NCCCCCCO 2230a_100000698827_100000766143 [0,1,0,1,0,0|2,0,0]=4 18588 B16R1.662 O=C1NCCCCC1NCCCCCCO 34a_100000698827_100000766143 [0,1,0,1,0,0|2,0,0]=4 18589 B16R1.662 O=C1NCCCCC1OCCCCCCBr 7a_100011215345_100000735217 [0,1,0,1,0,0|2,0,0]=4 18590 B16R1.662 O=C1NCCCCC1OCCCCCCCl 7a_100000766143_100000735217 [0,1,0,1,0,0|2,0,0]=4 18591 B16R1.662 O=C1NCCCCC1OCCCCCCF 7a_100000732779_100000735217 [0,1,0,1,0,0|2,0,0]=4 18592 B16R1.662 O=C1NCCCCC1SCCCCCCF 62a_100000735217_100015922095 [0,1,0,1,0,0|2,0,0]=4 18593 B16R1.662 O=C1NCCCCC1SCCCCCCF 62a_100015922095_100000735217 [0,1,0,1,0,0|2,0,0]=4 18594 B16R1.662 O=C1NCCCCC1SCCCCCCO 62a_100000735217_100000766143 [0,1,0,1,0,0|2,0,0]=4 18595 B16R1.662 O=C1NCCCCC1SCCCCCCO 62a_100000766143_100000735217 [0,1,0,1,0,0|2,0,0]=4 18596 B16R1.662 O=CCCCCCSC1CCCCCC1=O 62a_100000139337_100000243696 [0,1,0,1,0,0|1,0,1]=4 18597 B16R1.662 O=CCCCCCSC1CCCCCC1=O 62a_100000243696_100000139337 [0,1,0,1,0,0|1,0,1]=4 18598 B16R1.1193 BrCCCCCCCCCOC1CCCC1 34a_100009813782_100000179811 [0,1,0,1,0,0|1,0,1]=4 18599 B16R1.1193 BrCCCCCCCCCOC1CCCC1 7a_100009813782_100000179811 [0,1,0,1,0,0|1,0,1]=4 18600 B16R1.1193 BrCCCCCCCCOCC1CCCC1 34a_100009813846_100000740388 [0,1,0,1,0,0|1,0,1]=4 18601 B16R1.1193 BrCCCCCCCCOCC1CCCC1 7a_100009813846_100000740388 [0,1,0,1,0,0|1,0,1]=4 18602 B16R1.1193 BrCCCCCCCOCCC1CCCC1 34a_100000760002_100000760354 [0,1,0,1,0,0|1,0,1]=4 18603 B16R1.1193 BrCCCCCCCOCCC1CCCC1 7a_100000760002_100000760354 [0,1,0,1,0,0|1,0,1]=4 18604 B16R1.1193 BrCCCCCCOCCCC1CCCC1 34a_100011215345_100011713738 [0,1,0,1,0,0|1,0,1]=4 18605 B16R1.1193 BrCCCCCCOCCCC1CCCC1 7a_100011215345_100011713738 [0,1,0,1,0,0|1,0,1]=4 18606 B16R1.1193 C#CCCCCCCCCOC1CCCC1 34a_100000065265_100000179811 [0,1,0,1,0,0|1,0,1]=4 18607 B16R1.1193 C#CCCCCCCCCOC1CCCC1 7a_100000065265_100000179811 [0,1,0,1,0,0|1,0,1]=4 18608 B16R1.1193 C#CCCCCCCCNCC1CCCC1 2230a_100000737975_100153394163 [0,1,0,1,0,0|1,0,1]=4 18609 B16R1.1193 C#CCCCCCCCNCC1CCCC1 34a_100000737975_100153394163 [0,1,0,1,0,0|1,0,1]=4 18610 B16R1.1193 C#CCCCCCCCOCC1CCCC1 34a_100000054614_100000740388 [0,1,0,1,0,0|1,0,1]=4 18611 B16R1.1193 C#CCCCCCCCOCC1CCCC1 34a_100000742336_100153394163 [0,1,0,1,0,0|1,0,1]=4 18612 B16R1.1193 C#CCCCCCCCOCC1CCCC1 7a_100000054614_100000740388 [0,1,0,1,0,0|1,0,1]=4 18613 B16R1.1193 C#CCCCCCCCOCC1CCCC1 7a_100000742336_100153394163 [0,1,0,1,0,0|1,0,1]=4 18614 B16R1.1193 C#CCCCCCCCSCC1CCCC1 62a_100000740388_100153394163 [0,1,0,1,0,0|1,0,1]=4 18615 B16R1.1193 C#CCCCCCCCSCC1CCCC1 62a_100153394163_100000740388 [0,1,0,1,0,0|1,0,1]=4 18616 B16R1.1193 C#CCCCCCCNCCC1CCCC1 2230a_100000739158_100012276617 [0,1,0,1,0,0|1,0,1]=4 18617 B16R1.1193 C#CCCCCCCNCCC1CCCC1 34a_100000739158_100012276617 [0,1,0,1,0,0|1,0,1]=4 18618 B16R1.1193 C#CCCCCCCOCCC1CCCC1 34a_100000749090_100012276617 [0,1,0,1,0,0|1,0,1]=4 18619 B16R1.1193 C#CCCCCCCOCCC1CCCC1 34a_100011217361_100000760354 [0,1,0,1,0,0|1,0,1]=4 18620 B16R1.1193 C#CCCCCCCOCCC1CCCC1 7a_100000749090_100012276617 [0,1,0,1,0,0|1,0,1]=4 18621 B16R1.1193 C#CCCCCCCOCCC1CCCC1 7a_100011217361_100000760354 [0,1,0,1,0,0|1,0,1]=4 18622 B16R1.1193 C#CCCCCCCSCCC1CCCC1 62a_100000760354_100012276617 [0,1,0,1,0,0|1,0,1]=4 18623 B16R1.1193 C#CCCCCCCSCCC1CCCC1 62a_100012276617_100000760354 [0,1,0,1,0,0|1,0,1]=4 18624 B16R1.1193 C#CCCCCCNCCCC1CCCC1 2230a_100000736752_100012094781 [0,1,0,1,0,0|1,0,1]=4 18625 B16R1.1193 C#CCCCCCNCCCC1CCCC1 34a_100000736752_100012094781 [0,1,0,1,0,0|1,0,1]=4 18626 B16R1.1193 C#CCCCCCOCCCC1CCCC1 34a_100000766912_100011713738 [0,1,0,1,0,0|1,0,1]=4 18627 B16R1.1193 C#CCCCCCOCCCC1CCCC1 34a_100011215328_100012094781 [0,1,0,1,0,0|1,0,1]=4 18628 B16R1.1193 C#CCCCCCOCCCC1CCCC1 7a_100000766912_100011713738 [0,1,0,1,0,0|1,0,1]=4 18629 B16R1.1193 C#CCCCCCOCCCC1CCCC1 7a_100011215328_100012094781 [0,1,0,1,0,0|1,0,1]=4 18630 B16R1.1193 C#CCCCCCSCCCC1CCCC1 62a_100011713738_100012094781 [0,1,0,1,0,0|1,0,1]=4 18631 B16R1.1193 C#CCCCCCSCCCC1CCCC1 62a_100012094781_100011713738 [0,1,0,1,0,0|1,0,1]=4 18632 B16R1.1193 C=CCCCCCCCCCN1CCCC1 2230a_100000188435_100009814027 [0,1,0,1,0,0|1,0,0]=3 18633 B16R1.1193 C=CCCCCCCCCCN1CCCC1 269982a_100000188435_100009814027 [0,1,0,1,0,0|1,0,0]=3 18634 B16R1.1193 C=CCCCCCCCCCN1CCSC1 2230a_100011215254_100009814027 [0,1,0,1,0,0|2,0,0]=4 18635 B16R1.1193 C=CCCCCCCCCCN1CCSC1 269982a_100011215254_100009814027 [0,1,0,1,0,0|2,0,0]=4 18636 B16R1.1193 C=CCCCCCCCCNC1CCCC1 2230a_100000211070_100011933949 [0,1,0,1,0,0|1,0,0]=3 18637 B16R1.1193 C=CCCCCCCCCNC1CCCC1 34a_100000211070_100011933949 [0,1,0,1,0,0|1,0,0]=3 18638 B16R1.1193 C=CCCCCCCCCN[C@@H]1CCOC1 2230a_200015188469_100011933949 [0,1,0,1,0,0|2,0,0]=4 18639 B16R1.1193 C=CCCCCCCCCN[C@H]1CCOC1 2230a_100015188467_100011933949 [0,1,0,1,0,0|2,0,0]=4 18640 B16R1.1193 C=CCCCCCCCCN[C@H]1CCOC1 34a_100015188467_100011933949 [0,1,0,1,0,0|2,0,0]=4 18641 B16R1.1193 C=CCCCCCCCCOC1CCCC1 34a_100000210269_100011933949 [0,1,0,1,0,0|1,0,0]=3 18642 B16R1.1193 C=CCCCCCCCCOC1CCCC1 34a_100011215194_100000179811 [0,1,0,1,0,0|1,0,0]=3 18643 B16R1.1193 C=CCCCCCCCCOC1CCCC1 7a_100000210269_100011933949 [0,1,0,1,0,0|1,0,0]=3 18644 B16R1.1193 C=CCCCCCCCCOC1CCCC1 7a_100011215194_100000179811 [0,1,0,1,0,0|1,0,0]=3 18645 B16R1.1193 C=CCCCCCCCCOC1CCCO1 34a_100000085407_100011933949 [0,1,0,1,0,0|2,0,0]=4 18646 B16R1.1193 C=CCCCCCCCCOC1CCOC1 34a_100011215194_100000690089 [0,1,0,1,0,0|2,0,0]=4 18647 B16R1.1193 C=CCCCCCCCCOC1CCOC1 7a_100011215194_100000731011 [0,1,0,1,0,0|2,0,0]=4 18648 B16R1.1193 C=CCCCCCCCCOC1CCSC1 7a_100011232664_100011933949 [0,1,0,1,0,0|2,0,0]=4 18649 B16R1.1193 C=CCCCCCCCCO[C@H]1CCOC1 34a_100000717292_100011933949 [0,1,0,1,0,0|2,0,0]=4 18650 B16R1.1193 C=CCCCCCCCCSC1CCCC1 62a_100011217020_100011933949 [0,1,0,1,0,0|1,0,0]=3 18651 B16R1.1193 C=CCCCCCCCCSC1CCCC1 62a_100011933949_100000179811 [0,1,0,1,0,0|1,0,0]=3 18652 B16R1.1193 C=CCCCCCCCCSC1CCOC1 62a_100011933949_100000690089 [0,1,0,1,0,0|2,0,0]=4 18653 B16R1.1193 C=CCCCCCCCNCC1CCCC1 2230a_100000737975_100012355270 [0,1,0,1,0,0|1,0,0]=3 18654 B16R1.1193 C=CCCCCCCCNCC1CCCC1 34a_100000737975_100012355270 [0,1,0,1,0,0|1,0,0]=3 18655 B16R1.1193 C=CCCCCCCCNCC1CCOC1 2230a_100000737293_100012355270 [0,1,0,1,0,0|2,0,0]=4 18656 B16R1.1193 C=CCCCCCCCNCC1CCOC1 34a_100000737293_100012355270 [0,1,0,1,0,0|2,0,0]=4 18657 B16R1.1193 C=CCCCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100012355270 [0,1,0,1,0,0|2,0,0]=4 18658 B16R1.1193 C=CCCCCCCCNC[C@@H]1CCCO1 34a_100020590478_100012355270 [0,1,0,1,0,0|2,0,0]=4 18659 B16R1.1193 C=CCCCCCCCOCC1CCCC1 34a_100000730831_100000740388 [0,1,0,1,0,0|1,0,0]=3 18660 B16R1.1193 C=CCCCCCCCOCC1CCCC1 34a_100000742336_100012355270 [0,1,0,1,0,0|1,0,0]=3 18661 B16R1.1193 C=CCCCCCCCOCC1CCCC1 7a_100000730831_100000740388 [0,1,0,1,0,0|1,0,0]=3 18662 B16R1.1193 C=CCCCCCCCOCC1CCCC1 7a_100000742336_100012355270 [0,1,0,1,0,0|1,0,0]=3 18663 B16R1.1193 C=CCCCCCCCOCC1CCCO1 34a_100000210270_100012355270 [0,1,0,1,0,0|2,0,0]=4 18664 B16R1.1193 C=CCCCCCCCOCC1CCCO1 7a_100000210270_100012355270 [0,1,0,1,0,0|2,0,0]=4 18665 B16R1.1193 C=CCCCCCCCOCC1CCCO1 7a_100000730831_100000203698 [0,1,0,1,0,0|2,0,0]=4 18666 B16R1.1193 C=CCCCCCCCOCC1CCNC1 34a_100000748654_100012355270 [0,1,0,1,0,0|2,0,0]=4 18667 B16R1.1193 C=CCCCCCCCOCC1CCOC1 34a_100000730831_100011261433 [0,1,0,1,0,0|2,0,0]=4 18668 B16R1.1193 C=CCCCCCCCOCC1CCOC1 34a_100000740260_100012355270 [0,1,0,1,0,0|2,0,0]=4 18669 B16R1.1193 C=CCCCCCCCOCC1CCOC1 7a_100000730831_100000702531 [0,1,0,1,0,0|2,0,0]=4 18670 B16R1.1193 C=CCCCCCCCOC[C@H]1CCCN1 34a_100000745186_100012355270 [0,1,0,1,0,0|2,0,0]=4 18671 B16R1.1193 C=CCCCCCCCSCC1CCCC1 62a_100000740388_100012355270 [0,1,0,1,0,0|1,0,0]=3 18672 B16R1.1193 C=CCCCCCCCSCC1CCCC1 62a_100012355270_100000740388 [0,1,0,1,0,0|1,0,0]=3 18673 B16R1.1193 C=CCCCCCCCSCC1CCCO1 62a_100000203698_100012355270 [0,1,0,1,0,0|2,0,0]=4 18674 B16R1.1193 C=CCCCCCCCSCC1CCCO1 62a_100012355270_100000203698 [0,1,0,1,0,0|2,0,0]=4 18675 B16R1.1193 C=CCCCCCCCSCC1CCOC1 62a_100000702531_100012355270 [0,1,0,1,0,0|2,0,0]=4 18676 B16R1.1193 C=CCCCCCCCSCC1CCOC1 62a_100012355270_100000702531 [0,1,0,1,0,0|2,0,0]=4 18677 B16R1.1193 C=CCCCCCCNCCC1CCCC1 2230a_100000739158_100011215473 [0,1,0,1,0,0|1,0,0]=3 18678 B16R1.1193 C=CCCCCCCNCCC1CCCC1 34a_100000739158_100011215473 [0,1,0,1,0,0|1,0,0]=3 18679 B16R1.1193 C=CCCCCCCOCCC1CCCC1 34a_100000749090_100011215473 [0,1,0,1,0,0|1,0,0]=3 18680 B16R1.1193 C=CCCCCCCOCCC1CCCC1 34a_200011216477_100000760354 [0,1,0,1,0,0|1,0,0]=3 18681 B16R1.1193 C=CCCCCCCOCCC1CCCC1 7a_100000749090_100011215473 [0,1,0,1,0,0|1,0,0]=3 18682 B16R1.1193 C=CCCCCCCOCCC1CCCC1 7a_200011216477_100000760354 [0,1,0,1,0,0|1,0,0]=3 18683 B16R1.1193 C=CCCCCCCOCCC1CCNC1 34a_100016987287_100011215473 [0,1,0,1,0,0|2,0,0]=4 18684 B16R1.1193 C=CCCCCCCOCCC1CCOC1 34a_100011879284_100011215473 [0,1,0,1,0,0|2,0,0]=4 18685 B16R1.1193 C=CCCCCCCOCCN1CCCC1 7a_200011216477_100000004467 [0,1,0,1,0,0|2,0,0]=4 18686 B16R1.1193 C=CCCCCCCSCCC1CCCC1 62a_100000760354_100011215473 [0,1,0,1,0,0|1,0,0]=3 18687 B16R1.1193 C=CCCCCCCSCCC1CCCC1 62a_100011215473_100000760354 [0,1,0,1,0,0|1,0,0]=3 18688 B16R1.1193 C=CCCCCCCSCCN1CCCC1 62a_100000700749_100011215473 [0,1,0,1,0,0|2,0,0]=4 18689 B16R1.1193 C=CCCCCCCSCCN1CCCC1 62a_100011215473_100000004467 [0,1,0,1,0,0|2,0,0]=4 18690 B16R1.1193 C=CCCCCCNCCCC1CCCC1 2230a_100000736752_100000700193 [0,1,0,1,0,0|1,0,0]=3 18691 B16R1.1193 C=CCCCCCNCCCC1CCCC1 34a_100000736752_100000700193 [0,1,0,1,0,0|1,0,0]=3 18692 B16R1.1193 C=CCCCCCNCCOC1CCCC1 34a_100000741755_100000700193 [0,1,0,1,0,0|2,0,0]=4 18693 B16R1.1193 C=CCCCCCOCCCC1CCCC1 34a_100011215328_100000700193 [0,1,0,1,0,0|1,0,0]=3 18694 B16R1.1193 C=CCCCCCOCCCC1CCCC1 34a_100011216702_100011713738 [0,1,0,1,0,0|1,0,0]=3 18695 B16R1.1193 C=CCCCCCOCCCC1CCCC1 7a_100011215328_100000700193 [0,1,0,1,0,0|1,0,0]=3 18696 B16R1.1193 C=CCCCCCOCCCC1CCCC1 7a_100011216702_100011713738 [0,1,0,1,0,0|1,0,0]=3 18697 B16R1.1193 C=CCCCCCOCCCN1CCCC1 34a_100011216702_100016991639 [0,1,0,1,0,0|2,0,0]=4 18698 B16R1.1193 C=CCCCCCOCCCN1CCCC1 7a_100011216702_100011445909 [0,1,0,1,0,0|2,0,0]=4 18699 B16R1.1193 C=CCCCCCOCCNC1CCCC1 34a_200000200444_100000700193 [0,1,0,1,0,0|2,0,0]=4 18700 B16R1.1193 C=CCCCCCOCCOC1CCCC1 34a_100000738311_100000700193 [0,1,0,1,0,0|2,0,0]=4 18701 B16R1.1193 C=CCCCCCOCCOC1CCCC1 7a_100000738311_100000700193 [0,1,0,1,0,0|2,0,0]=4 18702 B16R1.1193 C=CCCCCCSCCCC1CCCC1 62a_100000700193_100011713738 [0,1,0,1,0,0|1,0,0]=3 18703 B16R1.1193 C=CCCCCCSCCCC1CCCC1 62a_100011713738_100000700193 [0,1,0,1,0,0|1,0,0]=3 18704 B16R1.1193 C=CCCCCCSCCCN1CCCC1 62a_100000700193_100011445909 [0,1,0,1,0,0|2,0,0]=4 18705 B16R1.1193 C=CCCCCCSCCCN1CCCC1 62a_100016991639_100000700193 [0,1,0,1,0,0|2,0,0]=4 18706 B16R1.1193 C=CCCCCNCCCOC1CCCC1 34a_100000747560_100011215482 [0,1,0,1,0,0|2,0,0]=4 18707 B16R1.1193 C=COCCCCOCCCC1CCCC1 34a_100000031558_100011713738 [0,1,0,1,0,0|2,0,0]=4 18708 B16R1.1193 C=COCCCCOCCCC1CCCC1 7a_100000031558_100011713738 [0,1,0,1,0,0|2,0,0]=4 18709 B16R1.1193 CCCCCCCCCCCN1CC=CC1 269982a_100015195280_100011215454 [0,1,0,1,0,0|1,0,1]=4 18710 B16R1.1193 CCCCCCCCCCCN1CCCC1 2230a_100000188435_100011215454 [0,1,0,1,0,0|1,0,1]=4 18711 B16R1.1193 CCCCCCCCCCCN1CCCC1 269982a_100000188435_100011215454 [0,1,0,1,0,0|1,0,1]=4 18712 B16R1.1193 CCCCCCCCCCCN1CCSC1 2230a_100011215254_100011215454 [0,1,0,1,0,0|2,0,0]=4 18713 B16R1.1193 CCCCCCCCCCCN1CCSC1 269982a_100011215254_100011215454 [0,1,0,1,0,0|2,0,0]=4 18714 B16R1.1193 CCCCCCCCCCNC1CC=CC1 2230a_100015188752_100000210320 [0,1,0,1,0,0|1,0,1]=4 18715 B16R1.1193 CCCCCCCCCCNC1CCCC1 2230a_100000211070_100000210320 [0,1,0,1,0,0|1,0,1]=4 18716 B16R1.1193 CCCCCCCCCCNC1CCCC1 2230a_100000684558_100000179811 [0,1,0,1,0,0|1,0,1]=4 18717 B16R1.1193 CCCCCCCCCCNC1CCCC1 270004a_100000684558_100000210133 [0,1,0,1,0,0|1,0,1]=4 18718 B16R1.1193 CCCCCCCCCCNC1CCCC1 34a_100000211070_100000210320 [0,1,0,1,0,0|1,0,1]=4 18719 B16R1.1193 CCCCCCCCCCNC1CCCC1 34a_100000684558_100000179811 [0,1,0,1,0,0|1,0,1]=4 18720 B16R1.1193 CCCCCCCCCCNC1CCOC1 2230a_100000684558_100000731011 [0,1,0,1,0,0|2,0,0]=4 18721 B16R1.1193 CCCCCCCCCCNC1CCOC1 270004a_100000684558_100000752484 [0,1,0,1,0,0|2,0,0]=4 18722 B16R1.1193 CCCCCCCCCCNC1CCOC1 34a_100000684558_100000690089 [0,1,0,1,0,0|2,0,0]=4 18723 B16R1.1193 CCCCCCCCCCNC1CCSC1 270004a_100000684558_100000212027 [0,1,0,1,0,0|2,0,0]=4 18724 B16R1.1193 CCCCCCCCCCN[C@@H]1CCOC1 2230a_200015188469_100000210320 [0,1,0,1,0,0|2,0,0]=4 18725 B16R1.1193 CCCCCCCCCCN[C@H]1CCOC1 2230a_100015188467_100000210320 [0,1,0,1,0,0|2,0,0]=4 18726 B16R1.1193 CCCCCCCCCCN[C@H]1CCOC1 34a_100015188467_100000210320 [0,1,0,1,0,0|2,0,0]=4 18727 B16R1.1193 CCCCCCCCCCOC1CCCC1 34a_100000210269_100000210320 [0,1,0,1,0,0|1,0,1]=4 18728 B16R1.1193 CCCCCCCCCCOC1CCCC1 34a_100000210711_100000179811 [0,1,0,1,0,0|1,0,1]=4 18729 B16R1.1193 CCCCCCCCCCOC1CCCC1 7a_100000210269_100000210320 [0,1,0,1,0,0|1,0,1]=4 18730 B16R1.1193 CCCCCCCCCCOC1CCCC1 7a_100000210711_100000179811 [0,1,0,1,0,0|1,0,1]=4 18731 B16R1.1193 CCCCCCCCCCOC1CCCO1 34a_100000085407_100000210320 [0,1,0,1,0,0|0,0,2]=4 18732 B16R1.1193 CCCCCCCCCCOC1CCOC1 34a_100000210711_100000690089 [0,1,0,1,0,0|2,0,0]=4 18733 B16R1.1193 CCCCCCCCCCOC1CCOC1 7a_100000210711_100000731011 [0,1,0,1,0,0|2,0,0]=4 18734 B16R1.1193 CCCCCCCCCCOC1CCSC1 7a_100011232664_100000210320 [0,1,0,1,0,0|2,0,0]=4 18735 B16R1.1193 CCCCCCCCCCO[C@H]1CCOC1 34a_100000717292_100000210320 [0,1,0,1,0,0|2,0,0]=4 18736 B16R1.1193 CCCCCCCCCCSC1CCCC1 62a_100011217020_100000210320 [0,1,0,1,0,0|1,0,1]=4 18737 B16R1.1193 CCCCCCCCCNCC1CCCC1 2230a_100000212291_100000740388 [0,1,0,1,0,0|1,0,1]=4 18738 B16R1.1193 CCCCCCCCCNCC1CCCC1 2230a_100000737975_100011214924 [0,1,0,1,0,0|1,0,1]=4 18739 B16R1.1193 CCCCCCCCCNCC1CCCC1 269862a_100000212291_100000746403 [0,1,0,1,0,0|1,0,1]=4 18740 B16R1.1193 CCCCCCCCCNCC1CCCC1 34a_100000212291_100000740388 [0,1,0,1,0,0|1,0,1]=4 18741 B16R1.1193 CCCCCCCCCNCC1CCCC1 34a_100000737975_100011214924 [0,1,0,1,0,0|1,0,1]=4 18742 B16R1.1193 CCCCCCCCCNCC1CCCO1 2230a_100000212291_100000203698 [0,1,0,1,0,0|0,0,2]=4 18743 B16R1.1193 CCCCCCCCCNCC1CCOC1 2230a_100000212291_100000702531 [0,1,0,1,0,0|2,0,0]=4 18744 B16R1.1193 CCCCCCCCCNCC1CCOC1 2230a_100000737293_100011214924 [0,1,0,1,0,0|2,0,0]=4 18745 B16R1.1193 CCCCCCCCCNCC1CCOC1 34a_100000212291_100011261433 [0,1,0,1,0,0|2,0,0]=4 18746 B16R1.1193 CCCCCCCCCNCC1CCOC1 34a_100000737293_100011214924 [0,1,0,1,0,0|2,0,0]=4 18747 B16R1.1193 CCCCCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100011214924 [0,1,0,1,0,0|0,0,2]=4 18748 B16R1.1193 CCCCCCCCCNC[C@@H]1CCCO1 34a_100020590478_100011214924 [0,1,0,1,0,0|0,0,2]=4 18749 B16R1.1193 CCCCCCCCCOCC1CC=CC1 34a_100000688395_100011214924 [0,1,0,1,0,0|1,0,1]=4 18750 B16R1.1193 CCCCCCCCCOCC1CCCC1 34a_100000210712_100000740388 [0,1,0,1,0,0|1,0,1]=4 18751 B16R1.1193 CCCCCCCCCOCC1CCCC1 34a_100000742336_100011214924 [0,1,0,1,0,0|1,0,1]=4 18752 B16R1.1193 CCCCCCCCCOCC1CCCC1 7a_100000210712_100000740388 [0,1,0,1,0,0|1,0,1]=4 18753 B16R1.1193 CCCCCCCCCOCC1CCCC1 7a_100000742336_100000210328 [0,1,0,1,0,0|1,0,1]=4 18754 B16R1.1193 CCCCCCCCCOCC1CCCO1 34a_100000210270_100011214924 [0,1,0,1,0,0|0,0,2]=4 18755 B16R1.1193 CCCCCCCCCOCC1CCCO1 7a_100000210270_100000210328 [0,1,0,1,0,0|0,0,2]=4 18756 B16R1.1193 CCCCCCCCCOCC1CCCO1 7a_100000210712_100000203698 [0,1,0,1,0,0|0,0,2]=4 18757 B16R1.1193 CCCCCCCCCOCC1CCNC1 34a_100000748654_100011214924 [0,1,0,1,0,0|2,0,0]=4 18758 B16R1.1193 CCCCCCCCCOCC1CCOC1 34a_100000210712_100011261433 [0,1,0,1,0,0|2,0,0]=4 18759 B16R1.1193 CCCCCCCCCOCC1CCOC1 34a_100000740260_100011214924 [0,1,0,1,0,0|2,0,0]=4 18760 B16R1.1193 CCCCCCCCCOCC1CCOC1 7a_100000210712_100000702531 [0,1,0,1,0,0|2,0,0]=4 18761 B16R1.1193 CCCCCCCCCOC[C@H]1CCCN1 34a_100000745186_100011214924 [0,1,0,1,0,0|1,0,1]=4 18762 B16R1.1193 CCCCCCCCCSCC1CCCC1 62a_100000740388_100000210670 [0,1,0,1,0,0|1,0,1]=4 18763 B16R1.1193 CCCCCCCCCSCC1CCCO1 62a_100000203698_100000210670 [0,1,0,1,0,0|0,0,2]=4 18764 B16R1.1193 CCCCCCCCCSCC1CCOC1 62a_100000702531_100000210670 [0,1,0,1,0,0|2,0,0]=4 18765 B16R1.1193 CCCCCCCCNCCC1CCCC1 2230a_100000229939_100000760354 [0,1,0,1,0,0|1,0,1]=4 18766 B16R1.1193 CCCCCCCCNCCC1CCCC1 2230a_100000739158_100000210759 [0,1,0,1,0,0|1,0,1]=4 18767 B16R1.1193 CCCCCCCCNCCC1CCCC1 34a_100000229939_100000760354 [0,1,0,1,0,0|1,0,1]=4 18768 B16R1.1193 CCCCCCCCNCCC1CCCC1 34a_100000739158_100000210759 [0,1,0,1,0,0|1,0,1]=4 18769 B16R1.1193 CCCCCCCCOCCC1CCCC1 34a_100000210232_100000760354 [0,1,0,1,0,0|1,0,1]=4 18770 B16R1.1193 CCCCCCCCOCCC1CCCC1 34a_100000749090_100000210759 [0,1,0,1,0,0|1,0,1]=4 18771 B16R1.1193 CCCCCCCCOCCC1CCCC1 7a_100000210232_100000760354 [0,1,0,1,0,0|1,0,1]=4 18772 B16R1.1193 CCCCCCCCOCCC1CCCC1 7a_100000749090_100000210759 [0,1,0,1,0,0|1,0,1]=4 18773 B16R1.1193 CCCCCCCCOCCC1CCNC1 34a_100016987287_100000210759 [0,1,0,1,0,0|2,0,0]=4 18774 B16R1.1193 CCCCCCCCOCCC1CCOC1 34a_100011879284_100000210759 [0,1,0,1,0,0|2,0,0]=4 18775 B16R1.1193 CCCCCCCCSCCC1CCCC1 62a_100000210759_100000760354 [0,1,0,1,0,0|1,0,1]=4 18776 B16R1.1193 CCCCCCCCSCCC1CCCC1 62a_100000760354_100000210317 [0,1,0,1,0,0|1,0,1]=4 18777 B16R1.1193 CCCCCCCNCCCC1CCCC1 2230a_100000229938_100011713738 [0,1,0,1,0,0|1,0,1]=4 18778 B16R1.1193 CCCCCCCNCCCC1CCCC1 2230a_100000736752_100000210681 [0,1,0,1,0,0|1,0,1]=4 18779 B16R1.1193 CCCCCCCNCCCC1CCCC1 34a_100000736752_100000210614 [0,1,0,1,0,0|1,0,1]=4 18780 B16R1.1193 CCCCCCCOCCCC1CCCC1 34a_100000210272_100011713738 [0,1,0,1,0,0|1,0,1]=4 18781 B16R1.1193 CCCCCCCOCCCC1CCCC1 34a_100011215328_100000210614 [0,1,0,1,0,0|1,0,1]=4 18782 B16R1.1193 CCCCCCCOCCCC1CCCC1 7a_100000210272_100011713738 [0,1,0,1,0,0|1,0,1]=4 18783 B16R1.1193 CCCCCCCOCCCC1CCCC1 7a_100011215328_100000210614 [0,1,0,1,0,0|1,0,1]=4 18784 B16R1.1193 CCCCCCCSCCCC1CCCC1 62a_100000210614_100011713738 [0,1,0,1,0,0|1,0,1]=4 18785 B16R1.1193 CCCCCCCSCCCC1CCCC1 62a_100011713738_100000210316 [0,1,0,1,0,0|1,0,1]=4 18786 B16R1.1193 CNCCCCCOCCCC1CCCC1 34a_100000722520_100011713738 [0,1,0,1,0,0|2,0,0]=4 18787 B16R1.1193 COCCCCCCNCCC1CCCC1 2230a_100000739158_100011998445 [0,1,0,1,0,0|2,0,0]=4 18788 B16R1.1193 COCCCCCCNCCC1CCCC1 34a_100000739158_100011998445 [0,1,0,1,0,0|2,0,0]=4 18789 B16R1.1193 COCCCCCCOCCC1CCCC1 34a_100000749090_100011998445 [0,1,0,1,0,0|2,0,0]=4 18790 B16R1.1193 COCCCCCCOCCC1CCCC1 34a_200012092642_100000760354 [0,1,0,1,0,0|2,0,0]=4 18791 B16R1.1193 COCCCCCCOCCC1CCCC1 7a_100000749090_100011998445 [0,1,0,1,0,0|2,0,0]=4 18792 B16R1.1193 COCCCCCCOCCC1CCCC1 7a_200012092642_100000760354 [0,1,0,1,0,0|2,0,0]=4 18793 B16R1.1193 COCCCCCCSCCC1CCCC1 62a_100000760354_100011998445 [0,1,0,1,0,0|2,0,0]=4 18794 B16R1.1193 COCCCCCCSCCC1CCCC1 62a_100011998445_100000760354 [0,1,0,1,0,0|2,0,0]=4 18795 B16R1.1193 COCCCCCNCCCC1CCCC1 2230a_100000747528_100011713738 [0,1,0,1,0,0|2,0,0]=4 18796 B16R1.1193 COCCCCCNCCCC1CCCC1 34a_100000747528_100011713738 [0,1,0,1,0,0|2,0,0]=4 18797 B16R1.1193 ClCCCCCCCCCOC1CCCC1 34a_100009868337_100000179811 [0,1,0,1,0,0|1,0,1]=4 18798 B16R1.1193 ClCCCCCCCCCOC1CCCC1 7a_100009868337_100000179811 [0,1,0,1,0,0|1,0,1]=4 18799 B16R1.1193 ClCCCCCCCCOCC1CCCC1 34a_100000033203_100000740388 [0,1,0,1,0,0|1,0,1]=4 18800 B16R1.1193 ClCCCCCCCCOCC1CCCC1 7a_100000033203_100000740388 [0,1,0,1,0,0|1,0,1]=4 18801 B16R1.1193 ClCCCCCCOCCCC1CCCC1 34a_100000766143_100011713738 [0,1,0,1,0,0|1,0,1]=4 18802 B16R1.1193 ClCCCCCCOCCCC1CCCC1 7a_100000766143_100011713738 [0,1,0,1,0,0|1,0,1]=4 18803 B16R1.1193 FCCCCCCNCCCC1CCCC1 2230a_100000736752_100015922095 [0,1,0,1,0,0|1,0,1]=4 18804 B16R1.1193 FCCCCCCNCCCC1CCCC1 34a_100000736752_100015922095 [0,1,0,1,0,0|1,0,1]=4 18805 B16R1.1193 FCCCCCCOCCCC1CCCC1 34a_100000732779_100011713738 [0,1,0,1,0,0|1,0,1]=4 18806 B16R1.1193 FCCCCCCOCCCC1CCCC1 34a_100011215328_100015922095 [0,1,0,1,0,0|1,0,1]=4 18807 B16R1.1193 FCCCCCCOCCCC1CCCC1 7a_100000732779_100011713738 [0,1,0,1,0,0|1,0,1]=4 18808 B16R1.1193 FCCCCCCOCCCC1CCCC1 7a_100011215328_100015922095 [0,1,0,1,0,0|1,0,1]=4 18809 B16R1.1193 FCCCCCCSCCCC1CCCC1 62a_100011713738_100015922095 [0,1,0,1,0,0|1,0,1]=4 18810 B16R1.1193 FCCCCCCSCCCC1CCCC1 62a_100015922095_100011713738 [0,1,0,1,0,0|1,0,1]=4 18811 B16R1.1193 N#CCCCCCCNCCC1CCCC1 2230a_100000739158_100009813337 [0,1,0,1,0,0|1,0,1]=4 18812 B16R1.1193 N#CCCCCCCOCCC1CCCC1 7a_100000749090_100009813337 [0,1,0,1,0,0|1,0,1]=4 18813 B16R1.1193 N#CCCCCCCSCCC1CCCC1 62a_100000760354_100009813337 [0,1,0,1,0,0|1,0,1]=4 18814 B16R1.1193 N#CCCCCCCSCCC1CCCC1 62a_100009813337_100000760354 [0,1,0,1,0,0|1,0,1]=4 18815 B16R1.1193 N#CCCCCCNCCCC1CCCC1 2230a_100000736752_100009813376 [0,1,0,1,0,0|1,0,1]=4 18816 B16R1.1193 N#CCCCCCOCCCC1CCCC1 7a_100011215328_100009813376 [0,1,0,1,0,0|1,0,1]=4 18817 B16R1.1193 N#CCCCCCSCCCC1CCCC1 62a_100009813376_100011713738 [0,1,0,1,0,0|1,0,1]=4 18818 B16R1.1193 N#CCCCCCSCCCC1CCCC1 62a_100011713738_100009813376 [0,1,0,1,0,0|1,0,1]=4 18819 B16R1.1193 NCCCCCCCCCOC1CCCC1 34a_100000078944_100000179811 [0,1,0,1,0,0|1,0,1]=4 18820 B16R1.1193 NCCCCCCCCOCC1CCCC1 34a_102515433106_100000740388 [0,1,0,1,0,0|1,0,1]=4 18821 B16R1.1193 NCCCCCCCOCCC1CCCC1 34a_100011996573_100000760354 [0,1,0,1,0,0|1,0,1]=4 18822 B16R1.1193 NCCCCCCOCCCC1CCCC1 34a_100000686447_100011713738 [0,1,0,1,0,0|1,0,1]=4 18823 B16R1.1193 O=CCCCCCNCCCC1CCCC1 2230a_100000736752_100000139337 [0,1,0,1,0,0|0,0,0]=2 18824 B16R1.1193 O=CCCCCCOCCCC1CCCC1 7a_100011215328_100000139337 [0,1,0,1,0,0|0,0,0]=2 18825 B16R1.1193 O=CCCCCCOCCCC1OCCO1 7a_100009871617_100000139337 [0,1,0,1,0,0|2,0,0]=4 18826 B16R1.1193 O=CCCCCCOCCOC1CCCC1 7a_100000738311_100000139337 [0,1,0,1,0,0|1,0,0]=3 18827 B16R1.1193 O=CCCCCCSCCCC1CCCC1 62a_100000139337_100011713738 [0,1,0,1,0,0|0,0,0]=2 18828 B16R1.1193 O=CCCCCCSCCCC1CCCC1 62a_100011713738_100000139337 [0,1,0,1,0,0|0,0,0]=2 18829 B16R1.1193 O=CCCCCCSCCCC1OCCO1 62a_100000139337_100000042513 [0,1,0,1,0,0|2,0,0]=4 18830 B16R1.1193 O=CCCCCCSCCCN1CCCC1 62a_100000139337_100011445909 [0,1,0,1,0,0|1,0,0]=3 18831 B16R1.1193 O=CCCCCCSCCCN1CCCC1 62a_100016991639_100000139337 [0,1,0,1,0,0|1,0,0]=3 18832 B16R1.1193 O=CCCCCSCCCCC1OCCO1 62a_100000139335_100000034956 [0,1,0,1,0,0|2,0,0]=4 18833 B16R1.1193 O=CCCCOCCCCOC1CCCO1 7a_100011018183_200011292268 [0,1,0,1,0,0|2,0,0]=4 18834 B16R1.1193 OCCCCCCCCCCN1CCCC1 2230a_100000188435_100009813290 [0,1,0,1,0,0|0,0,2]=4 18835 B16R1.1193 OCCCCCCCCCCN1CCCC1 269982a_100000188435_100009813290 [0,1,0,1,0,0|0,0,2]=4 18836 B16R1.1193 OCCCCCCCCCNC1CCCC1 2230a_100000078944_100000179811 [0,1,0,1,0,0|0,0,2]=4 18837 B16R1.1193 OCCCCCCCCCNC1CCCC1 2230a_100000211070_100009813782 [0,1,0,1,0,0|0,0,2]=4 18838 B16R1.1193 OCCCCCCCCCNC1CCCC1 270004a_100000078944_100000210133 [0,1,0,1,0,0|0,0,2]=4 18839 B16R1.1193 OCCCCCCCCCNC1CCCC1 34a_100000078944_100000179811 [0,1,0,1,0,0|0,0,2]=4 18840 B16R1.1193 OCCCCCCCCCNC1CCCC1 34a_100000211070_100009813782 [0,1,0,1,0,0|0,0,2]=4 18841 B16R1.1193 OCCCCCCCCCOC1CCCC1 34a_100000210269_100009813782 [0,1,0,1,0,0|0,0,2]=4 18842 B16R1.1193 OCCCCCCCCCOC1CCCC1 7a_100000210269_100009813782 [0,1,0,1,0,0|0,0,2]=4 18843 B16R1.1193 OCCCCCCCCCSC1CCCC1 62a_100009813782_100000179811 [0,1,0,1,0,0|0,0,2]=4 18844 B16R1.1193 OCCCCCCCCCSC1CCCC1 62a_100011217020_100009813782 [0,1,0,1,0,0|0,0,2]=4 18845 B16R1.1193 OCCCCCCCCNCC1CCCC1 2230a_100000737975_100000033203 [0,1,0,1,0,0|0,0,2]=4 18846 B16R1.1193 OCCCCCCCCNCC1CCCC1 2230a_102515433106_100000740388 [0,1,0,1,0,0|0,0,2]=4 18847 B16R1.1193 OCCCCCCCCNCC1CCCC1 269862a_102515433106_100000746403 [0,1,0,1,0,0|0,0,2]=4 18848 B16R1.1193 OCCCCCCCCNCC1CCCC1 34a_100000737975_100000033203 [0,1,0,1,0,0|0,0,2]=4 18849 B16R1.1193 OCCCCCCCCNCC1CCCC1 34a_102515433106_100000740388 [0,1,0,1,0,0|0,0,2]=4 18850 B16R1.1193 OCCCCCCCCOCC1CCCC1 34a_100000742336_100000033203 [0,1,0,1,0,0|0,0,2]=4 18851 B16R1.1193 OCCCCCCCCOCC1CCCC1 7a_100000742336_100000033203 [0,1,0,1,0,0|0,0,2]=4 18852 B16R1.1193 OCCCCCCCCSCC1CCCC1 62a_100000033203_100000740388 [0,1,0,1,0,0|0,0,2]=4 18853 B16R1.1193 OCCCCCCCCSCC1CCCC1 62a_100000740388_100000033203 [0,1,0,1,0,0|0,0,2]=4 18854 B16R1.1193 OCCCCCCCNCCC1CCCC1 2230a_100000739158_100000760002 [0,1,0,1,0,0|0,0,2]=4 18855 B16R1.1193 OCCCCCCCNCCC1CCCC1 2230a_100011996573_100000760354 [0,1,0,1,0,0|0,0,2]=4 18856 B16R1.1193 OCCCCCCCNCCC1CCCC1 34a_100000739158_100000760002 [0,1,0,1,0,0|0,0,2]=4 18857 B16R1.1193 OCCCCCCCNCCC1CCCC1 34a_100011996573_100000760354 [0,1,0,1,0,0|0,0,2]=4 18858 B16R1.1193 OCCCCCCCOCCC1CCCC1 34a_100000749090_100000760002 [0,1,0,1,0,0|0,0,2]=4 18859 B16R1.1193 OCCCCCCCOCCC1CCCC1 7a_100000749090_100000760002 [0,1,0,1,0,0|0,0,2]=4 18860 B16R1.1193 OCCCCCCCSCCC1CCCC1 62a_100000760002_100000760354 [0,1,0,1,0,0|0,0,2]=4 18861 B16R1.1193 OCCCCCCCSCCC1CCCC1 62a_100000760354_100000760002 [0,1,0,1,0,0|0,0,2]=4 18862 B16R1.1193 OCCCCCCNCCCC1CCCC1 2230a_100000686447_100011713738 [0,1,0,1,0,0|0,0,2]=4 18863 B16R1.1193 OCCCCCCNCCCC1CCCC1 2230a_100000736752_100000766143 [0,1,0,1,0,0|0,0,2]=4 18864 B16R1.1193 OCCCCCCNCCCC1CCCC1 34a_100000686447_100011713738 [0,1,0,1,0,0|0,0,2]=4 18865 B16R1.1193 OCCCCCCNCCCC1CCCC1 34a_100000736752_100000766143 [0,1,0,1,0,0|0,0,2]=4 18866 B16R1.1193 OCCCCCCOCCCC1CCCC1 34a_100011215328_100000766143 [0,1,0,1,0,0|0,0,2]=4 18867 B16R1.1193 OCCCCCCOCCCC1CCCC1 7a_100011215328_100000766143 [0,1,0,1,0,0|0,0,2]=4 18868 B16R1.1193 OCCCCCCSCCCC1CCCC1 62a_100000766143_100011713738 [0,1,0,1,0,0|0,0,2]=4 18869 B16R1.1193 OCCCCCCSCCCC1CCCC1 62a_100011713738_100000766143 [0,1,0,1,0,0|0,0,2]=4 18870 B16R1.1218 C#CCCCCCCCN1CCCCC1C 2230a_100000211376_100153394163 [0,1,0,1,0,0|1,0,1]=4 18871 B16R1.1218 C#CCCCCCCCN1CCCCC1C 269982a_100000211376_100153394163 [0,1,0,1,0,0|1,0,1]=4 18872 B16R1.1218 C#CCCCCCCCN1CCCCC1C 34a_100000211376_100153394163 [0,1,0,1,0,0|1,0,1]=4 18873 B16R1.1218 C#CCCCCCCNC1CCCCC1C 2230a_100000211402_100012276617 [0,1,0,1,0,0|1,0,1]=4 18874 B16R1.1218 C#CCCCCCCNC1CCCCC1C 34a_100000211402_100012276617 [0,1,0,1,0,0|1,0,1]=4 18875 B16R1.1218 C#CCCCCCCOC1CCCCC1=O 34a_100011214950_100012276617 [0,1,0,1,0,0|0,0,2]=4 18876 B16R1.1218 C#CCCCCCCOC1CCCCC1=O 34a_100011217361_100000754470 [0,1,0,1,0,0|0,0,2]=4 18877 B16R1.1218 C#CCCCCCCOC1CCCCC1=O 7a_100011217361_100000204591 [0,1,0,1,0,0|0,0,2]=4 18878 B16R1.1218 C#CCCCCCCOC1CCCCC1C 34a_100000211207_100012276617 [0,1,0,1,0,0|1,0,1]=4 18879 B16R1.1218 C#CCCCCCCOC1CCCCC1C 7a_100000211207_100012276617 [0,1,0,1,0,0|1,0,1]=4 18880 B16R1.1218 C#CCCCCCCSC1CCCCC1=O 62a_100000204591_100012276617 [0,1,0,1,0,0|0,0,2]=4 18881 B16R1.1218 C#CCCCCCCSC1CCCCC1=O 62a_100012276617_100000204591 [0,1,0,1,0,0|0,0,2]=4 18882 B16R1.1218 C#CCCCCCOCC1CCCCC1=O 34a_100009861125_100012094781 [0,1,0,1,0,0|0,0,2]=4 18883 B16R1.1218 C#CCCCCCOCC1CCCCC1=O 7a_100009861125_100012094781 [0,1,0,1,0,0|0,0,2]=4 18884 B16R1.1218 C=CCCCCCCCN1CCCCC1C 2230a_100000211376_100012355270 [0,1,0,1,0,0|1,0,0]=3 18885 B16R1.1218 C=CCCCCCCCN1CCCCC1C 269982a_100000211376_100012355270 [0,1,0,1,0,0|1,0,0]=3 18886 B16R1.1218 C=CCCCCCCCN1CCCCC1C 34a_100000211376_100012355270 [0,1,0,1,0,0|1,0,0]=3 18887 B16R1.1218 C=CCCCCCCCN1CCOC[C@@H]1C 2230a_100009815349_100012355270 [0,1,0,1,0,0|2,0,0]=4 18888 B16R1.1218 C=CCCCCCCCN1CCOC[C@@H]1C 269982a_100009815349_100012355270 [0,1,0,1,0,0|2,0,0]=4 18889 B16R1.1218 C=CCCCCCCCN1CCOC[C@@H]1C 34a_100009815349_100012355270 [0,1,0,1,0,0|2,0,0]=4 18890 B16R1.1218 C=CCCCCCCNC1CCCCC1C 2230a_100000211402_100011215473 [0,1,0,1,0,0|1,0,0]=3 18891 B16R1.1218 C=CCCCCCCNC1CCCCC1C 34a_100000211402_100011215473 [0,1,0,1,0,0|1,0,0]=3 18892 B16R1.1218 C=CCCCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100011215473 [0,1,0,1,0,0|2,0,0]=4 18893 B16R1.1218 C=CCCCCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100011215473 [0,1,0,1,0,0|2,0,0]=4 18894 B16R1.1218 C=CCCCCCCOC1CCCCC1=O 34a_100011214950_100011215473 [0,1,0,1,0,0|0,0,2]=4 18895 B16R1.1218 C=CCCCCCCOC1CCCCC1=O 34a_200011216477_100000754470 [0,1,0,1,0,0|0,0,2]=4 18896 B16R1.1218 C=CCCCCCCOC1CCCCC1=O 7a_200011216477_100000204591 [0,1,0,1,0,0|0,0,2]=4 18897 B16R1.1218 C=CCCCCCCOC1CCCCC1C 34a_100000211207_100011215473 [0,1,0,1,0,0|1,0,0]=3 18898 B16R1.1218 C=CCCCCCCOC1CCCCC1C 7a_100000211207_100011215473 [0,1,0,1,0,0|1,0,0]=3 18899 B16R1.1218 C=CCCCCCCOC1CCCCC1Cl 34a_100000038908_100011215473 [0,1,0,1,0,0|2,0,0]=4 18900 B16R1.1218 C=CCCCCCCOC1CCCCC1Cl 7a_100000038908_100011215473 [0,1,0,1,0,0|2,0,0]=4 18901 B16R1.1218 C=CCCCCCCOC1CCCCC1F 34a_200011216477_100015423560 [0,1,0,1,0,0|2,0,0]=4 18902 B16R1.1218 C=CCCCCCCOC1CCCCC1O 34a_200011216477_100000038908 [0,1,0,1,0,0|2,0,0]=4 18903 B16R1.1218 C=CCCCCCCOC1CCNCC1C 34a_100011998114_100011215473 [0,1,0,1,0,0|2,0,0]=4 18904 B16R1.1218 C=CCCCCCCOC1CNCCC1C 34a_100000696640_100011215473 [0,1,0,1,0,0|2,0,0]=4 18905 B16R1.1218 C=CCCCCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100011215473 [0,1,0,1,0,0|2,0,0]=4 18906 B16R1.1218 C=CCCCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100011215473 [0,1,0,1,0,0|2,0,0]=4 18907 B16R1.1218 C=CCCCCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100011215473 [0,1,0,1,0,0|2,0,0]=4 18908 B16R1.1218 C=CCCCCCCSC1CCCCC1=O 62a_100000204591_100011215473 [0,1,0,1,0,0|0,0,2]=4 18909 B16R1.1218 C=CCCCCCCSC1CCCCC1=O 62a_100011215473_100000204591 [0,1,0,1,0,0|0,0,2]=4 18910 B16R1.1218 C=CCCCCCCSC1CCCCC1F 62a_100011215473_100015423560 [0,1,0,1,0,0|2,0,0]=4 18911 B16R1.1218 C=CCCCCCCSC1CCCCC1F 62a_100015423560_100011215473 [0,1,0,1,0,0|2,0,0]=4 18912 B16R1.1218 C=CCCCCCCSC1CCCCC1O 62a_100000038908_100011215473 [0,1,0,1,0,0|2,0,0]=4 18913 B16R1.1218 C=CCCCCCCSC1CCCCC1O 62a_100011215473_100000038908 [0,1,0,1,0,0|2,0,0]=4 18914 B16R1.1218 C=CCCCCCNCC1CCCCC1O 34a_100011216029_100000700193 [0,1,0,1,0,0|2,0,0]=4 18915 B16R1.1218 C=CCCCCCNCC1CCCCN1C 34a_100011228421_100000700193 [0,1,0,1,0,0|2,0,0]=4 18916 B16R1.1218 C=CCCCCCOCC1CCCCC1=O 34a_100009861125_100000700193 [0,1,0,1,0,0|0,0,2]=4 18917 B16R1.1218 C=CCCCCCOCC1CCCCC1=O 7a_100009861125_100000700193 [0,1,0,1,0,0|0,0,2]=4 18918 B16R1.1218 C=CCCCCCOCC1CCCCN1C 34a_100000225079_100000700193 [0,1,0,1,0,0|2,0,0]=4 18919 B16R1.1218 C=CCCCCCOCC1CCCCN1C 34a_100011216702_100015186950 [0,1,0,1,0,0|2,0,0]=4 18920 B16R1.1218 C=CCCCCCOCC1CCCCN1C 7a_100011216702_100015185383 [0,1,0,1,0,0|2,0,0]=4 18921 B16R1.1218 C=CCCCCCSCC1CCCCN1C 62a_100000700193_100015185383 [0,1,0,1,0,0|2,0,0]=4 18922 B16R1.1218 C=CCCCCCSCC1CCCCN1C 62a_100015185383_100000700193 [0,1,0,1,0,0|2,0,0]=4 18923 B16R1.1218 C=CCCCCNCCC1CCCCN1C 2230a_100000703577_100000211948 [0,1,0,1,0,0|2,0,0]=4 18924 B16R1.1218 C=CCCCCNCCC1CCCCN1C 34a_100000703577_100000211948 [0,1,0,1,0,0|2,0,0]=4 18925 B16R1.1218 C=CCCCCNCCN1CCCCC1C 2230a_100000739827_100011215482 [0,1,0,1,0,0|2,0,0]=4 18926 B16R1.1218 C=CCCCCNCCN1CCCCC1C 34a_100000739827_100011215482 [0,1,0,1,0,0|2,0,0]=4 18927 B16R1.1218 C=CCCCCOCCC1CCCCN1C 34a_100000766645_100000211948 [0,1,0,1,0,0|2,0,0]=4 18928 B16R1.1218 C=CCCCCOCCC1CCCCN1C 7a_100000766645_100000211948 [0,1,0,1,0,0|2,0,0]=4 18929 B16R1.1218 C=CCCCCOCCN1CCCCC1C 34a_100011305533_100011215482 [0,1,0,1,0,0|2,0,0]=4 18930 B16R1.1218 C=CCCCCSCCC1CCCCN1C 62a_100000211948_100011215482 [0,1,0,1,0,0|2,0,0]=4 18931 B16R1.1218 C=CCCCCSCCC1CCCCN1C 62a_100011215482_100000211948 [0,1,0,1,0,0|2,0,0]=4 18932 B16R1.1218 C=CCCCNCCCN1CCCCC1C 34a_100000212276_100000757094 [0,1,0,1,0,0|2,0,0]=4 18933 B16R1.1218 C=CCCCOCCCN1CCCCC1C 34a_100000213889_100000757094 [0,1,0,1,0,0|2,0,0]=4 18934 B16R1.1218 C=CCCCOCCCN1CCCCC1C 7a_100000213889_100000757094 [0,1,0,1,0,0|2,0,0]=4 18935 B16R1.1218 CC/C=C\CCCCOC1CCCCC1=O 34a_100016287862_100000754470 [0,1,0,1,0,0|0,0,2]=4 18936 B16R1.1218 CC/C=C\CCCCOC1CCCCC1=O 7a_100016287862_100000204591 [0,1,0,1,0,0|0,0,2]=4 18937 B16R1.1218 CC1CCCCC1NCCCCCCC#N 2230a_100000211402_100009813337 [0,1,0,1,0,0|1,0,1]=4 18938 B16R1.1218 CC1CCCCC1NCCCCCCCO 2230a_100000211402_100000760002 [0,1,0,1,0,0|0,0,2]=4 18939 B16R1.1218 CC1CCCCC1NCCCCCCCO 269862a_100011996573_100000210921 [0,1,0,1,0,0|0,0,2]=4 18940 B16R1.1218 CC1CCCCC1NCCCCCCCO 270004a_100011996573_100000210921 [0,1,0,1,0,0|0,0,2]=4 18941 B16R1.1218 CC1CCCCC1NCCCCCCCO 34a_100000211402_100000760002 [0,1,0,1,0,0|0,0,2]=4 18942 B16R1.1218 CC1CCCCC1OCCCCCCC#N 7a_100000211207_100009813337 [0,1,0,1,0,0|1,0,1]=4 18943 B16R1.1218 CC1CCCCC1OCCCCCCCO 34a_100000211207_100000760002 [0,1,0,1,0,0|0,0,2]=4 18944 B16R1.1218 CC1CCCCC1OCCCCCCCO 7a_100000211207_100000760002 [0,1,0,1,0,0|0,0,2]=4 18945 B16R1.1218 CC1CCCCN1CCCCCCCCO 2230a_100000211376_100000033203 [0,1,0,1,0,0|0,0,2]=4 18946 B16R1.1218 CC1CCCCN1CCCCCCCCO 269982a_100000211376_100000033203 [0,1,0,1,0,0|0,0,2]=4 18947 B16R1.1218 CC1CCCCN1CCCCCCCCO 34a_100000211376_100000033203 [0,1,0,1,0,0|0,0,2]=4 18948 B16R1.1218 CC1CCCCN1CCCOCCCC=O 7a_100000213889_200011292268 [0,1,0,1,0,0|1,0,0]=3 18949 B16R1.1218 CC1CCCCN1CCNCCCCC=O 2230a_100000739827_100000139335 [0,1,0,1,0,0|1,0,0]=3 18950 B16R1.1218 CCCC/C=C\CCOC1CCCCC1=O 34a_200016286491_100000754470 [0,1,0,1,0,0|0,0,2]=4 18951 B16R1.1218 CCCC/C=C\CCOC1CCCCC1=O 7a_200016286491_100000204591 [0,1,0,1,0,0|0,0,2]=4 18952 B16R1.1218 CCCCC#CCCOC1CCCCC1=O 34a_100000037610_100000754470 [0,1,0,1,0,0|0,0,2]=4 18953 B16R1.1218 CCCCC#CCCOC1CCCCC1=O 7a_100000037610_100000204591 [0,1,0,1,0,0|0,0,2]=4 18954 B16R1.1218 CCCCC/C=C/COC1CCCCC1=O 34a_100016258190_100000754470 [0,1,0,1,0,0|0,0,2]=4 18955 B16R1.1218 CCCCC/C=C/COC1CCCCC1=O 7a_100016258190_100000204591 [0,1,0,1,0,0|0,0,2]=4 18956 B16R1.1218 CCCCCC#CCOC1CCCCC1=O 34a_100011214950_100009816472 [0,1,0,1,0,0|0,0,2]=4 18957 B16R1.1218 CCCCCC#CCOC1CCCCC1=O 34a_200000033628_100000754470 [0,1,0,1,0,0|0,0,2]=4 18958 B16R1.1218 CCCCCC#CCOC1CCCCC1=O 7a_200000033628_100000204591 [0,1,0,1,0,0|0,0,2]=4 18959 B16R1.1218 CCCCCC#CCSC1CCCCC1=O 62a_100000204591_100009816472 [0,1,0,1,0,0|0,0,2]=4 18960 B16R1.1218 CCCCCC#CCSC1CCCCC1=O 62a_100009816472_100000204591 [0,1,0,1,0,0|0,0,2]=4 18961 B16R1.1218 CCCCCCCCCN1CCCCC1C 2230a_100000211376_100011214924 [0,1,0,1,0,0|1,0,1]=4 18962 B16R1.1218 CCCCCCCCCN1CCCCC1C 269982a_100000211376_100000210670 [0,1,0,1,0,0|1,0,1]=4 18963 B16R1.1218 CCCCCCCCCN1CCCCC1C 34a_100000211376_100011214924 [0,1,0,1,0,0|1,0,1]=4 18964 B16R1.1218 CCCCCCCCNC1CCCCC1=O 34a_100000229939_100000754470 [0,1,0,1,0,0|0,0,0]=2 18965 B16R1.1218 CCCCCCCCNC1CCCCC1C 2230a_100000211402_100000210759 [0,1,0,1,0,0|1,0,1]=4 18966 B16R1.1218 CCCCCCCCNC1CCCCC1C 269862a_100000229939_100000210921 [0,1,0,1,0,0|1,0,1]=4 18967 B16R1.1218 CCCCCCCCNC1CCCCC1C 270004a_100000229939_100000210921 [0,1,0,1,0,0|1,0,1]=4 18968 B16R1.1218 CCCCCCCCNC1CCCCC1C 34a_100000211402_100000210759 [0,1,0,1,0,0|1,0,1]=4 18969 B16R1.1218 CCCCCCCCNC1CCCCC1F 34a_100000229939_100015423560 [0,1,0,1,0,0|1,0,1]=4 18970 B16R1.1218 CCCCCCCCNC1CCCCC1O 34a_100000229939_100000038908 [0,1,0,1,0,0|0,0,2]=4 18971 B16R1.1218 CCCCCCCCNC1CCCNC1=O 2230a_100000229939_100000687798 [0,1,0,1,0,0|1,0,0]=3 18972 B16R1.1218 CCCCCCCCNC1CCCNC1=O 2230a_100000747585_100000210759 [0,1,0,1,0,0|1,0,0]=3 18973 B16R1.1218 CCCCCCCCNC1CCCNC1=O 34a_100000229939_100000687798 [0,1,0,1,0,0|1,0,0]=3 18974 B16R1.1218 CCCCCCCCNC1CCCNC1=O 34a_100000747585_100000210759 [0,1,0,1,0,0|1,0,0]=3 18975 B16R1.1218 CCCCCCCCNC1COCCC1=O 34a_100000229939_100012180262 [0,1,0,1,0,0|1,0,0]=3 18976 B16R1.1218 CCCCCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000210759 [0,1,0,1,0,0|1,0,1]=4 18977 B16R1.1218 CCCCCCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000210759 [0,1,0,1,0,0|1,0,1]=4 18978 B16R1.1218 CCCCCCCCOC1CCCCC1=O 34a_100000210232_100000754470 [0,1,0,1,0,0|0,0,0]=2 18979 B16R1.1218 CCCCCCCCOC1CCCCC1=O 34a_100011214950_100000210759 [0,1,0,1,0,0|0,0,0]=2 18980 B16R1.1218 CCCCCCCCOC1CCCCC1=O 7a_100000210232_100000204591 [0,1,0,1,0,0|0,0,0]=2 18981 B16R1.1218 CCCCCCCCOC1CCCCC1C 34a_100000211207_100000210759 [0,1,0,1,0,0|1,0,1]=4 18982 B16R1.1218 CCCCCCCCOC1CCCCC1C 7a_100000211207_100000210759 [0,1,0,1,0,0|1,0,1]=4 18983 B16R1.1218 CCCCCCCCOC1CCCCC1Cl 34a_100000038908_100000210759 [0,1,0,1,0,0|1,0,1]=4 18984 B16R1.1218 CCCCCCCCOC1CCCCC1Cl 7a_100000038908_100000210759 [0,1,0,1,0,0|1,0,1]=4 18985 B16R1.1218 CCCCCCCCOC1CCCCC1F 34a_100000210232_100015423560 [0,1,0,1,0,0|1,0,1]=4 18986 B16R1.1218 CCCCCCCCOC1CCCCC1O 34a_100000210232_100000038908 [0,1,0,1,0,0|0,0,2]=4 18987 B16R1.1218 CCCCCCCCOC1CCCNC1=O 34a_100000073722_100000210759 [0,1,0,1,0,0|1,0,0]=3 18988 B16R1.1218 CCCCCCCCOC1CCCNC1=O 34a_100000210232_100000687798 [0,1,0,1,0,0|1,0,0]=3 18989 B16R1.1218 CCCCCCCCOC1CCCNC1=O 7a_100000210232_100000687798 [0,1,0,1,0,0|1,0,0]=3 18990 B16R1.1218 CCCCCCCCOC1COCCC1=O 34a_100000210232_100012180262 [0,1,0,1,0,0|1,0,0]=3 18991 B16R1.1218 CCCCCCCCOC1COCCC1=O 7a_100000210232_100012180262 [0,1,0,1,0,0|1,0,0]=3 18992 B16R1.1218 CCCCCCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000210759 [0,1,0,1,0,0|1,0,1]=4 18993 B16R1.1218 CCCCCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000210759 [0,1,0,1,0,0|1,0,1]=4 18994 B16R1.1218 CCCCCCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000210759 [0,1,0,1,0,0|1,0,1]=4 18995 B16R1.1218 CCCCCCCCSC1CCCCC1=O 62a_100000204591_100000210317 [0,1,0,1,0,0|0,0,0]=2 18996 B16R1.1218 CCCCCCCCSC1CCCCC1=O 62a_100000210759_100000204591 [0,1,0,1,0,0|0,0,0]=2 18997 B16R1.1218 CCCCCCCCSC1CCCCC1F 62a_100000210759_100015423560 [0,1,0,1,0,0|1,0,1]=4 18998 B16R1.1218 CCCCCCCCSC1CCCCC1F 62a_100015423560_100000210317 [0,1,0,1,0,0|1,0,1]=4 18999 B16R1.1218 CCCCCCCCSC1CCCCC1O 62a_100000038908_100000210317 [0,1,0,1,0,0|0,0,2]=4 19000 B16R1.1218 CCCCCCCCSC1CCCCC1O 62a_100000210759_100000038908 [0,1,0,1,0,0|0,0,2]=4 19001 B16R1.1218 CCCCCCCCSC1CCCNC1=O 62a_100000210759_100000687798 [0,1,0,1,0,0|1,0,0]=3 19002 B16R1.1218 CCCCCCCCSC1CCCNC1=O 62a_100000687798_100000210317 [0,1,0,1,0,0|1,0,0]=3 19003 B16R1.1218 CCCCCCCCSC1COCCC1=O 62a_100000210759_100012180262 [0,1,0,1,0,0|1,0,0]=3 19004 B16R1.1218 CCCCCCCCSC1COCCC1=O 62a_100012180262_100000210317 [0,1,0,1,0,0|1,0,0]=3 19005 B16R1.1218 CCCCCCCNCC1CCCCC1O 34a_100011216029_100000210614 [0,1,0,1,0,0|0,0,2]=4 19006 B16R1.1218 CCCCCCCNCC1CCCCN1C 34a_100011228421_100000210614 [0,1,0,1,0,0|2,0,0]=4 19007 B16R1.1218 CCCCCCCOCC1CCCCC1=O 34a_100009861125_100000210614 [0,1,0,1,0,0|0,0,0]=2 19008 B16R1.1218 CCCCCCCOCC1CCCCC1=O 7a_100009861125_100000210614 [0,1,0,1,0,0|0,0,0]=2 19009 B16R1.1218 CCCCCCCOCC1CCCCN1C 34a_100000210272_100015186950 [0,1,0,1,0,0|2,0,0]=4 19010 B16R1.1218 CCCCCCCOCC1CCCCN1C 34a_100000225079_100000210614 [0,1,0,1,0,0|2,0,0]=4 19011 B16R1.1218 CCCCCCCOCC1CCCCN1C 7a_100000210272_100015185383 [0,1,0,1,0,0|2,0,0]=4 19012 B16R1.1218 CCCCCCCSCC1CCCCN1C 62a_100000210614_100015185383 [0,1,0,1,0,0|2,0,0]=4 19013 B16R1.1218 CCCCCCCSCC1CCCCN1C 62a_100015185383_100000210316 [0,1,0,1,0,0|2,0,0]=4 19014 B16R1.1218 CCCCCCNCCC1CCCCN1C 2230a_100000210581_100000211948 [0,1,0,1,0,0|2,0,0]=4 19015 B16R1.1218 CCCCCCNCCN1CCCCC1=O 2230a_100160573077_100000210314 [0,1,0,1,0,0|1,0,0]=3 19016 B16R1.1218 CCCCCCNCCN1CCCCC1=O 34a_100160573077_100000210314 [0,1,0,1,0,0|1,0,0]=3 19017 B16R1.1218 CCCCCCOCCC1CCCCN1C 34a_100000210259_100000211948 [0,1,0,1,0,0|2,0,0]=4 19018 B16R1.1218 CCCCCCOCCC1CCCCN1C 7a_100000210259_100000211948 [0,1,0,1,0,0|2,0,0]=4 19019 B16R1.1218 CCCCCCOCCC1NCCNC1=O 34a_100000044719_100000210314 [0,1,0,1,0,0|2,0,0]=4 19020 B16R1.1218 CCCCCCSCCC1CCCCN1C 62a_100000210314_100000211948 [0,1,0,1,0,0|2,0,0]=4 19021 B16R1.1218 CCCCCCSCCC1CCCCN1C 62a_100000211948_100000210757 [0,1,0,1,0,0|2,0,0]=4 19022 B16R1.1218 CCCCCNCCOC1CCCCC1=O 34a_100000224656_100000754470 [0,1,0,1,0,0|1,0,0]=3 19023 B16R1.1218 CCCCCNCCOC1CCCNC1=O 34a_100000224656_100000687798 [0,1,0,1,0,0|2,0,0]=4 19024 B16R1.1218 CCCCCNCCOC1COCCC1=O 34a_100000224656_100012180262 [0,1,0,1,0,0|2,0,0]=4 19025 B16R1.1218 CCCCCOCCOC1CCCCC1=O 34a_100011215259_100000754470 [0,1,0,1,0,0|1,0,0]=3 19026 B16R1.1218 CCCCCOCCOC1CCCCC1=O 7a_100011215259_100000204591 [0,1,0,1,0,0|1,0,0]=3 19027 B16R1.1218 CCCCCOCCOC1CCCNC1=O 34a_100011215259_100000687798 [0,1,0,1,0,0|2,0,0]=4 19028 B16R1.1218 CCCCCOCCOC1CCCNC1=O 7a_100011215259_100000687798 [0,1,0,1,0,0|2,0,0]=4 19029 B16R1.1218 CCCCCOCCOC1COCCC1=O 34a_100011215259_100012180262 [0,1,0,1,0,0|2,0,0]=4 19030 B16R1.1218 CCCCCOCCOC1COCCC1=O 7a_100011215259_100012180262 [0,1,0,1,0,0|2,0,0]=4 19031 B16R1.1218 CCCCOCCCNC1CCCCC1=O 34a_200000211371_100000754470 [0,1,0,1,0,0|1,0,0]=3 19032 B16R1.1218 CCCCOCCCNC1CCCNC1=O 2230a_200000211371_100000687798 [0,1,0,1,0,0|2,0,0]=4 19033 B16R1.1218 CCCCOCCCNC1CCCNC1=O 34a_200000211371_100000687798 [0,1,0,1,0,0|2,0,0]=4 19034 B16R1.1218 CCCCOCCCNC1COCCC1=O 34a_200000211371_100012180262 [0,1,0,1,0,0|2,0,0]=4 19035 B16R1.1218 CCCCOCCCOC1CCCCC1=O 34a_200011215613_100000754470 [0,1,0,1,0,0|1,0,0]=3 19036 B16R1.1218 CCCCOCCCOC1CCCCC1=O 7a_200011215613_100000204591 [0,1,0,1,0,0|1,0,0]=3 19037 B16R1.1218 CCCCOCCCOC1CCCNC1=O 34a_200011215613_100000687798 [0,1,0,1,0,0|2,0,0]=4 19038 B16R1.1218 CCCCOCCCOC1CCCNC1=O 7a_200011215613_100000687798 [0,1,0,1,0,0|2,0,0]=4 19039 B16R1.1218 CCCCOCCCOC1COCCC1=O 34a_200011215613_100012180262 [0,1,0,1,0,0|2,0,0]=4 19040 B16R1.1218 CCCCOCCCOC1COCCC1=O 7a_200011215613_100012180262 [0,1,0,1,0,0|2,0,0]=4 19041 B16R1.1218 CCCCOCCOCC1CCCCC1=O 34a_100009861125_100000743108 [0,1,0,1,0,0|1,0,0]=3 19042 B16R1.1218 CCCCOCCOCC1CCCCC1=O 7a_100009861125_100000743108 [0,1,0,1,0,0|1,0,0]=3 19043 B16R1.1218 CCCCOCNCCN1CCCCC1=O 2230a_100160573077_100011995733 [0,1,0,1,0,0|2,0,0]=4 19044 B16R1.1218 CCCCOCNCCN1CCCCC1=O 34a_100160573077_100011995733 [0,1,0,1,0,0|2,0,0]=4 19045 B16R1.1218 CCCOCCNCCN1CCCCC1=O 2230a_100160573077_100011215938 [0,1,0,1,0,0|2,0,0]=4 19046 B16R1.1218 CCCOCCNCCN1CCCCC1=O 34a_100160573077_100011215938 [0,1,0,1,0,0|2,0,0]=4 19047 B16R1.1218 CCOCCCNCCN1CCCCC1=O 2230a_100160573077_100012232248 [0,1,0,1,0,0|2,0,0]=4 19048 B16R1.1218 CCOCCCNCCN1CCCCC1=O 34a_100160573077_100012232248 [0,1,0,1,0,0|2,0,0]=4 19049 B16R1.1218 CCOCCOCCNC1CCCCC1=O 34a_100102712874_100000754470 [0,1,0,1,0,0|2,0,0]=4 19050 B16R1.1218 CCOCCOCCOC1CCCCC1=O 34a_100000210240_100000754470 [0,1,0,1,0,0|2,0,0]=4 19051 B16R1.1218 CCOCCOCCOC1CCCCC1=O 34a_100011214950_100011211534 [0,1,0,1,0,0|2,0,0]=4 19052 B16R1.1218 CCOCCOCCOC1CCCCC1=O 7a_100000210240_100000204591 [0,1,0,1,0,0|2,0,0]=4 19053 B16R1.1218 CCOCCOCCSC1CCCCC1=O 62a_100000204591_100011211534 [0,1,0,1,0,0|2,0,0]=4 19054 B16R1.1218 CCOCCOCCSC1CCCCC1=O 62a_100011211534_100000204591 [0,1,0,1,0,0|2,0,0]=4 19055 B16R1.1218 CN1CCCCC1CCSCCCCC=O 62a_100000139335_100000211948 [0,1,0,1,0,0|1,0,0]=3 19056 B16R1.1218 CN1CCCCC1CCSCCCCC=O 62a_100000211948_100000139335 [0,1,0,1,0,0|1,0,0]=3 19057 B16R1.1218 CN1CCCCC1CSCCCCCC=O 62a_100000139337_100015185383 [0,1,0,1,0,0|1,0,0]=3 19058 B16R1.1218 CN1CCCCC1CSCCCCCC=O 62a_100015185383_100000139337 [0,1,0,1,0,0|1,0,0]=3 19059 B16R1.1218 COCCCCCCNC1CCCCC1C 2230a_100000211402_100011998445 [0,1,0,1,0,0|2,0,0]=4 19060 B16R1.1218 COCCCCCCNC1CCCCC1C 34a_100000211402_100011998445 [0,1,0,1,0,0|2,0,0]=4 19061 B16R1.1218 COCCCCCCNC1CCCNC1=O 2230a_100000747585_100011998445 [0,1,0,1,0,0|2,0,0]=4 19062 B16R1.1218 COCCCCCCNC1CCCNC1=O 34a_100000747585_100011998445 [0,1,0,1,0,0|2,0,0]=4 19063 B16R1.1218 COCCCCCCOC1CCCCC1=O 34a_100011214950_100011998445 [0,1,0,1,0,0|1,0,0]=3 19064 B16R1.1218 COCCCCCCOC1CCCCC1=O 34a_200012092642_100000754470 [0,1,0,1,0,0|1,0,0]=3 19065 B16R1.1218 COCCCCCCOC1CCCCC1=O 7a_200012092642_100000204591 [0,1,0,1,0,0|1,0,0]=3 19066 B16R1.1218 COCCCCCCOC1CCCCC1C 34a_100000211207_100011998445 [0,1,0,1,0,0|2,0,0]=4 19067 B16R1.1218 COCCCCCCOC1CCCCC1C 7a_100000211207_100011998445 [0,1,0,1,0,0|2,0,0]=4 19068 B16R1.1218 COCCCCCCOC1CCCNC1=O 34a_100000073722_100011998445 [0,1,0,1,0,0|2,0,0]=4 19069 B16R1.1218 COCCCCCCOC1CCCNC1=O 34a_200012092642_100000687798 [0,1,0,1,0,0|2,0,0]=4 19070 B16R1.1218 COCCCCCCOC1CCCNC1=O 7a_200012092642_100000687798 [0,1,0,1,0,0|2,0,0]=4 19071 B16R1.1218 COCCCCCCOC1COCCC1=O 34a_200012092642_100012180262 [0,1,0,1,0,0|2,0,0]=4 19072 B16R1.1218 COCCCCCCOC1COCCC1=O 7a_200012092642_100012180262 [0,1,0,1,0,0|2,0,0]=4 19073 B16R1.1218 COCCCCCCSC1CCCCC1=O 62a_100000204591_100011998445 [0,1,0,1,0,0|1,0,0]=3 19074 B16R1.1218 COCCCCCCSC1CCCCC1=O 62a_100011998445_100000204591 [0,1,0,1,0,0|1,0,0]=3 19075 B16R1.1218 COCCCCCCSC1CCCNC1=O 62a_100000687798_100011998445 [0,1,0,1,0,0|2,0,0]=4 19076 B16R1.1218 COCCCCCCSC1CCCNC1=O 62a_100011998445_100000687798 [0,1,0,1,0,0|2,0,0]=4 19077 B16R1.1218 COCCCCCCSC1COCCC1=O 62a_100011998445_100012180262 [0,1,0,1,0,0|2,0,0]=4 19078 B16R1.1218 COCCCCCCSC1COCCC1=O 62a_100012180262_100011998445 [0,1,0,1,0,0|2,0,0]=4 19079 B16R1.1218 COCCCCNCCN1CCCCC1=O 2230a_100160573077_100000730899 [0,1,0,1,0,0|2,0,0]=4 19080 B16R1.1218 COCCCCNCCN1CCCCC1=O 34a_100160573077_100000755781 [0,1,0,1,0,0|2,0,0]=4 19081 B16R1.1218 COCCOCCCNC1CCCCC1=O 34a_100000206027_100000754470 [0,1,0,1,0,0|2,0,0]=4 19082 B16R1.1218 COCCOCCCOC1CCCCC1=O 34a_100011214950_100011216529 [0,1,0,1,0,0|2,0,0]=4 19083 B16R1.1218 COCCOCCCSC1CCCCC1=O 62a_100000204591_100011216529 [0,1,0,1,0,0|2,0,0]=4 19084 B16R1.1218 COCCOCCCSC1CCCCC1=O 62a_100011216529_100000204591 [0,1,0,1,0,0|2,0,0]=4 19085 B16R1.1218 COCCOCCOCC1CCCCC1=O 34a_100009861125_100000695917 [0,1,0,1,0,0|2,0,0]=4 19086 B16R1.1218 COCCOCCOCC1CCCCC1=O 7a_100009861125_100000695917 [0,1,0,1,0,0|2,0,0]=4 19087 B16R1.1218 N#CCCCCCCSC1CCCCC1=O 62a_100000204591_100009813337 [0,1,0,1,0,0|1,0,1]=4 19088 B16R1.1218 N#CCCCCCCSC1CCCCC1=O 62a_100009813337_100000204591 [0,1,0,1,0,0|1,0,1]=4 19089 B16R1.1218 N#CCCCCCOCC1CCCCC1=O 7a_100009861125_100009813376 [0,1,0,1,0,0|1,0,1]=4 19090 B16R1.1218 NCCCCCCCOC1CCCCC1=O 34a_100011996573_100000754470 [0,1,0,1,0,0|1,0,0]=3 19091 B16R1.1218 NCCCCCCCOC1CCCNC1=O 34a_100011996573_100000687798 [0,1,0,1,0,0|2,0,0]=4 19092 B16R1.1218 NCCCCCCCOC1COCCC1=O 34a_100011996573_100012180262 [0,1,0,1,0,0|2,0,0]=4 19093 B16R1.1218 NCCCOCCCOC1CCCCC1=O 34a_100011310245_100000754470 [0,1,0,1,0,0|2,0,0]=4 19094 B16R1.1218 O=C1CCCCC1COCCCCCCF 34a_100009861125_100015922095 [0,1,0,1,0,0|1,0,0]=3 19095 B16R1.1218 O=C1CCCCC1COCCCCCCF 7a_100009861125_100015922095 [0,1,0,1,0,0|1,0,0]=3 19096 B16R1.1218 O=C1CCCCC1COCCCCCCO 34a_100009861125_100000766143 [0,1,0,1,0,0|1,0,0]=3 19097 B16R1.1218 O=C1CCCCC1COCCCCCCO 7a_100009861125_100000766143 [0,1,0,1,0,0|1,0,0]=3 19098 B16R1.1218 O=C1CCCCC1NCCCCCCCO 34a_100011996573_100000754470 [0,1,0,1,0,0|1,0,0]=3 19099 B16R1.1218 O=C1CCCCC1NCCCOCCCO 34a_100011310245_100000754470 [0,1,0,1,0,0|2,0,0]=4 19100 B16R1.1218 O=C1CCCCC1OCCCCCCCBr 34a_100000760002_100000754470 [0,1,0,1,0,0|1,0,0]=3 19101 B16R1.1218 O=C1CCCCC1OCCCCCCCBr 7a_100000760002_100000204591 [0,1,0,1,0,0|1,0,0]=3 19102 B16R1.1218 O=C1CCCCC1OCCCCCCCO 34a_100011214950_100000760002 [0,1,0,1,0,0|1,0,0]=3 19103 B16R1.1218 O=C1CCCCC1SCCCCCCCO 62a_100000204591_100000760002 [0,1,0,1,0,0|1,0,0]=3 19104 B16R1.1218 O=C1CCCCC1SCCCCCCCO 62a_100000760002_100000204591 [0,1,0,1,0,0|1,0,0]=3 19105 B16R1.1218 O=C1CCCCN1CCNCCCCCF 2230a_100160573077_100000729378 [0,1,0,1,0,0|2,0,0]=4 19106 B16R1.1218 O=C1CCCCN1CCNCCCCCF 34a_100160573077_100000729378 [0,1,0,1,0,0|2,0,0]=4 19107 B16R1.1218 O=C1CCCCN1CCNCCCCCO 2230a_100160573077_100000746330 [0,1,0,1,0,0|2,0,0]=4 19108 B16R1.1218 O=C1CCCCN1CCNCCCCCO 34a_100160573077_100000746330 [0,1,0,1,0,0|2,0,0]=4 19109 B16R1.1218 O=C1CCOCC1NCCCCCCCO 34a_100011996573_100012180262 [0,1,0,1,0,0|2,0,0]=4 19110 B16R1.1218 O=C1CCOCC1OCCCCCCCBr 34a_100000760002_100012180262 [0,1,0,1,0,0|2,0,0]=4 19111 B16R1.1218 O=C1CCOCC1OCCCCCCCBr 7a_100000760002_100012180262 [0,1,0,1,0,0|2,0,0]=4 19112 B16R1.1218 O=C1CCOCC1SCCCCCCCO 62a_100000760002_100012180262 [0,1,0,1,0,0|2,0,0]=4 19113 B16R1.1218 O=C1CCOCC1SCCCCCCCO 62a_100012180262_100000760002 [0,1,0,1,0,0|2,0,0]=4 19114 B16R1.1218 O=C1NCCCC1NCCCCCCCO 2230a_100000747585_100000760002 [0,1,0,1,0,0|2,0,0]=4 19115 B16R1.1218 O=C1NCCCC1NCCCCCCCO 2230a_100011996573_100000687798 [0,1,0,1,0,0|2,0,0]=4 19116 B16R1.1218 O=C1NCCCC1NCCCCCCCO 34a_100000747585_100000760002 [0,1,0,1,0,0|2,0,0]=4 19117 B16R1.1218 O=C1NCCCC1NCCCCCCCO 34a_100011996573_100000687798 [0,1,0,1,0,0|2,0,0]=4 19118 B16R1.1218 O=C1NCCCC1OCCCCCCCBr 34a_100000760002_100000687798 [0,1,0,1,0,0|2,0,0]=4 19119 B16R1.1218 O=C1NCCCC1OCCCCCCCBr 7a_100000760002_100000687798 [0,1,0,1,0,0|2,0,0]=4 19120 B16R1.1218 O=C1NCCCC1OCCCCCCCO 34a_100000073722_100000760002 [0,1,0,1,0,0|2,0,0]=4 19121 B16R1.1218 O=C1NCCCC1SCCCCCCCO 62a_100000687798_100000760002 [0,1,0,1,0,0|2,0,0]=4 19122 B16R1.1218 O=C1NCCCC1SCCCCCCCO 62a_100000760002_100000687798 [0,1,0,1,0,0|2,0,0]=4 19123 B16R1.1218 O=CCCCCCOCC1CCCCC1=O 7a_100009861125_100000139337 [0,1,0,1,0,0|1,0,1]=4 19124 B16R1.1219 C#CCCCCCCCN1CCCC1CC 2230a_100000754278_100153394163 [0,1,0,1,0,0|1,0,1]=4 19125 B16R1.1219 C#CCCCCCCCN1CCCC1CC 269982a_100000754278_100153394163 [0,1,0,1,0,0|1,0,1]=4 19126 B16R1.1219 C#CCCCCCCCN1CCCC1CC 34a_100000754278_100153394163 [0,1,0,1,0,0|1,0,1]=4 19127 B16R1.1219 C=CCCCCCCCN1CCCC1CC 2230a_100000754278_100012355270 [0,1,0,1,0,0|1,0,0]=3 19128 B16R1.1219 C=CCCCCCCCN1CCCC1CC 269982a_100000754278_100012355270 [0,1,0,1,0,0|1,0,0]=3 19129 B16R1.1219 C=CCCCCCCCN1CCCC1CC 34a_100000754278_100012355270 [0,1,0,1,0,0|1,0,0]=3 19130 B16R1.1219 C=CCCCCCCCN1CCC[C@@H]1CO 2230a_100000745186_100012355270 [0,1,0,1,0,0|2,0,0]=4 19131 B16R1.1219 C=CCCCCCCCN1CCC[C@@H]1CO 269982a_100000745186_100012355270 [0,1,0,1,0,0|2,0,0]=4 19132 B16R1.1219 C=CCCCCCCCN1CCC[C@@H]1CO 34a_100000745186_100012355270 [0,1,0,1,0,0|2,0,0]=4 19133 B16R1.1219 C=CCCCCCNCC1CCCN1CC 2230a_100000211693_100000700193 [0,1,0,1,0,0|2,0,0]=4 19134 B16R1.1219 C=CCCCCCOC[C@H]1CCCN1CC 34a_100011739246_100000700193 [0,1,0,1,0,0|2,0,0]=4 19135 B16R1.1219 C=CCCCCCOC[C@H]1CCCN1CC 7a_100011739246_100000700193 [0,1,0,1,0,0|2,0,0]=4 19136 B16R1.1219 CCC1CCCC1NCCCCCCCO 269862a_100011996573_100000749056 [0,1,0,1,0,0|0,0,2]=4 19137 B16R1.1219 CCC1CCCC1NCCCCCCCO 270004a_100011996573_100000749056 [0,1,0,1,0,0|0,0,2]=4 19138 B16R1.1219 CCC1CCCN1CCCCCCCCO 2230a_100000754278_100000033203 [0,1,0,1,0,0|0,0,2]=4 19139 B16R1.1219 CCC1CCCN1CCCCCCCCO 269982a_100000754278_100000033203 [0,1,0,1,0,0|0,0,2]=4 19140 B16R1.1219 CCC1CCCN1CCCCCCCCO 34a_100000754278_100000033203 [0,1,0,1,0,0|0,0,2]=4 19141 B16R1.1219 CCCCCCCCCN1CCCC1C#N 2230a_100000701862_100011214924 [0,1,0,1,0,0|1,0,1]=4 19142 B16R1.1219 CCCCCCCCCN1CCCC1CC 2230a_100000754278_100011214924 [0,1,0,1,0,0|1,0,1]=4 19143 B16R1.1219 CCCCCCCCCN1CCCC1CC 269982a_100000754278_100000210670 [0,1,0,1,0,0|1,0,1]=4 19144 B16R1.1219 CCCCCCCCCN1CCCC1CC 34a_100000754278_100011214924 [0,1,0,1,0,0|1,0,1]=4 19145 B16R1.1219 CCCCCCCCCN1CCC[C@@H]1C#N 2230a_106645074975_100011214924 [0,1,0,1,0,0|1,0,1]=4 19146 B16R1.1219 CCCCCCCCCN1CCC[C@@H]1C#N 269982a_106645074975_100000210670 [0,1,0,1,0,0|1,0,1]=4 19147 B16R1.1219 CCCCCCCCCN1CCC[C@@H]1CO 2230a_100000745186_100011214924 [0,1,0,1,0,0|0,0,2]=4 19148 B16R1.1219 CCCCCCCCCN1CCC[C@@H]1CO 269982a_100000745186_100000210670 [0,1,0,1,0,0|0,0,2]=4 19149 B16R1.1219 CCCCCCCCCN1CCC[C@@H]1CO 34a_100000745186_100011214924 [0,1,0,1,0,0|0,0,2]=4 19150 B16R1.1219 CCCCCCCCNC1CCCC1CC 269862a_100000229939_100000749056 [0,1,0,1,0,0|1,0,1]=4 19151 B16R1.1219 CCCCCCCCNC1CCCC1CC 270004a_100000229939_100000749056 [0,1,0,1,0,0|1,0,1]=4 19152 B16R1.1219 CCCCCCCCO[C@@H]1CCC[C@H]1C#N 34a_100011907464_100000210759 [0,1,0,1,0,0|1,0,1]=4 19153 B16R1.1219 CCCCCCCCO[C@@H]1CCC[C@H]1C#N 7a_100011907464_100000210759 [0,1,0,1,0,0|1,0,1]=4 19154 B16R1.1219 CCN1CCCC1CNCCCCCC=O 2230a_100000211693_100000139337 [0,1,0,1,0,0|1,0,0]=3 19155 B16R1.1219 CCN1CCC[C@@H]1COCCCCCC=O 7a_100011739246_100000139337 [0,1,0,1,0,0|1,0,0]=3 19156 B16R1.1418 C#CC1CCCCN1CCCCCCCC 2230a_200020621307_100000210759 [0,1,0,1,0,0|1,0,1]=4 19157 B16R1.1418 C#CC1CCCCN1CCCCCCCC 269982a_200020621307_100000210759 [0,1,0,1,0,0|1,0,1]=4 19158 B16R1.1418 C#CC1CCCCN1CCCCCCCC 34a_200020621307_100000210759 [0,1,0,1,0,0|1,0,1]=4 19159 B16R1.1418 C#CCCCCCCN1CCCCC1CC 2230a_100000210034_100012276617 [0,1,0,1,0,0|1,0,1]=4 19160 B16R1.1418 C#CCCCCCCN1CCCCC1CC 269982a_100000210034_100012276617 [0,1,0,1,0,0|1,0,1]=4 19161 B16R1.1418 C#CCCCCCCN1CCCCC1CC 34a_100000210034_100012276617 [0,1,0,1,0,0|1,0,1]=4 19162 B16R1.1418 C#CCCCCCOC1CCCCC1CC 34a_100000210738_100012094781 [0,1,0,1,0,0|1,0,1]=4 19163 B16R1.1418 C#CCCCCCOC1CCCCC1CC 7a_100000210738_100012094781 [0,1,0,1,0,0|1,0,1]=4 19164 B16R1.1418 C=CCCCCCCN1CCCCC1CC 2230a_100000210034_100011215473 [0,1,0,1,0,0|1,0,0]=3 19165 B16R1.1418 C=CCCCCCCN1CCCCC1CC 269982a_100000210034_100011215473 [0,1,0,1,0,0|1,0,0]=3 19166 B16R1.1418 C=CCCCCCCN1CCCCC1CC 34a_100000210034_100011215473 [0,1,0,1,0,0|1,0,0]=3 19167 B16R1.1418 C=CCCCCCCN1CCCCC1CO 2230a_100000210821_100011215473 [0,1,0,1,0,0|2,0,0]=4 19168 B16R1.1418 C=CCCCCCCN1CCCCC1CO 269982a_100000210821_100011215473 [0,1,0,1,0,0|2,0,0]=4 19169 B16R1.1418 C=CCCCCCCN1CCCCC1CO 34a_100000210821_100011215473 [0,1,0,1,0,0|2,0,0]=4 19170 B16R1.1418 C=CCCCCCCN1CCOC[C@@H]1CC 2230a_100016988097_100011215473 [0,1,0,1,0,0|2,0,0]=4 19171 B16R1.1418 C=CCCCCCCN1CCOC[C@@H]1CC 269982a_100016988097_100011215473 [0,1,0,1,0,0|2,0,0]=4 19172 B16R1.1418 C=CCCCCCCN1CCOC[C@@H]1CC 34a_100016988097_100011215473 [0,1,0,1,0,0|2,0,0]=4 19173 B16R1.1418 C=CCCCCCNC1CCCCC1OC 34a_100011208099_100000700193 [0,1,0,1,0,0|2,0,0]=4 19174 B16R1.1418 C=CCCCCCOC1CCCCC1CC 34a_100000210738_100000700193 [0,1,0,1,0,0|1,0,0]=3 19175 B16R1.1418 C=CCCCCCOC1CCCCC1CC 7a_100000210738_100000700193 [0,1,0,1,0,0|1,0,0]=3 19176 B16R1.1418 C=CCCCCCOC1CCCCC1CN 34a_100011216029_100000700193 [0,1,0,1,0,0|2,0,0]=4 19177 B16R1.1418 C=CCCCCCO[C@@H]1CCCC[C@H]1NC 34a_100000708425_100000700193 [0,1,0,1,0,0|2,0,0]=4 19178 B16R1.1418 C=CCCCCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000700193 [0,1,0,1,0,0|2,0,0]=4 19179 B16R1.1418 C=CCCCCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000700193 [0,1,0,1,0,0|2,0,0]=4 19180 B16R1.1418 C=CCCCCNCC1CCCCN1CC 2230a_100000754393_100011215482 [0,1,0,1,0,0|2,0,0]=4 19181 B16R1.1418 C=CCCCCNCC1CCCCN1CC 34a_100000754393_100011215482 [0,1,0,1,0,0|2,0,0]=4 19182 B16R1.1418 C=CCCCCOCC1CCCCN1CC 34a_100000225091_100011215482 [0,1,0,1,0,0|2,0,0]=4 19183 B16R1.1418 C=CCCCCOCC1CCCCN1CC 7a_100000225091_100011215482 [0,1,0,1,0,0|2,0,0]=4 19184 B16R1.1418 C=CCCCNCCN1CCCCC1CC 2230a_100000755458_100011713584 [0,1,0,1,0,0|2,0,0]=4 19185 B16R1.1418 C=CCCCNCCN1CCCCC1CC 34a_100000755458_100000757094 [0,1,0,1,0,0|2,0,0]=4 19186 B16R1.1418 C=CCCNCCCN1CCCCC1CC 34a_100011191702_100000754431 [0,1,0,1,0,0|2,0,0]=4 19187 B16R1.1418 CCC1CCCCC1NCCCCCC#N 270004a_100000061152_100000757040 [0,1,0,1,0,0|1,0,1]=4 19188 B16R1.1418 CCC1CCCCC1NCCCCCCO 269862a_100000686447_100000757040 [0,1,0,1,0,0|0,0,2]=4 19189 B16R1.1418 CCC1CCCCC1NCCCCCCO 270004a_100000686447_100000757040 [0,1,0,1,0,0|0,0,2]=4 19190 B16R1.1418 CCC1CCCCC1NCCCCCOC 269862a_100000747528_100000757040 [0,1,0,1,0,0|2,0,0]=4 19191 B16R1.1418 CCC1CCCCC1NCCCCCOC 270004a_100000747528_100000757040 [0,1,0,1,0,0|2,0,0]=4 19192 B16R1.1418 CCC1CCCCC1OCCCCCC#N 7a_100000210738_100009813376 [0,1,0,1,0,0|1,0,1]=4 19193 B16R1.1418 CCC1CCCCC1OCCCCCC=O 7a_100000210738_100000139337 [0,1,0,1,0,0|0,0,0]=2 19194 B16R1.1418 CCC1CCCCC1OCCCCCCF 34a_100000210738_100015922095 [0,1,0,1,0,0|1,0,1]=4 19195 B16R1.1418 CCC1CCCCC1OCCCCCCF 7a_100000210738_100015922095 [0,1,0,1,0,0|1,0,1]=4 19196 B16R1.1418 CCC1CCCCC1OCCCCCCO 34a_100000210738_100000766143 [0,1,0,1,0,0|0,0,2]=4 19197 B16R1.1418 CCC1CCCCC1OCCCCCCO 7a_100000210738_100000766143 [0,1,0,1,0,0|0,0,2]=4 19198 B16R1.1418 CCC1CCCCN1CCCCCCC#N 2230a_100000210034_100009813337 [0,1,0,1,0,0|1,0,1]=4 19199 B16R1.1418 CCC1CCCCN1CCCCCCC#N 269982a_100000210034_100009813337 [0,1,0,1,0,0|1,0,1]=4 19200 B16R1.1418 CCC1CCCCN1CCCCCCCO 2230a_100000210034_100000760002 [0,1,0,1,0,0|0,0,2]=4 19201 B16R1.1418 CCC1CCCCN1CCCCCCCO 269982a_100000210034_100000760002 [0,1,0,1,0,0|0,0,2]=4 19202 B16R1.1418 CCC1CCCCN1CCCCCCCO 34a_100000210034_100000760002 [0,1,0,1,0,0|0,0,2]=4 19203 B16R1.1418 CCC1CCCCN1CCCCCCOC 2230a_100000210034_100011998445 [0,1,0,1,0,0|2,0,0]=4 19204 B16R1.1418 CCC1CCCCN1CCCCCCOC 269982a_100000210034_100011998445 [0,1,0,1,0,0|2,0,0]=4 19205 B16R1.1418 CCC1CCCCN1CCCCCCOC 34a_100000210034_100011998445 [0,1,0,1,0,0|2,0,0]=4 19206 B16R1.1418 CCC1CCCCN1CCNCCCC=O 2230a_100000755458_200011292268 [0,1,0,1,0,0|1,0,0]=3 19207 B16R1.1418 CCCCCCCCN1CCCCC1C#N 34a_100016989756_100000210759 [0,1,0,1,0,0|1,0,1]=4 19208 B16R1.1418 CCCCCCCCN1CCCCC1CC 2230a_100000210034_100000210759 [0,1,0,1,0,0|1,0,1]=4 19209 B16R1.1418 CCCCCCCCN1CCCCC1CC 269982a_100000210034_100000210759 [0,1,0,1,0,0|1,0,1]=4 19210 B16R1.1418 CCCCCCCCN1CCCCC1CC 34a_100000210034_100000210759 [0,1,0,1,0,0|1,0,1]=4 19211 B16R1.1418 CCCCCCCCN1CCCCC1CO 2230a_100000210821_100000210759 [0,1,0,1,0,0|0,0,2]=4 19212 B16R1.1418 CCCCCCCCN1CCCCC1CO 269982a_100000210821_100000210759 [0,1,0,1,0,0|0,0,2]=4 19213 B16R1.1418 CCCCCCCCN1CCCCC1CO 34a_100000210821_100000210759 [0,1,0,1,0,0|0,0,2]=4 19214 B16R1.1418 CCCCCCCNC1CCCCC1CC 269862a_100000229938_100000757040 [0,1,0,1,0,0|1,0,1]=4 19215 B16R1.1418 CCCCCCCNC1CCCCC1CC 270004a_100000229938_100000757040 [0,1,0,1,0,0|1,0,1]=4 19216 B16R1.1418 CCCCCCCNC1CCCCC1CO 270004a_100000229938_100009861125 [0,1,0,1,0,0|0,0,2]=4 19217 B16R1.1418 CCCCCCCNC1CCCCC1OC 270004a_100000229938_100000740605 [0,1,0,1,0,0|2,0,0]=4 19218 B16R1.1418 CCCCCCCNC1CCCCC1OC 34a_100011208099_100000210614 [0,1,0,1,0,0|2,0,0]=4 19219 B16R1.1418 CCCCCCCOC1CCCCC1CC 34a_100000210738_100000210614 [0,1,0,1,0,0|1,0,1]=4 19220 B16R1.1418 CCCCCCCOC1CCCCC1CC 7a_100000210738_100000210614 [0,1,0,1,0,0|1,0,1]=4 19221 B16R1.1418 CCCCCCCOC1CCCCC1CN 34a_100011216029_100000210614 [0,1,0,1,0,0|1,0,1]=4 19222 B16R1.1418 CCCCCCCO[C@@H]1CCCC[C@H]1NC 34a_100000708425_100000210614 [0,1,0,1,0,0|2,0,0]=4 19223 B16R1.1418 CCCCCCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000210614 [0,1,0,1,0,0|2,0,0]=4 19224 B16R1.1418 CCCCCCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000210614 [0,1,0,1,0,0|2,0,0]=4 19225 B16R1.1418 CCN1CCCCC1CNCCCCC=O 2230a_100000754393_100000139335 [0,1,0,1,0,0|1,0,0]=3 19226 B16R1.1418 CCN1CCCCC1COCCCCC=O 7a_100000225091_100000139335 [0,1,0,1,0,0|1,0,0]=3 19227 B16R1.1418 CO[C@H]1CCCC[C@@H]1OCCCCCC=O 7a_200009815850_100000139337 [0,1,0,1,0,0|1,0,0]=3 19228 B16R1.1418 O=CCCCCCNC1CCOCC1CO 2230a_214813039666_100000139337 [0,1,0,1,0,0|2,0,0]=4 19229 B16R1.1418 O=CCCCNCCN1CCCCC1CO 2230a_100011473795_200011292268 [0,1,0,1,0,0|2,0,0]=4 19230 B16R1.1425 C=CCCCN1CCCCC1CCCOC 2230a_100011804088_100011713584 [0,1,0,1,0,0|2,0,0]=4 19231 B16R1.1425 C=CCCCN1CCCCC1CCCOC 269982a_100011804088_100000757094 [0,1,0,1,0,0|2,0,0]=4 19232 B16R1.1425 C=CCCCN1CCCCC1CCCOC 34a_100011804088_100000757094 [0,1,0,1,0,0|2,0,0]=4 19233 B16R1.1425 CCCCCN1CCCCC1CCCOC 2230a_100011804088_100000210326 [0,1,0,1,0,0|2,0,0]=4 19234 B16R1.1425 CCCCCN1CCCCC1CCCOC 269982a_100011804088_100000210215 [0,1,0,1,0,0|2,0,0]=4 19235 B16R1.1425 CCCCCN1CCCCC1CCCOC 34a_100011804088_100000718602 [0,1,0,1,0,0|2,0,0]=4 19236 B16R1.1425 COCCCC1CCCCN1CCCC=O 2230a_100011804088_200011292268 [0,1,0,1,0,0|1,0,0]=3 19237 B16R1.1425 COCCCC1CCCCN1CCCC=O 269982a_100011804088_200011292268 [0,1,0,1,0,0|1,0,0]=3 19238 B16R1.3890 C=CCCCCCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100009814027 [0,1,0,1,0,0|2,0,0]=4 19239 B16R1.3890 C=CCCCCCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100009814027 [0,1,0,1,0,0|2,0,0]=4 19240 B16R1.3890 C=CCCCCCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100009814027 [0,1,0,1,0,0|2,0,0]=4 19241 B16R1.3890 C=CCCCCCCCCOCC1CC1C 34a_100000744939_100011933949 [0,1,0,1,0,0|1,0,0]=3 19242 B16R1.3890 C=CCCCCCCCCOCC1CC1C 7a_100000744939_100011933949 [0,1,0,1,0,0|1,0,0]=3 19243 B16R1.3890 CC1CC1COCCCCCCCCCO 34a_100000744939_100009813782 [0,1,0,1,0,0|0,0,2]=4 19244 B16R1.3890 CC1CC1COCCCCCCCCCO 7a_100000744939_100009813782 [0,1,0,1,0,0|0,0,2]=4 19245 B16R1.3890 CCCCCCCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100011215454 [0,1,0,1,0,0|1,0,1]=4 19246 B16R1.3890 CCCCCCCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100011215454 [0,1,0,1,0,0|1,0,1]=4 19247 B16R1.3890 CCCCCCCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100011215454 [0,1,0,1,0,0|1,0,1]=4 19248 B16R1.3890 CCCCCCCCCCOCC1CC1C 34a_100000744939_100000210320 [0,1,0,1,0,0|1,0,1]=4 19249 B16R1.3890 CCCCCCCCCCOCC1CC1C 7a_100000744939_100000210320 [0,1,0,1,0,0|1,0,1]=4 19250 B16R1.3891 BrCCCCCCCCCCOC1CCC1 34a_100009813290_100000749161 [0,1,0,1,0,0|1,0,1]=4 19251 B16R1.3891 BrCCCCCCCCCOCC1CCC1 34a_100009813782_100000763275 [0,1,0,1,0,0|1,0,1]=4 19252 B16R1.3891 BrCCCCCCCCCOCC1CCC1 7a_100009813782_100000763275 [0,1,0,1,0,0|1,0,1]=4 19253 B16R1.3891 C#CCCCCCCCCCOC1CCC1 34a_100000034437_100000749161 [0,1,0,1,0,0|1,0,1]=4 19254 B16R1.3891 C#CCCCCCCCCOCC1CCC1 34a_100000065265_100000763275 [0,1,0,1,0,0|1,0,1]=4 19255 B16R1.3891 C#CCCCCCCCCOCC1CCC1 7a_100000065265_100000763275 [0,1,0,1,0,0|1,0,1]=4 19256 B16R1.3891 C=CCCCCCCCCCCN1CCC1 269982a_100000754969_100011093070 [0,1,0,1,0,0|1,0,0]=3 19257 B16R1.3891 C=CCCCCCCCCCNC1CCC1 2230a_100000749019_100009814027 [0,1,0,1,0,0|1,0,0]=3 19258 B16R1.3891 C=CCCCCCCCCCNC1CCC1 270004a_100000081888_100000241760 [0,1,0,1,0,0|1,0,0]=3 19259 B16R1.3891 C=CCCCCCCCCCNC1CCC1 34a_100000081888_100000749161 [0,1,0,1,0,0|1,0,0]=3 19260 B16R1.3891 C=CCCCCCCCCCNC1CCC1 34a_100000749019_100009814027 [0,1,0,1,0,0|1,0,0]=3 19261 B16R1.3891 C=CCCCCCCCCCNC1COC1 2230a_100016991112_100009814027 [0,1,0,1,0,0|2,0,0]=4 19262 B16R1.3891 C=CCCCCCCCCCNC1COC1 34a_100000081888_100009818527 [0,1,0,1,0,0|2,0,0]=4 19263 B16R1.3891 C=CCCCCCCCCCOC1CCC1 34a_100000038209_100000749161 [0,1,0,1,0,0|1,0,0]=3 19264 B16R1.3891 C=CCCCCCCCCCOC1CCC1 34a_100000748187_100009814027 [0,1,0,1,0,0|1,0,0]=3 19265 B16R1.3891 C=CCCCCCCCCCOC1COC1 34a_100000038209_100009818527 [0,1,0,1,0,0|2,0,0]=4 19266 B16R1.3891 C=CCCCCCCCCCOC1COC1 7a_100000038209_100009818527 [0,1,0,1,0,0|2,0,0]=4 19267 B16R1.3891 C=CCCCCCCCCCOC1CSC1 7a_100000072292_100009814027 [0,1,0,1,0,0|2,0,0]=4 19268 B16R1.3891 C=CCCCCCCCCCSC1CCC1 62a_100009814027_100000749161 [0,1,0,1,0,0|1,0,0]=3 19269 B16R1.3891 C=CCCCCCCCCCSC1COC1 62a_100009814027_100009818527 [0,1,0,1,0,0|2,0,0]=4 19270 B16R1.3891 C=CCCCCCCCCNCC1CCC1 2230a_100000738700_100011933949 [0,1,0,1,0,0|1,0,0]=3 19271 B16R1.3891 C=CCCCCCCCCNCC1CCC1 34a_100000738700_100011933949 [0,1,0,1,0,0|1,0,0]=3 19272 B16R1.3891 C=CCCCCCCCCNCC1COC1 2230a_100015281925_100011933949 [0,1,0,1,0,0|2,0,0]=4 19273 B16R1.3891 C=CCCCCCCCCNCC1COC1 34a_100015281925_100011933949 [0,1,0,1,0,0|2,0,0]=4 19274 B16R1.3891 C=CCCCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100011933949 [0,1,0,1,0,0|2,0,0]=4 19275 B16R1.3891 C=CCCCCCCCCNC[C@@H]1CCO1 34a_100020831831_100011933949 [0,1,0,1,0,0|2,0,0]=4 19276 B16R1.3891 C=CCCCCCCCCOCC1CCC1 34a_100000760304_100011933949 [0,1,0,1,0,0|1,0,0]=3 19277 B16R1.3891 C=CCCCCCCCCOCC1CCC1 34a_100011215194_100000763275 [0,1,0,1,0,0|1,0,0]=3 19278 B16R1.3891 C=CCCCCCCCCOCC1CCC1 7a_100011215194_100000763275 [0,1,0,1,0,0|1,0,0]=3 19279 B16R1.3891 C=CCCCCCCCCOCC1CCO1 34a_100000039022_100011933949 [0,1,0,1,0,0|2,0,0]=4 19280 B16R1.3891 C=CCCCCCCCCOCC1CCO1 34a_100011215194_100000103362 [0,1,0,1,0,0|2,0,0]=4 19281 B16R1.3891 C=CCCCCCCCCOCC1CCO1 7a_100011215194_100000103362 [0,1,0,1,0,0|2,0,0]=4 19282 B16R1.3891 C=CCCCCCCCCOCC1CNC1 34a_100016987283_100011933949 [0,1,0,1,0,0|2,0,0]=4 19283 B16R1.3891 C=CCCCCCCCCOCC1COC1 34a_100000060846_100011933949 [0,1,0,1,0,0|2,0,0]=4 19284 B16R1.3891 C=CCCCCCCCCOCC1COC1 34a_100011215194_100010264016 [0,1,0,1,0,0|2,0,0]=4 19285 B16R1.3891 C=CCCCCCCCCOCC1COC1 7a_100011215194_100010264016 [0,1,0,1,0,0|2,0,0]=4 19286 B16R1.3891 C=CCCCCCCCCSCC1CCC1 62a_100000763275_100011933949 [0,1,0,1,0,0|1,0,0]=3 19287 B16R1.3891 C=CCCCCCCCCSCC1CCC1 62a_100011933949_100000763275 [0,1,0,1,0,0|1,0,0]=3 19288 B16R1.3891 C=CCCCCCCCCSCC1CCO1 62a_100000103362_100011933949 [0,1,0,1,0,0|2,0,0]=4 19289 B16R1.3891 C=CCCCCCCCCSCC1CCO1 62a_100011933949_100000103362 [0,1,0,1,0,0|2,0,0]=4 19290 B16R1.3891 C=CCCCCCCCCSCC1COC1 62a_100010264016_100011933949 [0,1,0,1,0,0|2,0,0]=4 19291 B16R1.3891 C=CCCCCCCCCSCC1COC1 62a_100011933949_100010264016 [0,1,0,1,0,0|2,0,0]=4 19292 B16R1.3891 C=CCCCCCCCOCCC1COC1 34a_100009855314_100012355270 [0,1,0,1,0,0|2,0,0]=4 19293 B16R1.3891 CCCCCCCCCCCCN1CCC1 269982a_100000754969_100000759014 [0,1,0,1,0,0|1,0,1]=4 19294 B16R1.3891 CCCCCCCCCCCNC1CCC1 2230a_100000749019_100011215454 [0,1,0,1,0,0|1,0,1]=4 19295 B16R1.3891 CCCCCCCCCCCNC1CCC1 270004a_200011215754_100000241760 [0,1,0,1,0,0|1,0,1]=4 19296 B16R1.3891 CCCCCCCCCCCNC1CCC1 34a_100000749019_100011215454 [0,1,0,1,0,0|1,0,1]=4 19297 B16R1.3891 CCCCCCCCCCCNC1CCC1 34a_200011215754_100000749161 [0,1,0,1,0,0|1,0,1]=4 19298 B16R1.3891 CCCCCCCCCCCNC1COC1 2230a_100016991112_100011215454 [0,1,0,1,0,0|2,0,0]=4 19299 B16R1.3891 CCCCCCCCCCCNC1COC1 34a_200011215754_100009818527 [0,1,0,1,0,0|2,0,0]=4 19300 B16R1.3891 CCCCCCCCCCCOC1CCC1 34a_100000210809_100000749161 [0,1,0,1,0,0|1,0,1]=4 19301 B16R1.3891 CCCCCCCCCCCOC1CCC1 34a_100000748187_100011215454 [0,1,0,1,0,0|1,0,1]=4 19302 B16R1.3891 CCCCCCCCCCCOC1COC1 34a_100000210809_100009818527 [0,1,0,1,0,0|2,0,0]=4 19303 B16R1.3891 CCCCCCCCCCCOC1COC1 7a_100000210809_100009818527 [0,1,0,1,0,0|2,0,0]=4 19304 B16R1.3891 CCCCCCCCCCCOC1CSC1 7a_100000072292_100011215454 [0,1,0,1,0,0|2,0,0]=4 19305 B16R1.3891 CCCCCCCCCCNCC1CCC1 2230a_100000684558_100000763275 [0,1,0,1,0,0|1,0,1]=4 19306 B16R1.3891 CCCCCCCCCCNCC1CCC1 2230a_100000738700_100000210320 [0,1,0,1,0,0|1,0,1]=4 19307 B16R1.3891 CCCCCCCCCCNCC1CCC1 269862a_100000684558_100000753134 [0,1,0,1,0,0|1,0,1]=4 19308 B16R1.3891 CCCCCCCCCCNCC1CCC1 34a_100000684558_100000763275 [0,1,0,1,0,0|1,0,1]=4 19309 B16R1.3891 CCCCCCCCCCNCC1CCC1 34a_100000738700_100000210320 [0,1,0,1,0,0|1,0,1]=4 19310 B16R1.3891 CCCCCCCCCCNCC1CCO1 2230a_100000684558_100000103362 [0,1,0,1,0,0|0,0,2]=4 19311 B16R1.3891 CCCCCCCCCCNCC1CCO1 34a_100000684558_100000103362 [0,1,0,1,0,0|0,0,2]=4 19312 B16R1.3891 CCCCCCCCCCNCC1COC1 2230a_100000684558_100010264016 [0,1,0,1,0,0|2,0,0]=4 19313 B16R1.3891 CCCCCCCCCCNCC1COC1 2230a_100015281925_100000210320 [0,1,0,1,0,0|2,0,0]=4 19314 B16R1.3891 CCCCCCCCCCNCC1COC1 34a_100000684558_100010264016 [0,1,0,1,0,0|2,0,0]=4 19315 B16R1.3891 CCCCCCCCCCNCC1COC1 34a_100015281925_100000210320 [0,1,0,1,0,0|2,0,0]=4 19316 B16R1.3891 CCCCCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100000210320 [0,1,0,1,0,0|0,0,2]=4 19317 B16R1.3891 CCCCCCCCCCNC[C@@H]1CCO1 34a_100020831831_100000210320 [0,1,0,1,0,0|0,0,2]=4 19318 B16R1.3891 CCCCCCCCCCOCC1CCC1 34a_100000210711_100000763275 [0,1,0,1,0,0|1,0,1]=4 19319 B16R1.3891 CCCCCCCCCCOCC1CCC1 34a_100000760304_100000210320 [0,1,0,1,0,0|1,0,1]=4 19320 B16R1.3891 CCCCCCCCCCOCC1CCC1 7a_100000210711_100000763275 [0,1,0,1,0,0|1,0,1]=4 19321 B16R1.3891 CCCCCCCCCCOCC1CCO1 34a_100000039022_100000210320 [0,1,0,1,0,0|0,0,2]=4 19322 B16R1.3891 CCCCCCCCCCOCC1CCO1 34a_100000210711_100000103362 [0,1,0,1,0,0|0,0,2]=4 19323 B16R1.3891 CCCCCCCCCCOCC1CCO1 7a_100000210711_100000103362 [0,1,0,1,0,0|0,0,2]=4 19324 B16R1.3891 CCCCCCCCCCOCC1CNC1 34a_100016987283_100000210320 [0,1,0,1,0,0|2,0,0]=4 19325 B16R1.3891 CCCCCCCCCCOCC1COC1 34a_100000060846_100000210320 [0,1,0,1,0,0|2,0,0]=4 19326 B16R1.3891 CCCCCCCCCCOCC1COC1 34a_100000210711_100010264016 [0,1,0,1,0,0|2,0,0]=4 19327 B16R1.3891 CCCCCCCCCCOCC1COC1 7a_100000210711_100010264016 [0,1,0,1,0,0|2,0,0]=4 19328 B16R1.3891 CCCCCCCCCCSCC1CCC1 62a_100000763275_100000210320 [0,1,0,1,0,0|1,0,1]=4 19329 B16R1.3891 CCCCCCCCCCSCC1CCO1 62a_100000103362_100000210320 [0,1,0,1,0,0|0,0,2]=4 19330 B16R1.3891 CCCCCCCCCCSCC1COC1 62a_100010264016_100000210320 [0,1,0,1,0,0|2,0,0]=4 19331 B16R1.3891 CCCCCCCCCOCCC1COC1 34a_100009855314_100011214924 [0,1,0,1,0,0|2,0,0]=4 19332 B16R1.3891 ClCCCCCCCCCCOC1CCC1 34a_200000033068_100000749161 [0,1,0,1,0,0|1,0,1]=4 19333 B16R1.3891 ClCCCCCCCCCOCC1CCC1 34a_100009868337_100000763275 [0,1,0,1,0,0|1,0,1]=4 19334 B16R1.3891 ClCCCCCCCCCOCC1CCC1 7a_100009868337_100000763275 [0,1,0,1,0,0|1,0,1]=4 19335 B16R1.3891 NCCCCCCCCCCOC1CCC1 34a_100000066964_100000749161 [0,1,0,1,0,0|1,0,1]=4 19336 B16R1.3891 NCCCCCCCCCOCC1CCC1 34a_100000078944_100000763275 [0,1,0,1,0,0|1,0,1]=4 19337 B16R1.3891 OCCCCCCCCCCCN1CCC1 269982a_100000754969_100009812471 [0,1,0,1,0,0|0,0,2]=4 19338 B16R1.3891 OCCCCCCCCCCNC1CCC1 2230a_100000749019_100009813290 [0,1,0,1,0,0|0,0,2]=4 19339 B16R1.3891 OCCCCCCCCCCNC1CCC1 270004a_100000066964_100000241760 [0,1,0,1,0,0|0,0,2]=4 19340 B16R1.3891 OCCCCCCCCCCNC1CCC1 34a_100000066964_100000749161 [0,1,0,1,0,0|0,0,2]=4 19341 B16R1.3891 OCCCCCCCCCCNC1CCC1 34a_100000749019_100009813290 [0,1,0,1,0,0|0,0,2]=4 19342 B16R1.3891 OCCCCCCCCCCOC1CCC1 34a_100000748187_100009813290 [0,1,0,1,0,0|0,0,2]=4 19343 B16R1.3891 OCCCCCCCCCCSC1CCC1 62a_100009813290_100000749161 [0,1,0,1,0,0|0,0,2]=4 19344 B16R1.3891 OCCCCCCCCCNCC1CCC1 2230a_100000078944_100000763275 [0,1,0,1,0,0|0,0,2]=4 19345 B16R1.3891 OCCCCCCCCCNCC1CCC1 2230a_100000738700_100009813782 [0,1,0,1,0,0|0,0,2]=4 19346 B16R1.3891 OCCCCCCCCCNCC1CCC1 269862a_100000078944_100000753134 [0,1,0,1,0,0|0,0,2]=4 19347 B16R1.3891 OCCCCCCCCCNCC1CCC1 34a_100000078944_100000763275 [0,1,0,1,0,0|0,0,2]=4 19348 B16R1.3891 OCCCCCCCCCNCC1CCC1 34a_100000738700_100009813782 [0,1,0,1,0,0|0,0,2]=4 19349 B16R1.3891 OCCCCCCCCCOCC1CCC1 34a_100000760304_100009813782 [0,1,0,1,0,0|0,0,2]=4 19350 B16R1.3891 OCCCCCCCCCSCC1CCC1 62a_100000763275_100009813782 [0,1,0,1,0,0|0,0,2]=4 19351 B16R1.3891 OCCCCCCCCCSCC1CCC1 62a_100009813782_100000763275 [0,1,0,1,0,0|0,0,2]=4 19352 B16R1.3905 C=CCCCCNC1CCCC1CCCC 269862a_100000703577_100000750825 [0,1,0,1,0,0|1,0,0]=3 19353 B16R1.3905 C=CCCCCNC1CCCC1CCCC 270004a_100000703577_100000750825 [0,1,0,1,0,0|1,0,0]=3 19354 B16R1.3905 C=CCNC1CCCC1CCCCCCC 270004a_100020586998_200011216720 [0,1,0,1,0,0|1,0,0]=3 19355 B16R1.3905 C=COCCCNC1CCCC1CCCC 269862a_100000210767_100000750825 [0,1,0,1,0,0|2,0,0]=4 19356 B16R1.3905 C=COCCCNC1CCCC1CCCC 270004a_100000210767_100000750825 [0,1,0,1,0,0|2,0,0]=4 19357 B16R1.3905 CCCCC1C=CCN1CCCCCC=O 2230a_100015184376_100000139337 [0,1,0,1,0,0|0,0,2]=4 19358 B16R1.3905 CCCCC1C=CCN1CCCCCC=O 269982a_100015184376_100000139337 [0,1,0,1,0,0|0,0,2]=4 19359 B16R1.3905 CCCCC1CCCC1NCCCCC#N 270004a_100000751965_100000750825 [0,1,0,1,0,0|1,0,1]=4 19360 B16R1.3905 CCCCC1CCCC1NCCCCCO 269862a_100000762737_100000750825 [0,1,0,1,0,0|0,0,2]=4 19361 B16R1.3905 CCCCC1CCCC1NCCCCCO 270004a_100000762737_100000750825 [0,1,0,1,0,0|0,0,2]=4 19362 B16R1.3905 CCCCCCCC1CCCC1NCCC 269862a_100020643023_200011216720 [0,1,0,1,0,0|1,0,1]=4 19363 B16R1.3905 CCCCCCCC1CCCC1NCCC 270004a_100020643023_200011216720 [0,1,0,1,0,0|1,0,1]=4 19364 B16R1.3905 CCCCCCCC1CCCC1NCCF 269862a_100000724931_200011216720 [0,1,0,1,0,0|1,0,1]=4 19365 B16R1.3905 CCCCCCCC1CCCC1NCCO 269862a_100000210304_200011216720 [0,1,0,1,0,0|0,0,2]=4 19366 B16R1.3905 CCCCCCCC1CCCC1NCCO 270004a_100000210304_200011216720 [0,1,0,1,0,0|0,0,2]=4 19367 B16R1.3905 CCCCCCNC1CCCC1CCC#N 270004a_100000210581_100000073560 [0,1,0,1,0,0|1,0,1]=4 19368 B16R1.3905 CCCCCCNC1CCCC1CCCC 269862a_100000210581_100000750825 [0,1,0,1,0,0|1,0,1]=4 19369 B16R1.3905 CCCCCCNC1CCCC1CCCC 270004a_100000210581_100000750825 [0,1,0,1,0,0|1,0,1]=4 19370 B16R1.4697 C=CCCCCCCCN1CCC1COC 2230a_100015195929_100012355270 [0,1,0,1,0,0|2,0,0]=4 19371 B16R1.4697 C=CCCCCCCCN1CCC1COC 269982a_100015195929_100012355270 [0,1,0,1,0,0|2,0,0]=4 19372 B16R1.4697 C=CCCCCCCCN1CCC1COC 34a_100015195929_100012355270 [0,1,0,1,0,0|2,0,0]=4 19373 B16R1.4697 CCCCCCCCCN1CCC1COC 2230a_100015195929_100011214924 [0,1,0,1,0,0|2,0,0]=4 19374 B16R1.4697 CCCCCCCCCN1CCC1COC 269982a_100015195929_100000210670 [0,1,0,1,0,0|2,0,0]=4 19375 B16R1.4697 CCCCCCCCCN1CCC1COC 34a_100015195929_100011214924 [0,1,0,1,0,0|2,0,0]=4 19376 B16R1.6680 C#CCCCCCCCOC1CCCC1=O 34a_100000054614_100000709159 [0,1,0,1,0,0|0,0,2]=4 19377 B16R1.6680 C#CCCCCCCCOC1CCCC1=O 34a_200000719330_100153394163 [0,1,0,1,0,0|0,0,2]=4 19378 B16R1.6680 C#CCCCCCCCOC1CCCC1=O 7a_100000054614_100000211823 [0,1,0,1,0,0|0,0,2]=4 19379 B16R1.6680 C#CCCCCCCCOC1CCCC1C 34a_100011216460_100153394163 [0,1,0,1,0,0|1,0,1]=4 19380 B16R1.6680 C#CCCCCCCCOC1CCCC1C 7a_100011216460_100153394163 [0,1,0,1,0,0|1,0,1]=4 19381 B16R1.6680 C#CCCCCCCCSC1CCCC1=O 62a_100000211823_100153394163 [0,1,0,1,0,0|0,0,2]=4 19382 B16R1.6680 C#CCCCCCCCSC1CCCC1=O 62a_100153394163_100000211823 [0,1,0,1,0,0|0,0,2]=4 19383 B16R1.6680 C=CCCCCCCCCN1CCC[C@@H]1C 2230a_100020605311_100011933949 [0,1,0,1,0,0|1,0,0]=3 19384 B16R1.6680 C=CCCCCCCCCN1CCC[C@@H]1C 269982a_100020605311_100011933949 [0,1,0,1,0,0|1,0,0]=3 19385 B16R1.6680 C=CCCCCCCCCN1CCC[C@H]1C 2230a_100015189458_100011933949 [0,1,0,1,0,0|1,0,0]=3 19386 B16R1.6680 C=CCCCCCCCCN1CCC[C@H]1C 269982a_100015189458_100011933949 [0,1,0,1,0,0|1,0,0]=3 19387 B16R1.6680 C=CCCCCCCCCN1CCC[C@H]1C 34a_100015189458_100011933949 [0,1,0,1,0,0|1,0,0]=3 19388 B16R1.6680 C=CCCCCCCCCN1CCSC1C 2230a_200011216479_100011933949 [0,1,0,1,0,0|2,0,0]=4 19389 B16R1.6680 C=CCCCCCCCCN1CCSC1C 269982a_200011216479_100011933949 [0,1,0,1,0,0|2,0,0]=4 19390 B16R1.6680 C=CCCCCCCCCN1CCSC1C 34a_200011216479_100011933949 [0,1,0,1,0,0|2,0,0]=4 19391 B16R1.6680 C=CCCCCCCCOC1CCCC1=O 34a_100000730831_100000709159 [0,1,0,1,0,0|0,0,2]=4 19392 B16R1.6680 C=CCCCCCCCOC1CCCC1=O 34a_200000719330_100012355270 [0,1,0,1,0,0|0,0,2]=4 19393 B16R1.6680 C=CCCCCCCCOC1CCCC1=O 7a_100000730831_100000211823 [0,1,0,1,0,0|0,0,2]=4 19394 B16R1.6680 C=CCCCCCCCOC1CCCC1C 34a_100011216460_100012355270 [0,1,0,1,0,0|1,0,0]=3 19395 B16R1.6680 C=CCCCCCCCOC1CCCC1C 7a_100011216460_100012355270 [0,1,0,1,0,0|1,0,0]=3 19396 B16R1.6680 C=CCCCCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100012355270 [0,1,0,1,0,0|2,0,0]=4 19397 B16R1.6680 C=CCCCCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100012355270 [0,1,0,1,0,0|2,0,0]=4 19398 B16R1.6680 C=CCCCCCCCO[C@H]1CNC[C@H]1C 34a_200015306588_100012355270 [0,1,0,1,0,0|2,0,0]=4 19399 B16R1.6680 C=CCCCCCCCSC1CCCC1=O 62a_100000211823_100012355270 [0,1,0,1,0,0|0,0,2]=4 19400 B16R1.6680 C=CCCCCCCCSC1CCCC1=O 62a_100012355270_100000211823 [0,1,0,1,0,0|0,0,2]=4 19401 B16R1.6680 C=CCCCCCCCS[C@@H]1CCC[C@H]1O 62a_100012355270_200016002552 [0,1,0,1,0,0|2,0,0]=4 19402 B16R1.6680 C=CCCCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100012355270 [0,1,0,1,0,0|2,0,0]=4 19403 B16R1.6680 C=CCCCCCCOCC1CCCN1C 34a_100000743107_100011215473 [0,1,0,1,0,0|2,0,0]=4 19404 B16R1.6680 C=CCCCCCOCCC1CCCN1C 34a_100011215177_100000700193 [0,1,0,1,0,0|2,0,0]=4 19405 B16R1.6680 C=CCCCCCOCCC1CCCN1C 34a_100011216702_100000005710 [0,1,0,1,0,0|2,0,0]=4 19406 B16R1.6680 C=CCCCCCOCCC1CCCN1C 7a_100011215177_100000700193 [0,1,0,1,0,0|2,0,0]=4 19407 B16R1.6680 C=CCCCCCOCCC1CCCN1C 7a_100011216702_100000005710 [0,1,0,1,0,0|2,0,0]=4 19408 B16R1.6680 C=CCCCCCSCCC1CCCN1C 62a_100000005710_100000700193 [0,1,0,1,0,0|2,0,0]=4 19409 B16R1.6680 C=CCCCCCSCCC1CCCN1C 62a_100000700193_100000005710 [0,1,0,1,0,0|2,0,0]=4 19410 B16R1.6680 CC/C=C\CCCCCOC1CCCC1=O 34a_100016268722_100000709159 [0,1,0,1,0,0|0,0,2]=4 19411 B16R1.6680 CC/C=C\CCCCCOC1CCCC1=O 7a_100016268722_100000211823 [0,1,0,1,0,0|0,0,2]=4 19412 B16R1.6680 CC1CCCC1NCCCCCCCCO 269862a_102515433106_100000752053 [0,1,0,1,0,0|0,0,2]=4 19413 B16R1.6680 CC1CCCC1OCCCCCCCCO 34a_100011216460_100000033203 [0,1,0,1,0,0|0,0,2]=4 19414 B16R1.6680 CC1CCCC1OCCCCCCCCO 7a_100011216460_100000033203 [0,1,0,1,0,0|0,0,2]=4 19415 B16R1.6680 CCCCC#CCCCOC1CCCC1=O 34a_200000719330_200000047210 [0,1,0,1,0,0|0,0,2]=4 19416 B16R1.6680 CCCCC#CCCCSC1CCCC1=O 62a_100000211823_200000047210 [0,1,0,1,0,0|0,0,2]=4 19417 B16R1.6680 CCCCC#CCCCSC1CCCC1=O 62a_200000047210_100000211823 [0,1,0,1,0,0|0,0,2]=4 19418 B16R1.6680 CCCCC/C=C\CCOC1CCCC1=O 34a_100016277358_100000709159 [0,1,0,1,0,0|0,0,2]=4 19419 B16R1.6680 CCCCC/C=C\CCOC1CCCC1=O 7a_100016277358_100000211823 [0,1,0,1,0,0|0,0,2]=4 19420 B16R1.6680 CCCCCC#CCCOC1CCCC1=O 34a_200000042877_100000709159 [0,1,0,1,0,0|0,0,2]=4 19421 B16R1.6680 CCCCCC#CCCOC1CCCC1=O 7a_200000042877_100000211823 [0,1,0,1,0,0|0,0,2]=4 19422 B16R1.6680 CCCCCC/C=C/COC1CCCC1=O 34a_200016276170_100000709159 [0,1,0,1,0,0|0,0,2]=4 19423 B16R1.6680 CCCCCC/C=C/COC1CCCC1=O 7a_200016276170_100000211823 [0,1,0,1,0,0|0,0,2]=4 19424 B16R1.6680 CCCCCCC#CCOC1CCCC1=O 34a_200000037284_100000709159 [0,1,0,1,0,0|0,0,2]=4 19425 B16R1.6680 CCCCCCC#CCOC1CCCC1=O 7a_200000037284_100000211823 [0,1,0,1,0,0|0,0,2]=4 19426 B16R1.6680 CCCCCCCCCCN1CCC[C@@H]1C 2230a_100020605311_100000210320 [0,1,0,1,0,0|1,0,1]=4 19427 B16R1.6680 CCCCCCCCCCN1CCC[C@@H]1C 269982a_100020605311_100000210320 [0,1,0,1,0,0|1,0,1]=4 19428 B16R1.6680 CCCCCCCCCCN1CCC[C@H]1C 2230a_100015189458_100000210320 [0,1,0,1,0,0|1,0,1]=4 19429 B16R1.6680 CCCCCCCCCCN1CCC[C@H]1C 269982a_100015189458_100000210320 [0,1,0,1,0,0|1,0,1]=4 19430 B16R1.6680 CCCCCCCCCCN1CCC[C@H]1C 34a_100015189458_100000210320 [0,1,0,1,0,0|1,0,1]=4 19431 B16R1.6680 CCCCCCCCCNC1CCCC1=O 2230a_100000212291_100000211823 [0,1,0,1,0,0|0,0,0]=2 19432 B16R1.6680 CCCCCCCCCNC1CCCC1=O 34a_100000212291_100000709159 [0,1,0,1,0,0|0,0,0]=2 19433 B16R1.6680 CCCCCCCCCNC1CCCC1C 269862a_100000212291_100000752053 [0,1,0,1,0,0|1,0,1]=4 19434 B16R1.6680 CCCCCCCCCNC1CCNC1=O 2230a_100016995588_100011214924 [0,1,0,1,0,0|1,0,0]=3 19435 B16R1.6680 CCCCCCCCCNC1CCNC1=O 34a_100016995588_100011214924 [0,1,0,1,0,0|1,0,0]=3 19436 B16R1.6680 CCCCCCCCCNC1CCOC1=O 2230a_100000212291_100000211211 [0,1,0,1,0,0|1,0,0]=3 19437 B16R1.6680 CCCCCCCCCNC1CCOC1=O 34a_100000212291_100000211211 [0,1,0,1,0,0|1,0,0]=3 19438 B16R1.6680 CCCCCCCCCN[C@@H]1CONC1=O 2230a_100000765999_100011214924 [0,1,0,1,0,0|2,0,0]=4 19439 B16R1.6680 CCCCCCCCCN[C@@H]1CONC1=O 34a_100000765999_100011214924 [0,1,0,1,0,0|2,0,0]=4 19440 B16R1.6680 CCCCCCCCCOC1CCCC1=O 34a_100000210712_100000709159 [0,1,0,1,0,0|0,0,0]=2 19441 B16R1.6680 CCCCCCCCCOC1CCCC1=O 34a_200000719330_100011214924 [0,1,0,1,0,0|0,0,0]=2 19442 B16R1.6680 CCCCCCCCCOC1CCCC1=O 7a_100000210712_100000211823 [0,1,0,1,0,0|0,0,0]=2 19443 B16R1.6680 CCCCCCCCCOC1CCCC1C 34a_100011216460_100011214924 [0,1,0,1,0,0|1,0,1]=4 19444 B16R1.6680 CCCCCCCCCOC1CCCC1C 7a_100011216460_100000210328 [0,1,0,1,0,0|1,0,1]=4 19445 B16R1.6680 CCCCCCCCCOC1CCOC1=O 34a_100000210712_100000211211 [0,1,0,1,0,0|1,0,0]=3 19446 B16R1.6680 CCCCCCCCCOC1CCOC1=O 7a_100000210712_100000211211 [0,1,0,1,0,0|1,0,0]=3 19447 B16R1.6680 CCCCCCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100011214924 [0,1,0,1,0,0|1,0,1]=4 19448 B16R1.6680 CCCCCCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100011214924 [0,1,0,1,0,0|1,0,1]=4 19449 B16R1.6680 CCCCCCCCCO[C@H]1CCNC1=O 34a_100000688343_100011214924 [0,1,0,1,0,0|1,0,0]=3 19450 B16R1.6680 CCCCCCCCCSC1CCCC1=O 62a_100000211823_100000210670 [0,1,0,1,0,0|0,0,0]=2 19451 B16R1.6680 CCCCCCCCCSC1CCOC1=O 62a_100000211211_100000210670 [0,1,0,1,0,0|1,0,0]=3 19452 B16R1.6680 CCCCCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000210670 [0,1,0,1,0,0|0,0,2]=4 19453 B16R1.6680 CCCCCCCCOCC1=CCCC1=O 34a_100000087531_100000210759 [0,1,0,1,0,0|0,0,2]=4 19454 B16R1.6680 CCCCCCCCOCC1CCCN1C 34a_100000743107_100000210759 [0,1,0,1,0,0|2,0,0]=4 19455 B16R1.6680 CCCCCCCCOCC1CCNC1=O 34a_100000133458_100000210759 [0,1,0,1,0,0|1,0,0]=3 19456 B16R1.6680 CCCCCCCCSCN1CCCC1=O 62a_100000026320_100000210317 [0,1,0,1,0,0|1,0,0]=3 19457 B16R1.6680 CCCCCCCCSCN1CCCC1=O 62a_100000210759_100000026320 [0,1,0,1,0,0|1,0,0]=3 19458 B16R1.6680 CCCCCCCNCCC1CCCN1C 2230a_100000229938_100000005710 [0,1,0,1,0,0|2,0,0]=4 19459 B16R1.6680 CCCCCCCNCCN1CCCC1=O 2230a_100000229938_100000739059 [0,1,0,1,0,0|1,0,0]=3 19460 B16R1.6680 CCCCCCCNCCN1CCCC1=O 2230a_100011200922_100000210681 [0,1,0,1,0,0|1,0,0]=3 19461 B16R1.6680 CCCCCCCNCCN1CCNC1=O 2230a_100000229938_100000090651 [0,1,0,1,0,0|2,0,0]=4 19462 B16R1.6680 CCCCCCCNCCN1CCNC1=O 2230a_100011207550_100000210681 [0,1,0,1,0,0|2,0,0]=4 19463 B16R1.6680 CCCCCCCOCCC1CCCN1C 34a_100000210272_100000005710 [0,1,0,1,0,0|2,0,0]=4 19464 B16R1.6680 CCCCCCCOCCC1CCCN1C 34a_100011215177_100000210614 [0,1,0,1,0,0|2,0,0]=4 19465 B16R1.6680 CCCCCCCOCCC1CCCN1C 7a_100000210272_100000005710 [0,1,0,1,0,0|2,0,0]=4 19466 B16R1.6680 CCCCCCCOCCC1CCCN1C 7a_100011215177_100000210614 [0,1,0,1,0,0|2,0,0]=4 19467 B16R1.6680 CCCCCCCOCCN1CCCC1=O 34a_100000210272_100000739059 [0,1,0,1,0,0|1,0,0]=3 19468 B16R1.6680 CCCCCCCOCCN1CCCC1=O 34a_100000211209_100000210614 [0,1,0,1,0,0|1,0,0]=3 19469 B16R1.6680 CCCCCCCOCCN1CCCC1=O 7a_100000210272_100000739059 [0,1,0,1,0,0|1,0,0]=3 19470 B16R1.6680 CCCCCCCOCCN1CCCC1=O 7a_100000211209_100000210614 [0,1,0,1,0,0|1,0,0]=3 19471 B16R1.6680 CCCCCCCOCCN1CCNC1=O 34a_100000216532_100000210614 [0,1,0,1,0,0|2,0,0]=4 19472 B16R1.6680 CCCCCCCOCCN1CCNC1=O 7a_100000210272_100000090651 [0,1,0,1,0,0|2,0,0]=4 19473 B16R1.6680 CCCCCCCSCCC1CCCN1C 62a_100000005710_100000210316 [0,1,0,1,0,0|2,0,0]=4 19474 B16R1.6680 CCCCCCCSCCC1CCCN1C 62a_100000210614_100000005710 [0,1,0,1,0,0|2,0,0]=4 19475 B16R1.6680 CCCCCCCSCCN1CCCC1=O 62a_100000210614_100000739059 [0,1,0,1,0,0|1,0,0]=3 19476 B16R1.6680 CCCCCCCSCCN1CCCC1=O 62a_100000739059_100000210316 [0,1,0,1,0,0|1,0,0]=3 19477 B16R1.6680 CCCCCCCSCCN1CCNC1=O 62a_100000090651_100000210316 [0,1,0,1,0,0|2,0,0]=4 19478 B16R1.6680 CCCCCCCSCCN1CCNC1=O 62a_100000210614_100000090651 [0,1,0,1,0,0|2,0,0]=4 19479 B16R1.6680 CCCCCCNCCCN1CCCC1=O 2230a_100000210347_100000210314 [0,1,0,1,0,0|1,0,0]=3 19480 B16R1.6680 CCCCCCNCCCN1CCCC1=O 34a_100000210347_100000210314 [0,1,0,1,0,0|1,0,0]=3 19481 B16R1.6680 CCCCCCOCCCN1CCCC1=O 34a_100011216539_100000210314 [0,1,0,1,0,0|1,0,0]=3 19482 B16R1.6680 CCCCCCOCCCN1CCCC1=O 7a_100011216539_100000210314 [0,1,0,1,0,0|1,0,0]=3 19483 B16R1.6680 CCCCCCOCCOC1CCCC1=O 34a_100000691444_100000709159 [0,1,0,1,0,0|1,0,0]=3 19484 B16R1.6680 CCCCCCOCCOC1CCCC1=O 7a_100000691444_100000211823 [0,1,0,1,0,0|1,0,0]=3 19485 B16R1.6680 CCCCCCOCCOC1CCOC1=O 34a_100000691444_100000211211 [0,1,0,1,0,0|2,0,0]=4 19486 B16R1.6680 CCCCCCOCCOC1CCOC1=O 7a_100000691444_100000211211 [0,1,0,1,0,0|2,0,0]=4 19487 B16R1.6680 CCCCNCCCCOC1CCCC1=O 34a_200011216965_100000709159 [0,1,0,1,0,0|1,0,0]=3 19488 B16R1.6680 CCCCNCCCCOC1CCOC1=O 34a_200011216965_100000211211 [0,1,0,1,0,0|2,0,0]=4 19489 B16R1.6680 CCCCOCCCCOC1CCCC1=O 34a_200000760531_100000709159 [0,1,0,1,0,0|1,0,0]=3 19490 B16R1.6680 CCCCOCCCCOC1CCCC1=O 7a_200000760531_100000211823 [0,1,0,1,0,0|1,0,0]=3 19491 B16R1.6680 CCCCOCCCCOC1CCOC1=O 34a_200000760531_100000211211 [0,1,0,1,0,0|2,0,0]=4 19492 B16R1.6680 CCCCOCCCCOC1CCOC1=O 7a_200000760531_100000211211 [0,1,0,1,0,0|2,0,0]=4 19493 B16R1.6680 CCCCOCCNCCN1CCCC1=O 2230a_100011200922_100000743108 [0,1,0,1,0,0|2,0,0]=4 19494 B16R1.6680 CCCCOCCOCCN1CCCC1=O 34a_100000210238_100000739059 [0,1,0,1,0,0|2,0,0]=4 19495 B16R1.6680 CCCCOCCOCCN1CCCC1=O 34a_100000211209_100000743108 [0,1,0,1,0,0|2,0,0]=4 19496 B16R1.6680 CCCCOCCOCCN1CCCC1=O 7a_100000210238_100000739059 [0,1,0,1,0,0|2,0,0]=4 19497 B16R1.6680 CCCCOCCOCCN1CCCC1=O 7a_100000211209_100000743108 [0,1,0,1,0,0|2,0,0]=4 19498 B16R1.6680 CCCCOCCSCCN1CCCC1=O 62a_100000739059_100000743108 [0,1,0,1,0,0|2,0,0]=4 19499 B16R1.6680 CCCCOCCSCCN1CCCC1=O 62a_100000743108_100000739059 [0,1,0,1,0,0|2,0,0]=4 19500 B16R1.6680 CCCCOCNCCCN1CCCC1=O 2230a_100000210347_100011995733 [0,1,0,1,0,0|2,0,0]=4 19501 B16R1.6680 CCCCOCNCCCN1CCCC1=O 34a_100000210347_100011995733 [0,1,0,1,0,0|2,0,0]=4 19502 B16R1.6680 CCCCOCOCCCN1CCCC1=O 34a_100011216539_100011995733 [0,1,0,1,0,0|2,0,0]=4 19503 B16R1.6680 CCCCSCCNCCN1CCCC1=O 2230a_100025743550_100000739059 [0,1,0,1,0,0|2,0,0]=4 19504 B16R1.6680 CCCCSCCOCCN1CCCC1=O 34a_200000230436_100000739059 [0,1,0,1,0,0|2,0,0]=4 19505 B16R1.6680 CCCCSCCOCCN1CCCC1=O 7a_200000230436_100000739059 [0,1,0,1,0,0|2,0,0]=4 19506 B16R1.6680 CCCOCCCNCCN1CCCC1=O 2230a_100011217757_100000739059 [0,1,0,1,0,0|2,0,0]=4 19507 B16R1.6680 CCCOCCCNCCN1CCCC1=O 34a_100011217757_100000739059 [0,1,0,1,0,0|2,0,0]=4 19508 B16R1.6680 CCCOCCNCCCN1CCCC1=O 2230a_100000210347_100011215938 [0,1,0,1,0,0|2,0,0]=4 19509 B16R1.6680 CCCOCCNCCCN1CCCC1=O 34a_100000210347_100011215938 [0,1,0,1,0,0|2,0,0]=4 19510 B16R1.6680 CCCOCCOCCCN1CCCC1=O 34a_100011216539_100011215938 [0,1,0,1,0,0|2,0,0]=4 19511 B16R1.6680 CCCOCCOCCCN1CCCC1=O 7a_100011216539_100011215938 [0,1,0,1,0,0|2,0,0]=4 19512 B16R1.6680 CCCOCCOCCNC1CCCC1=O 2230a_200011904461_100000211823 [0,1,0,1,0,0|2,0,0]=4 19513 B16R1.6680 CCCOCCOCCNC1CCCC1=O 34a_200011904461_100000709159 [0,1,0,1,0,0|2,0,0]=4 19514 B16R1.6680 CCOCCCNCCCN1CCCC1=O 2230a_100000210347_100012232248 [0,1,0,1,0,0|2,0,0]=4 19515 B16R1.6680 CCOCCCNCCCN1CCCC1=O 34a_100000210347_100012232248 [0,1,0,1,0,0|2,0,0]=4 19516 B16R1.6680 CCOCCCOCCCN1CCCC1=O 34a_100011216539_100012232248 [0,1,0,1,0,0|2,0,0]=4 19517 B16R1.6680 CCOCCCOCCCN1CCCC1=O 7a_100011216539_100012232248 [0,1,0,1,0,0|2,0,0]=4 19518 B16R1.6680 CN1CCCC1CCOCCCCCC=O 7a_100011215177_100000139337 [0,1,0,1,0,0|1,0,0]=3 19519 B16R1.6680 CN1CCCC1CCSCCCCCC=O 62a_100000005710_100000139337 [0,1,0,1,0,0|1,0,0]=3 19520 B16R1.6680 CN1CCCC1CCSCCCCCC=O 62a_100000139337_100000005710 [0,1,0,1,0,0|1,0,0]=3 19521 B16R1.6680 CNCCCCCOCCN1CCCC1=O 34a_100000722520_100000739059 [0,1,0,1,0,0|2,0,0]=4 19522 B16R1.6680 COCCCCCCOCC1CCNC1=O 34a_100000133458_100011998445 [0,1,0,1,0,0|2,0,0]=4 19523 B16R1.6680 COCCCCCCSCN1CCCC1=O 62a_100000026320_100011998445 [0,1,0,1,0,0|2,0,0]=4 19524 B16R1.6680 COCCCCCCSCN1CCCC1=O 62a_100011998445_100000026320 [0,1,0,1,0,0|2,0,0]=4 19525 B16R1.6680 COCCCCCNCCN1CCCC1=O 2230a_100000747528_100000739059 [0,1,0,1,0,0|2,0,0]=4 19526 B16R1.6680 COCCCCCNCCN1CCCC1=O 34a_100000747528_100000739059 [0,1,0,1,0,0|2,0,0]=4 19527 B16R1.6680 COCCCCNCCCN1CCCC1=O 2230a_100000210347_100000730899 [0,1,0,1,0,0|2,0,0]=4 19528 B16R1.6680 COCCCCNCCCN1CCCC1=O 34a_100000210347_100000755781 [0,1,0,1,0,0|2,0,0]=4 19529 B16R1.6680 COCCCCOCCCN1CCCC1=O 34a_100011216539_100000755781 [0,1,0,1,0,0|2,0,0]=4 19530 B16R1.6680 COCCCCOCCCN1CCCC1=O 7a_100011216539_100000730899 [0,1,0,1,0,0|2,0,0]=4 19531 B16R1.6680 COCCCOCCCOC1CCCC1=O 34a_200011215475_100000709159 [0,1,0,1,0,0|2,0,0]=4 19532 B16R1.6680 COCCCOCCCOC1CCCC1=O 7a_200011215475_100000211823 [0,1,0,1,0,0|2,0,0]=4 19533 B16R1.6680 C[C@@H]1CCCN1CCCCCCCCCO 2230a_100015189458_100009813782 [0,1,0,1,0,0|0,0,2]=4 19534 B16R1.6680 C[C@@H]1CCCN1CCCCCCCCCO 269982a_100015189458_100009813782 [0,1,0,1,0,0|0,0,2]=4 19535 B16R1.6680 C[C@@H]1CCCN1CCCCCCCCCO 34a_100015189458_100009813782 [0,1,0,1,0,0|0,0,2]=4 19536 B16R1.6680 C[C@H]1CCCN1CCCCCCCCCO 2230a_100020605311_100009813782 [0,1,0,1,0,0|0,0,2]=4 19537 B16R1.6680 C[C@H]1CCCN1CCCCCCCCCO 269982a_100020605311_100009813782 [0,1,0,1,0,0|0,0,2]=4 19538 B16R1.6680 NCCCCCCCCOC1CCCC1=O 34a_102515433106_100000709159 [0,1,0,1,0,0|1,0,0]=3 19539 B16R1.6680 NCCCCCCCCOC1CCOC1=O 34a_102515433106_100000211211 [0,1,0,1,0,0|2,0,0]=4 19540 B16R1.6680 NCCCCCCOCCN1CCCC1=O 34a_100000686447_100000739059 [0,1,0,1,0,0|2,0,0]=4 19541 B16R1.6680 NCCNCCCCCOC1CCCC1=O 34a_103619048469_100000709159 [0,1,0,1,0,0|2,0,0]=4 19542 B16R1.6680 O=C1CCCC1NCCCCCCCCO 2230a_102515433106_100000211823 [0,1,0,1,0,0|1,0,0]=3 19543 B16R1.6680 O=C1CCCC1NCCCCCCCCO 34a_102515433106_100000709159 [0,1,0,1,0,0|1,0,0]=3 19544 B16R1.6680 O=C1CCCC1OCCCCCCCCBr 34a_100009813846_100000709159 [0,1,0,1,0,0|1,0,0]=3 19545 B16R1.6680 O=C1CCCC1OCCCCCCCCBr 7a_100009813846_100000211823 [0,1,0,1,0,0|1,0,0]=3 19546 B16R1.6680 O=C1CCCC1OCCCCCCCCCl 34a_100000033203_100000709159 [0,1,0,1,0,0|1,0,0]=3 19547 B16R1.6680 O=C1CCCC1OCCCCCCCCCl 7a_100000033203_100000211823 [0,1,0,1,0,0|1,0,0]=3 19548 B16R1.6680 O=C1CCCC1OCCCCCCCCO 34a_200000719330_100000033203 [0,1,0,1,0,0|1,0,0]=3 19549 B16R1.6680 O=C1CCCC1SCCCCCCCCO 62a_100000033203_100000211823 [0,1,0,1,0,0|1,0,0]=3 19550 B16R1.6680 O=C1CCCC1SCCCCCCCCO 62a_100000211823_100000033203 [0,1,0,1,0,0|1,0,0]=3 19551 B16R1.6680 O=C1CCCN1CCCNCCCCCF 2230a_100000210347_100000729378 [0,1,0,1,0,0|2,0,0]=4 19552 B16R1.6680 O=C1CCCN1CCCNCCCCCF 34a_100000210347_100000729378 [0,1,0,1,0,0|2,0,0]=4 19553 B16R1.6680 O=C1CCCN1CCCNCCCCCO 2230a_100000210347_100000746330 [0,1,0,1,0,0|2,0,0]=4 19554 B16R1.6680 O=C1CCCN1CCCNCCCCCO 34a_100000210347_100000746330 [0,1,0,1,0,0|2,0,0]=4 19555 B16R1.6680 O=C1CCCN1CCCOCCCCCF 34a_100011216539_100000729378 [0,1,0,1,0,0|2,0,0]=4 19556 B16R1.6680 O=C1CCCN1CCCOCCCCCF 7a_100011216539_100000729378 [0,1,0,1,0,0|2,0,0]=4 19557 B16R1.6680 O=C1CCCN1CCCOCCCCCO 34a_100011216539_100000746330 [0,1,0,1,0,0|2,0,0]=4 19558 B16R1.6680 O=C1CCCN1CCCOCCCCCO 7a_100011216539_100000746330 [0,1,0,1,0,0|2,0,0]=4 19559 B16R1.6680 O=C1CCCN1CCNCCCCCCF 2230a_100011200922_100015922095 [0,1,0,1,0,0|2,0,0]=4 19560 B16R1.6680 O=C1CCCN1CCNCCCCCCO 2230a_100000686447_100000739059 [0,1,0,1,0,0|2,0,0]=4 19561 B16R1.6680 O=C1CCCN1CCNCCCCCCO 2230a_100011200922_100000766143 [0,1,0,1,0,0|2,0,0]=4 19562 B16R1.6680 O=C1CCCN1CCNCCCCCCO 34a_100000686447_100000739059 [0,1,0,1,0,0|2,0,0]=4 19563 B16R1.6680 O=C1CCCN1CCOCCCCCCBr 34a_100011215345_100000739059 [0,1,0,1,0,0|2,0,0]=4 19564 B16R1.6680 O=C1CCCN1CCOCCCCCCBr 7a_100011215345_100000739059 [0,1,0,1,0,0|2,0,0]=4 19565 B16R1.6680 O=C1CCCN1CCOCCCCCCCl 34a_100000766143_100000739059 [0,1,0,1,0,0|2,0,0]=4 19566 B16R1.6680 O=C1CCCN1CCOCCCCCCCl 7a_100000766143_100000739059 [0,1,0,1,0,0|2,0,0]=4 19567 B16R1.6680 O=C1CCCN1CCOCCCCCCF 34a_100000211209_100015922095 [0,1,0,1,0,0|2,0,0]=4 19568 B16R1.6680 O=C1CCCN1CCOCCCCCCF 34a_100000732779_100000739059 [0,1,0,1,0,0|2,0,0]=4 19569 B16R1.6680 O=C1CCCN1CCOCCCCCCF 7a_100000211209_100015922095 [0,1,0,1,0,0|2,0,0]=4 19570 B16R1.6680 O=C1CCCN1CCOCCCCCCF 7a_100000732779_100000739059 [0,1,0,1,0,0|2,0,0]=4 19571 B16R1.6680 O=C1CCCN1CCOCCCCCCO 34a_100000211209_100000766143 [0,1,0,1,0,0|2,0,0]=4 19572 B16R1.6680 O=C1CCCN1CCOCCCCCCO 7a_100000211209_100000766143 [0,1,0,1,0,0|2,0,0]=4 19573 B16R1.6680 O=C1CCCN1CCSCCCCCCF 62a_100000739059_100015922095 [0,1,0,1,0,0|2,0,0]=4 19574 B16R1.6680 O=C1CCCN1CCSCCCCCCF 62a_100015922095_100000739059 [0,1,0,1,0,0|2,0,0]=4 19575 B16R1.6680 O=C1CCCN1CCSCCCCCCO 62a_100000739059_100000766143 [0,1,0,1,0,0|2,0,0]=4 19576 B16R1.6680 O=C1CCCN1CCSCCCCCCO 62a_100000766143_100000739059 [0,1,0,1,0,0|2,0,0]=4 19577 B16R1.6680 O=C1CCCN1CSCCCCCCCO 62a_100000026320_100000760002 [0,1,0,1,0,0|2,0,0]=4 19578 B16R1.6680 O=C1CCCN1CSCCCCCCCO 62a_100000760002_100000026320 [0,1,0,1,0,0|2,0,0]=4 19579 B16R1.6680 O=C1NCCC1COCCCCCCCO 34a_100000133458_100000760002 [0,1,0,1,0,0|2,0,0]=4 19580 B16R1.6680 O=C1NCCC1NCCCCCCCCO 2230a_100016995588_100000033203 [0,1,0,1,0,0|2,0,0]=4 19581 B16R1.6680 O=C1NCCC1NCCCCCCCCO 34a_100016995588_100000033203 [0,1,0,1,0,0|2,0,0]=4 19582 B16R1.6680 O=C1NCC[C@@H]1OCCCCCCCCO 34a_100000688343_100000033203 [0,1,0,1,0,0|2,0,0]=4 19583 B16R1.6680 O=C1OCCC1NCCCCCCCCO 2230a_102515433106_100000211211 [0,1,0,1,0,0|2,0,0]=4 19584 B16R1.6680 O=C1OCCC1NCCCCCCCCO 34a_102515433106_100000211211 [0,1,0,1,0,0|2,0,0]=4 19585 B16R1.6680 O=C1OCCC1OCCCCCCCCBr 34a_100009813846_100000211211 [0,1,0,1,0,0|2,0,0]=4 19586 B16R1.6680 O=C1OCCC1OCCCCCCCCBr 7a_100009813846_100000211211 [0,1,0,1,0,0|2,0,0]=4 19587 B16R1.6680 O=C1OCCC1OCCCCCCCCCl 34a_100000033203_100000211211 [0,1,0,1,0,0|2,0,0]=4 19588 B16R1.6680 O=C1OCCC1OCCCCCCCCCl 7a_100000033203_100000211211 [0,1,0,1,0,0|2,0,0]=4 19589 B16R1.6680 O=C1OCCC1SCCCCCCCCO 62a_100000033203_100000211211 [0,1,0,1,0,0|2,0,0]=4 19590 B16R1.6680 O=C1OCCC1SCCCCCCCCO 62a_100000211211_100000033203 [0,1,0,1,0,0|2,0,0]=4 19591 B16R1.6688 C#CCCCCCCCCOC1CCC1=O 34a_100000065265_100009892977 [0,1,0,1,0,0|0,0,2]=4 19592 B16R1.6688 C#CCCCCCCCCOC1CCC1=O 7a_100000065265_100009892977 [0,1,0,1,0,0|0,0,2]=4 19593 B16R1.6688 C#CCCCCCCOCCC1CCC1=O 7a_100011217361_200016118888 [0,1,0,1,0,0|0,0,2]=4 19594 B16R1.6688 C#CCCCCCCSCCC1CCC1=O 62a_100012276617_200016118888 [0,1,0,1,0,0|0,0,2]=4 19595 B16R1.6688 C#CCCCCCCSCCC1CCC1=O 62a_200016118888_100012276617 [0,1,0,1,0,0|0,0,2]=4 19596 B16R1.6688 C=CCCCCCCCCCN1CCC1C 269982a_100000755817_100009814027 [0,1,0,1,0,0|1,0,0]=3 19597 B16R1.6688 C=CCCCCCCCCCN1CCC1C 34a_100000755817_100009814027 [0,1,0,1,0,0|1,0,0]=3 19598 B16R1.6688 C=CCCCCCCCCOC1CCC1=O 34a_100011215194_100009892977 [0,1,0,1,0,0|0,0,2]=4 19599 B16R1.6688 C=CCCCCCCCCOC1CCC1=O 7a_100011215194_100009892977 [0,1,0,1,0,0|0,0,2]=4 19600 B16R1.6688 C=CCCCCCCCCSC1CCC1=O 62a_100009892977_100011933949 [0,1,0,1,0,0|0,0,2]=4 19601 B16R1.6688 C=CCCCCCCCCSC1CCC1=O 62a_100011933949_100009892977 [0,1,0,1,0,0|0,0,2]=4 19602 B16R1.6688 C=CCCCCCCOCCC1CCC1=O 7a_200011216477_200016118888 [0,1,0,1,0,0|0,0,2]=4 19603 B16R1.6688 C=CCCCCCCSCCC1CCC1=O 62a_100011215473_200016118888 [0,1,0,1,0,0|0,0,2]=4 19604 B16R1.6688 C=CCCCCCCSCCC1CCC1=O 62a_200016118888_100011215473 [0,1,0,1,0,0|0,0,2]=4 19605 B16R1.6688 CC/C=C\CCCCOCCC1CCC1=O 7a_100016287862_200016118888 [0,1,0,1,0,0|0,0,2]=4 19606 B16R1.6688 CC1CCN1CCCCCCCCCCO 269982a_100000755817_100009813290 [0,1,0,1,0,0|0,0,2]=4 19607 B16R1.6688 CC1CCN1CCCCCCCCCCO 34a_100000755817_100009813290 [0,1,0,1,0,0|0,0,2]=4 19608 B16R1.6688 CCC#CCCCCCCSC1CCC1=O 62a_100009892977_200000036426 [0,1,0,1,0,0|0,0,2]=4 19609 B16R1.6688 CCC#CCCCCCCSC1CCC1=O 62a_200000036426_100009892977 [0,1,0,1,0,0|0,0,2]=4 19610 B16R1.6688 CCCC/C=C/CCCCOC1CCC1=O 34a_200020645093_100009892977 [0,1,0,1,0,0|0,0,2]=4 19611 B16R1.6688 CCCC/C=C/CCCCOC1CCC1=O 7a_200020645093_100009892977 [0,1,0,1,0,0|0,0,2]=4 19612 B16R1.6688 CCCC/C=C\CCOCCC1CCC1=O 7a_200016286491_200016118888 [0,1,0,1,0,0|0,0,2]=4 19613 B16R1.6688 CCCCC#CCCCCOC1CCC1=O 34a_200000066234_100009892977 [0,1,0,1,0,0|0,0,2]=4 19614 B16R1.6688 CCCCC#CCCCCOC1CCC1=O 7a_200000066234_100009892977 [0,1,0,1,0,0|0,0,2]=4 19615 B16R1.6688 CCCCC#CCCOCCC1CCC1=O 7a_100000037610_200016118888 [0,1,0,1,0,0|0,0,2]=4 19616 B16R1.6688 CCCCC/C=C/COCCC1CCC1=O 7a_100016258190_200016118888 [0,1,0,1,0,0|0,0,2]=4 19617 B16R1.6688 CCCCC/C=C\CCCOC1CCC1=O 34a_100020655193_100009892977 [0,1,0,1,0,0|0,0,2]=4 19618 B16R1.6688 CCCCC/C=C\CCCOC1CCC1=O 7a_100020655193_100009892977 [0,1,0,1,0,0|0,0,2]=4 19619 B16R1.6688 CCCCCC#CCOCCC1CCC1=O 7a_200000033628_200016118888 [0,1,0,1,0,0|0,0,2]=4 19620 B16R1.6688 CCCCCC#CCSCCC1CCC1=O 62a_100009816472_200016118888 [0,1,0,1,0,0|0,0,2]=4 19621 B16R1.6688 CCCCCC#CCSCCC1CCC1=O 62a_200016118888_100009816472 [0,1,0,1,0,0|0,0,2]=4 19622 B16R1.6688 CCCCCCC#CCCOC1CCC1=O 34a_200000033163_100009892977 [0,1,0,1,0,0|0,0,2]=4 19623 B16R1.6688 CCCCCCC#CCCOC1CCC1=O 7a_200000033163_100009892977 [0,1,0,1,0,0|0,0,2]=4 19624 B16R1.6688 CCCCCCCC#CCOC1CCC1=O 34a_200000061759_100009892977 [0,1,0,1,0,0|0,0,2]=4 19625 B16R1.6688 CCCCCCCC#CCOC1CCC1=O 7a_200000061759_100009892977 [0,1,0,1,0,0|0,0,2]=4 19626 B16R1.6688 CCCCCCCCCCCN1CCC1C 269982a_100000755817_100011215454 [0,1,0,1,0,0|1,0,1]=4 19627 B16R1.6688 CCCCCCCCCCCN1CCC1C 34a_100000755817_100011215454 [0,1,0,1,0,0|1,0,1]=4 19628 B16R1.6688 CCCCCCCCCCNC1CCC1=O 34a_100000684558_100009892977 [0,1,0,1,0,0|0,0,0]=2 19629 B16R1.6688 CCCCCCCCCCOC1CCC1=O 34a_100000210711_100009892977 [0,1,0,1,0,0|0,0,0]=2 19630 B16R1.6688 CCCCCCCCCCOC1CCC1=O 7a_100000210711_100009892977 [0,1,0,1,0,0|0,0,0]=2 19631 B16R1.6688 CCCCCCCCCCSC1CCC1=O 62a_100009892977_100000210320 [0,1,0,1,0,0|0,0,0]=2 19632 B16R1.6688 CCCCCCCCNCCC1CCC1=O 2230a_100000229939_200016118888 [0,1,0,1,0,0|0,0,0]=2 19633 B16R1.6688 CCCCCCCCOCCC1CCC1=O 7a_100000210232_200016118888 [0,1,0,1,0,0|0,0,0]=2 19634 B16R1.6688 CCCCCCCCSCCC1CCC1=O 62a_100000210759_200016118888 [0,1,0,1,0,0|0,0,0]=2 19635 B16R1.6688 CCCCCCCCSCCC1CCC1=O 62a_200016118888_100000210317 [0,1,0,1,0,0|0,0,0]=2 19636 B16R1.6688 CCCCCOCCOCCC1CCC1=O 7a_100011215259_200016118888 [0,1,0,1,0,0|1,0,0]=3 19637 B16R1.6688 CCCCOCCCNCCC1CCC1=O 2230a_200000211371_200016118888 [0,1,0,1,0,0|1,0,0]=3 19638 B16R1.6688 CCCCOCCCOCCC1CCC1=O 7a_200011215613_200016118888 [0,1,0,1,0,0|1,0,0]=3 19639 B16R1.6688 CCCCOCCOCCOC1CCC1=O 34a_100011215186_100009892977 [0,1,0,1,0,0|2,0,0]=4 19640 B16R1.6688 CCCCOCCOCCOC1CCC1=O 7a_100011215186_100009892977 [0,1,0,1,0,0|2,0,0]=4 19641 B16R1.6688 CCOCCOCCNCCC1CCC1=O 2230a_100102712874_200016118888 [0,1,0,1,0,0|2,0,0]=4 19642 B16R1.6688 CCOCCOCCOCCC1CCC1=O 7a_100000210240_200016118888 [0,1,0,1,0,0|2,0,0]=4 19643 B16R1.6688 CCOCCOCCSCCC1CCC1=O 62a_100011211534_200016118888 [0,1,0,1,0,0|2,0,0]=4 19644 B16R1.6688 CCOCCOCCSCCC1CCC1=O 62a_200016118888_100011211534 [0,1,0,1,0,0|2,0,0]=4 19645 B16R1.6688 COCCCCCCOCCC1CCC1=O 7a_200012092642_200016118888 [0,1,0,1,0,0|1,0,0]=3 19646 B16R1.6688 COCCCCCCSCCC1CCC1=O 62a_100011998445_200016118888 [0,1,0,1,0,0|1,0,0]=3 19647 B16R1.6688 COCCCCCCSCCC1CCC1=O 62a_200016118888_100011998445 [0,1,0,1,0,0|1,0,0]=3 19648 B16R1.6688 COCCOCCCNCCC1CCC1=O 2230a_100000206027_200016118888 [0,1,0,1,0,0|2,0,0]=4 19649 B16R1.6688 COCCOCCCSCCC1CCC1=O 62a_100011216529_200016118888 [0,1,0,1,0,0|2,0,0]=4 19650 B16R1.6688 COCCOCCCSCCC1CCC1=O 62a_200016118888_100011216529 [0,1,0,1,0,0|2,0,0]=4 19651 B16R1.6688 N#CCCCCCCSCCC1CCC1=O 62a_100009813337_200016118888 [0,1,0,1,0,0|1,0,1]=4 19652 B16R1.6688 N#CCCCCCCSCCC1CCC1=O 62a_200016118888_100009813337 [0,1,0,1,0,0|1,0,1]=4 19653 B16R1.6688 NCCCCCCCCCOC1CCC1=O 34a_100000078944_100009892977 [0,1,0,1,0,0|1,0,0]=3 19654 B16R1.6688 O=C1CCC1CCNCCCCCCCO 2230a_100011996573_200016118888 [0,1,0,1,0,0|1,0,0]=3 19655 B16R1.6688 O=C1CCC1CCNCCCOCCCO 2230a_100011310245_200016118888 [0,1,0,1,0,0|2,0,0]=4 19656 B16R1.6688 O=C1CCC1CCOCCCCCCCBr 7a_100000760002_200016118888 [0,1,0,1,0,0|1,0,0]=3 19657 B16R1.6688 O=C1CCC1CCSCCCCCCCO 62a_100000760002_200016118888 [0,1,0,1,0,0|1,0,0]=3 19658 B16R1.6688 O=C1CCC1CCSCCCCCCCO 62a_200016118888_100000760002 [0,1,0,1,0,0|1,0,0]=3 19659 B16R1.6688 O=C1CCC1NCCCCCCCCCO 34a_100000078944_100009892977 [0,1,0,1,0,0|1,0,0]=3 19660 B16R1.6688 O=C1CCC1OCCCCCCCCCBr 34a_100009813782_100009892977 [0,1,0,1,0,0|1,0,0]=3 19661 B16R1.6688 O=C1CCC1OCCCCCCCCCBr 7a_100009813782_100009892977 [0,1,0,1,0,0|1,0,0]=3 19662 B16R1.6688 O=C1CCC1OCCCCCCCCCCl 34a_100009868337_100009892977 [0,1,0,1,0,0|1,0,0]=3 19663 B16R1.6688 O=C1CCC1OCCCCCCCCCCl 7a_100009868337_100009892977 [0,1,0,1,0,0|1,0,0]=3 19664 B16R1.6688 O=C1CCC1SCCCCCCCCCO 62a_100009813782_100009892977 [0,1,0,1,0,0|1,0,0]=3 19665 B16R1.6688 O=C1CCC1SCCCCCCCCCO 62a_100009892977_100009813782 [0,1,0,1,0,0|1,0,0]=3 19666 B16R1.7352 C#CCNC1CCCCCCCCCCC1 2230a_100011194316_100000038162 [0,1,0,1,0,0|1,0,1]=4 19667 B16R1.7352 C#CCNC1CCCCCCCCCCC1 34a_100011194316_100000184674 [0,1,0,1,0,0|1,0,1]=4 19668 B16R1.7352 C#CCOC1CCCCCCCCCCC1 34a_100000211378_100000184674 [0,1,0,1,0,0|1,0,1]=4 19669 B16R1.7352 C#CCOC1CCCCCCCCCCC1 7a_100000211378_100000038162 [0,1,0,1,0,0|1,0,1]=4 19670 B16R1.7352 C=CCNC1CCCCCCCCCCC1 2230a_100011194316_100000210623 [0,1,0,1,0,0|1,0,0]=3 19671 B16R1.7352 C=CCNC1CCCCCCCCCCC1 270004a_100020586998_100000210130 [0,1,0,1,0,0|1,0,0]=3 19672 B16R1.7352 C=CCNC1CCCCCCCCCCC1 34a_100011194316_100015514636 [0,1,0,1,0,0|1,0,0]=3 19673 B16R1.7352 C=CCOC1CCCCCCCCCCC1 34a_100000211378_100015514636 [0,1,0,1,0,0|1,0,0]=3 19674 B16R1.7352 C=CCOC1CCCCCCCCCCC1 7a_100000211378_100015514636 [0,1,0,1,0,0|1,0,0]=3 19675 B16R1.7352 CCCNC1CCCCCCCCCCC1 2230a_100011194316_100000210303 [0,1,0,1,0,0|1,0,1]=4 19676 B16R1.7352 CCCNC1CCCCCCCCCCC1 270004a_100020643023_100000210130 [0,1,0,1,0,0|1,0,1]=4 19677 B16R1.7352 CCCNC1CCCCCCCCCCC1 34a_100011194316_100000210303 [0,1,0,1,0,0|1,0,1]=4 19678 B16R1.7352 CCCOC1CCCCCCCCCCC1 34a_100000211378_100000210303 [0,1,0,1,0,0|1,0,1]=4 19679 B16R1.7352 CCCOC1CCCCCCCCCCC1 7a_100000211378_100000210303 [0,1,0,1,0,0|1,0,1]=4 19680 B16R1.7352 COCNC1CCCCCCCCCCC1 2230a_100011194316_100000766300 [0,1,0,1,0,0|2,0,0]=4 19681 B16R1.7352 CSCNC1CCCCCCCCCCC1 2230a_100011194316_100011218213 [0,1,0,1,0,0|2,0,0]=4 19682 B16R1.7352 CSCNC1CCCCCCCCCCC1 34a_100011194316_100011218213 [0,1,0,1,0,0|2,0,0]=4 19683 B16R1.7352 CSCOC1CCCCCCCCCCC1 34a_100000211378_100011218213 [0,1,0,1,0,0|2,0,0]=4 19684 B16R1.7352 FCCNC1CCCCCCCCCCC1 2230a_100011194316_100011217306 [0,1,0,1,0,0|1,0,1]=4 19685 B16R1.7352 FCCNC1CCCCCCCCCCC1 34a_100011194316_100011217306 [0,1,0,1,0,0|1,0,1]=4 19686 B16R1.7352 FCCOC1CCCCCCCCCCC1 34a_100000211378_100011217306 [0,1,0,1,0,0|1,0,1]=4 19687 B16R1.7352 FCCOC1CCCCCCCCCCC1 7a_100000211378_100011217306 [0,1,0,1,0,0|1,0,1]=4 19688 B16R1.7352 N#CCNC1CCCCCCCCCCC1 2230a_100011194316_100011215382 [0,1,0,1,0,0|1,0,1]=4 19689 B16R1.7352 N#CCOC1CCCCCCCCCCC1 7a_100000211378_100011215382 [0,1,0,1,0,0|1,0,1]=4 19690 B16R1.7352 O=CCNC1CCCCCCCCCCC1 2230a_100011194316_200015260668 [0,1,0,1,0,0|0,0,0]=2 19691 B16R1.7352 O=CCNC1CCCCCCCCCCC1 34a_100011194316_200009817547 [0,1,0,1,0,0|0,0,0]=2 19692 B16R1.7352 O=CCOC1CCCCCCCCCCC1 34a_100000211378_200009817547 [0,1,0,1,0,0|0,0,0]=2 19693 B16R1.7352 O=CCOC1CCCCCCCCCCC1 7a_100000211378_200015260668 [0,1,0,1,0,0|0,0,0]=2 19694 B16R1.7352 OCCNC1CCCCCCCCCCC1 2230a_100011194316_100000211926 [0,1,0,1,0,0|0,0,2]=4 19695 B16R1.7352 OCCNC1CCCCCCCCCCC1 270004a_100000210304_100000210130 [0,1,0,1,0,0|0,0,2]=4 19696 B16R1.7352 OCCNC1CCCCCCCCCCC1 34a_100011194316_100000211926 [0,1,0,1,0,0|0,0,2]=4 19697 B16R1.7352 OCCOC1CCCCCCCCCCC1 34a_100000211378_100000211926 [0,1,0,1,0,0|0,0,2]=4 19698 B16R1.7352 OCCOC1CCCCCCCCCCC1 7a_100000211378_100000211926 [0,1,0,1,0,0|0,0,2]=4 19699 B16R1.8376 C=CCCCCCCN1CCC[C@H]1COC 2230a_100020646714_100011215473 [0,1,0,1,0,0|2,0,0]=4 19700 B16R1.8376 C=CCCCCCCN1CCC[C@H]1COC 269982a_100020646714_100011215473 [0,1,0,1,0,0|2,0,0]=4 19701 B16R1.8376 C=CCCCCCCN1CCC[C@H]1COC 34a_100020646714_100011215473 [0,1,0,1,0,0|2,0,0]=4 19702 B16R1.8376 C=CCCCCOCC1CCCN1CCC 34a_200000694710_100011215482 [0,1,0,1,0,0|2,0,0]=4 19703 B16R1.8376 C=CCCCCOCC1CCCN1CCC 7a_200000694710_100011215482 [0,1,0,1,0,0|2,0,0]=4 19704 B16R1.8376 CCCC1CCCC1NCCCCCC#N 270004a_100000061152_100000723119 [0,1,0,1,0,0|1,0,1]=4 19705 B16R1.8376 CCCC1CCCC1NCCCCCCO 269862a_100000686447_100000723119 [0,1,0,1,0,0|0,0,2]=4 19706 B16R1.8376 CCCC1CCCC1NCCCCCCO 270004a_100000686447_100000723119 [0,1,0,1,0,0|0,0,2]=4 19707 B16R1.8376 CCCC1CCCC1NCCCCCOC 269862a_100000747528_100000723119 [0,1,0,1,0,0|2,0,0]=4 19708 B16R1.8376 CCCC1CCCC1NCCCCCOC 270004a_100000747528_100000723119 [0,1,0,1,0,0|2,0,0]=4 19709 B16R1.8376 CCCCCCCCN1CCC[C@H]1COC 2230a_100020646714_100000210759 [0,1,0,1,0,0|2,0,0]=4 19710 B16R1.8376 CCCCCCCCN1CCC[C@H]1COC 269982a_100020646714_100000210759 [0,1,0,1,0,0|2,0,0]=4 19711 B16R1.8376 CCCCCCCCN1CCC[C@H]1COC 34a_100020646714_100000210759 [0,1,0,1,0,0|2,0,0]=4 19712 B16R1.8376 CCCCCCCNC1CCCC1CCC 269862a_100000229938_100000723119 [0,1,0,1,0,0|1,0,1]=4 19713 B16R1.8376 CCCCCCCNC1CCCC1CCC 270004a_100000229938_100000723119 [0,1,0,1,0,0|1,0,1]=4 19714 B16R1.8376 CCCN1CCCC1COCCCCC=O 7a_200000694710_100000139335 [0,1,0,1,0,0|1,0,0]=3 19715 B16R1.8379 C#CCCCCCCN1CCCCCCC1 2230a_100000211400_100012276617 [0,1,0,1,0,0|1,0,1]=4 19716 B16R1.8379 C#CCCCCCCN1CCCCCCC1 269982a_100000211400_100012276617 [0,1,0,1,0,0|1,0,1]=4 19717 B16R1.8379 C#CCCCCCCN1CCCCCCC1 34a_100000211400_100012276617 [0,1,0,1,0,0|1,0,1]=4 19718 B16R1.8379 C#CCCCCCNC1CCCCCCC1 2230a_100000211152_100012094781 [0,1,0,1,0,0|1,0,1]=4 19719 B16R1.8379 C#CCCCCCNC1CCCCCCC1 34a_100000211152_100012094781 [0,1,0,1,0,0|1,0,1]=4 19720 B16R1.8379 C#CCCCCCOC1CCCCCCC1 34a_100000210054_100012094781 [0,1,0,1,0,0|1,0,1]=4 19721 B16R1.8379 C#CCCCCCOC1CCCCCCC1 7a_100000210054_100012094781 [0,1,0,1,0,0|1,0,1]=4 19722 B16R1.8379 C#CCCCCOCC1CCCCCCC1 34a_100011216312_100010269958 [0,1,0,1,0,0|1,0,1]=4 19723 B16R1.8379 C#CCCCCOCC1CCCCCCC1 7a_100011216312_100010269958 [0,1,0,1,0,0|1,0,1]=4 19724 B16R1.8379 C#CCCCNCCC1CCCCCCC1 2230a_100011532352_100000731252 [0,1,0,1,0,0|1,0,1]=4 19725 B16R1.8379 C#CCCCNCCC1CCCCCCC1 34a_100011532352_100000695029 [0,1,0,1,0,0|1,0,1]=4 19726 B16R1.8379 C=CCCCCCCN1CCCCCCC1 2230a_100000211400_100011215473 [0,1,0,1,0,0|1,0,0]=3 19727 B16R1.8379 C=CCCCCCCN1CCCCCCC1 269982a_100000211400_100011215473 [0,1,0,1,0,0|1,0,0]=3 19728 B16R1.8379 C=CCCCCCCN1CCCCCCC1 34a_100000211400_100011215473 [0,1,0,1,0,0|1,0,0]=3 19729 B16R1.8379 C=CCCCCCNC1CCCCCCC1 2230a_100000211152_100000700193 [0,1,0,1,0,0|1,0,0]=3 19730 B16R1.8379 C=CCCCCCNC1CCCCCCC1 34a_100000211152_100000700193 [0,1,0,1,0,0|1,0,0]=3 19731 B16R1.8379 C=CCCCCCOC1CCCCCCC1 34a_100000210054_100000700193 [0,1,0,1,0,0|1,0,0]=3 19732 B16R1.8379 C=CCCCCCOC1CCCCCCC1 7a_100000210054_100000700193 [0,1,0,1,0,0|1,0,0]=3 19733 B16R1.8379 C=CCCCCOCC1CCCCCCC1 34a_100011216312_100011215482 [0,1,0,1,0,0|1,0,0]=3 19734 B16R1.8379 C=CCCCCOCC1CCCCCCC1 7a_100011216312_100011215482 [0,1,0,1,0,0|1,0,0]=3 19735 B16R1.8379 C=CCCCNCCC1CCCCCCC1 2230a_100011532352_100011713584 [0,1,0,1,0,0|1,0,0]=3 19736 B16R1.8379 C=CCCCNCCC1CCCCCCC1 34a_100011532352_100000757094 [0,1,0,1,0,0|1,0,0]=3 19737 B16R1.8379 C=COCCNCCC1CCCCCCC1 2230a_100011532352_100000039644 [0,1,0,1,0,0|2,0,0]=4 19738 B16R1.8379 C=COCCNCCC1CCCCCCC1 34a_100011532352_100000039644 [0,1,0,1,0,0|2,0,0]=4 19739 B16R1.8379 CCCCCCCCN1CCCCCCC1 2230a_100000211400_100000210759 [0,1,0,1,0,0|1,0,1]=4 19740 B16R1.8379 CCCCCCCCN1CCCCCCC1 269982a_100000211400_100000210759 [0,1,0,1,0,0|1,0,1]=4 19741 B16R1.8379 CCCCCCCCN1CCCCCCC1 34a_100000211400_100000210759 [0,1,0,1,0,0|1,0,1]=4 19742 B16R1.8379 CCCCCCCNC1CCCCCCC1 2230a_100000211152_100000210681 [0,1,0,1,0,0|1,0,1]=4 19743 B16R1.8379 CCCCCCCNC1CCCCCCC1 270004a_100000229938_100000210524 [0,1,0,1,0,0|1,0,1]=4 19744 B16R1.8379 CCCCCCCNC1CCCCCCC1 34a_100000211152_100000210614 [0,1,0,1,0,0|1,0,1]=4 19745 B16R1.8379 CCCCCCCOC1C=CCCCCC1 34a_100000688657_100000210614 [0,1,0,1,0,0|1,0,0]=3 19746 B16R1.8379 CCCCCCCOC1CCCCCCC1 34a_100000210054_100000210614 [0,1,0,1,0,0|1,0,1]=4 19747 B16R1.8379 CCCCCCCOC1CCCCCCC1 7a_100000210054_100000210614 [0,1,0,1,0,0|1,0,1]=4 19748 B16R1.8379 CCCCCCOCC1CCCCCCC1 34a_100011216312_100000210314 [0,1,0,1,0,0|1,0,1]=4 19749 B16R1.8379 CCCCCCOCC1CCCCCCC1 7a_100011216312_100000210314 [0,1,0,1,0,0|1,0,1]=4 19750 B16R1.8379 CCCCCNCCC1CCCCCCC1 2230a_100011532352_100000210326 [0,1,0,1,0,0|1,0,1]=4 19751 B16R1.8379 CCCCCNCCC1CCCCCCC1 34a_100011532352_100000718602 [0,1,0,1,0,0|1,0,1]=4 19752 B16R1.8379 CCCCOCCOC1C=CCCCCC1 34a_100000688657_100000743108 [0,1,0,1,0,0|2,0,0]=4 19753 B16R1.8379 COCCCCCCN1CCCCCCC1 2230a_100000211400_100011998445 [0,1,0,1,0,0|2,0,0]=4 19754 B16R1.8379 COCCCCCCN1CCCCCCC1 269982a_100000211400_100011998445 [0,1,0,1,0,0|2,0,0]=4 19755 B16R1.8379 COCCCCCCN1CCCCCCC1 34a_100000211400_100011998445 [0,1,0,1,0,0|2,0,0]=4 19756 B16R1.8379 COCCCCCNC1CCCCCCC1 270004a_100000747528_100000210524 [0,1,0,1,0,0|2,0,0]=4 19757 B16R1.8379 COCCCCOCC1CCCCCCC1 34a_100011216312_100000755781 [0,1,0,1,0,0|2,0,0]=4 19758 B16R1.8379 COCCCCOCC1CCCCCCC1 7a_100011216312_100000730899 [0,1,0,1,0,0|2,0,0]=4 19759 B16R1.8379 COCCCNCCC1CCCCCCC1 2230a_100011532352_100000740836 [0,1,0,1,0,0|2,0,0]=4 19760 B16R1.8379 COCCCNCCC1CCCCCCC1 34a_100011532352_100000740836 [0,1,0,1,0,0|2,0,0]=4 19761 B16R1.8379 FCCCCCCNC1CCCCCCC1 2230a_100000211152_100015922095 [0,1,0,1,0,0|1,0,1]=4 19762 B16R1.8379 FCCCCCCNC1CCCCCCC1 34a_100000211152_100015922095 [0,1,0,1,0,0|1,0,1]=4 19763 B16R1.8379 FCCCCCCOC1C=CCCCCC1 34a_100000688657_100015922095 [0,1,0,1,0,0|2,0,0]=4 19764 B16R1.8379 FCCCCCCOC1CCCCCCC1 34a_100000210054_100015922095 [0,1,0,1,0,0|1,0,1]=4 19765 B16R1.8379 FCCCCCCOC1CCCCCCC1 7a_100000210054_100015922095 [0,1,0,1,0,0|1,0,1]=4 19766 B16R1.8379 FCCCCCOCC1CCCCCCC1 34a_100011216312_100000729378 [0,1,0,1,0,0|1,0,1]=4 19767 B16R1.8379 FCCCCCOCC1CCCCCCC1 7a_100011216312_100000729378 [0,1,0,1,0,0|1,0,1]=4 19768 B16R1.8379 FCCCCNCCC1CCCCCCC1 2230a_100011532352_100000729493 [0,1,0,1,0,0|1,0,1]=4 19769 B16R1.8379 FCCCCNCCC1CCCCCCC1 34a_100011532352_100000729493 [0,1,0,1,0,0|1,0,1]=4 19770 B16R1.8379 N#CCCCCCCN1CCCCCCC1 2230a_100000211400_100009813337 [0,1,0,1,0,0|1,0,1]=4 19771 B16R1.8379 N#CCCCCCCN1CCCCCCC1 269982a_100000211400_100009813337 [0,1,0,1,0,0|1,0,1]=4 19772 B16R1.8379 N#CCCCCCNC1CCCCCCC1 2230a_100000211152_100009813376 [0,1,0,1,0,0|1,0,1]=4 19773 B16R1.8379 N#CCCCCCNC1CCCCCCC1 270004a_100000061152_100000210524 [0,1,0,1,0,0|1,0,1]=4 19774 B16R1.8379 N#CCCCCCOC1CCCCCCC1 7a_100000210054_100009813376 [0,1,0,1,0,0|1,0,1]=4 19775 B16R1.8379 N#CCCCCOCC1CCCCCCC1 7a_100011216312_100000211819 [0,1,0,1,0,0|1,0,1]=4 19776 B16R1.8379 N#CCCCNCCC1CCCCCCC1 2230a_100011532352_100000687738 [0,1,0,1,0,0|1,0,1]=4 19777 B16R1.8379 O=CCCCCCNC1CCCCCCC1 2230a_100000211152_100000139337 [0,1,0,1,0,0|0,0,0]=2 19778 B16R1.8379 O=CCCCCCOC1CCCCCCC1 7a_100000210054_100000139337 [0,1,0,1,0,0|0,0,0]=2 19779 B16R1.8379 O=CCCCCCSC1CC/C=C\CCC1 62a_100000139337_100021000466 [0,1,0,1,0,0|0,0,2]=4 19780 B16R1.8379 O=CCCCCCSC1CC/C=C\CCC1 62a_100021000466_100000139337 [0,1,0,1,0,0|0,0,2]=4 19781 B16R1.8379 O=CCCCCNCC1CC/C=C\CCC1 2230a_100102730862_100000139335 [0,1,0,1,0,0|0,0,2]=4 19782 B16R1.8379 O=CCCCCOCC1CCCCCCC1 7a_100011216312_100000139335 [0,1,0,1,0,0|0,0,0]=2 19783 B16R1.8379 O=CCCCNCCC1CCCCCCC1 2230a_100011532352_200011292268 [0,1,0,1,0,0|0,0,0]=2 19784 B16R1.8379 OCCCCCCCN1CCCCCCC1 2230a_100000211400_100000760002 [0,1,0,1,0,0|0,0,2]=4 19785 B16R1.8379 OCCCCCCCN1CCCCCCC1 269982a_100000211400_100000760002 [0,1,0,1,0,0|0,0,2]=4 19786 B16R1.8379 OCCCCCCCN1CCCCCCC1 34a_100000211400_100000760002 [0,1,0,1,0,0|0,0,2]=4 19787 B16R1.8379 OCCCCCCNC1CCCCCCC1 2230a_100000211152_100000766143 [0,1,0,1,0,0|0,0,2]=4 19788 B16R1.8379 OCCCCCCNC1CCCCCCC1 270004a_100000686447_100000210524 [0,1,0,1,0,0|0,0,2]=4 19789 B16R1.8379 OCCCCCCNC1CCCCCCC1 34a_100000211152_100000766143 [0,1,0,1,0,0|0,0,2]=4 19790 B16R1.8379 OCCCCCCOC1C=CCCCCC1 34a_100000688657_100000766143 [0,1,0,1,0,0|2,0,0]=4 19791 B16R1.8379 OCCCCCCOC1CCCCCCC1 34a_100000210054_100000766143 [0,1,0,1,0,0|0,0,2]=4 19792 B16R1.8379 OCCCCCCOC1CCCCCCC1 7a_100000210054_100000766143 [0,1,0,1,0,0|0,0,2]=4 19793 B16R1.8379 OCCCCCOCC1CCCCCCC1 34a_100011216312_100000746330 [0,1,0,1,0,0|0,0,2]=4 19794 B16R1.8379 OCCCCCOCC1CCCCCCC1 7a_100011216312_100000746330 [0,1,0,1,0,0|0,0,2]=4 19795 B16R1.8379 OCCCCNCCC1CCCCCCC1 2230a_100011532352_100000210776 [0,1,0,1,0,0|0,0,2]=4 19796 B16R1.8379 OCCCCNCCC1CCCCCCC1 34a_100011532352_100011216708 [0,1,0,1,0,0|0,0,2]=4 19797 B16R1.17455 BrCCCCCCCCCCCOC1CC1 34a_100009812471_100000211595 [0,1,0,1,0,0|1,0,1]=4 19798 B16R1.17455 BrCCCCCCCCCCOCC1CC1 34a_100009813290_100000742324 [0,1,0,1,0,0|1,0,1]=4 19799 B16R1.17455 BrCCCCCCCCCCOCC1CC1 7a_100009813290_100000742324 [0,1,0,1,0,0|1,0,1]=4 19800 B16R1.17455 BrCCCCCCCCCOCCC1CC1 34a_100009813782_100000694398 [0,1,0,1,0,0|1,0,1]=4 19801 B16R1.17455 BrCCCCCCCCCOCCC1CC1 7a_100009813782_100000764125 [0,1,0,1,0,0|1,0,1]=4 19802 B16R1.17455 C#CCCCCCCCCCCOC1CC1 34a_100000054667_100000211595 [0,1,0,1,0,0|1,0,1]=4 19803 B16R1.17455 C#CCCCCCCCCCOCC1CC1 34a_100000034437_100000742324 [0,1,0,1,0,0|1,0,1]=4 19804 B16R1.17455 C#CCCCCCCCCCOCC1CC1 7a_100000034437_100000742324 [0,1,0,1,0,0|1,0,1]=4 19805 B16R1.17455 C#CCCCCCCCCOCCC1CC1 34a_100000065265_100000694398 [0,1,0,1,0,0|1,0,1]=4 19806 B16R1.17455 C#CCCCCCCCCOCCC1CC1 7a_100000065265_100000764125 [0,1,0,1,0,0|1,0,1]=4 19807 B16R1.17455 C=CCCCCCCCCCCNC1CC1 34a_100000212008_100011093070 [0,1,0,1,0,0|1,0,0]=3 19808 B16R1.17455 C=CCCCCCCCCCCSC1CC1 62a_100011093070_100000211595 [0,1,0,1,0,0|1,0,0]=3 19809 B16R1.17455 C=CCCCCCCCCCNCC1CC1 2230a_100000081888_100000742324 [0,1,0,1,0,0|1,0,0]=3 19810 B16R1.17455 C=CCCCCCCCCCNCC1CC1 2230a_100000735609_100009814027 [0,1,0,1,0,0|1,0,0]=3 19811 B16R1.17455 C=CCCCCCCCCCNCC1CC1 269862a_100000081888_100000741477 [0,1,0,1,0,0|1,0,0]=3 19812 B16R1.17455 C=CCCCCCCCCCNCC1CC1 34a_100000081888_100000742324 [0,1,0,1,0,0|1,0,0]=3 19813 B16R1.17455 C=CCCCCCCCCCNCC1CC1 34a_100000735609_100009814027 [0,1,0,1,0,0|1,0,0]=3 19814 B16R1.17455 C=CCCCCCCCCCNCC1CO1 2230a_100000081888_100011216344 [0,1,0,1,0,0|2,0,0]=4 19815 B16R1.17455 C=CCCCCCCCCCNCC1CO1 34a_100000081888_102125554688 [0,1,0,1,0,0|2,0,0]=4 19816 B16R1.17455 C=CCCCCCCCCCOCC1CC1 34a_100000038209_100000742324 [0,1,0,1,0,0|1,0,0]=3 19817 B16R1.17455 C=CCCCCCCCCCOCC1CC1 34a_100000211283_100009814027 [0,1,0,1,0,0|1,0,0]=3 19818 B16R1.17455 C=CCCCCCCCCCOCC1CC1 7a_100000038209_100000742324 [0,1,0,1,0,0|1,0,0]=3 19819 B16R1.17455 C=CCCCCCCCCCOCC1CO1 34a_100000038209_102125554688 [0,1,0,1,0,0|2,0,0]=4 19820 B16R1.17455 C=CCCCCCCCCCOCC1CO1 7a_100000038209_102125554688 [0,1,0,1,0,0|2,0,0]=4 19821 B16R1.17455 C=CCCCCCCCCCOCC1CS1 7a_100000038209_100000031435 [0,1,0,1,0,0|2,0,0]=4 19822 B16R1.17455 C=CCCCCCCCCCOC[C@@H]1CO1 34a_100000757423_100009814027 [0,1,0,1,0,0|2,0,0]=4 19823 B16R1.17455 C=CCCCCCCCCCOC[C@@H]1CO1 7a_100000038209_100000745022 [0,1,0,1,0,0|2,0,0]=4 19824 B16R1.17455 C=CCCCCCCCCCSCC1CC1 62a_100000756562_100009814027 [0,1,0,1,0,0|1,0,0]=3 19825 B16R1.17455 C=CCCCCCCCCCSCC1CC1 62a_100009814027_100000742324 [0,1,0,1,0,0|1,0,0]=3 19826 B16R1.17455 C=CCCCCCCCCCSCC1CO1 62a_100009814027_102125554688 [0,1,0,1,0,0|2,0,0]=4 19827 B16R1.17455 C=CCCCCCCCCCSCC1CO1 62a_102125554688_100009814027 [0,1,0,1,0,0|2,0,0]=4 19828 B16R1.17455 C=CCCCCCCCCCSCC1CS1 62a_100000031435_100009814027 [0,1,0,1,0,0|2,0,0]=4 19829 B16R1.17455 C=CCCCCCCCCCSCC1CS1 62a_100009814027_100000031435 [0,1,0,1,0,0|2,0,0]=4 19830 B16R1.17455 C=CCCCCCCCCCSC[C@@H]1CO1 62a_100000745022_100009814027 [0,1,0,1,0,0|2,0,0]=4 19831 B16R1.17455 C=CCCCCCCCCCSC[C@@H]1CO1 62a_100009814027_100000745022 [0,1,0,1,0,0|2,0,0]=4 19832 B16R1.17455 C=CCCCCCCCCNCCC1CC1 34a_100000764129_100011933949 [0,1,0,1,0,0|1,0,0]=3 19833 B16R1.17455 C=CCCCCCCCCOCCC1CC1 34a_100000754188_100011933949 [0,1,0,1,0,0|1,0,0]=3 19834 B16R1.17455 C=CCCCCCCCCOCCC1CC1 34a_100011215194_100000694398 [0,1,0,1,0,0|1,0,0]=3 19835 B16R1.17455 C=CCCCCCCCCOCCC1CC1 7a_100000754188_100011933949 [0,1,0,1,0,0|1,0,0]=3 19836 B16R1.17455 C=CCCCCCCCCOCCC1CC1 7a_100011215194_100000764125 [0,1,0,1,0,0|1,0,0]=3 19837 B16R1.17455 C=CCCCCCCCCOCCC1CO1 34a_100011215194_100000732470 [0,1,0,1,0,0|2,0,0]=4 19838 B16R1.17455 C=CCCCCCCCCOCCC1CO1 7a_100011215194_100000732470 [0,1,0,1,0,0|2,0,0]=4 19839 B16R1.17455 C=CCCCCCCCCOCC[C@@H]1CO1 34a_100009820653_100011933949 [0,1,0,1,0,0|2,0,0]=4 19840 B16R1.17455 C=CCCCCCCCCSCCC1CC1 62a_100000764125_100011933949 [0,1,0,1,0,0|1,0,0]=3 19841 B16R1.17455 C=CCCCCCCCCSCCC1CC1 62a_100011933949_100000764125 [0,1,0,1,0,0|1,0,0]=3 19842 B16R1.17455 C=CCCCCCCCCSCCC1CO1 62a_100000732470_100011933949 [0,1,0,1,0,0|2,0,0]=4 19843 B16R1.17455 C=CCCCCCCCCSCCC1CO1 62a_100011933949_100000732470 [0,1,0,1,0,0|2,0,0]=4 19844 B16R1.17455 C=CCCCCCCCOCCCC1CO1 34a_100000730831_100000733510 [0,1,0,1,0,0|2,0,0]=4 19845 B16R1.17455 C=CCCCCCCCOCCCC1CO1 7a_100000730831_100000733510 [0,1,0,1,0,0|2,0,0]=4 19846 B16R1.17455 C=CCCCCCCCOCCNC1CC1 34a_100000738766_100012355270 [0,1,0,1,0,0|2,0,0]=4 19847 B16R1.17455 C=CCCCCCCCSCCCC1CO1 62a_100000733510_100012355270 [0,1,0,1,0,0|2,0,0]=4 19848 B16R1.17455 C=CCCCCCCCSCCCC1CO1 62a_100012355270_100000733510 [0,1,0,1,0,0|2,0,0]=4 19849 B16R1.17455 CCCCCCCCCCCCNC1CC1 34a_100000210451_100000211595 [0,1,0,1,0,0|1,0,1]=4 19850 B16R1.17455 CCCCCCCCCCCCNC1CC1 34a_100000212008_100000759014 [0,1,0,1,0,0|1,0,1]=4 19851 B16R1.17455 CCCCCCCCCCCCOC1CC1 34a_100000210810_100000211595 [0,1,0,1,0,0|1,0,1]=4 19852 B16R1.17455 CCCCCCCCCCCNCC1CC1 2230a_100000735609_100011215454 [0,1,0,1,0,0|1,0,1]=4 19853 B16R1.17455 CCCCCCCCCCCNCC1CC1 2230a_200011215754_100000742324 [0,1,0,1,0,0|1,0,1]=4 19854 B16R1.17455 CCCCCCCCCCCNCC1CC1 269862a_200011215754_100000741477 [0,1,0,1,0,0|1,0,1]=4 19855 B16R1.17455 CCCCCCCCCCCNCC1CC1 34a_100000735609_100011215454 [0,1,0,1,0,0|1,0,1]=4 19856 B16R1.17455 CCCCCCCCCCCNCC1CC1 34a_200011215754_100000742324 [0,1,0,1,0,0|1,0,1]=4 19857 B16R1.17455 CCCCCCCCCCCNCC1CO1 2230a_200011215754_100011216344 [0,1,0,1,0,0|0,0,2]=4 19858 B16R1.17455 CCCCCCCCCCCNCC1CO1 34a_200011215754_102125554688 [0,1,0,1,0,0|0,0,2]=4 19859 B16R1.17455 CCCCCCCCCCCOCC1CC1 34a_100000210809_100000742324 [0,1,0,1,0,0|1,0,1]=4 19860 B16R1.17455 CCCCCCCCCCCOCC1CC1 34a_100000211283_100011215454 [0,1,0,1,0,0|1,0,1]=4 19861 B16R1.17455 CCCCCCCCCCCOCC1CC1 7a_100000210809_100000742324 [0,1,0,1,0,0|1,0,1]=4 19862 B16R1.17455 CCCCCCCCCCCOCC1CO1 34a_100000210809_102125554688 [0,1,0,1,0,0|0,0,2]=4 19863 B16R1.17455 CCCCCCCCCCCOCC1CO1 7a_100000210809_102125554688 [0,1,0,1,0,0|0,0,2]=4 19864 B16R1.17455 CCCCCCCCCCCOCC1CS1 7a_100000210809_100000031435 [0,1,0,1,0,0|0,1,1]=4 19865 B16R1.17455 CCCCCCCCCCCOC[C@@H]1CO1 34a_100000757423_100011215454 [0,1,0,1,0,0|0,0,2]=4 19866 B16R1.17455 CCCCCCCCCCCOC[C@@H]1CO1 7a_100000210809_100000745022 [0,1,0,1,0,0|0,0,2]=4 19867 B16R1.17455 CCCCCCCCCCCSCC1CC1 62a_100000756562_100011215454 [0,1,0,1,0,0|1,0,1]=4 19868 B16R1.17455 CCCCCCCCCCCSCC1CO1 62a_102125554688_100011215454 [0,1,0,1,0,0|0,0,2]=4 19869 B16R1.17455 CCCCCCCCCCCSCC1CS1 62a_100000031435_100011215454 [0,1,0,1,0,0|0,1,1]=4 19870 B16R1.17455 CCCCCCCCCCCSC[C@@H]1CO1 62a_100000745022_100011215454 [0,1,0,1,0,0|0,0,2]=4 19871 B16R1.17455 CCCCCCCCCCNCCC1CC1 2230a_100000684558_100000694398 [0,1,0,1,0,0|1,0,1]=4 19872 B16R1.17455 CCCCCCCCCCNCCC1CC1 34a_100000684558_100000694398 [0,1,0,1,0,0|1,0,1]=4 19873 B16R1.17455 CCCCCCCCCCNCCC1CC1 34a_100000764129_100000210320 [0,1,0,1,0,0|1,0,1]=4 19874 B16R1.17455 CCCCCCCCCCNCCC1CO1 2230a_100000684558_100000732470 [0,1,0,1,0,0|0,0,2]=4 19875 B16R1.17455 CCCCCCCCCCNCCC1CO1 34a_100000684558_100000732470 [0,1,0,1,0,0|0,0,2]=4 19876 B16R1.17455 CCCCCCCCCCOCCC1CC1 34a_100000210711_100000694398 [0,1,0,1,0,0|1,0,1]=4 19877 B16R1.17455 CCCCCCCCCCOCCC1CC1 34a_100000754188_100000210320 [0,1,0,1,0,0|1,0,1]=4 19878 B16R1.17455 CCCCCCCCCCOCCC1CC1 7a_100000210711_100000764125 [0,1,0,1,0,0|1,0,1]=4 19879 B16R1.17455 CCCCCCCCCCOCCC1CC1 7a_100000754188_100000210320 [0,1,0,1,0,0|1,0,1]=4 19880 B16R1.17455 CCCCCCCCCCOCCC1CO1 34a_100000210711_100000732470 [0,1,0,1,0,0|0,0,2]=4 19881 B16R1.17455 CCCCCCCCCCOCCC1CO1 7a_100000210711_100000732470 [0,1,0,1,0,0|0,0,2]=4 19882 B16R1.17455 CCCCCCCCCCOCC[C@@H]1CO1 34a_100009820653_100000210320 [0,1,0,1,0,0|0,0,2]=4 19883 B16R1.17455 CCCCCCCCCCSCCC1CC1 62a_100000764125_100000210320 [0,1,0,1,0,0|1,0,1]=4 19884 B16R1.17455 CCCCCCCCCCSCCC1CO1 62a_100000732470_100000210320 [0,1,0,1,0,0|0,0,2]=4 19885 B16R1.17455 CCCCCCCCCNCCCC1CO1 2230a_100000212291_100000733510 [0,1,0,1,0,0|0,0,2]=4 19886 B16R1.17455 CCCCCCCCCNCCCC1CO1 34a_100000212291_100000733510 [0,1,0,1,0,0|0,0,2]=4 19887 B16R1.17455 CCCCCCCCCOCCCC1CO1 34a_100000210712_100000733510 [0,1,0,1,0,0|0,0,2]=4 19888 B16R1.17455 CCCCCCCCCOCCCC1CO1 7a_100000210712_100000733510 [0,1,0,1,0,0|0,0,2]=4 19889 B16R1.17455 CCCCCCCCCSCCCC1CO1 62a_100000733510_100000210670 [0,1,0,1,0,0|0,0,2]=4 19890 B16R1.17455 ClCCCCCCCCCCOCC1CC1 34a_200000033068_100000742324 [0,1,0,1,0,0|1,0,1]=4 19891 B16R1.17455 ClCCCCCCCCCCOCC1CC1 7a_200000033068_100000742324 [0,1,0,1,0,0|1,0,1]=4 19892 B16R1.17455 ClCCCCCCCCCOCCC1CC1 34a_100009868337_100000694398 [0,1,0,1,0,0|1,0,1]=4 19893 B16R1.17455 ClCCCCCCCCCOCCC1CC1 7a_100009868337_100000764125 [0,1,0,1,0,0|1,0,1]=4 19894 B16R1.17455 NCCCCCCCCCCOCC1CC1 34a_100000066964_100000742324 [0,1,0,1,0,0|1,0,1]=4 19895 B16R1.17455 NCCCCCCCCCOCCC1CC1 34a_100000078944_100000694398 [0,1,0,1,0,0|1,0,1]=4 19896 B16R1.17455 O=CCCCCOCCCCOCC1CO1 7a_100010889290_100000139335 [0,1,0,1,0,0|2,0,0]=4 19897 B16R1.17455 OCCCCCCCCCCCNC1CC1 34a_100000212008_100009812471 [0,1,0,1,0,0|0,0,2]=4 19898 B16R1.17455 OCCCCCCCCCCCSC1CC1 62a_100009812471_100000211595 [0,1,0,1,0,0|0,0,2]=4 19899 B16R1.17455 OCCCCCCCCCCNCC1CC1 2230a_100000066964_100000742324 [0,1,0,1,0,0|0,0,2]=4 19900 B16R1.17455 OCCCCCCCCCCNCC1CC1 2230a_100000735609_100009813290 [0,1,0,1,0,0|0,0,2]=4 19901 B16R1.17455 OCCCCCCCCCCNCC1CC1 269862a_100000066964_100000741477 [0,1,0,1,0,0|0,0,2]=4 19902 B16R1.17455 OCCCCCCCCCCNCC1CC1 34a_100000066964_100000742324 [0,1,0,1,0,0|0,0,2]=4 19903 B16R1.17455 OCCCCCCCCCCNCC1CC1 34a_100000735609_100009813290 [0,1,0,1,0,0|0,0,2]=4 19904 B16R1.17455 OCCCCCCCCCCOCC1CC1 34a_100000211283_100009813290 [0,1,0,1,0,0|0,0,2]=4 19905 B16R1.17455 OCCCCCCCCCCSCC1CC1 62a_100000756562_200000033068 [0,1,0,1,0,0|0,0,2]=4 19906 B16R1.17455 OCCCCCCCCCCSCC1CC1 62a_100009813290_100000742324 [0,1,0,1,0,0|0,0,2]=4 19907 B16R1.17455 OCCCCCCCCCNCCC1CC1 2230a_100000078944_100000694398 [0,1,0,1,0,0|0,0,2]=4 19908 B16R1.17455 OCCCCCCCCCNCCC1CC1 34a_100000078944_100000694398 [0,1,0,1,0,0|0,0,2]=4 19909 B16R1.17455 OCCCCCCCCCNCCC1CC1 34a_100000764129_100009813782 [0,1,0,1,0,0|0,0,2]=4 19910 B16R1.17455 OCCCCCCCCCOCCC1CC1 34a_100000754188_100009813782 [0,1,0,1,0,0|0,0,2]=4 19911 B16R1.17455 OCCCCCCCCCOCCC1CC1 7a_100000754188_100009813782 [0,1,0,1,0,0|0,0,2]=4 19912 B16R1.17455 OCCCCCCCCCSCCC1CC1 62a_100000764125_100009813782 [0,1,0,1,0,0|0,0,2]=4 19913 B16R1.17455 OCCCCCCCCCSCCC1CC1 62a_100009813782_100000764125 [0,1,0,1,0,0|0,0,2]=4 19914 B16R1.17539 BrCCCCCCCOC1CCCCCC1 34a_100000760002_100011217769 [0,1,0,1,0,0|1,0,1]=4 19915 B16R1.17539 BrCCCCCCOCC1CCCCCC1 34a_100011215345_200000696569 [0,1,0,1,0,0|1,0,1]=4 19916 B16R1.17539 BrCCCCCCOCC1CCCCCC1 7a_100011215345_200000696569 [0,1,0,1,0,0|1,0,1]=4 19917 B16R1.17539 C#CCCCCCCCN1CCCCCC1 2230a_100000185865_100153394163 [0,1,0,1,0,0|1,0,1]=4 19918 B16R1.17539 C#CCCCCCCCN1CCCCCC1 269982a_100000185865_100153394163 [0,1,0,1,0,0|1,0,1]=4 19919 B16R1.17539 C#CCCCCCCCN1CCCCCC1 34a_100000185865_100153394163 [0,1,0,1,0,0|1,0,1]=4 19920 B16R1.17539 C#CCCCCCCNC1CCCCCC1 2230a_100000210984_100012276617 [0,1,0,1,0,0|1,0,1]=4 19921 B16R1.17539 C#CCCCCCCNC1CCCCCC1 34a_100000210984_100012276617 [0,1,0,1,0,0|1,0,1]=4 19922 B16R1.17539 C#CCCCCCCOC1CCCCCC1 34a_100000210887_100012276617 [0,1,0,1,0,0|1,0,1]=4 19923 B16R1.17539 C#CCCCCCCOC1CCCCCC1 34a_100011217361_100011217769 [0,1,0,1,0,0|1,0,1]=4 19924 B16R1.17539 C#CCCCCCCOC1CCCCCC1 7a_100000210887_100012276617 [0,1,0,1,0,0|1,0,1]=4 19925 B16R1.17539 C#CCCCCCCSC1CCCCCC1 62a_100011217769_100012276617 [0,1,0,1,0,0|1,0,1]=4 19926 B16R1.17539 C#CCCCCCCSC1CCCCCC1 62a_100012276617_100011217769 [0,1,0,1,0,0|1,0,1]=4 19927 B16R1.17539 C#CCCCCCNCC1CCCCCC1 2230a_100015204231_100012094781 [0,1,0,1,0,0|1,0,1]=4 19928 B16R1.17539 C#CCCCCCNCC1CCCCCC1 34a_100015204231_100012094781 [0,1,0,1,0,0|1,0,1]=4 19929 B16R1.17539 C#CCCCCCOCC1CCCCCC1 34a_100000699130_100012094781 [0,1,0,1,0,0|1,0,1]=4 19930 B16R1.17539 C#CCCCCCOCC1CCCCCC1 34a_100000766912_200000696569 [0,1,0,1,0,0|1,0,1]=4 19931 B16R1.17539 C#CCCCCCOCC1CCCCCC1 7a_100000699130_100012094781 [0,1,0,1,0,0|1,0,1]=4 19932 B16R1.17539 C#CCCCCCOCC1CCCCCC1 7a_100000766912_200000696569 [0,1,0,1,0,0|1,0,1]=4 19933 B16R1.17539 C#CCCCCCSCC1CCCCCC1 62a_100012094781_200000696569 [0,1,0,1,0,0|1,0,1]=4 19934 B16R1.17539 C#CCCCCCSCC1CCCCCC1 62a_200000696569_100012094781 [0,1,0,1,0,0|1,0,1]=4 19935 B16R1.17539 C#CCCCCNCCC1CCCCCC1 2230a_100011532351_100010269958 [0,1,0,1,0,0|1,0,1]=4 19936 B16R1.17539 C#CCCCCNCCC1CCCCCC1 34a_100011532351_100010269958 [0,1,0,1,0,0|1,0,1]=4 19937 B16R1.17539 C=CCCCCCCCN1CCCCCC1 2230a_100000185865_100012355270 [0,1,0,1,0,0|1,0,0]=3 19938 B16R1.17539 C=CCCCCCCCN1CCCCCC1 269982a_100000185865_100012355270 [0,1,0,1,0,0|1,0,0]=3 19939 B16R1.17539 C=CCCCCCCCN1CCCCCC1 34a_100000185865_100012355270 [0,1,0,1,0,0|1,0,0]=3 19940 B16R1.17539 C=CCCCCCCCN1CCCOCC1 2230a_100000685342_100012355270 [0,1,0,1,0,0|2,0,0]=4 19941 B16R1.17539 C=CCCCCCCCN1CCCOCC1 269982a_100000685342_100012355270 [0,1,0,1,0,0|2,0,0]=4 19942 B16R1.17539 C=CCCCCCCCN1CCCOCC1 34a_100000685342_100012355270 [0,1,0,1,0,0|2,0,0]=4 19943 B16R1.17539 C=CCCCCCCNC1CCCCCC1 2230a_100000210984_100011215473 [0,1,0,1,0,0|1,0,0]=3 19944 B16R1.17539 C=CCCCCCCNC1CCCCCC1 34a_100000210984_100011215473 [0,1,0,1,0,0|1,0,0]=3 19945 B16R1.17539 C=CCCCCCCOC1CCCCCC1 34a_100000210887_100011215473 [0,1,0,1,0,0|1,0,0]=3 19946 B16R1.17539 C=CCCCCCCOC1CCCCCC1 34a_200011216477_100011217769 [0,1,0,1,0,0|1,0,0]=3 19947 B16R1.17539 C=CCCCCCCOC1CCCCCC1 7a_100000210887_100011215473 [0,1,0,1,0,0|1,0,0]=3 19948 B16R1.17539 C=CCCCCCCSC1CCCCCC1 62a_100011215473_100011217769 [0,1,0,1,0,0|1,0,0]=3 19949 B16R1.17539 C=CCCCCCCSC1CCCCCC1 62a_100011217769_100011215473 [0,1,0,1,0,0|1,0,0]=3 19950 B16R1.17539 C=CCCCCCNCC1CCCCCC1 2230a_100015204231_100000700193 [0,1,0,1,0,0|1,0,0]=3 19951 B16R1.17539 C=CCCCCCNCC1CCCCCC1 34a_100015204231_100000700193 [0,1,0,1,0,0|1,0,0]=3 19952 B16R1.17539 C=CCCCCCOCC1CCCCCC1 34a_100000699130_100000700193 [0,1,0,1,0,0|1,0,0]=3 19953 B16R1.17539 C=CCCCCCOCC1CCCCCC1 34a_100011216702_200000696569 [0,1,0,1,0,0|1,0,0]=3 19954 B16R1.17539 C=CCCCCCOCC1CCCCCC1 7a_100000699130_100000700193 [0,1,0,1,0,0|1,0,0]=3 19955 B16R1.17539 C=CCCCCCOCC1CCCCCC1 7a_100011216702_200000696569 [0,1,0,1,0,0|1,0,0]=3 19956 B16R1.17539 C=CCCCCCSCC1CCCCCC1 62a_100000700193_200000696569 [0,1,0,1,0,0|1,0,0]=3 19957 B16R1.17539 C=CCCCCCSCC1CCCCCC1 62a_200000696569_100000700193 [0,1,0,1,0,0|1,0,0]=3 19958 B16R1.17539 C=CCCCCNCCC1CCCCCC1 2230a_100011532351_100011215482 [0,1,0,1,0,0|1,0,0]=3 19959 B16R1.17539 C=CCCCCNCCC1CCCCCC1 34a_100011532351_100011215482 [0,1,0,1,0,0|1,0,0]=3 19960 B16R1.17539 C=CCCCCOCCN1CCCCCC1 34a_100000238007_100011215482 [0,1,0,1,0,0|2,0,0]=4 19961 B16R1.17539 C=CCCCCOCCN1CCCCCC1 7a_100000766645_100000722644 [0,1,0,1,0,0|2,0,0]=4 19962 B16R1.17539 C=CCCCCSCCN1CCCCCC1 62a_100000722644_100011215482 [0,1,0,1,0,0|2,0,0]=4 19963 B16R1.17539 C=CCCCCSCCN1CCCCCC1 62a_100011215482_100000722644 [0,1,0,1,0,0|2,0,0]=4 19964 B16R1.17539 C=CCCCOCCCN1CCCCCC1 34a_100102886287_100000757094 [0,1,0,1,0,0|2,0,0]=4 19965 B16R1.17539 C=CCCCOCCCN1CCCCCC1 7a_100102886287_100000757094 [0,1,0,1,0,0|2,0,0]=4 19966 B16R1.17539 C=CCCOCCCCN1CCCCCC1 34a_100011305542_100000754431 [0,1,0,1,0,0|2,0,0]=4 19967 B16R1.17539 C=COCCCCOCC1CCCCCC1 34a_100000031558_200000696569 [0,1,0,1,0,0|2,0,0]=4 19968 B16R1.17539 C=COCCCCOCC1CCCCCC1 7a_100000031558_200000696569 [0,1,0,1,0,0|2,0,0]=4 19969 B16R1.17539 CCCCCCCCCN1CCCCCC1 2230a_100000185865_100011214924 [0,1,0,1,0,0|1,0,1]=4 19970 B16R1.17539 CCCCCCCCCN1CCCCCC1 269982a_100000185865_100000210670 [0,1,0,1,0,0|1,0,1]=4 19971 B16R1.17539 CCCCCCCCCN1CCCCCC1 34a_100000185865_100011214924 [0,1,0,1,0,0|1,0,1]=4 19972 B16R1.17539 CCCCCCCCNC1CCCCCC1 2230a_100000210984_100000210759 [0,1,0,1,0,0|1,0,1]=4 19973 B16R1.17539 CCCCCCCCNC1CCCCCC1 270004a_100000229939_100000210131 [0,1,0,1,0,0|1,0,1]=4 19974 B16R1.17539 CCCCCCCCNC1CCCCCC1 34a_100000210984_100000210759 [0,1,0,1,0,0|1,0,1]=4 19975 B16R1.17539 CCCCCCCCNC1CCCCCC1 34a_100000229939_100011217769 [0,1,0,1,0,0|1,0,1]=4 19976 B16R1.17539 CCCCCCCCOC1CCCCCC1 34a_100000210232_100011217769 [0,1,0,1,0,0|1,0,1]=4 19977 B16R1.17539 CCCCCCCCOC1CCCCCC1 34a_100000210887_100000210759 [0,1,0,1,0,0|1,0,1]=4 19978 B16R1.17539 CCCCCCCCOC1CCCCCC1 7a_100000210887_100000210759 [0,1,0,1,0,0|1,0,1]=4 19979 B16R1.17539 CCCCCCCCSC1CCCCCC1 62a_100000210759_100011217769 [0,1,0,1,0,0|1,0,1]=4 19980 B16R1.17539 CCCCCCCCSC1CCCCCC1 62a_100011217769_100000210317 [0,1,0,1,0,0|1,0,1]=4 19981 B16R1.17539 CCCCCCCNCC1CCCCCC1 2230a_100000229938_200000696569 [0,1,0,1,0,0|1,0,1]=4 19982 B16R1.17539 CCCCCCCNCC1CCCCCC1 2230a_100015204231_100000210681 [0,1,0,1,0,0|1,0,1]=4 19983 B16R1.17539 CCCCCCCNCC1CCCCCC1 269862a_100000229938_200000763224 [0,1,0,1,0,0|1,0,1]=4 19984 B16R1.17539 CCCCCCCNCC1CCCCCC1 34a_100015204231_100000210614 [0,1,0,1,0,0|1,0,1]=4 19985 B16R1.17539 CCCCCCCOCC1CCCCCC1 34a_100000210272_200000696569 [0,1,0,1,0,0|1,0,1]=4 19986 B16R1.17539 CCCCCCCOCC1CCCCCC1 34a_100000699130_100000210614 [0,1,0,1,0,0|1,0,1]=4 19987 B16R1.17539 CCCCCCCOCC1CCCCCC1 7a_100000210272_200000696569 [0,1,0,1,0,0|1,0,1]=4 19988 B16R1.17539 CCCCCCCOCC1CCCCCC1 7a_100000699130_100000210614 [0,1,0,1,0,0|1,0,1]=4 19989 B16R1.17539 CCCCCCCSCC1CCCCCC1 62a_100000210614_200000696569 [0,1,0,1,0,0|1,0,1]=4 19990 B16R1.17539 CCCCCCCSCC1CCCCCC1 62a_200000696569_100000210316 [0,1,0,1,0,0|1,0,1]=4 19991 B16R1.17539 CCCCCCNCCC1CCCCCC1 2230a_100011532351_100000210314 [0,1,0,1,0,0|1,0,1]=4 19992 B16R1.17539 CCCCCCNCCC1CCCCCC1 34a_100011532351_100000210314 [0,1,0,1,0,0|1,0,1]=4 19993 B16R1.17539 CNCCCCCOCC1CCCCCC1 34a_100000722520_200000696569 [0,1,0,1,0,0|2,0,0]=4 19994 B16R1.17539 COCCCCCCNC1CCCCCC1 2230a_100000210984_100011998445 [0,1,0,1,0,0|2,0,0]=4 19995 B16R1.17539 COCCCCCCNC1CCCCCC1 34a_100000210984_100011998445 [0,1,0,1,0,0|2,0,0]=4 19996 B16R1.17539 COCCCCCCOC1CCCCCC1 34a_100000210887_100011998445 [0,1,0,1,0,0|2,0,0]=4 19997 B16R1.17539 COCCCCCCOC1CCCCCC1 34a_200012092642_100011217769 [0,1,0,1,0,0|2,0,0]=4 19998 B16R1.17539 COCCCCCCOC1CCCCCC1 7a_100000210887_100011998445 [0,1,0,1,0,0|2,0,0]=4 19999 B16R1.17539 COCCCCCCSC1CCCCCC1 62a_100011217769_100011998445 [0,1,0,1,0,0|2,0,0]=4 20000 B16R1.17539 COCCCCCCSC1CCCCCC1 62a_100011998445_100011217769 [0,1,0,1,0,0|2,0,0]=4 20001 B16R1.17539 COCCCCCNCC1CCCCCC1 2230a_100000747528_200000696569 [0,1,0,1,0,0|2,0,0]=4 20002 B16R1.17539 COCCCCCNCC1CCCCCC1 269862a_100000747528_200000763224 [0,1,0,1,0,0|2,0,0]=4 20003 B16R1.17539 COCCCCCNCC1CCCCCC1 34a_100000747528_200000696569 [0,1,0,1,0,0|2,0,0]=4 20004 B16R1.17539 COCCCCNCCC1CCCCCC1 2230a_100011532351_100000730899 [0,1,0,1,0,0|2,0,0]=4 20005 B16R1.17539 COCCCCNCCC1CCCCCC1 34a_100011532351_100000755781 [0,1,0,1,0,0|2,0,0]=4 20006 B16R1.17539 ClCCCCCCOCC1CCCCCC1 34a_100000766143_200000696569 [0,1,0,1,0,0|1,0,1]=4 20007 B16R1.17539 ClCCCCCCOCC1CCCCCC1 7a_100000766143_200000696569 [0,1,0,1,0,0|1,0,1]=4 20008 B16R1.17539 FCCCCCCNCC1CCCCCC1 2230a_100015204231_100015922095 [0,1,0,1,0,0|1,0,1]=4 20009 B16R1.17539 FCCCCCCNCC1CCCCCC1 34a_100015204231_100015922095 [0,1,0,1,0,0|1,0,1]=4 20010 B16R1.17539 FCCCCCCOCC1CCCCCC1 34a_100000699130_100015922095 [0,1,0,1,0,0|1,0,1]=4 20011 B16R1.17539 FCCCCCCOCC1CCCCCC1 34a_100000732779_200000696569 [0,1,0,1,0,0|1,0,1]=4 20012 B16R1.17539 FCCCCCCOCC1CCCCCC1 7a_100000699130_100015922095 [0,1,0,1,0,0|1,0,1]=4 20013 B16R1.17539 FCCCCCCOCC1CCCCCC1 7a_100000732779_200000696569 [0,1,0,1,0,0|1,0,1]=4 20014 B16R1.17539 FCCCCCCSCC1CCCCCC1 62a_100015922095_200000696569 [0,1,0,1,0,0|1,0,1]=4 20015 B16R1.17539 FCCCCCCSCC1CCCCCC1 62a_200000696569_100015922095 [0,1,0,1,0,0|1,0,1]=4 20016 B16R1.17539 FCCCCCNCCC1CCCCCC1 2230a_100011532351_100000729378 [0,1,0,1,0,0|1,0,1]=4 20017 B16R1.17539 FCCCCCNCCC1CCCCCC1 34a_100011532351_100000729378 [0,1,0,1,0,0|1,0,1]=4 20018 B16R1.17539 N#CCCCCCCNC1CCCCCC1 2230a_100000210984_100009813337 [0,1,0,1,0,0|1,0,1]=4 20019 B16R1.17539 N#CCCCCCCOC1CCCCCC1 7a_100000210887_100009813337 [0,1,0,1,0,0|1,0,1]=4 20020 B16R1.17539 N#CCCCCCCSC1CCCCCC1 62a_100009813337_100011217769 [0,1,0,1,0,0|1,0,1]=4 20021 B16R1.17539 N#CCCCCCCSC1CCCCCC1 62a_100011217769_100009813337 [0,1,0,1,0,0|1,0,1]=4 20022 B16R1.17539 N#CCCCCCNCC1CCCCCC1 2230a_100015204231_100009813376 [0,1,0,1,0,0|1,0,1]=4 20023 B16R1.17539 N#CCCCCCOCC1CCCCCC1 7a_100000699130_100009813376 [0,1,0,1,0,0|1,0,1]=4 20024 B16R1.17539 N#CCCCCCSCC1CCCCCC1 62a_100009813376_200000696569 [0,1,0,1,0,0|1,0,1]=4 20025 B16R1.17539 N#CCCCCCSCC1CCCCCC1 62a_200000696569_100009813376 [0,1,0,1,0,0|1,0,1]=4 20026 B16R1.17539 N#CCCCCNCCC1CCCCCC1 2230a_100011532351_100000211819 [0,1,0,1,0,0|1,0,1]=4 20027 B16R1.17539 NCCCCCCCOC1CCCCCC1 34a_100011996573_100011217769 [0,1,0,1,0,0|1,0,1]=4 20028 B16R1.17539 NCCCCCCOCC1CCCCCC1 34a_100000686447_200000696569 [0,1,0,1,0,0|1,0,1]=4 20029 B16R1.17539 O=CCCCCCNCC1CCCCCC1 2230a_100015204231_100000139337 [0,1,0,1,0,0|0,0,0]=2 20030 B16R1.17539 O=CCCCCCOCC1CCCCCC1 7a_100000699130_100000139337 [0,1,0,1,0,0|0,0,0]=2 20031 B16R1.17539 O=CCCCCCSCC1CCCCCC1 62a_100000139337_200000696569 [0,1,0,1,0,0|0,0,0]=2 20032 B16R1.17539 O=CCCCCCSCC1CCCCCC1 62a_200000696569_100000139337 [0,1,0,1,0,0|0,0,0]=2 20033 B16R1.17539 O=CCCCCNCCC1CCCCCC1 2230a_100011532351_100000139335 [0,1,0,1,0,0|0,0,0]=2 20034 B16R1.17539 O=CCCCCSCCN1CCCCCC1 62a_100000139335_100000722644 [0,1,0,1,0,0|1,0,0]=3 20035 B16R1.17539 O=CCCCCSCCN1CCCCCC1 62a_100000722644_100000139335 [0,1,0,1,0,0|1,0,0]=3 20036 B16R1.17539 O=CCCCOCCCN1CCCCCC1 7a_100102886287_200011292268 [0,1,0,1,0,0|1,0,0]=3 20037 B16R1.17539 OCCCCCCCCN1CCCCCC1 2230a_100000185865_100000033203 [0,1,0,1,0,0|0,0,2]=4 20038 B16R1.17539 OCCCCCCCCN1CCCCCC1 269982a_100000185865_100000033203 [0,1,0,1,0,0|0,0,2]=4 20039 B16R1.17539 OCCCCCCCCN1CCCCCC1 34a_100000185865_100000033203 [0,1,0,1,0,0|0,0,2]=4 20040 B16R1.17539 OCCCCCCCNC1CCCCCC1 2230a_100000210984_100000760002 [0,1,0,1,0,0|0,0,2]=4 20041 B16R1.17539 OCCCCCCCNC1CCCCCC1 270004a_100011996573_100000210131 [0,1,0,1,0,0|0,0,2]=4 20042 B16R1.17539 OCCCCCCCNC1CCCCCC1 34a_100000210984_100000760002 [0,1,0,1,0,0|0,0,2]=4 20043 B16R1.17539 OCCCCCCCNC1CCCCCC1 34a_100011996573_100011217769 [0,1,0,1,0,0|0,0,2]=4 20044 B16R1.17539 OCCCCCCCOC1CCCCCC1 34a_100000210887_100000760002 [0,1,0,1,0,0|0,0,2]=4 20045 B16R1.17539 OCCCCCCCOC1CCCCCC1 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62a_200000696569_100000766143 [0,1,0,1,0,0|0,0,2]=4 20057 B16R1.17539 OCCCCCNCCC1CCCCCC1 2230a_100011532351_100000746330 [0,1,0,1,0,0|0,0,2]=4 20058 B16R1.17539 OCCCCCNCCC1CCCCCC1 34a_100011532351_100000746330 [0,1,0,1,0,0|0,0,2]=4 20059 B16R1.20288 C#CCCCCCN1CCCCC1CCC 2230a_100000701414_100012094781 [0,1,0,1,0,0|1,0,1]=4 20060 B16R1.20288 C#CCCCCCN1CCCCC1CCC 269982a_100000701414_100012094781 [0,1,0,1,0,0|1,0,1]=4 20061 B16R1.20288 C#CCCCCCN1CCCCC1CCC 34a_100000701414_100012094781 [0,1,0,1,0,0|1,0,1]=4 20062 B16R1.20288 C#CCCCCOC1CCCCC1CCC 34a_100011217265_100010269958 [0,1,0,1,0,0|1,0,1]=4 20063 B16R1.20288 C#CCCCCOC1CCCCC1CCC 7a_100011217265_100010269958 [0,1,0,1,0,0|1,0,1]=4 20064 B16R1.20288 C=CCC1CCCCC1NCCCCCC 269862a_100000210581_100011214939 [0,1,0,1,0,0|1,0,0]=3 20065 B16R1.20288 C=CCC1CCCCC1NCCCCCC 270004a_100000210581_100011214939 [0,1,0,1,0,0|1,0,0]=3 20066 B16R1.20288 C=CCC1CCCCC1NCCCCCO 269862a_100000762737_100011214939 [0,1,0,1,0,0|2,0,0]=4 20067 B16R1.20288 C=CCC1CCCCC1NCCCCCO 270004a_100000762737_100011214939 [0,1,0,1,0,0|2,0,0]=4 20068 B16R1.20288 C=CCC1CCCCC1NCCCOCC 269862a_100000210961_100011214939 [0,1,0,1,0,0|2,0,0]=4 20069 B16R1.20288 C=CCC1CCCCC1NCCCOCC 270004a_100000210961_100011214939 [0,1,0,1,0,0|2,0,0]=4 20070 B16R1.20288 C=CCC1CCCCC1NCCOCCC 269862a_100161115042_100011214939 [0,1,0,1,0,0|2,0,0]=4 20071 B16R1.20288 C=CCC1CCCCC1NCCOCCC 270004a_100161115042_100011214939 [0,1,0,1,0,0|2,0,0]=4 20072 B16R1.20288 C=CCC1CCCCC1NCCSCCC 269862a_100020603323_100011214939 [0,1,0,1,0,0|2,0,0]=4 20073 B16R1.20288 C=CCC1CCCCC1NCCSCCC 270004a_100020603323_100011214939 [0,1,0,1,0,0|2,0,0]=4 20074 B16R1.20288 C=CCCCCCN1CCCCC1CCC 2230a_100000701414_100000700193 [0,1,0,1,0,0|1,0,0]=3 20075 B16R1.20288 C=CCCCCCN1CCCCC1CCC 269982a_100000701414_100000700193 [0,1,0,1,0,0|1,0,0]=3 20076 B16R1.20288 C=CCCCCCN1CCCCC1CCC 34a_100000701414_100000700193 [0,1,0,1,0,0|1,0,0]=3 20077 B16R1.20288 C=CCCCCCN1CCCCC1CCO 2230a_100000211664_100000700193 [0,1,0,1,0,0|2,0,0]=4 20078 B16R1.20288 C=CCCCCCN1CCCCC1CCO 269982a_100000211664_100000700193 [0,1,0,1,0,0|2,0,0]=4 20079 B16R1.20288 C=CCCCCCN1CCCCC1CCO 34a_100000211664_100000700193 [0,1,0,1,0,0|2,0,0]=4 20080 B16R1.20288 C=CCCCCCN1CCCCC1COC 2230a_100015184032_100000700193 [0,1,0,1,0,0|2,0,0]=4 20081 B16R1.20288 C=CCCCCCN1CCCCC1COC 269982a_100015184032_100000700193 [0,1,0,1,0,0|2,0,0]=4 20082 B16R1.20288 C=CCCCCCN1CCCCC1COC 34a_100015184032_100000700193 [0,1,0,1,0,0|2,0,0]=4 20083 B16R1.20288 C=CCCCCCN1CCOCC1CCC 2230a_102495339903_100000700193 [0,1,0,1,0,0|2,0,0]=4 20084 B16R1.20288 C=CCCCCCN1CCOCC1CCC 269982a_102495339903_100000700193 [0,1,0,1,0,0|2,0,0]=4 20085 B16R1.20288 C=CCCCCCN1CCOCC1CCC 34a_102495339903_100000700193 [0,1,0,1,0,0|2,0,0]=4 20086 B16R1.20288 C=CCCCCNC1CCCCC1CCC 269862a_100000703577_100011218038 [0,1,0,1,0,0|1,0,0]=3 20087 B16R1.20288 C=CCCCCNC1CCCCC1CCC 270004a_100000703577_100011218038 [0,1,0,1,0,0|1,0,0]=3 20088 B16R1.20288 C=CCCCCNC1CCCCC1OCC 270004a_100000703577_200000031474 [0,1,0,1,0,0|2,0,0]=4 20089 B16R1.20288 C=CCCCCOC1CCCCC1CCC 34a_100011217265_100011215482 [0,1,0,1,0,0|1,0,0]=3 20090 B16R1.20288 C=CCCCCOC1CCCCC1CCC 7a_100011217265_100011215482 [0,1,0,1,0,0|1,0,0]=3 20091 B16R1.20288 C=COCCCNC1CCCCC1CCC 269862a_100000210767_100011218038 [0,1,0,1,0,0|2,0,0]=4 20092 B16R1.20288 C=COCCCNC1CCCCC1CCC 270004a_100000210767_100011218038 [0,1,0,1,0,0|2,0,0]=4 20093 B16R1.20288 CCCC1CCCCC1NCCCCC#N 270004a_100000751965_100011218038 [0,1,0,1,0,0|1,0,1]=4 20094 B16R1.20288 CCCC1CCCCC1NCCCCCO 269862a_100000762737_100011218038 [0,1,0,1,0,0|0,0,2]=4 20095 B16R1.20288 CCCC1CCCCC1NCCCCCO 270004a_100000762737_100011218038 [0,1,0,1,0,0|0,0,2]=4 20096 B16R1.20288 CCCC1CCCCC1OCCCCC#N 7a_100011217265_100000211819 [0,1,0,1,0,0|1,0,1]=4 20097 B16R1.20288 CCCC1CCCCC1OCCCCC=O 7a_100011217265_100000139335 [0,1,0,1,0,0|0,0,0]=2 20098 B16R1.20288 CCCC1CCCCC1OCCCCCF 34a_100011217265_100000729378 [0,1,0,1,0,0|1,0,1]=4 20099 B16R1.20288 CCCC1CCCCC1OCCCCCF 7a_100011217265_100000729378 [0,1,0,1,0,0|1,0,1]=4 20100 B16R1.20288 CCCC1CCCCC1OCCCCCO 34a_100011217265_100000746330 [0,1,0,1,0,0|0,0,2]=4 20101 B16R1.20288 CCCC1CCCCC1OCCCCCO 7a_100011217265_100000746330 [0,1,0,1,0,0|0,0,2]=4 20102 B16R1.20288 CCCC1CCCCC1OCCCCOC 34a_100011217265_100000755781 [0,1,0,1,0,0|2,0,0]=4 20103 B16R1.20288 CCCC1CCCCC1OCCCCOC 7a_100011217265_100000730899 [0,1,0,1,0,0|2,0,0]=4 20104 B16R1.20288 CCCC1CCCCN1CCCCCC#N 2230a_100000701414_100009813376 [0,1,0,1,0,0|1,0,1]=4 20105 B16R1.20288 CCCC1CCCCN1CCCCCC#N 269982a_100000701414_100009813376 [0,1,0,1,0,0|1,0,1]=4 20106 B16R1.20288 CCCC1CCCCN1CCCCCC=O 2230a_100000701414_100000139337 [0,1,0,1,0,0|0,0,0]=2 20107 B16R1.20288 CCCC1CCCCN1CCCCCC=O 269982a_100000701414_100000139337 [0,1,0,1,0,0|0,0,0]=2 20108 B16R1.20288 CCCC1CCCCN1CCCCCCF 2230a_100000701414_100015922095 [0,1,0,1,0,0|1,0,1]=4 20109 B16R1.20288 CCCC1CCCCN1CCCCCCF 269982a_100000701414_100015922095 [0,1,0,1,0,0|1,0,1]=4 20110 B16R1.20288 CCCC1CCCCN1CCCCCCF 34a_100000701414_100015922095 [0,1,0,1,0,0|1,0,1]=4 20111 B16R1.20288 CCCC1CCCCN1CCCCCCO 2230a_100000701414_100000766143 [0,1,0,1,0,0|0,0,2]=4 20112 B16R1.20288 CCCC1CCCCN1CCCCCCO 269982a_100000701414_100000766143 [0,1,0,1,0,0|0,0,2]=4 20113 B16R1.20288 CCCC1CCCCN1CCCCCCO 34a_100000701414_100000766143 [0,1,0,1,0,0|0,0,2]=4 20114 B16R1.20288 CCCC1COCCN1CCCCCC=O 2230a_102495339903_100000139337 [0,1,0,1,0,0|1,0,0]=3 20115 B16R1.20288 CCCC1COCCN1CCCCCC=O 269982a_102495339903_100000139337 [0,1,0,1,0,0|1,0,0]=3 20116 B16R1.20288 CCCCCCCN1CCCCC1CC#N 2230a_100000133382_100000210681 [0,1,0,1,0,0|1,0,1]=4 20117 B16R1.20288 CCCCCCCN1CCCCC1CC#N 34a_100000133382_100000210614 [0,1,0,1,0,0|1,0,1]=4 20118 B16R1.20288 CCCCCCCN1CCCCC1CCC 2230a_100000701414_100000210681 [0,1,0,1,0,0|1,0,1]=4 20119 B16R1.20288 CCCCCCCN1CCCCC1CCC 269982a_100000701414_100000210681 [0,1,0,1,0,0|1,0,1]=4 20120 B16R1.20288 CCCCCCCN1CCCCC1CCC 34a_100000701414_100000210614 [0,1,0,1,0,0|1,0,1]=4 20121 B16R1.20288 CCCCCCCN1CCCCC1CCO 2230a_100000211664_100000210681 [0,1,0,1,0,0|0,0,2]=4 20122 B16R1.20288 CCCCCCCN1CCCCC1CCO 269982a_100000211664_100000210681 [0,1,0,1,0,0|0,0,2]=4 20123 B16R1.20288 CCCCCCCN1CCCCC1CCO 34a_100000211664_100000210614 [0,1,0,1,0,0|0,0,2]=4 20124 B16R1.20288 CCCCCCCN1CCCCC1COC 2230a_100015184032_100000210681 [0,1,0,1,0,0|2,0,0]=4 20125 B16R1.20288 CCCCCCCN1CCCCC1COC 269982a_100015184032_100000210681 [0,1,0,1,0,0|2,0,0]=4 20126 B16R1.20288 CCCCCCCN1CCCCC1COC 34a_100015184032_100000210614 [0,1,0,1,0,0|2,0,0]=4 20127 B16R1.20288 CCCCCCNC1CCCCC1CC#N 270004a_100000210581_100009866218 [0,1,0,1,0,0|1,0,1]=4 20128 B16R1.20288 CCCCCCNC1CCCCC1CCC 269862a_100000210581_100011218038 [0,1,0,1,0,0|1,0,1]=4 20129 B16R1.20288 CCCCCCNC1CCCCC1CCC 270004a_100000210581_100011218038 [0,1,0,1,0,0|1,0,1]=4 20130 B16R1.20288 CCCCCCOC1CCCCC1CCC 34a_100011217265_100000210314 [0,1,0,1,0,0|1,0,1]=4 20131 B16R1.20288 CCCCCCOC1CCCCC1CCC 7a_100011217265_100000210314 [0,1,0,1,0,0|1,0,1]=4 20132 B16R1.20288 COCC1CCCCN1CCCCCC=O 2230a_100015184032_100000139337 [0,1,0,1,0,0|1,0,0]=3 20133 B16R1.20288 COCC1CCCCN1CCCCCC=O 269982a_100015184032_100000139337 [0,1,0,1,0,0|1,0,0]=3 20134 B16R1.20288 COC[C@H]1COCCN1CCCCCC=O 2230a_100016989928_100000139337 [0,1,0,1,0,0|2,0,0]=4 20135 B16R1.20288 COC[C@H]1COCCN1CCCCCC=O 269982a_100016989928_100000139337 [0,1,0,1,0,0|2,0,0]=4 20136 B16R1.20288 N#CCC1CCCCN1CCCCCC=O 2230a_100000133382_100000139337 [0,1,0,1,0,0|1,0,1]=4 20137 B16R1.20288 O=CCCCCCN1CCCCC1CCO 2230a_100000211664_100000139337 [0,1,0,1,0,0|1,0,0]=3 20138 B16R1.20288 O=CCCCCCN1CCCCC1CCO 269982a_100000211664_100000139337 [0,1,0,1,0,0|1,0,0]=3 20139 B16R1.20290 C#CCCCCCN1CCCCCCCC1 2230a_100000039187_100012094781 [0,1,0,1,0,0|1,0,1]=4 20140 B16R1.20290 C#CCCCCCN1CCCCCCCC1 269982a_100000039187_100012094781 [0,1,0,1,0,0|1,0,1]=4 20141 B16R1.20290 C#CCCCCCN1CCCCCCCC1 34a_100000039187_100012094781 [0,1,0,1,0,0|1,0,1]=4 20142 B16R1.20290 C=CCCCCCN1CCCCCCCC1 2230a_100000039187_100000700193 [0,1,0,1,0,0|1,0,0]=3 20143 B16R1.20290 C=CCCCCCN1CCCCCCCC1 269982a_100000039187_100000700193 [0,1,0,1,0,0|1,0,0]=3 20144 B16R1.20290 C=CCCCCCN1CCCCCCCC1 34a_100000039187_100000700193 [0,1,0,1,0,0|1,0,0]=3 20145 B16R1.20290 C=CCCCCNC1CCCCCCCC1 270004a_100000703577_100000038600 [0,1,0,1,0,0|1,0,0]=3 20146 B16R1.20290 C=COCCCNC1CCCCCCCC1 270004a_100000210767_100000038600 [0,1,0,1,0,0|2,0,0]=4 20147 B16R1.20290 CCCCCCCN1CCCCCCCC1 2230a_100000039187_100000210681 [0,1,0,1,0,0|1,0,1]=4 20148 B16R1.20290 CCCCCCCN1CCCCCCCC1 269982a_100000039187_100000210681 [0,1,0,1,0,0|1,0,1]=4 20149 B16R1.20290 CCCCCCCN1CCCCCCCC1 34a_100000039187_100000210614 [0,1,0,1,0,0|1,0,1]=4 20150 B16R1.20290 CCCCCCNC1CCCCCCCC1 270004a_100000210581_100000038600 [0,1,0,1,0,0|1,0,1]=4 20151 B16R1.20290 FCCCCCCN1CCCCCCCC1 2230a_100000039187_100015922095 [0,1,0,1,0,0|1,0,1]=4 20152 B16R1.20290 FCCCCCCN1CCCCCCCC1 269982a_100000039187_100015922095 [0,1,0,1,0,0|1,0,1]=4 20153 B16R1.20290 FCCCCCCN1CCCCCCCC1 34a_100000039187_100015922095 [0,1,0,1,0,0|1,0,1]=4 20154 B16R1.20290 N#CCCCCCN1CCCCCCCC1 2230a_100000039187_100009813376 [0,1,0,1,0,0|1,0,1]=4 20155 B16R1.20290 N#CCCCCCN1CCCCCCCC1 269982a_100000039187_100009813376 [0,1,0,1,0,0|1,0,1]=4 20156 B16R1.20290 N#CCCCCNC1CCCCCCCC1 270004a_100000751965_100000038600 [0,1,0,1,0,0|1,0,1]=4 20157 B16R1.20290 O=CCCCCCN1CCCCCCCC1 2230a_100000039187_100000139337 [0,1,0,1,0,0|0,0,0]=2 20158 B16R1.20290 O=CCCCCCN1CCCCCCCC1 269982a_100000039187_100000139337 [0,1,0,1,0,0|0,0,0]=2 20159 B16R1.20290 OCCCCCCN1CCCCCCCC1 2230a_100000039187_100000766143 [0,1,0,1,0,0|0,0,2]=4 20160 B16R1.20290 OCCCCCCN1CCCCCCCC1 269982a_100000039187_100000766143 [0,1,0,1,0,0|0,0,2]=4 20161 B16R1.20290 OCCCCCCN1CCCCCCCC1 34a_100000039187_100000766143 [0,1,0,1,0,0|0,0,2]=4 20162 B16R1.20290 OCCCCCNC1CCCCCCCC1 270004a_100000762737_100000038600 [0,1,0,1,0,0|0,0,2]=4 20163 B16R1.6 C=CCCCCCCCN1CCC(CC1)C 2230a_100000188429_100012355270 [0,1,0,1,0,0|2,0,0]=4 20164 B16R1.6 C=CCCCCCCCN1CCC(CC1)C 269982a_100000188429_100012355270 [0,1,0,1,0,0|2,0,0]=4 20165 B16R1.6 C=CCCCCCCCN1CCC(CC1)C 34a_100000188429_100012355270 [0,1,0,1,0,0|2,0,0]=4 20166 B16R1.6 C=CCCCCCCCN1CCC(CC1)F 2230a_100015193889_100012355270 [0,1,0,1,0,0|2,0,0]=4 20167 B16R1.6 C=CCCCCCCCN1CCC(CC1)F 269982a_100015193889_100012355270 [0,1,0,1,0,0|2,0,0]=4 20168 B16R1.6 C=CCCCCCCCN1CCC(CC1)F 34a_100015193889_100012355270 [0,1,0,1,0,0|2,0,0]=4 20169 B16R1.6 C=CCCCCCCCN1CCC(CC1)O 2230a_100025773856_100012355270 [0,1,0,1,0,0|2,0,0]=4 20170 B16R1.6 C=CCCCCCCCN1CCC(CC1)O 269982a_100025773856_100012355270 [0,1,0,1,0,0|2,0,0]=4 20171 B16R1.6 C=CCCCCCCN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100011215473 [0,1,0,1,0,0|2,0,0]=4 20172 B16R1.6 C=CCCCCCCN[C@H]1CC[C@@H](CC1)C 34a_100020625639_100011215473 [0,1,0,1,0,0|2,0,0]=4 20173 B16R1.6 C=CCCCCCCOC1CCC(CC1)C 34a_100000210714_100011215473 [0,1,0,1,0,0|2,0,0]=4 20174 B16R1.6 C=CCCCCCCOC1CCC(CC1)C 34a_200011216477_200011216234 [0,1,0,1,0,0|2,0,0]=4 20175 B16R1.6 C=CCCCCCCOC1CCC(CC1)C 7a_100000210714_100011215473 [0,1,0,1,0,0|2,0,0]=4 20176 B16R1.6 C=CCCCCCCO[C@H]1CC[C@H](CC1)N 34a_100020628982_100011215473 [0,1,0,1,0,0|2,0,0]=4 20177 B16R1.6 C=CCCCCCCSC1CCC(CC1)C 62a_100011215473_200011216234 [0,1,0,1,0,0|2,0,0]=4 20178 B16R1.6 C=CCCCCCNCC1CCC(CC1)C 2230a_103436935547_100000700193 [0,1,0,1,0,0|2,0,0]=4 20179 B16R1.6 C=CCCCCCNCC1CCC(CC1)C 34a_103436935547_100000700193 [0,1,0,1,0,0|2,0,0]=4 20180 B16R1.6 C=CCCCCCOCC1CCC(CC1)C 34a_100000701341_100000700193 [0,1,0,1,0,0|2,0,0]=4 20181 B16R1.6 C=CCCCCCOC[C@H]1CC[C@@H](CC1)N 34a_100009821084_100000700193 [0,1,0,1,0,0|2,0,0]=4 20182 B16R1.6 C=CCCCCNCCC1CCC(CC1)O 34a_200011935226_100011215482 [0,1,0,1,0,0|2,0,0]=4 20183 B16R1.6 C=CCCCCOCCC1CCC(CC1)N 34a_100000070672_100011215482 [0,1,0,1,0,0|2,0,0]=4 20184 B16R1.6 CC1CCC(CC1)CNCCCCCC=O 2230a_103436935547_100000139337 [0,1,0,1,0,0|1,0,0]=3 20185 B16R1.6 CN1CCC(CC1)CCCOCCCC=O 7a_100000083870_200011292268 [0,1,0,1,0,0|2,0,0]=4 20186 B16R1.6 CN1CCC(CC1)CSCCCCCC=O 62a_100000139337_100015183002 [0,1,0,1,0,0|2,0,0]=4 20187 B16R1.6 CN1CCC(CC1)CSCCCCCC=O 62a_100015183002_100000139337 [0,1,0,1,0,0|2,0,0]=4 20188 B16R1.75 C=CCCCCCNC1CCCC(C1C)C 2230a_100000211273_100000700193 [0,1,0,1,0,0|2,0,0]=4 20189 B16R1.75 C=CCCCCCNC1CCCC(C1C)C 34a_100000211273_100000700193 [0,1,0,1,0,0|2,0,0]=4 20190 B16R1.75 C=CCCCCCOC1CCCC(C1C)C 34a_100011217532_100000700193 [0,1,0,1,0,0|2,0,0]=4 20191 B16R1.75 C=CCCCCCOC1CCCC(C1C)C 7a_100011217532_100000700193 [0,1,0,1,0,0|2,0,0]=4 20192 B16R1.75 CC1CCCC(C1C)NCCCCCC=O 2230a_100000211273_100000139337 [0,1,0,1,0,0|1,0,0]=3 20193 B16R1.75 CC1CCCC(C1C)OCCCCCC=O 7a_100011217532_100000139337 [0,1,0,1,0,0|1,0,0]=3 20194 B16R1.273 C=CCCCNC1CCCCC1C(C)CC 269862a_100000700776_100011216798 [0,1,0,1,0,0|2,0,0]=4 20195 B16R1.642 C=CCCCCCCCCN1CCC(C1)O 2230a_100011215560_100011933949 [0,1,0,1,0,0|2,0,0]=4 20196 B16R1.642 C=CCCCCCCCCN1CCC(C1)O 269982a_100011215560_100011933949 [0,1,0,1,0,0|2,0,0]=4 20197 B16R1.642 C=CCCCCCCCCN1CC[C@@H](C1)F 2230a_100015203821_100011933949 [0,1,0,1,0,0|2,0,0]=4 20198 B16R1.642 C=CCCCCCCCCN1CC[C@@H](C1)F 269982a_100015203821_100011933949 [0,1,0,1,0,0|2,0,0]=4 20199 B16R1.642 C=CCCCCCCCCN1CC[C@@H](C1)F 34a_100015203821_100011933949 [0,1,0,1,0,0|2,0,0]=4 20200 B16R1.642 C=CCCCCCCCCN1CC[C@H](C1)C 2230a_100016987628_100011933949 [0,1,0,1,0,0|2,0,0]=4 20201 B16R1.642 C=CCCCCCCCCN1CC[C@H](C1)C 269982a_100016987628_100011933949 [0,1,0,1,0,0|2,0,0]=4 20202 B16R1.642 C=CCCCCCCCCN1CC[C@H](C1)C 34a_100016987628_100011933949 [0,1,0,1,0,0|2,0,0]=4 20203 B16R1.642 C=CCCCCCCCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100012355270 [0,1,0,1,0,0|2,0,0]=4 20204 B16R1.642 C=CCCCCCCCOC1CCC(C1)C 34a_100000698185_100012355270 [0,1,0,1,0,0|2,0,0]=4 20205 B16R1.642 CCCCCCCCCCN1CNC(=O)C1 2230a_200000708111_100000210320 [0,1,0,1,0,0|2,0,0]=4 20206 B16R1.642 CCCCCCCCCNC1CNC(=O)C1 2230a_100000697751_100011214924 [0,1,0,1,0,0|2,0,0]=4 20207 B16R1.642 CCCCCCCCCNC1COC(=O)O1 34a_100000212291_100000032252 [0,1,0,1,0,0|2,0,0]=4 20208 B16R1.642 CCCCCCCCCOC1CCC(=O)C1 34a_100012614533_100011214924 [0,1,0,1,0,0|1,0,0]=3 20209 B16R1.642 CCCCCCCCCOC1CNC(=O)C1 34a_100000690082_100011214924 [0,1,0,1,0,0|2,0,0]=4 20210 B16R1.642 CCCCCCCCCOC1COC(=O)O1 34a_100000210712_100000032252 [0,1,0,1,0,0|2,0,0]=4 20211 B16R1.642 CCCCCCCCNCC1CNC(=O)C1 2230a_100016993742_100000210759 [0,1,0,1,0,0|2,0,0]=4 20212 B16R1.642 CCCCCCCCNCC1CNC(=O)C1 34a_100016993742_100000210759 [0,1,0,1,0,0|2,0,0]=4 20213 B16R1.642 CCCCCCCCNCC1CNC(=O)O1 2230a_100000229939_100000181169 [0,1,0,1,0,0|2,0,0]=4 20214 B16R1.642 CCCCCCCCNCC1CNC(=O)O1 34a_100000229939_100000181169 [0,1,0,1,0,0|2,0,0]=4 20215 B16R1.642 CCCCCCCCNCC1COC(=O)O1 34a_100000229939_100000073702 [0,1,0,1,0,0|2,0,0]=4 20216 B16R1.642 CCCCCCCCNC[C@@H]1CCC(=O)N1 2230a_100000229939_100015189358 [0,1,0,1,0,0|1,0,0]=3 20217 B16R1.642 CCCCCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000210759 [0,1,0,1,0,0|1,0,0]=3 20218 B16R1.642 CCCCCCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000210759 [0,1,0,1,0,0|1,0,0]=3 20219 B16R1.642 CCCCCCCCNC[C@H]1COC(=O)N1 2230a_100000229939_100015307671 [0,1,0,1,0,0|2,0,0]=4 20220 B16R1.642 CCCCCCCCNC[C@H]1COC(=O)N1 34a_100000229939_100015307671 [0,1,0,1,0,0|2,0,0]=4 20221 B16R1.642 CCCCCCCCOCC1CCC(=O)N1 34a_100000737831_100000210759 [0,1,0,1,0,0|1,0,0]=3 20222 B16R1.642 CCCCCCCCOCC1CNC(=O)C1 34a_100016041077_100000210759 [0,1,0,1,0,0|2,0,0]=4 20223 B16R1.642 CCCCCCCCOCC1CNC(=O)O1 34a_100000210232_100000181169 [0,1,0,1,0,0|2,0,0]=4 20224 B16R1.642 CCCCCCCCOCC1CNC(=O)O1 34a_100011315639_100000210759 [0,1,0,1,0,0|2,0,0]=4 20225 B16R1.642 CCCCCCCCOCC1CNC(=O)O1 7a_100000210232_100000181169 [0,1,0,1,0,0|2,0,0]=4 20226 B16R1.642 CCCCCCCCOCC1COC(=O)O1 34a_100000210232_100000073702 [0,1,0,1,0,0|2,0,0]=4 20227 B16R1.642 CCCCCCCCOC[C@@H]1C=C[C@@H](C1)N 34a_100020646542_100000210759 [0,1,0,1,0,0|2,0,0]=4 20228 B16R1.642 CCCCCCCCOC[C@@H]1CCC(=O)N1 7a_100000210232_100015189358 [0,1,0,1,0,0|1,0,0]=3 20229 B16R1.642 CCCCCCCCOC[C@H]1COC(=O)N1 34a_100000210232_100015307671 [0,1,0,1,0,0|2,0,0]=4 20230 B16R1.642 CCCCCCCCOC[C@H]1COC(=O)N1 7a_100000210232_100015307671 [0,1,0,1,0,0|2,0,0]=4 20231 B16R1.642 CCCCCCCCSCC1CNC(=O)O1 62a_100000181169_100000210317 [0,1,0,1,0,0|2,0,0]=4 20232 B16R1.642 CCCCCCCCSCC1CNC(=O)O1 62a_100000210759_100000181169 [0,1,0,1,0,0|2,0,0]=4 20233 B16R1.642 CCCCCCCCSCC1COC(=O)O1 62a_100000073702_100000210317 [0,1,0,1,0,0|2,0,0]=4 20234 B16R1.642 CCCCCCCCSCC1COC(=O)O1 62a_100000210759_100000073702 [0,1,0,1,0,0|2,0,0]=4 20235 B16R1.642 CCCCCCCCSC[C@@H]1CCC(=O)N1 62a_100000210759_100015189358 [0,1,0,1,0,0|1,0,0]=3 20236 B16R1.642 CCCCCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210317 [0,1,0,1,0,0|1,0,0]=3 20237 B16R1.642 CCCCCCCCSC[C@H]1COC(=O)N1 62a_100000210759_100015307671 [0,1,0,1,0,0|2,0,0]=4 20238 B16R1.642 CCCCCCCCSC[C@H]1COC(=O)N1 62a_100015307671_100000210317 [0,1,0,1,0,0|2,0,0]=4 20239 B16R1.642 CCCCCOCCOC[C@@H]1CCC(=O)N1 7a_100011215259_100015189358 [0,1,0,1,0,0|2,0,0]=4 20240 B16R1.642 CCCCOCCCNC[C@@H]1CCC(=O)N1 2230a_200000211371_100015189358 [0,1,0,1,0,0|2,0,0]=4 20241 B16R1.642 CCCCOCCCOC[C@@H]1CCC(=O)N1 7a_200011215613_100015189358 [0,1,0,1,0,0|2,0,0]=4 20242 B16R1.642 COCCCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100011998445 [0,1,0,1,0,0|2,0,0]=4 20243 B16R1.642 COCCCCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100011998445 [0,1,0,1,0,0|2,0,0]=4 20244 B16R1.642 COCCCCCCOCC1CCC(=O)N1 34a_100000737831_100011998445 [0,1,0,1,0,0|2,0,0]=4 20245 B16R1.642 COCCCCCCOC[C@@H]1CCC(=O)N1 7a_200012092642_100015189358 [0,1,0,1,0,0|2,0,0]=4 20246 B16R1.642 COCCCCCCSC[C@@H]1CCC(=O)N1 62a_100011998445_100015189358 [0,1,0,1,0,0|2,0,0]=4 20247 B16R1.642 COCCCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100011998445 [0,1,0,1,0,0|2,0,0]=4 20248 B16R1.642 O=C1CCC(C1)OCCCCCCCCO 34a_100012614533_100000033203 [0,1,0,1,0,0|2,0,0]=4 20249 B16R1.642 O=C1CCC(N1)COCCCCCCCO 34a_100000737831_100000760002 [0,1,0,1,0,0|2,0,0]=4 20250 B16R1.642 O=C1CC[C@@H](N1)CNCCCCCCCO 2230a_100015423886_100000760002 [0,1,0,1,0,0|2,0,0]=4 20251 B16R1.642 O=C1CC[C@@H](N1)CNCCCCCCCO 34a_100015423886_100000760002 [0,1,0,1,0,0|2,0,0]=4 20252 B16R1.642 O=C1CC[C@H](N1)CNCCCCCCCO 2230a_100011996573_100015189358 [0,1,0,1,0,0|2,0,0]=4 20253 B16R1.642 O=C1CC[C@H](N1)COCCCCCCCBr 7a_100000760002_100015189358 [0,1,0,1,0,0|2,0,0]=4 20254 B16R1.642 O=C1CC[C@H](N1)CSCCCCCCCO 62a_100000760002_100015189358 [0,1,0,1,0,0|2,0,0]=4 20255 B16R1.642 O=C1CC[C@H](N1)CSCCCCCCCO 62a_100015189358_100000760002 [0,1,0,1,0,0|2,0,0]=4 20256 B16R1.696 C=CCC1CCCCC1NCCC(C)CC 269862a_100020591266_100011214939 [0,1,0,1,0,0|2,0,0]=4 20257 B16R1.696 C=CCC1CCCCC1NCCC(C)CC 270004a_100020591266_100011214939 [0,1,0,1,0,0|2,0,0]=4 20258 B16R1.1100 CCC(C)CCCOC1CCCCCC1=O 7a_100011216074_100000243696 [0,1,0,1,0,0|1,0,0]=3 20259 B16R1.1100 CCC(C)CCCOC1CCCCNC1=O 7a_100011216074_100000735217 [0,1,0,1,0,0|2,0,0]=4 20260 B16R1.1100 CCC(C)NCCCN1CCCCCC1=O 2230a_100000195386_100000758301 [0,1,0,1,0,0|2,0,0]=4 20261 B16R1.1100 CCC(C)NCCCN1CCCCCC1=O 34a_100000195386_100011215416 [0,1,0,1,0,0|2,0,0]=4 20262 B16R1.1100 CCN(C)CCCSC1CCCCCC1=O 62a_100000243696_100015186262 [0,1,0,1,0,0|2,0,0]=4 20263 B16R1.1133 CCN(C)CCCOCC1CCCCC1=O 7a_100009861125_100015186262 [0,1,0,1,0,0|2,0,0]=4 20264 B16R1.1166 C=CC(O)COCCCCC1CCCCC1 34a_100011215267_100000730141 [0,1,0,1,0,0|2,0,0]=4 20265 B16R1.1166 C=CC(O)COCCCCC1CCCCC1 7a_100011215267_100000730141 [0,1,0,1,0,0|2,0,0]=4 20266 B16R1.1166 CCC(C)CCCCCOC1C=CCCC1 7a_200000035636_100000751183 [0,1,0,1,0,0|2,0,0]=4 20267 B16R1.8378 C=CCCCCCCN1CCCC(CC1)C 2230a_100025706717_100011215473 [0,1,0,1,0,0|2,0,0]=4 20268 B16R1.8378 C=CCCCCCCN1CCCC(CC1)C 269982a_100025706717_100011215473 [0,1,0,1,0,0|2,0,0]=4 20269 B16R1.8378 C=CCCCCCCN1CCCC(CC1)C 34a_100025706717_100011215473 [0,1,0,1,0,0|2,0,0]=4 20270 B16R1.8378 C=CCCCCCCN1CCCC(CC1)O 2230a_100015186869_100011215473 [0,1,0,1,0,0|2,0,0]=4 20271 B16R1.8378 C=CCCCCCCN1CCCC(CC1)O 269982a_100015186869_100011215473 [0,1,0,1,0,0|2,0,0]=4 20272 B16R1.16885 CCC(C)CCCCCOC1CCCC1=O 7a_200000035636_100000211823 [0,1,0,1,0,0|1,0,0]=3 20273 B16R1.16885 CCC(C)CCCCCOC1CCOC1=O 7a_200000035636_100000211211 [0,1,0,1,0,0|2,0,0]=4 20274 B16R1.16885 CCC(C)CCCOCCN1CCCC1=O 7a_100011216074_100000739059 [0,1,0,1,0,0|2,0,0]=4 20275 B16R1.17547 CCCCCCCCNC1CCN(C1=O)C 2230a_100000229939_100000755940 [0,1,0,1,0,0|2,0,0]=4 20276 B16R1.17547 CCCCCCCCNC1CCN(C1=O)C 34a_100000229939_100000755940 [0,1,0,1,0,0|2,0,0]=4 20277 B16R1.17547 CCCCCCCCOC1CCN(C1=O)C 34a_100000210232_100000755940 [0,1,0,1,0,0|2,0,0]=4 20278 B16R1.17547 CCCCCCCCOC1CCN(C1=O)C 7a_100000210232_100000755940 [0,1,0,1,0,0|2,0,0]=4 20279 B16R1.17547 CCCCCCCCSC1CCN(C1=O)C 62a_100000210759_100000755940 [0,1,0,1,0,0|2,0,0]=4 20280 B16R1.17547 CCCCCCCCSC1CCN(C1=O)C 62a_100000755940_100000210317 [0,1,0,1,0,0|2,0,0]=4 20281 B16R1.17547 CCCCCCCOCC1CCN(C1=O)C 34a_100009823153_100000210614 [0,1,0,1,0,0|2,0,0]=4 20282 B16R1.17549 CCN1CCC(C1)CNCCCCCC=O 2230a_100011224064_100000139337 [0,1,0,1,0,0|2,0,0]=4 20283 B16R1.17549 CCN1CCC(C1)CSCCCCCC=O 62a_100000139337_100015184589 [0,1,0,1,0,0|2,0,0]=4 20284 B16R1.17549 CCN1CCC(C1)CSCCCCCC=O 62a_100015184589_100000139337 [0,1,0,1,0,0|2,0,0]=4 20285 B16R1.18261 C=CC(O)CNCCC1CCCCCCC1 2230a_100011532352_100000730141 [0,1,0,1,0,0|2,0,0]=4 20286 B16R1.18261 C=CC(O)CNCCC1CCCCCCC1 34a_100011532352_100000730141 [0,1,0,1,0,0|2,0,0]=4 20287 B16R1.20277 C=CCCCCCCCCCNC1(CC1)C 2230a_100000757604_100009814027 [0,1,0,1,0,0|2,0,0]=4 20288 B16R1.20277 C=CCCCCCCCCCOC1(CC1)C 7a_100011725673_100009814027 [0,1,0,1,0,0|2,0,0]=4 20289 B16R1.20277 C=CCCCCCCCCNCC1(CC1)C 2230a_100000766693_100011933949 [0,1,0,1,0,0|2,0,0]=4 20290 B16R1.20277 C=CCCCCCCCCNCC1(CC1)O 2230a_100011936951_100011933949 [0,1,0,1,0,0|2,0,0]=4 20291 B16R1.20277 C=CCCCCCCCCOCC1(CC1)C 7a_100000698024_100011933949 [0,1,0,1,0,0|2,0,0]=4 20292 B16R1.20277 C=CCCCCCCCCOCC1(CC1)F 34a_200000703853_100011933949 [0,1,0,1,0,0|2,0,0]=4 20293 B16R1.20277 C=CCCCCCCCCOCC1(CC1)F 7a_200000703853_100011933949 [0,1,0,1,0,0|2,0,0]=4 20294 B16R1.20336 C=CCCCCCCCCN1CC(C1)CC 2230a_100015205115_100011933949 [0,1,0,1,0,0|2,0,0]=4 20295 B16R1.20336 C=CCCCCCCCCN1CC(C1)CC 269982a_100015205115_100011933949 [0,1,0,1,0,0|2,0,0]=4 20296 B16R1.20496 C=CCCCCCOC1CCCC(C1)CC 7a_100011985506_100000700193 [0,1,0,1,0,0|2,0,0]=4 20297 B16R1.20496 CCC1CCCC(C1)OCCCCCC=O 7a_100011985506_100000139337 [0,1,0,1,0,0|1,0,0]=3 20298 B16R1.20496 CCN1CCCC(C1)CNCCCCC=O 2230a_100000747413_100000139335 [0,1,0,1,0,0|2,0,0]=4 20299 B16R1.20496 CCN1CCCC(C1)COCCCCC=O 7a_200000227639_100000139335 [0,1,0,1,0,0|2,0,0]=4 20300 B16R1.20496 CCN1CCC[C@H](C1)NCCCCCC=O 2230a_100025775482_100000139337 [0,1,0,1,0,0|2,0,0]=4 20301 B16R1.23400 CCCCCCNC1CCCCN(C1=O)C 2230a_100159325733_100000210314 [0,1,0,1,0,0|2,0,0]=4 20302 B16R1.23400 CCCCCCNC1CCCCN(C1=O)C 34a_100159325733_100000210314 [0,1,0,1,0,0|2,0,0]=4 20303 B16R1.36993 C=CCCCCCCCCN1C[C@@H]([C@@H]1C)O 2230a_206633788156_100011933949 [0,1,0,1,0,0|2,0,0]=4 20304 B16R1.36993 C=CCCCCCCCCN1C[C@@H]([C@@H]1C)O 269982a_206633788156_100011933949 [0,1,0,1,0,0|2,0,0]=4 20305 B16R1.693 C=CCCCCCC(=O)CC1CCCCC1 1458a_100000211666_100000700193 [0,1,0,1,0,0|1,0,1]=4 20306 B16R1.693 C=CCCCCCC(=O)CC1CCCCC1 1458a_100011934241_100000211423 [0,1,0,1,0,0|1,0,1]=4 20307 B16R1.693 C=CCCCCCN(C)CC1CCCCC1 2230a_100000736448_100000700193 [0,1,0,1,0,0|2,0,0]=4 20308 B16R1.693 C=CCCCCCN(C)CC1CCCCC1 269982a_100000736448_100000700193 [0,1,0,1,0,0|2,0,0]=4 20309 B16R1.693 C=CCCCCCN(C)CC1CCCCC1 34a_100000736448_100000700193 [0,1,0,1,0,0|2,0,0]=4 20310 B16R1.693 C=CCCCCNC(C)CC1CCCCC1 270004a_100000703577_100011215996 [0,1,0,1,0,0|2,0,0]=4 20311 B16R1.693 C=CCCCOC[C@@H](N)CC1CCCCC1 34a_100015184289_100000757094 [0,1,0,1,0,0|2,0,0]=4 20312 B16R1.693 CC(CN1CCCCC1)NCCCCC=O 2230a_100000738326_100000139335 [0,1,0,1,0,0|2,0,0]=4 20313 B16R1.693 CC(CN1CCCCC1)SCCCCC=O 62a_100000139335_100009831500 [0,1,0,1,0,0|2,0,0]=4 20314 B16R1.693 CC(CN1CCCCC1)SCCCCC=O 62a_100009831500_100000139335 [0,1,0,1,0,0|2,0,0]=4 20315 B16R1.693 CCCCCCCC(C)OC1C=CCCC1 34a_100011215024_200011218727 [0,1,0,1,0,0|2,0,0]=4 20316 B16R1.693 CCCCCCCC(C)OC1C=CCCC1 7a_200011215852_100000751183 [0,1,0,1,0,0|2,0,0]=4 20317 B16R1.693 CCCCCCCC(C)SC1C=CCCC1 62a_100000751183_200011218727 [0,1,0,1,0,0|2,0,0]=4 20318 B16R1.693 CCCCCCCC(C)SC1C=CCCC1 62a_200011218727_100000751183 [0,1,0,1,0,0|2,0,0]=4 20319 B16R1.693 CN(CCCCCC=O)CC1CCCCC1 2230a_100000736448_100000139337 [0,1,0,1,0,0|1,0,0]=3 20320 B16R1.693 CN(CCCCCC=O)CC1CCCCC1 269982a_100000736448_100000139337 [0,1,0,1,0,0|1,0,0]=3 20321 B16R1.693 CN(CCCCCC=O)CC1CCCCO1 2230a_100000225654_100000139337 [0,1,0,1,0,0|2,0,0]=4 20322 B16R1.693 CN(CCCCCC=O)CC1CCCCO1 269982a_100000225654_100000139337 [0,1,0,1,0,0|2,0,0]=4 20323 B16R1.693 CN(CCCCCC=O)CC1CCOCC1 2230a_100025706683_100000139337 [0,1,0,1,0,0|2,0,0]=4 20324 B16R1.693 CN(CCCCCC=O)CC1CCOCC1 269982a_100025706683_100000139337 [0,1,0,1,0,0|2,0,0]=4 20325 B16R1.693 CN(CCCCCC=O)CC1CCSCC1 2230a_100011935259_100000139337 [0,1,0,1,0,0|2,0,0]=4 20326 B16R1.693 CN(CCCCCC=O)CC1CCSCC1 269982a_100011935259_100000139337 [0,1,0,1,0,0|2,0,0]=4 20327 B16R1.693 O=CCCCNC[C@H](O)CN1CCCCC1 2230a_100015205997_200011292268 [0,1,0,1,0,0|2,0,0]=4 20328 B16R1.1245 C=CCCCCCC(=O)CCC1CCCC1 1458a_100000211120_100000700193 [0,1,0,1,0,0|1,0,1]=4 20329 B16R1.1245 C=CCCCCCC(=O)CCC1CCCC1 1458a_100011934241_100000760354 [0,1,0,1,0,0|1,0,1]=4 20330 B16R1.1245 CN(CCCCCC=O)CCN1CCCC1 2230a_100000225677_100000139337 [0,1,0,1,0,0|2,0,0]=4 20331 B16R1.1245 CN(CCCCCC=O)CCN1CCCC1 269982a_100000225677_100000139337 [0,1,0,1,0,0|2,0,0]=4 20332 B16R1.7596 C=CCCCCCC(=O)C1CCCCC1C 1458a_100011215568_100000700193 [0,1,0,1,0,0|1,0,1]=4 20333 B16R1.7596 CC1CCCCN1C(C)COCCCC=O 7a_200011934825_200011292268 [0,1,0,1,0,0|2,0,0]=4 20334 B16R1.7596 CCCCCCCC(=O)C1CCCCC1=O 1458a_100000211969_100000204591 [0,1,0,1,0,0|0,0,1]=3 20335 B16R1.7596 CCCCCCCC(=O)C1CCCNC1=O 1458a_100000087122_100000210614 [0,1,0,1,0,0|1,0,1]=4 20336 B16R1.7596 CCCCCCCC(=O)C1CCCNC1=O 1458a_100000211969_100000687798 [0,1,0,1,0,0|1,0,1]=4 20337 B16R1.7596 CCCCCCCC(=O)C1COCCC1=O 1458a_100000211969_100012180262 [0,1,0,1,0,0|1,0,1]=4 20338 B16R1.7596 CCCCCCCN(C)C1CCCCC1=O 269982a_100000228206_100000204591 [0,1,0,1,0,0|1,0,0]=3 20339 B16R1.7596 CCCCCCCN(C)C1CCCNC1=O 2230a_100000228206_100000687798 [0,1,0,1,0,0|2,0,0]=4 20340 B16R1.7596 CCCCCCCN(C)C1CCCNC1=O 269982a_100000228206_100000687798 [0,1,0,1,0,0|2,0,0]=4 20341 B16R1.7596 CN(CCCCCC=O)[C@@H]1CCCC[C@H]1O 269982a_100000708425_100000139337 [0,1,0,1,0,0|2,0,0]=4 20342 B16R1.7596 COCCCCCC(=O)C1CCCCC1=O 1458a_100011935119_100000204591 [0,1,0,1,0,0|1,0,1]=4 20343 B16R1.7596 O=C(CCCCCCO)C1CCCCC1=O 1458a_100011996774_100000204591 [0,1,0,1,0,0|1,0,1]=4 20344 B16R1.7598 CCCCCCCC(=O)CCC1CCC1=O 1458a_100000211969_200016118888 [0,1,0,1,0,0|0,0,1]=3 20345 B16R1.7598 CCCCCCCN(C)CCC1CCC1=O 2230a_100000228206_200016118888 [0,1,0,1,0,0|1,0,0]=3 20346 B16R1.7598 CCCCCCCN(C)CCC1CCC1=O 269982a_100000228206_200016118888 [0,1,0,1,0,0|1,0,0]=3 20347 B16R1.7598 COCCCCCC(=O)CCC1CCC1=O 1458a_100011935119_200016118888 [0,1,0,1,0,0|1,0,1]=4 20348 B16R1.7598 O=C(CCCCCCO)CCC1CCC1=O 1458a_100011996774_200016118888 [0,1,0,1,0,0|1,0,1]=4 20349 B16R1.7605 CCCCCCCC(=O)CN1CCCC1=O 1458a_100000189602_100000210614 [0,1,0,1,0,0|1,0,1]=4 20350 B16R1.7605 CCCCCCCC(C)NC1CCNC1=O 2230a_100016995588_200011218727 [0,1,0,1,0,0|2,0,0]=4 20351 B16R1.7605 CCCCCCCC(C)NC1CCNC1=O 270004a_100016995588_100000210596 [0,1,0,1,0,0|2,0,0]=4 20352 B16R1.7605 CCCCCCCC(C)NC1CCNC1=O 34a_100016995588_200011218727 [0,1,0,1,0,0|2,0,0]=4 20353 B16R1.7605 CCCCCCCC(C)OC1CCCC1=O 34a_200000719330_200011218727 [0,1,0,1,0,0|1,0,0]=3 20354 B16R1.7605 CCCCCCCC(C)OC1CCCC1=O 34a_200011215852_100000709159 [0,1,0,1,0,0|1,0,0]=3 20355 B16R1.7605 CCCCCCCC(C)OC1CCCC1=O 7a_200011215852_100000211823 [0,1,0,1,0,0|1,0,0]=3 20356 B16R1.7605 CCCCCCCC(C)OC1CCOC1=O 34a_200011215852_100000211211 [0,1,0,1,0,0|2,0,0]=4 20357 B16R1.7605 CCCCCCCC(C)OC1CCOC1=O 7a_200011215852_100000211211 [0,1,0,1,0,0|2,0,0]=4 20358 B16R1.7605 CCCCCCCC(C)O[C@H]1CCNC1=O 34a_100000688343_200011218727 [0,1,0,1,0,0|2,0,0]=4 20359 B16R1.7605 CCCCCCCC(C)SC1CCCC1=O 62a_100000211823_200011218727 [0,1,0,1,0,0|1,0,0]=3 20360 B16R1.7605 CCCCCCCC(C)SC1CCCC1=O 62a_200011218727_100000211823 [0,1,0,1,0,0|1,0,0]=3 20361 B16R1.7605 CCCCCCCC(C)SC1CCOC1=O 62a_100000211211_200011218727 [0,1,0,1,0,0|2,0,0]=4 20362 B16R1.7605 CCCCCCCC(C)SC1CCOC1=O 62a_200011218727_100000211211 [0,1,0,1,0,0|2,0,0]=4 20363 B16R1.7605 CCCCCCCN(C)CN1CCCC1=O 269982a_100000228206_100000026320 [0,1,0,1,0,0|2,0,0]=4 20364 B16R1.17796 CCCN1CCCC(C1)NCCCCC=O 2230a_100011435248_100000139335 [0,1,0,1,0,0|2,0,0]=4 20365 B16R1.17796 CCOC1CCCN(C1)CCCCCC=O 2230a_100000745229_100000139337 [0,1,0,1,0,0|2,0,0]=4 20366 B16R1.17796 CCOC1CCCN(C1)CCCCCC=O 269982a_100000745229_100000139337 [0,1,0,1,0,0|2,0,0]=4 20367 B16R1.17796 COCC1CCCN(C1)CCCCCC=O 2230a_100000755410_100000139337 [0,1,0,1,0,0|2,0,0]=4 20368 B16R1.17796 COCC1CCCN(C1)CCCCCC=O 269982a_100000755410_100000139337 [0,1,0,1,0,0|2,0,0]=4 20369 B16R1.17796 O=CCCCCCN1CCCC(C1)CCO 2230a_100000752241_100000139337 [0,1,0,1,0,0|2,0,0]=4 20370 B16R1.17796 O=CCCCCCN1CCCC(C1)CCO 269982a_100000752241_100000139337 [0,1,0,1,0,0|2,0,0]=4 20371 B16R1.40691 C=CCCCCCC(=O)C1CCCCCC1 1458a_100000749507_100000700193 [0,1,0,1,0,0|1,0,1]=4 20372 B16R1.40691 C=CCCCCCC(=O)C1CCCCCC1 1458a_100011934241_100011217769 [0,1,0,1,0,0|1,0,1]=4 20373 B16R1.40691 C=CCCCCCN(C)C1CCCCCC1 2230a_100015185097_100000700193 [0,1,0,1,0,0|2,0,0]=4 20374 B16R1.40691 C=CCCCCCN(C)C1CCCCCC1 269982a_100015185097_100000700193 [0,1,0,1,0,0|2,0,0]=4 20375 B16R1.40691 C=CCCCCCN(C)C1CCCCCC1 34a_100015185097_100000700193 [0,1,0,1,0,0|2,0,0]=4 20376 B16R1.40691 CN(CCCCCC=O)C1CCCCCC1 2230a_100015185097_100000139337 [0,1,0,1,0,0|1,0,0]=3 20377 B16R1.40691 CN(CCCCCC=O)C1CCCCCC1 269982a_100015185097_100000139337 [0,1,0,1,0,0|1,0,0]=3 20378 B16R1.64 C=CCCCCCCC(=O)C1CCCCC1 1458a_100000210647_100011215473 [0,1,0,1,0,0|1,0,1]=4 20379 B16R1.64 C=CCCCCCCC(=O)C1CCCCC1 1458a_100011809334_100000210327 [0,1,0,1,0,0|1,0,1]=4 20380 B16R1.64 C=CCCCCCCN(C)C1CCCCC1 2230a_100000207522_100011215473 [0,1,0,1,0,0|2,0,0]=4 20381 B16R1.64 C=CCCCCCCN(C)C1CCCCC1 269982a_100000207522_100011215473 [0,1,0,1,0,0|2,0,0]=4 20382 B16R1.64 C=CCCCCCCN(C)C1CCCCC1 34a_100000207522_100011215473 [0,1,0,1,0,0|2,0,0]=4 20383 B16R1.64 C=CCCCCCN[C@H](C)C1CCCCC1 2230a_100025707633_100000700193 [0,1,0,1,0,0|2,0,0]=4 20384 B16R1.64 C=CCCCCCN[C@H](C)C1CCCCC1 34a_100025707633_100000700193 [0,1,0,1,0,0|2,0,0]=4 20385 B16R1.64 C=CCCCCCOC(C)C1CCCCC1 34a_100011216961_100000700193 [0,1,0,1,0,0|2,0,0]=4 20386 B16R1.64 C=CCCCCCOC(C)C1CCCCC1 7a_100011216961_100000700193 [0,1,0,1,0,0|2,0,0]=4 20387 B16R1.64 C=CCCCCOC[C@H](N)C1CCCCC1 34a_100009817630_100011215482 [0,1,0,1,0,0|2,0,0]=4 20388 B16R1.64 C=CCCCOCCC(N)C1CCCCC1 34a_200020622111_100000757094 [0,1,0,1,0,0|2,0,0]=4 20389 B16R1.64 CC(OCCCCCC=O)C1CCCCC1 7a_100011216961_100000139337 [0,1,0,1,0,0|1,0,0]=3 20390 B16R1.64 CCCCCCCCC(=O)C1C=CCCC1 1458a_100000210188_100000751183 [0,1,0,1,0,0|1,0,1]=4 20391 B16R1.64 CCCCCCCCN(C)C1C=CCCC1 2230a_100000207567_100000751183 [0,1,0,1,0,0|2,0,0]=4 20392 B16R1.64 CCCCCCCCN(C)C1C=CCCC1 269982a_100000207567_100000751183 [0,1,0,1,0,0|2,0,0]=4 20393 B16R1.64 C[C@@H](NCCCCCC=O)C1CCCCC1 2230a_100025707633_100000139337 [0,1,0,1,0,0|1,0,0]=3 20394 B16R1.64 C[C@@H](OCCCCCC=O)C1CCOCC1 7a_100000703848_100000139337 [0,1,0,1,0,0|2,0,0]=4 20395 B16R1.64 O=CCCCCSCC(=O)C1CCCCC1 62a_100000139335_100000241979 [0,1,0,1,0,0|1,0,1]=4 20396 B16R1.64 O=CCCCCSCC(=O)C1CCCCC1 62a_100000241979_100000139335 [0,1,0,1,0,0|1,0,1]=4 20397 B16R1.246 CCCOCC1CCN(C1)CCCCC=O 2230a_200011652792_100000139335 [0,1,0,1,0,0|2,0,0]=4 20398 B16R1.246 CCCOCC1CCN(C1)CCCCC=O 269982a_200011652792_100000139335 [0,1,0,1,0,0|2,0,0]=4 20399 B16R1.263 CCCOC1CCCN(C1)CCCCC=O 2230a_100000743837_100000139335 [0,1,0,1,0,0|2,0,0]=4 20400 B16R1.263 CCCOC1CCCN(C1)CCCCC=O 269982a_100000743837_100000139335 [0,1,0,1,0,0|2,0,0]=4 20401 B16R1.263 COCCC1CCCN(C1)CCCCC=O 2230a_100011653411_100000139335 [0,1,0,1,0,0|2,0,0]=4 20402 B16R1.263 COCCC1CCCN(C1)CCCCC=O 269982a_100011653411_100000139335 [0,1,0,1,0,0|2,0,0]=4 20403 B16R1.263 O=CCCCCN1CCCC(C1)CCCO 2230a_100150707839_100000139335 [0,1,0,1,0,0|2,0,0]=4 20404 B16R1.263 O=CCCCCN1CCCC(C1)CCCO 269982a_100150707839_100000139335 [0,1,0,1,0,0|2,0,0]=4 20405 B16R1.688 C=CCCCCC(=O)CCC1CCCCC1 1458a_100000211375_100011215482 [0,1,0,1,0,0|1,0,1]=4 20406 B16R1.688 C=CCCCCC(=O)CCC1CCCCC1 1458a_100011215552_100011273959 [0,1,0,1,0,0|1,0,1]=4 20407 B16R1.688 C=CCCCCN(C)CCC1CCCCC1 2230a_100012000471_100012355289 [0,1,0,1,0,0|2,0,0]=4 20408 B16R1.688 C=CCCCCN(C)CCC1CCCCC1 269982a_100012000471_100011273959 [0,1,0,1,0,0|2,0,0]=4 20409 B16R1.688 C=CCCCCN(C)CCC1CCCCC1 270004a_100012000471_100011713444 [0,1,0,1,0,0|2,0,0]=4 20410 B16R1.688 CN(CCCCC=O)CCC1CCCCO1 2230a_100015183322_100000139335 [0,1,0,1,0,0|2,0,0]=4 20411 B16R1.688 CN(CCCCC=O)CCC1CCCCO1 269982a_100015183322_100000139335 [0,1,0,1,0,0|2,0,0]=4 20412 B16R1.1251 C=CCCCCCCC(=O)CC1CCCC1 1458a_100000210891_100011215473 [0,1,0,1,0,0|1,0,1]=4 20413 B16R1.1251 C=CCCCCCCC(=O)CC1CCCC1 1458a_100011809334_100000740388 [0,1,0,1,0,0|1,0,1]=4 20414 B16R1.1251 CC(COCCCCC=O)CN1CCCC1 7a_200011934648_100000139335 [0,1,0,1,0,0|2,0,0]=4 20415 B16R1.1251 CCCCCCCCC(=O)CC1C=CCC1 1458a_100000212241_100000210759 [0,1,0,1,0,0|1,0,1]=4 20416 B16R1.1251 CCCCCCCNC(C)CC1C=CCC1 270004a_100000229938_100000116859 [0,1,0,1,0,0|2,0,0]=4 20417 B16R1.4593 CCCCCCC(=O)CCC1CCOC1=O 1458a_100000117037_100000210757 [0,1,0,1,0,0|1,0,1]=4 20418 B16R1.4593 CCCCCCC(=O)CCN1CCCC1=O 1458a_100000751031_100000210757 [0,1,0,1,0,0|1,0,1]=4 20419 B16R1.4593 CCCCCCC(=O)CCN1CCCC1=O 1458a_100102632555_100000742232 [0,1,0,1,0,0|1,0,1]=4 20420 B16R1.4593 CCCCCCC(C)OCC1CCNC1=O 34a_100000133458_100011215978 [0,1,0,1,0,0|2,0,0]=4 20421 B16R1.4593 CCCCCCC(C)SCN1CCCC1=O 62a_100000026320_100011215978 [0,1,0,1,0,0|2,0,0]=4 20422 B16R1.4593 CCCCCCC(C)SCN1CCCC1=O 62a_100011215978_100000026320 [0,1,0,1,0,0|2,0,0]=4 20423 B16R1.4593 CCCCCCN(C)CCN1CCCC1=O 2230a_106256046315_100000739059 [0,1,0,1,0,0|2,0,0]=4 20424 B16R1.4593 CCCCCCN(C)CCN1CCCC1=O 269982a_106256046315_100000739059 [0,1,0,1,0,0|2,0,0]=4 20425 B16R1.4612 CCCCCCC(C)CCOC1CCC1=O 34a_200011024964_100009892977 [0,1,0,1,0,0|1,0,0]=3 20426 B16R1.4612 CCCCCCC(C)CCOC1CCC1=O 7a_200011024964_100009892977 [0,1,0,1,0,0|1,0,0]=3 20427 B16R1.4612 CCCCCCC(C)NCCC1CCC1=O 2230a_100000210919_200016118888 [0,1,0,1,0,0|1,0,0]=3 20428 B16R1.4612 CCCCCCC(C)OCCC1CCC1=O 7a_100000210265_200016118888 [0,1,0,1,0,0|1,0,0]=3 20429 B16R1.4612 CCCCCCC(C)SCCC1CCC1=O 62a_100011215978_200016118888 [0,1,0,1,0,0|1,0,0]=3 20430 B16R1.4612 CCCCCCC(C)SCCC1CCC1=O 62a_200016118888_100011215978 [0,1,0,1,0,0|1,0,0]=3 20431 B16R1.4612 CCCCOCC(C)OCCC1CCC1=O 7a_100011217071_200016118888 [0,1,0,1,0,0|2,0,0]=4 20432 B16R1.4613 CCCCCCC(=O)C1CCCCCC1=O 1458a_100102632555_100000243696 [0,1,0,1,0,0|0,0,1]=3 20433 B16R1.4613 CCCCCCC(=O)C1CCCCNC1=O 1458a_100102632555_100000735217 [0,1,0,1,0,0|1,0,1]=4 20434 B16R1.4613 CCCCCCN(C)C1CCCCCC1=O 269982a_106256046315_100000243696 [0,1,0,1,0,0|1,0,0]=3 20435 B16R1.4613 CCCCCCN(C)C1CCCCNC1=O 2230a_106256046315_100000735217 [0,1,0,1,0,0|2,0,0]=4 20436 B16R1.4613 CCCCCCN(C)C1CCCCNC1=O 269982a_106256046315_100000735217 [0,1,0,1,0,0|2,0,0]=4 20437 B16R1.4613 CCCCOCC(=O)C1CCCCCC1=O 1458a_100000757543_100000243696 [0,1,0,1,0,0|1,0,1]=4 20438 B16R1.4613 CCCCSCC(=O)C1CCCCCC1=O 1458a_100000191162_100000243696 [0,1,0,1,0,0|1,0,1]=4 20439 B16R1.4613 CN(CCCCCO)C1CCCCCC1=O 269982a_100000722520_100000243696 [0,1,0,1,0,0|2,0,0]=4 20440 B16R1.4613 O=C(CCCCCO)C1CCCCCC1=O 1458a_100102619762_100000243696 [0,1,0,1,0,0|1,0,1]=4 20441 B16R1.4614 C=CCCCCN(C)C1CCCCC1CC 270004a_100012000471_100000757040 [0,1,0,1,0,0|2,0,0]=4 20442 B16R1.4618 C=CCCCCN(C)C1CCCC1CCC 270004a_100012000471_100000723119 [0,1,0,1,0,0|2,0,0]=4 20443 B16R1.4621 CCCCCCC(C)NC1CCCCC1=O 34a_100000210919_100000754470 [0,1,0,1,0,0|1,0,0]=3 20444 B16R1.4621 CCCCCCC(C)NC1CCCNC1=O 2230a_100000210919_100000687798 [0,1,0,1,0,0|2,0,0]=4 20445 B16R1.4621 CCCCCCC(C)NC1CCCNC1=O 2230a_100000747585_100011215978 [0,1,0,1,0,0|2,0,0]=4 20446 B16R1.4621 CCCCCCC(C)NC1CCCNC1=O 270004a_100000747585_100000210826 [0,1,0,1,0,0|2,0,0]=4 20447 B16R1.4621 CCCCCCC(C)NC1CCCNC1=O 34a_100000210919_100000687798 [0,1,0,1,0,0|2,0,0]=4 20448 B16R1.4621 CCCCCCC(C)NC1CCCNC1=O 34a_100000747585_100011215978 [0,1,0,1,0,0|2,0,0]=4 20449 B16R1.4621 CCCCCCC(C)NC1COCCC1=O 34a_100000210919_100012180262 [0,1,0,1,0,0|2,0,0]=4 20450 B16R1.4621 CCCCCCC(C)OC1CCCCC1=O 34a_100000210265_100000754470 [0,1,0,1,0,0|1,0,0]=3 20451 B16R1.4621 CCCCCCC(C)OC1CCCCC1=O 34a_100011214950_100011215978 [0,1,0,1,0,0|1,0,0]=3 20452 B16R1.4621 CCCCCCC(C)OC1CCCCC1=O 7a_100000210265_100000204591 [0,1,0,1,0,0|1,0,0]=3 20453 B16R1.4621 CCCCCCC(C)OC1CCCNC1=O 34a_100000073722_100011215978 [0,1,0,1,0,0|2,0,0]=4 20454 B16R1.4621 CCCCCCC(C)OC1CCCNC1=O 34a_100000210265_100000687798 [0,1,0,1,0,0|2,0,0]=4 20455 B16R1.4621 CCCCCCC(C)OC1CCCNC1=O 7a_100000210265_100000687798 [0,1,0,1,0,0|2,0,0]=4 20456 B16R1.4621 CCCCCCC(C)OC1COCCC1=O 34a_100000210265_100012180262 [0,1,0,1,0,0|2,0,0]=4 20457 B16R1.4621 CCCCCCC(C)OC1COCCC1=O 7a_100000210265_100012180262 [0,1,0,1,0,0|2,0,0]=4 20458 B16R1.4621 CCCCCCC(C)SC1CCCCC1=O 62a_100000204591_100011215978 [0,1,0,1,0,0|1,0,0]=3 20459 B16R1.4621 CCCCCCC(C)SC1CCCCC1=O 62a_100011215978_100000204591 [0,1,0,1,0,0|1,0,0]=3 20460 B16R1.4621 CCCCCCC(C)SC1CCCNC1=O 62a_100000687798_100011215978 [0,1,0,1,0,0|2,0,0]=4 20461 B16R1.4621 CCCCCCC(C)SC1CCCNC1=O 62a_100011215978_100000687798 [0,1,0,1,0,0|2,0,0]=4 20462 B16R1.4621 CCCCCCC(C)SC1COCCC1=O 62a_100011215978_100012180262 [0,1,0,1,0,0|2,0,0]=4 20463 B16R1.4621 CCCCCCC(C)SC1COCCC1=O 62a_100012180262_100011215978 [0,1,0,1,0,0|2,0,0]=4 20464 B16R1.4621 CCCCOCC(C)OC1CCCCC1=O 34a_100011217071_100000754470 [0,1,0,1,0,0|2,0,0]=4 20465 B16R1.4621 CCCCOCC(C)OC1CCCCC1=O 7a_100011217071_100000204591 [0,1,0,1,0,0|2,0,0]=4 20466 B16R1.4621 CN(CCCCC=O)CC1CCCCN1C 2230a_100015185953_100000139335 [0,1,0,1,0,0|2,0,0]=4 20467 B16R1.4621 CN(CCCCC=O)CC1CCCCN1C 269982a_100015185953_100000139335 [0,1,0,1,0,0|2,0,0]=4 20468 B16R1.5833 C=CCCCCCCC(=O)C1CCCC1C 1458a_100000690547_100011215473 [0,1,0,1,0,0|1,0,1]=4 20469 B16R1.5833 CCCCCCCCC(=O)C1CCCC1=O 1458a_100000210188_100000211823 [0,1,0,1,0,0|0,0,1]=3 20470 B16R1.5833 CCCCCCCCC(=O)C1CCOC1=O 1458a_100000210188_100000211211 [0,1,0,1,0,0|1,0,1]=4 20471 B16R1.5833 CCCCCCCCN(C)C1CCCC1=O 2230a_100000207567_100000211823 [0,1,0,1,0,0|1,0,0]=3 20472 B16R1.5833 CCCCCCCCN(C)C1CCCC1=O 269982a_100000207567_100000211823 [0,1,0,1,0,0|1,0,0]=3 20473 B16R1.5833 CCCCCCCCN(C)C1CCOC1=O 2230a_100000207567_100000211211 [0,1,0,1,0,0|2,0,0]=4 20474 B16R1.5833 CCCCCCCCN(C)C1CCOC1=O 269982a_100000207567_100000211211 [0,1,0,1,0,0|2,0,0]=4 20475 B16R1.5833 O=C(CCCCCCCO)C1CCCC1=O 1458a_100011219782_100000211823 [0,1,0,1,0,0|1,0,1]=4 20476 B16R1.6645 C=CCCCCC(=O)CCCC1CCCC1 1458a_100011215552_100011713738 [0,1,0,1,0,0|1,0,1]=4 20477 B16R1.6645 C=CCCCCN(C)CCCC1CCCC1 2230a_100012000471_100011713738 [0,1,0,1,0,0|2,0,0]=4 20478 B16R1.6645 C=CCCCCN(C)CCCC1CCCC1 2230a_100015186261_100011215482 [0,1,0,1,0,0|2,0,0]=4 20479 B16R1.6645 C=CCCCCN(C)CCCC1CCCC1 269982a_100012000471_100011713738 [0,1,0,1,0,0|2,0,0]=4 20480 B16R1.6645 C=CCCCCN(C)CCCC1CCCC1 269982a_100015186261_100011215482 [0,1,0,1,0,0|2,0,0]=4 20481 B16R1.6645 C=CCCCCN(C)CCCC1CCCC1 34a_100015186261_100011215482 [0,1,0,1,0,0|2,0,0]=4 20482 B16R1.6645 CN(CCCCC=O)CCCC1CCCC1 2230a_100015186261_100000139335 [0,1,0,1,0,0|1,0,0]=3 20483 B16R1.6645 CN(CCCCC=O)CCCC1CCCC1 269982a_100015186261_100000139335 [0,1,0,1,0,0|1,0,0]=3 20484 B16R1.6645 CN(CCCCC=O)CCCC1CCCO1 2230a_100011698863_100000139335 [0,1,0,1,0,0|2,0,0]=4 20485 B16R1.6645 CN(CCCCC=O)CCCC1CCCO1 269982a_100011698863_100000139335 [0,1,0,1,0,0|2,0,0]=4 20486 B16R1.6645 CN(CCCCC=O)CCCN1CCCC1 269982a_100000233079_100000139335 [0,1,0,1,0,0|2,0,0]=4 20487 B16R1.8377 C=CCCCCCCN1CCCCC(C1)O 2230a_100025706797_100011215473 [0,1,0,1,0,0|2,0,0]=4 20488 B16R1.8377 C=CCCCCCCN1CCCCC(C1)O 269982a_100025706797_100011215473 [0,1,0,1,0,0|2,0,0]=4 20489 B16R1.8377 CCCCCCCCN1CCCNC(=O)C1 2230a_100015190381_100000210759 [0,1,0,1,0,0|2,0,0]=4 20490 B16R1.17903 CCCCCCCCC(C)OC1CCC1=O 34a_100000210740_100009892977 [0,1,0,1,0,0|1,0,0]=3 20491 B16R1.17903 CCCCCCCCC(C)OC1CCC1=O 7a_100000210740_100009892977 [0,1,0,1,0,0|1,0,0]=3 20492 B16R1.26546 C=CCCCCN(C)C1CCCCCCC1 270004a_100012000471_100000210524 [0,1,0,1,0,0|2,0,0]=4 20493 B16R1.26669 C=CCCCCC(=O)CC1CCCCCC1 1458a_100000685095_100011215482 [0,1,0,1,0,0|1,0,1]=4 20494 B16R1.26669 C=CCCCCC(=O)CC1CCCCCC1 1458a_100011215552_200000696569 [0,1,0,1,0,0|1,0,1]=4 20495 B16R1.26669 C=CCCCCN(C)CC1CCCCCC1 2230a_100012000471_200000696569 [0,1,0,1,0,0|2,0,0]=4 20496 B16R1.26669 C=CCCCCN(C)CC1CCCCCC1 269982a_100012000471_200000696569 [0,1,0,1,0,0|2,0,0]=4 20497 B16R1.43498 C=CCCCCCNC1(CCCCCC1)C 2230a_100000704638_100000700193 [0,1,0,1,0,0|2,0,0]=4 20498 B16R1.43498 C=CCCCCCNC1(CCCCCC1)C 34a_100000704638_100000700193 [0,1,0,1,0,0|2,0,0]=4 20499 B16R1.43498 C=CCCCCCOC1(CCCCCC1)C 34a_100000708895_100000700193 [0,1,0,1,0,0|2,0,0]=4 20500 B16R1.43498 C=CCCCCCOC1(CCCCCC1)C 7a_100000708895_100000700193 [0,1,0,1,0,0|2,0,0]=4 20501 B16R1.43498 CC1(CCCCCC1)NCCCCCC=O 2230a_100000704638_100000139337 [0,1,0,1,0,0|1,0,0]=3 20502 B16R1.43498 CC1(CCCCCC1)OCCCCCC=O 7a_100000708895_100000139337 [0,1,0,1,0,0|1,0,0]=3 20503 B16R1.27 C=CCCCCCCCN1CCCC(C1)F 2230a_100000697950_100012355270 [0,1,0,1,0,0|2,0,0]=4 20504 B16R1.27 C=CCCCCCCCN1CCCC(C1)F 269982a_100000697950_100012355270 [0,1,0,1,0,0|2,0,0]=4 20505 B16R1.27 C=CCCCCCCCN1CCCC(C1)F 34a_100000697950_100012355270 [0,1,0,1,0,0|2,0,0]=4 20506 B16R1.27 C=CCCCCCCCN1CCCC(C1)O 2230a_100000211013_100012355270 [0,1,0,1,0,0|2,0,0]=4 20507 B16R1.27 C=CCCCCCCCN1CCCC(C1)O 269982a_100000211013_100012355270 [0,1,0,1,0,0|2,0,0]=4 20508 B16R1.27 C=CCCCCCCCN1CCC[C@@H](C1)C 2230a_100000717927_100012355270 [0,1,0,1,0,0|2,0,0]=4 20509 B16R1.27 C=CCCCCCCCN1CCC[C@@H](C1)C 269982a_100000717927_100012355270 [0,1,0,1,0,0|2,0,0]=4 20510 B16R1.27 C=CCCCCCCCN1CCC[C@@H](C1)C 34a_100000717927_100012355270 [0,1,0,1,0,0|2,0,0]=4 20511 B16R1.27 C=CCCCCCCNC1CCCC(C1)C 2230a_100011194320_100011215473 [0,1,0,1,0,0|2,0,0]=4 20512 B16R1.27 C=CCCCCCCNC1CCCC(C1)C 34a_100011194320_100011215473 [0,1,0,1,0,0|2,0,0]=4 20513 B16R1.27 C=CCCCCCCNC1CCCC(C1)O 2230a_100015190357_100011215473 [0,1,0,1,0,0|2,0,0]=4 20514 B16R1.27 C=CCCCCCCOC1CCCC(C1)C 34a_100000211399_100011215473 [0,1,0,1,0,0|2,0,0]=4 20515 B16R1.27 C=CCCCCCNCC1CCCC(C1)O 2230a_100011254705_100000700193 [0,1,0,1,0,0|2,0,0]=4 20516 B16R1.27 CC1CCCN(C1)CCNCCCCC=O 2230a_100000739826_100000139335 [0,1,0,1,0,0|2,0,0]=4 20517 B16R1.27 CC1CCCN(C1)CCSCCCCC=O 62a_100000139335_100000766211 [0,1,0,1,0,0|2,0,0]=4 20518 B16R1.27 CCCCCCCCCN1CCNC(=O)C1 2230a_100000184651_100011214924 [0,1,0,1,0,0|2,0,0]=4 20519 B16R1.27 CCCCCCCCCN1CCOC(=O)C1 2230a_100000131268_100011214924 [0,1,0,1,0,0|2,0,0]=4 20520 B16R1.27 CCCCCCCCNC1CCNC(=O)C1 2230a_100016994916_100000210759 [0,1,0,1,0,0|2,0,0]=4 20521 B16R1.27 CCCCCCCCNC1CCNC(=O)C1 34a_100016994916_100000210759 [0,1,0,1,0,0|2,0,0]=4 20522 B16R1.27 CCCCCCCCOC1C=C(CCC1)C 34a_100011218613_100000210759 [0,1,0,1,0,0|2,0,0]=4 20523 B16R1.27 CCCCCCCCOC1CCCC(=O)C1 34a_100012613340_100000210759 [0,1,0,1,0,0|1,0,0]=3 20524 B16R1.27 CCCCCCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000210759 [0,1,0,1,0,0|2,0,0]=4 20525 B16R1.27 CCCCCCCOCC1CCCC(=O)N1 34a_200000102386_100000210614 [0,1,0,1,0,0|1,0,0]=3 20526 B16R1.27 CCCCCCCOCC1CCNC(=O)C1 34a_100009886756_100000210614 [0,1,0,1,0,0|2,0,0]=4 20527 B16R1.27 CCCCCCCOCC1COCC(=O)N1 34a_200000101122_100000210614 [0,1,0,1,0,0|2,0,0]=4 20528 B16R1.27 CCCCOCCOCC1CCCC(=O)N1 34a_200000102386_100000743108 [0,1,0,1,0,0|2,0,0]=4 20529 B16R1.27 CN1CCCC(C1)CSCCCCCC=O 62a_100000139337_100000752043 [0,1,0,1,0,0|2,0,0]=4 20530 B16R1.27 CN1CCCC(C1)CSCCCCCC=O 62a_100000752043_100000139337 [0,1,0,1,0,0|2,0,0]=4 20531 B16R1.27 COCCCCCCOC1CCCC(=O)C1 34a_100012613340_100011998445 [0,1,0,1,0,0|2,0,0]=4 20532 B16R1.27 O=C1CCCC(C1)OCCCCCCCO 34a_100012613340_100000760002 [0,1,0,1,0,0|2,0,0]=4 20533 B16R1.27 O=C1CCCC(N1)COCCCCCCF 34a_200000102386_100015922095 [0,1,0,1,0,0|2,0,0]=4 20534 B16R1.27 O=C1CCCC(N1)COCCCCCCO 34a_200000102386_100000766143 [0,1,0,1,0,0|2,0,0]=4 20535 B16R1.27 O=CCCCCCNCC1CCCC(C1)O 2230a_100011254705_100000139337 [0,1,0,1,0,0|1,0,0]=3 20536 B16R1.57 CC(=O)CCCCOC1CCCCC1CN 34a_100011216029_100009817362 [0,1,0,1,0,0|2,0,0]=4 20537 B16R1.57 CCC1CCCCC1NCCCCC(=O)N 269862a_100000696515_100000757040 [0,1,0,1,0,0|1,0,0]=3 20538 B16R1.57 CCC1CCCCC1NCCCCC(=O)N 270004a_100000696515_100000757040 [0,1,0,1,0,0|1,0,0]=3 20539 B16R1.57 CCC1CCCCC1NCCCNC(=O)C 269862a_100000736810_100000757040 [0,1,0,1,0,0|2,0,0]=4 20540 B16R1.57 CCC1CCCCC1NCCCNC(=O)C 270004a_100000736810_100000757040 [0,1,0,1,0,0|2,0,0]=4 20541 B16R1.57 CCC1CCCCC1OCCCCC(=O)C 34a_100000210738_100009817362 [0,1,0,1,0,0|1,0,0]=3 20542 B16R1.57 CCC1CCCCC1OCCCCC(=O)C 7a_100000210738_100000735457 [0,1,0,1,0,0|1,0,0]=3 20543 B16R1.57 CCC1CCCCC1OCCCOC(=O)C 34a_100000210738_100000042594 [0,1,0,1,0,0|2,0,0]=4 20544 B16R1.57 CCC1CCCCC1OCCCOC(=O)C 7a_100000210738_100000042594 [0,1,0,1,0,0|2,0,0]=4 20545 B16R1.57 CCC1CCCCC1OCCCSC(=O)C 34a_100000210738_100000038929 [0,1,0,1,0,0|2,0,0]=4 20546 B16R1.57 CCC1CCCCC1OCCCSC(=O)C 7a_100000210738_100000038929 [0,1,0,1,0,0|2,0,0]=4 20547 B16R1.57 CCC1CCCCC1OCCOCC(=O)N 34a_100000210738_100000076697 [0,1,0,1,0,0|2,0,0]=4 20548 B16R1.57 CCC1CCCCC1OCCOCC(=O)N 7a_100000210738_100000076697 [0,1,0,1,0,0|2,0,0]=4 20549 B16R1.57 CCC1CCCCN1CCCCCC(=O)N 2230a_100000210034_100009817443 [0,1,0,1,0,0|1,0,0]=3 20550 B16R1.57 CCC1CCCCN1CCCCCC(=O)N 269982a_100000210034_100009817443 [0,1,0,1,0,0|1,0,0]=3 20551 B16R1.57 CCC1CCCCN1CCCCCC(=O)N 34a_100000210034_100009817443 [0,1,0,1,0,0|1,0,0]=3 20552 B16R1.57 CCC1CCCCN1CCCCOC(=O)C 269982a_100000210034_100000033659 [0,1,0,1,0,0|2,0,0]=4 20553 B16R1.57 CCC1CCCCN1CCCCOC(=O)C 34a_100000210034_100000033659 [0,1,0,1,0,0|2,0,0]=4 20554 B16R1.57 CCC1CCCCN1CCCCSC(=O)C 2230a_100000210034_200010402107 [0,1,0,1,0,0|2,0,0]=4 20555 B16R1.57 CCC1CCCCN1CCCCSC(=O)C 269982a_100000210034_200010402107 [0,1,0,1,0,0|2,0,0]=4 20556 B16R1.57 CCC1CCCCN1CCCCSC(=O)C 34a_100000210034_200010402107 [0,1,0,1,0,0|2,0,0]=4 20557 B16R1.57 CCC1CCCCN1CCCNCC(=O)N 34a_100011191702_100000187820 [0,1,0,1,0,0|2,0,0]=4 20558 B16R1.57 CCC1CCCCN1CCCNCC(=O)[O-] 34a_100011191702_100020667443 [0,1,0,1,0,0|2,0,0]=4 20559 B16R1.57 CCC1CCCCN1CCNCCC(=O)N 2230a_100000755458_100000744528 [0,1,0,1,0,0|2,0,0]=4 20560 B16R1.57 CCC1CCCCN1CCNCCC(=O)N 34a_100000755458_100000731001 [0,1,0,1,0,0|2,0,0]=4 20561 B16R1.57 CCN1CCCCC1CNCCCC(=O)C 34a_100000754393_100000685027 [0,1,0,1,0,0|2,0,0]=4 20562 B16R1.57 CCN1CCCCC1CNCCCC(=O)N 34a_100000754393_100102525003 [0,1,0,1,0,0|2,0,0]=4 20563 B16R1.57 CCN1CCCCC1COCCCC(=O)C 34a_100000225091_100000685027 [0,1,0,1,0,0|2,0,0]=4 20564 B16R1.57 CCN1CCCCC1COCCCC(=O)C 7a_100000225091_100011215641 [0,1,0,1,0,0|2,0,0]=4 20565 B16R1.57 CCN1CCCCC1COCCCC(=O)N 34a_100000225091_100102525003 [0,1,0,1,0,0|2,0,0]=4 20566 B16R1.57 CCN1CCCCC1COCCCC(=O)N 7a_100000225091_100102525003 [0,1,0,1,0,0|2,0,0]=4 20567 B16R1.57 CC[C@H]1COCCN1CCCCCC(=O)N 2230a_100016988097_100009817443 [0,1,0,1,0,0|2,0,0]=4 20568 B16R1.57 CC[C@H]1COCCN1CCCCCC(=O)N 269982a_100016988097_100009817443 [0,1,0,1,0,0|2,0,0]=4 20569 B16R1.57 CC[C@H]1COCCN1CCCCCC(=O)N 34a_100016988097_100009817443 [0,1,0,1,0,0|2,0,0]=4 20570 B16R1.57 CN[C@@H]1CCCC[C@H]1OCCCCC(=O)C 34a_100000708425_100009817362 [0,1,0,1,0,0|2,0,0]=4 20571 B16R1.57 COC1CCCCC1NCCCCC(=O)C 34a_100011208099_100009817362 [0,1,0,1,0,0|2,0,0]=4 20572 B16R1.57 COC1CCCCC1NCCCCC(=O)N 270004a_100000696515_100000740605 [0,1,0,1,0,0|2,0,0]=4 20573 B16R1.57 CO[C@H]1CCCC[C@@H]1OCCCCC(=O)C 34a_200009815850_100009817362 [0,1,0,1,0,0|2,0,0]=4 20574 B16R1.57 CO[C@H]1CCCC[C@@H]1OCCCCC(=O)C 7a_200009815850_100000735457 [0,1,0,1,0,0|2,0,0]=4 20575 B16R1.57 NC(=O)CCCCCN1CCCCC1CO 2230a_100000210821_100009817443 [0,1,0,1,0,0|2,0,0]=4 20576 B16R1.57 NC(=O)CCCCCN1CCCCC1CO 269982a_100000210821_100009817443 [0,1,0,1,0,0|2,0,0]=4 20577 B16R1.57 NC(=O)CCCCCN1CCCCC1CO 34a_100000210821_100009817443 [0,1,0,1,0,0|2,0,0]=4 20578 B16R1.57 NC(=O)CCCCNC1CCCCC1CO 270004a_100000696515_100009861125 [0,1,0,1,0,0|2,0,0]=4 20579 B16R1.250 C=C1CC(C1)CNCCCCCCCCC 2230a_100102567296_100011214924 [0,1,0,1,0,0|2,0,0]=4 20580 B16R1.250 C=C1CC(C1)CNCCCCCCCCC 34a_100102567296_100011214924 [0,1,0,1,0,0|2,0,0]=4 20581 B16R1.250 C=C1CC(C1)COCCCCCCCCC 34a_100011011225_100011214924 [0,1,0,1,0,0|2,0,0]=4 20582 B16R1.250 C=C1CC(C1)NCCCCCCCCCC 2230a_100132301982_100000210320 [0,1,0,1,0,0|2,0,0]=4 20583 B16R1.250 C=CCCCCCCCCCN1CC(C1)C 2230a_100000702820_100009814027 [0,1,0,1,0,0|2,0,0]=4 20584 B16R1.250 C=CCCCCCCCCCN1CC(C1)C 269982a_100000702820_100009814027 [0,1,0,1,0,0|2,0,0]=4 20585 B16R1.250 C=CCCCCCCCCCN1CC(C1)C 34a_100000702820_100009814027 [0,1,0,1,0,0|2,0,0]=4 20586 B16R1.250 C=CCCCCCCCCCN1CC(C1)F 2230a_100000690557_100009814027 [0,1,0,1,0,0|2,0,0]=4 20587 B16R1.250 C=CCCCCCCCCCN1CC(C1)F 269982a_100000690557_100009814027 [0,1,0,1,0,0|2,0,0]=4 20588 B16R1.250 C=CCCCCCCCCCN1CC(C1)F 34a_100000690557_100009814027 [0,1,0,1,0,0|2,0,0]=4 20589 B16R1.250 C=CCCCCCCCCCN1CC(C1)O 269982a_100000749847_100009814027 [0,1,0,1,0,0|2,0,0]=4 20590 B16R1.250 C=CCCCCCCCCNC1CC(C1)F 2230a_100016993743_100011933949 [0,1,0,1,0,0|2,0,0]=4 20591 B16R1.250 C=CCCCCCCCCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100011933949 [0,1,0,1,0,0|2,0,0]=4 20592 B16R1.250 C=CCCCCCCCNCC1CC(C1)O 2230a_100016992100_100012355270 [0,1,0,1,0,0|2,0,0]=4 20593 B16R1.250 C=CCCCCCCCOCC1CC(C1)Cl 34a_100009874164_100012355270 [0,1,0,1,0,0|2,0,0]=4 20594 B16R1.250 CCCCCCCCCCSC1CC(=O)C1 62a_100009894365_100000210320 [0,1,0,1,0,0|1,0,0]=3 20595 B16R1.250 CCCCCCCCCNCC1CC(=O)C1 2230a_100000212291_100009874392 [0,1,0,1,0,0|1,0,0]=3 20596 B16R1.250 CCCCCCCCCOCC1CC(=O)C1 34a_100000101936_100011214924 [0,1,0,1,0,0|1,0,0]=3 20597 B16R1.250 CCCCCCCCCOCC1CC(=O)C1 7a_100000210712_100009874392 [0,1,0,1,0,0|1,0,0]=3 20598 B16R1.250 CCCCCCCCCSCC1CC(=O)C1 62a_100009874392_100000210670 [0,1,0,1,0,0|1,0,0]=3 20599 B16R1.250 CCCCCCOCCOCC1CC(=O)C1 7a_100000691444_100009874392 [0,1,0,1,0,0|2,0,0]=4 20600 B16R1.250 CCCCOCCCCOCC1CC(=O)C1 7a_200000760531_100009874392 [0,1,0,1,0,0|2,0,0]=4 20601 B16R1.250 O=C1CC(C1)CNCCCCCCCCO 2230a_102515433106_100009874392 [0,1,0,1,0,0|2,0,0]=4 20602 B16R1.250 O=C1CC(C1)COCCCCCCCCBr 7a_100009813846_100009874392 [0,1,0,1,0,0|2,0,0]=4 20603 B16R1.250 O=C1CC(C1)COCCCCCCCCCl 7a_100000033203_100009874392 [0,1,0,1,0,0|2,0,0]=4 20604 B16R1.250 O=C1CC(C1)COCCCCCCCCO 34a_100000101936_100000033203 [0,1,0,1,0,0|2,0,0]=4 20605 B16R1.250 O=C1CC(C1)CSCCCCCCCCO 62a_100000033203_100009874392 [0,1,0,1,0,0|2,0,0]=4 20606 B16R1.250 O=C1CC(C1)CSCCCCCCCCO 62a_100009874392_100000033203 [0,1,0,1,0,0|2,0,0]=4 20607 B16R1.250 O=C1CC(C1)SCCCCCCCCCO 62a_100009894365_100009813782 [0,1,0,1,0,0|2,0,0]=4 20608 B16R1.270 CC(C)CC1COCCN1CCCCC=O 2230a_100000755734_100000139335 [0,1,0,1,0,0|2,0,0]=4 20609 B16R1.270 CC(C)CC1COCCN1CCCCC=O 269982a_100000755734_100000139335 [0,1,0,1,0,0|2,0,0]=4 20610 B16R1.270 CC(C)CN1CCCCC1CCNCC=O 2230a_200011919211_200015260668 [0,1,0,1,0,0|2,0,0]=4 20611 B16R1.270 CC(C)CN1CCCCC1CCNCC=O 34a_200011919211_200009817547 [0,1,0,1,0,0|2,0,0]=4 20612 B16R1.270 CCCCCCN1CCCCC1CC(=O)N 2230a_100015184752_100000210314 [0,1,0,1,0,0|1,0,0]=3 20613 B16R1.270 CCCCCCN1CCCCC1CC(=O)N 269982a_100015184752_100000210757 [0,1,0,1,0,0|1,0,0]=3 20614 B16R1.270 CCCCCCN1CCCCC1CC(=O)N 34a_100015184752_100000210314 [0,1,0,1,0,0|1,0,0]=3 20615 B16R1.270 CCCCOCN1CCCCC1CC(=O)N 2230a_100015184752_100011995733 [0,1,0,1,0,0|2,0,0]=4 20616 B16R1.270 CCCCOCN1CCCCC1CC(=O)N 269982a_100015184752_100011995733 [0,1,0,1,0,0|2,0,0]=4 20617 B16R1.270 CCCCOCN1CCCCC1CC(=O)N 34a_100015184752_100011995733 [0,1,0,1,0,0|2,0,0]=4 20618 B16R1.270 CCCOCCN1CCCCC1CC(=O)N 2230a_100015184752_100011215938 [0,1,0,1,0,0|2,0,0]=4 20619 B16R1.270 CCCOCCN1CCCCC1CC(=O)N 269982a_100015184752_100011215938 [0,1,0,1,0,0|2,0,0]=4 20620 B16R1.270 CCCOCCN1CCCCC1CC(=O)N 34a_100015184752_100011215938 [0,1,0,1,0,0|2,0,0]=4 20621 B16R1.270 CCOCCCN1CCCCC1CC(=O)N 2230a_100015184752_100012232248 [0,1,0,1,0,0|2,0,0]=4 20622 B16R1.270 CCOCCCN1CCCCC1CC(=O)N 269982a_100015184752_100012232248 [0,1,0,1,0,0|2,0,0]=4 20623 B16R1.270 CCOCCCN1CCCCC1CC(=O)N 34a_100015184752_100012232248 [0,1,0,1,0,0|2,0,0]=4 20624 B16R1.270 CN(C)CC1CCCCN1CCCCC=O 2230a_100000746231_100000139335 [0,1,0,1,0,0|2,0,0]=4 20625 B16R1.270 CN(C)CC1CCCCN1CCCCC=O 269982a_100000746231_100000139335 [0,1,0,1,0,0|2,0,0]=4 20626 B16R1.270 COCCCCN1CCCCC1CC(=O)N 2230a_100015184752_100000730899 [0,1,0,1,0,0|2,0,0]=4 20627 B16R1.270 COCCCCN1CCCCC1CC(=O)N 269982a_100015184752_100000730899 [0,1,0,1,0,0|2,0,0]=4 20628 B16R1.270 COCCCCN1CCCCC1CC(=O)N 34a_100015184752_100000755781 [0,1,0,1,0,0|2,0,0]=4 20629 B16R1.270 NC(=O)CC1CCCCN1CCCCCF 2230a_100015184752_100000729378 [0,1,0,1,0,0|2,0,0]=4 20630 B16R1.270 NC(=O)CC1CCCCN1CCCCCF 269982a_100015184752_100000729378 [0,1,0,1,0,0|2,0,0]=4 20631 B16R1.270 NC(=O)CC1CCCCN1CCCCCF 34a_100015184752_100000729378 [0,1,0,1,0,0|2,0,0]=4 20632 B16R1.270 NC(=O)CC1CCCCN1CCCCCO 2230a_100015184752_100000746330 [0,1,0,1,0,0|2,0,0]=4 20633 B16R1.270 NC(=O)CC1CCCCN1CCCCCO 269982a_100015184752_100000746330 [0,1,0,1,0,0|2,0,0]=4 20634 B16R1.270 NC(=O)CC1CCCCN1CCCCCO 34a_100015184752_100000746330 [0,1,0,1,0,0|2,0,0]=4 20635 B16R1.290 CC(=O)CCCCNCC1CCCCC1O 34a_100011216029_100009817362 [0,1,0,1,0,0|2,0,0]=4 20636 B16R1.290 CC(=O)CCCCNCC1CCCCN1C 34a_100011228421_100009817362 [0,1,0,1,0,0|2,0,0]=4 20637 B16R1.290 CC(=O)CCCCOCC1CCCCC1=O 34a_100009861125_100009817362 [0,1,0,1,0,0|1,0,1]=4 20638 B16R1.290 CC(=O)CCCCOCC1CCCCC1=O 7a_100009861125_100000735457 [0,1,0,1,0,0|1,0,1]=4 20639 B16R1.290 CC(=O)CCCCOCC1CCCCN1C 34a_100000225079_100009817362 [0,1,0,1,0,0|2,0,0]=4 20640 B16R1.290 CC(=O)CCCCSCC1CCCCN1C 62a_100000735457_100015185383 [0,1,0,1,0,0|2,0,0]=4 20641 B16R1.290 CC(=O)CCCCSCC1CCCCN1C 62a_100015185383_100000735457 [0,1,0,1,0,0|2,0,0]=4 20642 B16R1.290 CC(=O)CCCNCCN1CCCCC1C 34a_100000739827_100000685027 [0,1,0,1,0,0|2,0,0]=4 20643 B16R1.290 CC(=O)CCCOCCC1CCCCN1C 34a_100000759063_100000211948 [0,1,0,1,0,0|2,0,0]=4 20644 B16R1.290 CC(=O)CCCOCCC1CCCCN1C 7a_100000759063_100000211948 [0,1,0,1,0,0|2,0,0]=4 20645 B16R1.290 CC(=O)CCCOCCN1CCCCC1C 34a_100011305533_100000685027 [0,1,0,1,0,0|2,0,0]=4 20646 B16R1.290 CC(=O)CCCSCCC1CCCCN1C 62a_100000211948_100011215641 [0,1,0,1,0,0|2,0,0]=4 20647 B16R1.290 CC(=O)CCCSCCC1CCCCN1C 62a_100011215641_100000211948 [0,1,0,1,0,0|2,0,0]=4 20648 B16R1.290 CC(=O)CCOCCCN1CCCCC1C 7a_100000213889_100000053229 [0,1,0,1,0,0|2,0,0]=4 20649 B16R1.290 CC(=O)NCCCCNC1CCCCC1C 269862a_200011368371_100000210921 [0,1,0,1,0,0|2,0,0]=4 20650 B16R1.290 CC(=O)NCCCCNC1CCCCC1C 270004a_200011368371_100000210921 [0,1,0,1,0,0|2,0,0]=4 20651 B16R1.290 CC(=O)OCCCCCN1CCCCC1C 2230a_100000211376_100009813381 [0,1,0,1,0,0|2,0,0]=4 20652 B16R1.290 CC(=O)OCCCCCN1CCCCC1C 269982a_100000211376_100000033007 [0,1,0,1,0,0|2,0,0]=4 20653 B16R1.290 CC(=O)OCCCCCN1CCCCC1C 34a_100000211376_100000033007 [0,1,0,1,0,0|2,0,0]=4 20654 B16R1.290 CC(=O)OCCCCNC1CCCCC1C 34a_100000211402_100000033659 [0,1,0,1,0,0|2,0,0]=4 20655 B16R1.290 CC(=O)OCCCCOC1CCCCC1C 34a_100000211207_100000033659 [0,1,0,1,0,0|2,0,0]=4 20656 B16R1.290 CC(=O)OCCCCOC1CCCCC1C 7a_100000211207_100000033659 [0,1,0,1,0,0|2,0,0]=4 20657 B16R1.290 CC(=O)SCCCCNC1CCCCC1C 2230a_100000211402_200010402107 [0,1,0,1,0,0|2,0,0]=4 20658 B16R1.290 CC(=O)SCCCCNC1CCCCC1C 34a_100000211402_200010402107 [0,1,0,1,0,0|2,0,0]=4 20659 B16R1.290 CC(=O)SCCCCOC1CCCCC1C 34a_100000211207_200010402107 [0,1,0,1,0,0|2,0,0]=4 20660 B16R1.290 CC(=O)SCCCCOC1CCCCC1C 7a_100000211207_200010402107 [0,1,0,1,0,0|2,0,0]=4 20661 B16R1.290 CC(C)CCCCCNC1CCCCC1=O 34a_100011290863_100000754470 [0,1,0,1,0,0|1,0,0]=3 20662 B16R1.290 CC(C)CCCCCNC1CCCNC1=O 2230a_100000747585_100000210682 [0,1,0,1,0,0|2,0,0]=4 20663 B16R1.290 CC(C)CCCCCNC1CCCNC1=O 2230a_100011290863_100000687798 [0,1,0,1,0,0|2,0,0]=4 20664 B16R1.290 CC(C)CCCCCNC1CCCNC1=O 34a_100000747585_100000210682 [0,1,0,1,0,0|2,0,0]=4 20665 B16R1.290 CC(C)CCCCCNC1CCCNC1=O 34a_100011290863_100000687798 [0,1,0,1,0,0|2,0,0]=4 20666 B16R1.290 CC(C)CCCCCNC1COCCC1=O 34a_100011290863_100012180262 [0,1,0,1,0,0|2,0,0]=4 20667 B16R1.290 CC(C)CCCCCOC1CCCCC1=O 34a_100011214950_100000210682 [0,1,0,1,0,0|1,0,0]=3 20668 B16R1.290 CC(C)CCCCCOC1CCCCC1=O 34a_100011995859_100000754470 [0,1,0,1,0,0|1,0,0]=3 20669 B16R1.290 CC(C)CCCCCOC1CCCCC1=O 7a_100011995859_100000204591 [0,1,0,1,0,0|1,0,0]=3 20670 B16R1.290 CC(C)CCCCCOC1CCCNC1=O 34a_100000073722_100000210682 [0,1,0,1,0,0|2,0,0]=4 20671 B16R1.290 CC(C)CCCCCOC1CCCNC1=O 34a_100011995859_100000687798 [0,1,0,1,0,0|2,0,0]=4 20672 B16R1.290 CC(C)CCCCCOC1CCCNC1=O 7a_100011995859_100000687798 [0,1,0,1,0,0|2,0,0]=4 20673 B16R1.290 CC(C)CCCCCOC1COCCC1=O 34a_100011995859_100012180262 [0,1,0,1,0,0|2,0,0]=4 20674 B16R1.290 CC(C)CCCCCOC1COCCC1=O 7a_100011995859_100012180262 [0,1,0,1,0,0|2,0,0]=4 20675 B16R1.290 CC(C)CCCCCSC1CCCCC1=O 62a_100000204591_100000210682 [0,1,0,1,0,0|1,0,0]=3 20676 B16R1.290 CC(C)CCCCCSC1CCCCC1=O 62a_100000210682_100000204591 [0,1,0,1,0,0|1,0,0]=3 20677 B16R1.290 CC(C)CCCCCSC1CCCNC1=O 62a_100000210682_100000687798 [0,1,0,1,0,0|2,0,0]=4 20678 B16R1.290 CC(C)CCCCCSC1CCCNC1=O 62a_100000687798_100000210682 [0,1,0,1,0,0|2,0,0]=4 20679 B16R1.290 CC(C)CCCCCSC1COCCC1=O 62a_100000210682_100012180262 [0,1,0,1,0,0|2,0,0]=4 20680 B16R1.290 CC(C)CCCCCSC1COCCC1=O 62a_100012180262_100000210682 [0,1,0,1,0,0|2,0,0]=4 20681 B16R1.290 CC(C)CCCCOCC1CCCCC1=O 34a_100009861125_100011216152 [0,1,0,1,0,0|1,0,0]=3 20682 B16R1.290 CC(C)CCCCOCC1CCCCC1=O 7a_100009861125_100011216152 [0,1,0,1,0,0|1,0,0]=3 20683 B16R1.290 CC(C)CCCNCCN1CCCCC1=O 2230a_100160573077_100011214892 [0,1,0,1,0,0|2,0,0]=4 20684 B16R1.290 CC(C)CCCNCCN1CCCCC1=O 34a_100160573077_100011214892 [0,1,0,1,0,0|2,0,0]=4 20685 B16R1.290 CC(C)COCCCNC1CCCCC1=O 34a_100000205972_100000754470 [0,1,0,1,0,0|2,0,0]=4 20686 B16R1.290 CC(C)NCCCCOC1CCCCC1=O 34a_100011521146_100000754470 [0,1,0,1,0,0|2,0,0]=4 20687 B16R1.290 CC(O)CCCNCCN1CCCCC1=O 2230a_100160573077_200000718107 [0,1,0,1,0,0|2,0,0]=4 20688 B16R1.290 CC(O)CCCNCCN1CCCCC1=O 34a_100160573077_200000718107 [0,1,0,1,0,0|2,0,0]=4 20689 B16R1.290 CC1CCCCC1NCCCCCC(=O)N 2230a_100000211402_100009817443 [0,1,0,1,0,0|1,0,0]=3 20690 B16R1.290 CC1CCCCC1NCCCCCC(=O)N 34a_100000211402_100009817443 [0,1,0,1,0,0|1,0,0]=3 20691 B16R1.290 CC1CCCCC1OCCCCCC(=O)N 34a_100000211207_100009817443 [0,1,0,1,0,0|1,0,0]=3 20692 B16R1.290 CC1CCCCC1OCCCCCC(=O)N 7a_100000211207_100009817443 [0,1,0,1,0,0|1,0,0]=3 20693 B16R1.290 CC1CCCCN1CCCNCCC(=O)N 34a_100000212276_100000731001 [0,1,0,1,0,0|2,0,0]=4 20694 B16R1.290 CC1CCCCN1CCCOCCC(=O)N 34a_100000213889_100000731001 [0,1,0,1,0,0|2,0,0]=4 20695 B16R1.290 CC1CCCCN1CCCOCCC(=O)N 7a_100000213889_100000744528 [0,1,0,1,0,0|2,0,0]=4 20696 B16R1.290 CC1CCCCN1CCNCCCC(=O)N 34a_100000739827_100102525003 [0,1,0,1,0,0|2,0,0]=4 20697 B16R1.290 CC1CCCCN1CCOCCCC(=O)N 34a_100011305533_100102525003 [0,1,0,1,0,0|2,0,0]=4 20698 B16R1.290 CC1CCNCC1OCCCCCC(=O)N 34a_100000696640_100009817443 [0,1,0,1,0,0|2,0,0]=4 20699 B16R1.290 CC1CNCCC1OCCCCCC(=O)N 34a_100011998114_100009817443 [0,1,0,1,0,0|2,0,0]=4 20700 B16R1.290 CN1CCCCC1CCNCCCC(=O)N 34a_100000739312_100000211948 [0,1,0,1,0,0|2,0,0]=4 20701 B16R1.290 CN1CCCCC1CCSCCCC(=O)N 62a_100000211948_100102525003 [0,1,0,1,0,0|2,0,0]=4 20702 B16R1.290 CN1CCCCC1CCSCCCC(=O)N 62a_100102525003_100000211948 [0,1,0,1,0,0|2,0,0]=4 20703 B16R1.290 CN1CCCCC1CNCCCCC(=O)N 34a_100000696515_100015186950 [0,1,0,1,0,0|2,0,0]=4 20704 B16R1.290 CN1CCCCC1COCCCCC(=O)N 34a_100012022536_100015186950 [0,1,0,1,0,0|2,0,0]=4 20705 B16R1.290 CN1CCCCC1COCCCCC(=O)N 7a_100012022536_100015185383 [0,1,0,1,0,0|2,0,0]=4 20706 B16R1.290 NC(=O)CCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100009817443 [0,1,0,1,0,0|2,0,0]=4 20707 B16R1.290 NC(=O)CCCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100009817443 [0,1,0,1,0,0|2,0,0]=4 20708 B16R1.290 NC(=O)CCCCCOC1CCCCC1Cl 34a_100000038908_100009817443 [0,1,0,1,0,0|2,0,0]=4 20709 B16R1.290 NC(=O)CCCCCOC1CCCCC1Cl 7a_100000038908_100009817443 [0,1,0,1,0,0|2,0,0]=4 20710 B16R1.290 NC(=O)CCCCCOC1CCCCC1F 34a_100000123541_100015423560 [0,1,0,1,0,0|2,0,0]=4 20711 B16R1.290 NC(=O)CCCCCOC1CCCCC1O 34a_100000123541_100000038908 [0,1,0,1,0,0|2,0,0]=4 20712 B16R1.290 NC(=O)CCCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100009817443 [0,1,0,1,0,0|2,0,0]=4 20713 B16R1.290 NC(=O)CCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100009817443 [0,1,0,1,0,0|2,0,0]=4 20714 B16R1.290 NC(=O)CCCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100009817443 [0,1,0,1,0,0|2,0,0]=4 20715 B16R1.290 NC(=O)CCCCCSC1CCCCC1F 62a_100009817443_100015423560 [0,1,0,1,0,0|2,0,0]=4 20716 B16R1.290 NC(=O)CCCCCSC1CCCCC1F 62a_100015423560_100009817443 [0,1,0,1,0,0|2,0,0]=4 20717 B16R1.290 NC(=O)CCCCCSC1CCCCC1O 62a_100000038908_100009817443 [0,1,0,1,0,0|2,0,0]=4 20718 B16R1.290 NC(=O)CCCCCSC1CCCCC1O 62a_100009817443_100000038908 [0,1,0,1,0,0|2,0,0]=4 20719 B16R1.390 CC(=O)CCCCSC1CCCCCC1=O 62a_100000243696_100000735457 [0,1,0,1,0,0|1,0,1]=4 20720 B16R1.390 CC(=O)CCCCSC1CCCCCC1=O 62a_100000735457_100000243696 [0,1,0,1,0,0|1,0,1]=4 20721 B16R1.390 CC(C)CCCCNC1CCCCNC1=O 2230a_100000698827_100011216152 [0,1,0,1,0,0|2,0,0]=4 20722 B16R1.390 CC(C)CCCCNC1CCCCNC1=O 34a_100000698827_100011216152 [0,1,0,1,0,0|2,0,0]=4 20723 B16R1.390 CC(C)CCCCOC1CCCCCC1=O 7a_100011214890_100000243696 [0,1,0,1,0,0|1,0,0]=3 20724 B16R1.390 CC(C)CCCCOC1CCCCNC1=O 7a_100011214890_100000735217 [0,1,0,1,0,0|2,0,0]=4 20725 B16R1.390 CC(C)CCCCSC1CCCCCC1=O 62a_100000243696_100011216152 [0,1,0,1,0,0|1,0,0]=3 20726 B16R1.390 CC(C)CCCCSC1CCCCCC1=O 62a_100011216152_100000243696 [0,1,0,1,0,0|1,0,0]=3 20727 B16R1.390 CC(C)CCCCSC1CCCCNC1=O 62a_100000735217_100011216152 [0,1,0,1,0,0|2,0,0]=4 20728 B16R1.390 CC(C)CCCCSC1CCCCNC1=O 62a_100011216152_100000735217 [0,1,0,1,0,0|2,0,0]=4 20729 B16R1.390 CC(C)CNCCCN1CCCCCC1=O 2230a_100000195386_100000210760 [0,1,0,1,0,0|2,0,0]=4 20730 B16R1.390 CC(C)CNCCCN1CCCCCC1=O 270004a_100000195386_100000210432 [0,1,0,1,0,0|2,0,0]=4 20731 B16R1.390 CC(C)CNCCCN1CCCCCC1=O 34a_100000195386_100000210624 [0,1,0,1,0,0|2,0,0]=4 20732 B16R1.390 CC(C)COCCOC1CCCCCC1=O 7a_100000703358_100000243696 [0,1,0,1,0,0|2,0,0]=4 20733 B16R1.390 CC(C)CSCCOC1CCCCCC1=O 7a_200000230437_100000243696 [0,1,0,1,0,0|2,0,0]=4 20734 B16R1.390 CC(O)CNCCCN1CCCCCC1=O 2230a_100000195386_100011218427 [0,1,0,1,0,0|2,0,0]=4 20735 B16R1.390 CC(O)CNCCCN1CCCCCC1=O 34a_100000195386_100011218427 [0,1,0,1,0,0|2,0,0]=4 20736 B16R1.390 CN(C)CCCCSC1CCCCCC1=O 62a_100000243696_100000690147 [0,1,0,1,0,0|2,0,0]=4 20737 B16R1.390 C[C@@H](O)CNCCCN1CCCCCC1=O 2230a_100000195386_100009817552 [0,1,0,1,0,0|2,0,0]=4 20738 B16R1.390 C[C@@H](O)CNCCCN1CCCCCC1=O 34a_100000195386_100009817552 [0,1,0,1,0,0|2,0,0]=4 20739 B16R1.394 CC(=O)CCCCOCCC1CCCN1C 34a_100011215177_100009817362 [0,1,0,1,0,0|2,0,0]=4 20740 B16R1.394 CC(=O)CCCCOCCC1CCCN1C 7a_100011215177_100000735457 [0,1,0,1,0,0|2,0,0]=4 20741 B16R1.394 CC(=O)CCCCSCCC1CCCN1C 62a_100000005710_100000735457 [0,1,0,1,0,0|2,0,0]=4 20742 B16R1.394 CC(=O)CCCCSCCC1CCCN1C 62a_100000735457_100000005710 [0,1,0,1,0,0|2,0,0]=4 20743 B16R1.394 CC(=O)NCCCCCNC1CCCC1C 269862a_200012022750_100000752053 [0,1,0,1,0,0|2,0,0]=4 20744 B16R1.394 CC(=O)OCCCCCOC1CCCC1C 34a_100011216460_100000033007 [0,1,0,1,0,0|2,0,0]=4 20745 B16R1.394 CC(=O)OCCCCCOC1CCCC1C 7a_100011216460_100000033007 [0,1,0,1,0,0|2,0,0]=4 20746 B16R1.394 CC(C)CCCCCCNC1CCCC1=O 2230a_100000211014_100000211823 [0,1,0,1,0,0|1,0,0]=3 20747 B16R1.394 CC(C)CCCCCCNC1CCCC1=O 34a_100000211014_100000709159 [0,1,0,1,0,0|1,0,0]=3 20748 B16R1.394 CC(C)CCCCCCNC1CCOC1=O 2230a_100000211014_100000211211 [0,1,0,1,0,0|2,0,0]=4 20749 B16R1.394 CC(C)CCCCCCNC1CCOC1=O 34a_100000211014_100000211211 [0,1,0,1,0,0|2,0,0]=4 20750 B16R1.394 CC(C)CCCCCOCC1CCNC1=O 34a_100000133458_100000210682 [0,1,0,1,0,0|2,0,0]=4 20751 B16R1.394 CC(C)CCCCCSCN1CCCC1=O 62a_100000026320_100000210682 [0,1,0,1,0,0|2,0,0]=4 20752 B16R1.394 CC(C)CCCCCSCN1CCCC1=O 62a_100000210682_100000026320 [0,1,0,1,0,0|2,0,0]=4 20753 B16R1.394 CC(C)CCCCNCCN1CCCC1=O 2230a_100011200922_100011216152 [0,1,0,1,0,0|2,0,0]=4 20754 B16R1.394 CC(C)CCCCOCCN1CCCC1=O 34a_100000211209_100011216152 [0,1,0,1,0,0|2,0,0]=4 20755 B16R1.394 CC(C)CCCCOCCN1CCCC1=O 34a_100011214890_100000739059 [0,1,0,1,0,0|2,0,0]=4 20756 B16R1.394 CC(C)CCCCOCCN1CCCC1=O 7a_100000211209_100011216152 [0,1,0,1,0,0|2,0,0]=4 20757 B16R1.394 CC(C)CCCCOCCN1CCCC1=O 7a_100011214890_100000739059 [0,1,0,1,0,0|2,0,0]=4 20758 B16R1.394 CC(C)CCCCSCCN1CCCC1=O 62a_100000739059_100011216152 [0,1,0,1,0,0|2,0,0]=4 20759 B16R1.394 CC(C)CCCCSCCN1CCCC1=O 62a_100011216152_100000739059 [0,1,0,1,0,0|2,0,0]=4 20760 B16R1.394 CC(C)CCCNCCCN1CCCC1=O 2230a_100000210347_100011214892 [0,1,0,1,0,0|2,0,0]=4 20761 B16R1.394 CC(C)CCCNCCCN1CCCC1=O 34a_100000210347_100011214892 [0,1,0,1,0,0|2,0,0]=4 20762 B16R1.394 CC(C)CCCOCCCN1CCCC1=O 34a_100011216539_100011214892 [0,1,0,1,0,0|2,0,0]=4 20763 B16R1.394 CC(C)CCCOCCCN1CCCC1=O 7a_100011216539_100011214892 [0,1,0,1,0,0|2,0,0]=4 20764 B16R1.394 CC(C)NCCCCCOC1CCCC1=O 34a_100011629493_100000709159 [0,1,0,1,0,0|2,0,0]=4 20765 B16R1.394 CC(O)CCCNCCCN1CCCC1=O 2230a_100000210347_200000718107 [0,1,0,1,0,0|2,0,0]=4 20766 B16R1.394 CC(O)CCCNCCCN1CCCC1=O 34a_100000210347_200000718107 [0,1,0,1,0,0|2,0,0]=4 20767 B16R1.394 CC(O)CCCOCCCN1CCCC1=O 34a_100011216539_200000718107 [0,1,0,1,0,0|2,0,0]=4 20768 B16R1.394 CC(O)CCCOCCCN1CCCC1=O 7a_100011216539_200000718107 [0,1,0,1,0,0|2,0,0]=4 20769 B16R1.394 CN1CCCC1CCNCCCCC(=O)N 34a_100000696515_100000005710 [0,1,0,1,0,0|2,0,0]=4 20770 B16R1.394 CN1CCCC1CCOCCCCC(=O)N 34a_100012022536_100000005710 [0,1,0,1,0,0|2,0,0]=4 20771 B16R1.394 CN1CCCC1CCOCCCCC(=O)N 7a_100012022536_100000005710 [0,1,0,1,0,0|2,0,0]=4 20772 B16R1.394 CN1CCCC1COCCCCCC(=O)N 34a_100000743107_100009817443 [0,1,0,1,0,0|2,0,0]=4 20773 B16R1.596 C=C(C)CCOCCCCC1CCCCC1 34a_100011215267_100000730704 [0,1,0,1,0,0|2,0,0]=4 20774 B16R1.596 C=C(C)CCOCCCCC1CCCCC1 7a_100011215267_100000730704 [0,1,0,1,0,0|2,0,0]=4 20775 B16R1.596 CC(=O)CCCCCCOC1CCCCO1 1458a_100000070787_100000033462 [0,1,0,1,0,0|2,0,0]=4 20776 B16R1.596 CC(=O)CCCCNCCC1CCCCC1 34a_100000738074_100009817362 [0,1,0,1,0,0|1,0,0]=3 20777 B16R1.596 CC(=O)CCCCNCCC1CCCCO1 34a_100015183643_100009817362 [0,1,0,1,0,0|2,0,0]=4 20778 B16R1.596 CC(=O)CCCCNCCC1CCOCC1 34a_100000755988_100009817362 [0,1,0,1,0,0|2,0,0]=4 20779 B16R1.596 CC(=O)CCCCOCCC1CCCCC1 34a_100011217863_100009817362 [0,1,0,1,0,0|1,0,0]=3 20780 B16R1.596 CC(=O)CCCCOCCC1CCCCC1 7a_100011217863_100000735457 [0,1,0,1,0,0|1,0,0]=3 20781 B16R1.596 CC(=O)CCCCOCCC1CCCCN1 34a_100000211664_100009817362 [0,1,0,1,0,0|2,0,0]=4 20782 B16R1.596 CC(=O)CCCCOCCC1CCCNC1 34a_100000752241_100009817362 [0,1,0,1,0,0|2,0,0]=4 20783 B16R1.596 CC(=O)CCCCOCCC1CCNCC1 34a_100015190746_100009817362 [0,1,0,1,0,0|2,0,0]=4 20784 B16R1.596 CC(=O)CCCCOCCC1CCOCC1 34a_100011933979_100009817362 [0,1,0,1,0,0|2,0,0]=4 20785 B16R1.596 CC(=O)CCCCOCCC1CCOCC1 7a_100011933979_100000735457 [0,1,0,1,0,0|2,0,0]=4 20786 B16R1.596 CC(=O)CCCCSCCC1CCCCC1 62a_100000735457_100012355289 [0,1,0,1,0,0|1,0,0]=3 20787 B16R1.596 CC(=O)CCCCSCCC1CCCCC1 62a_100012355289_100000735457 [0,1,0,1,0,0|1,0,0]=3 20788 B16R1.596 CC(=O)CCCCSCCC1CCOCC1 62a_100000735457_100011934994 [0,1,0,1,0,0|2,0,0]=4 20789 B16R1.596 CC(=O)CCCCSCCC1CCOCC1 62a_100011934994_100000735457 [0,1,0,1,0,0|2,0,0]=4 20790 B16R1.596 CC(=O)CCCCSCCN1CCCCC1 62a_100000735457_100000739454 [0,1,0,1,0,0|2,0,0]=4 20791 B16R1.596 CC(=O)CCCCSCCN1CCCCC1 62a_100000739454_100000735457 [0,1,0,1,0,0|2,0,0]=4 20792 B16R1.596 CC(=O)CCCCSCOC1CCCCC1 62a_100000735457_100011935260 [0,1,0,1,0,0|2,0,0]=4 20793 B16R1.596 CC(=O)CCCCSCOC1CCCCC1 62a_100011935260_100000735457 [0,1,0,1,0,0|2,0,0]=4 20794 B16R1.596 CC(=O)CCCNCCCC1CCCCC1 34a_100011211642_100000685027 [0,1,0,1,0,0|1,0,0]=3 20795 B16R1.596 CC(=O)CCCNCCOC1CCCCC1 34a_100015206981_100000685027 [0,1,0,1,0,0|2,0,0]=4 20796 B16R1.596 CC(=O)CCCOCCCC1CCCCC1 34a_100000198086_100000685027 [0,1,0,1,0,0|1,0,0]=3 20797 B16R1.596 CC(=O)CCCOCCCC1CCCCC1 34a_100000759063_100011713725 [0,1,0,1,0,0|1,0,0]=3 20798 B16R1.596 CC(=O)CCCOCCCC1CCCCC1 7a_100000198086_100011215641 [0,1,0,1,0,0|1,0,0]=3 20799 B16R1.596 CC(=O)CCCOCCCC1CCCCC1 7a_100000759063_100011713725 [0,1,0,1,0,0|1,0,0]=3 20800 B16R1.596 CC(=O)CCCOCCCC1CCCCN1 34a_100011934581_100000685027 [0,1,0,1,0,0|2,0,0]=4 20801 B16R1.596 CC(=O)CCCOCCCC1CCCNC1 34a_100150707839_100000685027 [0,1,0,1,0,0|2,0,0]=4 20802 B16R1.596 CC(=O)CCCOCCCC1CCNCC1 34a_100016988962_100000685027 [0,1,0,1,0,0|2,0,0]=4 20803 B16R1.596 CC(=O)CCCOCCCN1CCCCC1 34a_100000212458_100000685027 [0,1,0,1,0,0|2,0,0]=4 20804 B16R1.596 CC(=O)CCCOCCCN1CCCCC1 34a_100000759063_100000690320 [0,1,0,1,0,0|2,0,0]=4 20805 B16R1.596 CC(=O)CCCOCCCN1CCCCC1 7a_100000759063_100000007876 [0,1,0,1,0,0|2,0,0]=4 20806 B16R1.596 CC(=O)CCCOCCNC1CCCCC1 34a_100000200466_100000685027 [0,1,0,1,0,0|2,0,0]=4 20807 B16R1.596 CC(=O)CCCOCCOC1CCCCC1 34a_100000759063_100011211530 [0,1,0,1,0,0|2,0,0]=4 20808 B16R1.596 CC(=O)CCCOCCOC1CCCCC1 34a_100011249652_100000685027 [0,1,0,1,0,0|2,0,0]=4 20809 B16R1.596 CC(=O)CCCOCCOC1CCCCC1 7a_100000759063_100011211530 [0,1,0,1,0,0|2,0,0]=4 20810 B16R1.596 CC(=O)CCCOCCOC1CCCCC1 7a_100011249652_100011215641 [0,1,0,1,0,0|2,0,0]=4 20811 B16R1.596 CC(=O)CCCSCCCC1CCCCC1 62a_100011215641_100011713725 [0,1,0,1,0,0|1,0,0]=3 20812 B16R1.596 CC(=O)CCCSCCCC1CCCCC1 62a_100011713725_100011215641 [0,1,0,1,0,0|1,0,0]=3 20813 B16R1.596 CC(=O)CCCSCCCN1CCCCC1 62a_100011215641_100000007876 [0,1,0,1,0,0|2,0,0]=4 20814 B16R1.596 CC(=O)CCCSCCCN1CCCCC1 62a_100132302099_100011215641 [0,1,0,1,0,0|2,0,0]=4 20815 B16R1.596 CC(=O)CCCSCCOC1CCCCC1 62a_100011211530_100011215641 [0,1,0,1,0,0|2,0,0]=4 20816 B16R1.596 CC(=O)CCCSCCOC1CCCCC1 62a_100011215641_100011211530 [0,1,0,1,0,0|2,0,0]=4 20817 B16R1.596 CC(=O)CCOCCCCC1CCCCC1 7a_100011215267_100000053229 [0,1,0,1,0,0|1,0,0]=3 20818 B16R1.596 CC(=O)NCCCCCNC1CCCCC1 270004a_200012022750_100000210434 [0,1,0,1,0,0|2,0,0]=4 20819 B16R1.596 CC(=O)NCCCCCNC1CCCCC1 34a_200012022750_100000210327 [0,1,0,1,0,0|2,0,0]=4 20820 B16R1.596 CC(=O)NCCCCNCC1CCCCC1 2230a_200011368371_100000211423 [0,1,0,1,0,0|2,0,0]=4 20821 B16R1.596 CC(=O)NCCCCNCC1CCCCC1 269862a_200011368371_100000211278 [0,1,0,1,0,0|2,0,0]=4 20822 B16R1.596 CC(=O)NCCCCNCC1CCCCC1 34a_200011368371_100000211423 [0,1,0,1,0,0|2,0,0]=4 20823 B16R1.596 CC(=O)NCCCNCCC1CCCCC1 270004a_100000736810_100011713444 [0,1,0,1,0,0|2,0,0]=4 20824 B16R1.596 CC(=O)NCCCNCCC1CCCCC1 34a_100000736810_100011209188 [0,1,0,1,0,0|2,0,0]=4 20825 B16R1.596 CC(=O)NCCCOCCC1CCCCC1 34a_100000752032_100011209188 [0,1,0,1,0,0|2,0,0]=4 20826 B16R1.596 CC(=O)NCCNCCCC1CCCCC1 2230a_100000209853_100011713725 [0,1,0,1,0,0|2,0,0]=4 20827 B16R1.596 CC(=O)NCCNCCCC1CCCCC1 2230a_100011211642_100000189650 [0,1,0,1,0,0|2,0,0]=4 20828 B16R1.596 CC(=O)NCCOCCCC1CCCCC1 34a_100000158858_100011713725 [0,1,0,1,0,0|2,0,0]=4 20829 B16R1.596 CC(=O)NCCOCCCC1CCCCC1 7a_100000198086_100000189650 [0,1,0,1,0,0|2,0,0]=4 20830 B16R1.596 CC(=O)NCCSCCCC1CCCCC1 62a_100000189650_100011713725 [0,1,0,1,0,0|2,0,0]=4 20831 B16R1.596 CC(=O)NCCSCCCC1CCCCC1 62a_100011713725_100000189650 [0,1,0,1,0,0|2,0,0]=4 20832 B16R1.596 CC(=O)OCCCCCNC1CCCCC1 2230a_100000182618_100009813381 [0,1,0,1,0,0|2,0,0]=4 20833 B16R1.596 CC(=O)OCCCCCNC1CCCCC1 34a_100000182618_100000033007 [0,1,0,1,0,0|2,0,0]=4 20834 B16R1.596 CC(=O)OCCCCCOC1CCCCC1 34a_100000210231_100000033007 [0,1,0,1,0,0|2,0,0]=4 20835 B16R1.596 CC(=O)OCCCCCOC1CCCCC1 7a_100000210231_100000033007 [0,1,0,1,0,0|2,0,0]=4 20836 B16R1.596 CC(=O)OCCCCCSC1CCCCC1 62a_100000033007_100000210327 [0,1,0,1,0,0|2,0,0]=4 20837 B16R1.596 CC(=O)OCCCCCSC1CCCCC1 62a_100000210327_100000033007 [0,1,0,1,0,0|2,0,0]=4 20838 B16R1.596 CC(=O)OCCCCNCC1CCCCC1 34a_100000210473_100000033659 [0,1,0,1,0,0|2,0,0]=4 20839 B16R1.596 CC(=O)OCCCCOCC1CCCCC1 34a_100000073216_100000211423 [0,1,0,1,0,0|2,0,0]=4 20840 B16R1.596 CC(=O)OCCCCOCC1CCCCC1 34a_100000212181_100000033659 [0,1,0,1,0,0|2,0,0]=4 20841 B16R1.596 CC(=O)OCCCCOCC1CCCCC1 7a_100000073216_100000211423 [0,1,0,1,0,0|2,0,0]=4 20842 B16R1.596 CC(=O)OCCCCOCC1CCCCC1 7a_100000212181_100000033659 [0,1,0,1,0,0|2,0,0]=4 20843 B16R1.596 CC(=O)OCCCCSCC1CCCCC1 62a_100000033659_100000211423 [0,1,0,1,0,0|2,0,0]=4 20844 B16R1.596 CC(=O)OCCCCSCC1CCCCC1 62a_100000211423_100000033659 [0,1,0,1,0,0|2,0,0]=4 20845 B16R1.596 CC(=O)OCCCNCCC1CCCCC1 34a_100000738074_100000042594 [0,1,0,1,0,0|2,0,0]=4 20846 B16R1.596 CC(=O)OCCCOCCC1CCCCC1 34a_100011217863_100000042594 [0,1,0,1,0,0|2,0,0]=4 20847 B16R1.596 CC(=O)OCCCOCCC1CCCCC1 7a_100011217863_100000042594 [0,1,0,1,0,0|2,0,0]=4 20848 B16R1.596 CC(=O)OCCCSCCC1CCCCC1 62a_100000042594_100012355289 [0,1,0,1,0,0|2,0,0]=4 20849 B16R1.596 CC(=O)OCCCSCCC1CCCCC1 62a_100012355289_100000042594 [0,1,0,1,0,0|2,0,0]=4 20850 B16R1.596 CC(=O)OCCNCCCC1CCCCC1 34a_100011211642_100009814007 [0,1,0,1,0,0|2,0,0]=4 20851 B16R1.596 CC(=O)OCCOCCCC1CCCCC1 34a_100000198086_100009814007 [0,1,0,1,0,0|2,0,0]=4 20852 B16R1.596 CC(=O)OCCOCCCC1CCCCC1 7a_100000198086_100009814007 [0,1,0,1,0,0|2,0,0]=4 20853 B16R1.596 CC(=O)OCCSCCCC1CCCCC1 62a_100009814007_100011713725 [0,1,0,1,0,0|2,0,0]=4 20854 B16R1.596 CC(=O)OCCSCCCC1CCCCC1 62a_100011713725_100009814007 [0,1,0,1,0,0|2,0,0]=4 20855 B16R1.596 CC(=O)OCOCCCCC1CCCCC1 34a_100011215267_100009813279 [0,1,0,1,0,0|2,0,0]=4 20856 B16R1.596 CC(=O)SCCCCNCC1CCCCC1 2230a_100000210473_200010402107 [0,1,0,1,0,0|2,0,0]=4 20857 B16R1.596 CC(=O)SCCCCNCC1CCCCC1 34a_100000210473_200010402107 [0,1,0,1,0,0|2,0,0]=4 20858 B16R1.596 CC(=O)SCCCCOCC1CCCCC1 34a_100000212181_200010402107 [0,1,0,1,0,0|2,0,0]=4 20859 B16R1.596 CC(=O)SCCCCOCC1CCCCC1 7a_100000212181_200010402107 [0,1,0,1,0,0|2,0,0]=4 20860 B16R1.596 CC(=O)SCCCCSCC1CCCCC1 62a_100000211423_200010402107 [0,1,0,1,0,0|2,0,0]=4 20861 B16R1.596 CC(=O)SCCCCSCC1CCCCC1 62a_200010402107_100000211423 [0,1,0,1,0,0|2,0,0]=4 20862 B16R1.596 CC(=O)SCCCNCCC1CCCCC1 2230a_100000738074_100000038929 [0,1,0,1,0,0|2,0,0]=4 20863 B16R1.596 CC(=O)SCCCNCCC1CCCCC1 34a_100000738074_100000038929 [0,1,0,1,0,0|2,0,0]=4 20864 B16R1.596 CC(=O)SCCCOCCC1CCCCC1 34a_100011217863_100000038929 [0,1,0,1,0,0|2,0,0]=4 20865 B16R1.596 CC(=O)SCCCOCCC1CCCCC1 7a_100011217863_100000038929 [0,1,0,1,0,0|2,0,0]=4 20866 B16R1.596 CC(=O)SCCCSCCC1CCCCC1 62a_100000038929_100012355289 [0,1,0,1,0,0|2,0,0]=4 20867 B16R1.596 CC(=O)SCCCSCCC1CCCCC1 62a_100012355289_100000038929 [0,1,0,1,0,0|2,0,0]=4 20868 B16R1.596 CC(C)CCCCCCNC1C=CCCC1 2230a_100000211014_100000751183 [0,1,0,1,0,0|2,0,0]=4 20869 B16R1.596 CS(=O)CCCNCCCC1CCCCC1 2230a_200000753449_100011713725 [0,1,0,1,0,0|2,0,0]=4 20870 B16R1.596 NC(=O)CCCCCNCC1CCCCC1 2230a_100000210473_100009817443 [0,1,0,1,0,0|1,0,0]=3 20871 B16R1.596 NC(=O)CCCCCNCC1CCCCC1 34a_100000210473_100009817443 [0,1,0,1,0,0|1,0,0]=3 20872 B16R1.596 NC(=O)CCCCCNCC1CCCCO1 2230a_100000174945_100009817443 [0,1,0,1,0,0|2,0,0]=4 20873 B16R1.596 NC(=O)CCCCCNCC1CCCCO1 34a_100000174945_100009817443 [0,1,0,1,0,0|2,0,0]=4 20874 B16R1.596 NC(=O)CCCCCNCC1CCCOC1 2230a_100000720124_100009817443 [0,1,0,1,0,0|2,0,0]=4 20875 B16R1.596 NC(=O)CCCCCNCC1CCCOC1 34a_100000720124_100009817443 [0,1,0,1,0,0|2,0,0]=4 20876 B16R1.596 NC(=O)CCCCCNCC1CCOCC1 2230a_100000746373_100009817443 [0,1,0,1,0,0|2,0,0]=4 20877 B16R1.596 NC(=O)CCCCCNCC1CCOCC1 34a_100000746373_100009817443 [0,1,0,1,0,0|2,0,0]=4 20878 B16R1.596 NC(=O)CCCCCNCC1CCSCC1 2230a_100015188806_100009817443 [0,1,0,1,0,0|2,0,0]=4 20879 B16R1.596 NC(=O)CCCCCNCC1CCSCC1 34a_100015188806_100009817443 [0,1,0,1,0,0|2,0,0]=4 20880 B16R1.596 NC(=O)CCCCCOCC1CCCCC1 34a_100000123541_100000211423 [0,1,0,1,0,0|1,0,0]=3 20881 B16R1.596 NC(=O)CCCCCOCC1CCCCC1 34a_100000212181_100009817443 [0,1,0,1,0,0|1,0,0]=3 20882 B16R1.596 NC(=O)CCCCCOCC1CCCCC1 7a_100000123541_100000211423 [0,1,0,1,0,0|1,0,0]=3 20883 B16R1.596 NC(=O)CCCCCOCC1CCCCC1 7a_100000212181_100009817443 [0,1,0,1,0,0|1,0,0]=3 20884 B16R1.596 NC(=O)CCCCCOCC1CCCCN1 34a_100000210821_100009817443 [0,1,0,1,0,0|2,0,0]=4 20885 B16R1.596 NC(=O)CCCCCOCC1CCCCO1 34a_100000123541_100000211543 [0,1,0,1,0,0|2,0,0]=4 20886 B16R1.596 NC(=O)CCCCCOCC1CCCCO1 34a_100000211370_100009817443 [0,1,0,1,0,0|2,0,0]=4 20887 B16R1.596 NC(=O)CCCCCOCC1CCCCO1 7a_100000123541_100000211543 [0,1,0,1,0,0|2,0,0]=4 20888 B16R1.596 NC(=O)CCCCCOCC1CCCCO1 7a_100000211370_100009817443 [0,1,0,1,0,0|2,0,0]=4 20889 B16R1.596 NC(=O)CCCCCOCC1CCCNC1 34a_100000211344_100009817443 [0,1,0,1,0,0|2,0,0]=4 20890 B16R1.596 NC(=O)CCCCCOCC1CCCOC1 34a_100000123541_100000741521 [0,1,0,1,0,0|2,0,0]=4 20891 B16R1.596 NC(=O)CCCCCOCC1CCCOC1 34a_100000741520_100009817443 [0,1,0,1,0,0|2,0,0]=4 20892 B16R1.596 NC(=O)CCCCCOCC1CCCOC1 7a_100000123541_100000741521 [0,1,0,1,0,0|2,0,0]=4 20893 B16R1.596 NC(=O)CCCCCOCC1CCNCC1 34a_100000738675_100009817443 [0,1,0,1,0,0|2,0,0]=4 20894 B16R1.596 NC(=O)CCCCCOCC1CCOCC1 34a_100000123541_100000754603 [0,1,0,1,0,0|2,0,0]=4 20895 B16R1.596 NC(=O)CCCCCOCC1CCOCC1 34a_100000749013_100009817443 [0,1,0,1,0,0|2,0,0]=4 20896 B16R1.596 NC(=O)CCCCCOCC1CCOCC1 7a_100000123541_100000754603 [0,1,0,1,0,0|2,0,0]=4 20897 B16R1.596 NC(=O)CCCCCOCC1CCSCC1 34a_100000070558_100009817443 [0,1,0,1,0,0|2,0,0]=4 20898 B16R1.596 NC(=O)CCCCCOCC1CCSCC1 7a_100000070558_100009817443 [0,1,0,1,0,0|2,0,0]=4 20899 B16R1.596 NC(=O)CCCCCSCC1CCCCC1 62a_100000211423_100009817443 [0,1,0,1,0,0|1,0,0]=3 20900 B16R1.596 NC(=O)CCCCCSCC1CCCCC1 62a_100009817443_100000211423 [0,1,0,1,0,0|1,0,0]=3 20901 B16R1.596 NC(=O)CCCCCSCC1CCCCO1 62a_100000211543_100009817443 [0,1,0,1,0,0|2,0,0]=4 20902 B16R1.596 NC(=O)CCCCCSCC1CCCCO1 62a_100009817443_100000211543 [0,1,0,1,0,0|2,0,0]=4 20903 B16R1.596 NC(=O)CCCCCSCC1CCCOC1 62a_100000741521_100009817443 [0,1,0,1,0,0|2,0,0]=4 20904 B16R1.596 NC(=O)CCCCCSCC1CCCOC1 62a_100009817443_100000741521 [0,1,0,1,0,0|2,0,0]=4 20905 B16R1.596 NC(=O)CCCCCSCC1CCOCC1 62a_100000754603_100009817443 [0,1,0,1,0,0|2,0,0]=4 20906 B16R1.596 NC(=O)CCCCCSCC1CCOCC1 62a_100009817443_100000749018 [0,1,0,1,0,0|2,0,0]=4 20907 B16R1.596 NC(=O)CCCCNCCC1CCCCC1 270004a_100000696515_100011713444 [0,1,0,1,0,0|1,0,0]=3 20908 B16R1.596 NC(=O)CCCCNCCC1CCCCC1 34a_100000696515_100011209188 [0,1,0,1,0,0|1,0,0]=3 20909 B16R1.596 NC(=O)CCCCNCCC1CCOCC1 34a_100000696515_100011934994 [0,1,0,1,0,0|2,0,0]=4 20910 B16R1.596 NC(=O)CCCCNCCN1CCCCC1 34a_100000696515_100000739454 [0,1,0,1,0,0|2,0,0]=4 20911 B16R1.596 NC(=O)CCCCNCOC1CCCCC1 34a_100000696515_100011935260 [0,1,0,1,0,0|2,0,0]=4 20912 B16R1.596 NC(=O)CCCCOCCC1CCCCC1 34a_100012022536_100011209188 [0,1,0,1,0,0|1,0,0]=3 20913 B16R1.596 NC(=O)CCCCOCCC1CCCCC1 7a_100012022536_100011273959 [0,1,0,1,0,0|1,0,0]=3 20914 B16R1.596 NC(=O)CCCCOCCC1CCOCC1 34a_100012022536_100011934994 [0,1,0,1,0,0|2,0,0]=4 20915 B16R1.596 NC(=O)CCCCOCCC1CCOCC1 7a_100012022536_100011934994 [0,1,0,1,0,0|2,0,0]=4 20916 B16R1.596 NC(=O)CCCCOCCN1CCCCC1 34a_100012022536_100000739454 [0,1,0,1,0,0|2,0,0]=4 20917 B16R1.596 NC(=O)CCCCOCCN1CCCCC1 7a_100012022536_100000739454 [0,1,0,1,0,0|2,0,0]=4 20918 B16R1.596 NC(=O)CCCCOCOC1CCCCC1 34a_100012022536_100011935260 [0,1,0,1,0,0|2,0,0]=4 20919 B16R1.596 NC(=O)CCCCOCOC1CCCCC1 7a_100012022536_100011935260 [0,1,0,1,0,0|2,0,0]=4 20920 B16R1.596 NC(=O)CCCNCCCC1CCCCC1 34a_100000739312_100011713725 [0,1,0,1,0,0|1,0,0]=3 20921 B16R1.596 NC(=O)CCCNCCCC1CCCCC1 34a_100011211642_100102525003 [0,1,0,1,0,0|1,0,0]=3 20922 B16R1.596 NC(=O)CCCNCCCN1CCCCC1 34a_100000739312_100000690320 [0,1,0,1,0,0|2,0,0]=4 20923 B16R1.596 NC(=O)CCCNCCOC1CCCCC1 34a_100000739312_100011211530 [0,1,0,1,0,0|2,0,0]=4 20924 B16R1.596 NC(=O)CCCNCCOC1CCCCC1 34a_100015206981_100102525003 [0,1,0,1,0,0|2,0,0]=4 20925 B16R1.596 NC(=O)CCCOCCCC1CCCCC1 34a_100000198086_100102525003 [0,1,0,1,0,0|1,0,0]=3 20926 B16R1.596 NC(=O)CCCOCCCC1CCCCC1 7a_100000198086_100102525003 [0,1,0,1,0,0|1,0,0]=3 20927 B16R1.596 NC(=O)CCCOCCCC1CCCCN1 34a_100011934581_100102525003 [0,1,0,1,0,0|2,0,0]=4 20928 B16R1.596 NC(=O)CCCOCCCC1CCCNC1 34a_100150707839_100102525003 [0,1,0,1,0,0|2,0,0]=4 20929 B16R1.596 NC(=O)CCCOCCCC1CCNCC1 34a_100016988962_100102525003 [0,1,0,1,0,0|2,0,0]=4 20930 B16R1.596 NC(=O)CCCOCCCN1CCCCC1 34a_100000212458_100102525003 [0,1,0,1,0,0|2,0,0]=4 20931 B16R1.596 NC(=O)CCCOCCNC1CCCCC1 34a_100000200466_100102525003 [0,1,0,1,0,0|2,0,0]=4 20932 B16R1.596 NC(=O)CCCOCCOC1CCCCC1 34a_100011249652_100102525003 [0,1,0,1,0,0|2,0,0]=4 20933 B16R1.596 NC(=O)CCCOCCOC1CCCCC1 7a_100011249652_100102525003 [0,1,0,1,0,0|2,0,0]=4 20934 B16R1.596 NC(=O)CCCSCCCC1CCCCC1 62a_100011713725_100102525003 [0,1,0,1,0,0|1,0,0]=3 20935 B16R1.596 NC(=O)CCCSCCCC1CCCCC1 62a_100102525003_100011713725 [0,1,0,1,0,0|1,0,0]=3 20936 B16R1.596 NC(=O)CCCSCCCN1CCCCC1 62a_100102525003_100000007876 [0,1,0,1,0,0|2,0,0]=4 20937 B16R1.596 NC(=O)CCCSCCCN1CCCCC1 62a_100132302099_100102525003 [0,1,0,1,0,0|2,0,0]=4 20938 B16R1.596 NC(=O)CCCSCCOC1CCCCC1 62a_100011211530_100102525003 [0,1,0,1,0,0|2,0,0]=4 20939 B16R1.596 NC(=O)CCCSCCOC1CCCCC1 62a_100102525003_100011211530 [0,1,0,1,0,0|2,0,0]=4 20940 B16R1.596 NC(=O)CCNCCCOC1CCCCC1 34a_100000205933_100000731001 [0,1,0,1,0,0|2,0,0]=4 20941 B16R1.596 NC(=O)CCOCCCCC1CCCCC1 34a_100011215267_100000731001 [0,1,0,1,0,0|1,0,0]=3 20942 B16R1.596 NC(=O)CCOCCCCC1CCCCC1 7a_100011215267_100000744528 [0,1,0,1,0,0|1,0,0]=3 20943 B16R1.596 NC(=O)CCOCCCCC1CCNCC1 34a_100016989291_100000731001 [0,1,0,1,0,0|2,0,0]=4 20944 B16R1.596 NC(=O)COCCCCCN1CCCCC1 34a_100011216611_100000187820 [0,1,0,1,0,0|2,0,0]=4 20945 B16R1.596 NC(=O)COCCCCCN1CCCCC1 7a_100011216611_100000187820 [0,1,0,1,0,0|2,0,0]=4 20946 B16R1.596 NC(=O)COCCNCCC1CCCCC1 2230a_100000738074_100000076697 [0,1,0,1,0,0|2,0,0]=4 20947 B16R1.596 NC(=O)COCCNCCC1CCCCC1 34a_100000738074_100000076697 [0,1,0,1,0,0|2,0,0]=4 20948 B16R1.596 NC(=O)COCCOCCC1CCCCC1 34a_100011217863_100000076697 [0,1,0,1,0,0|2,0,0]=4 20949 B16R1.596 NC(=O)COCCOCCC1CCCCC1 7a_100011217863_100000076697 [0,1,0,1,0,0|2,0,0]=4 20950 B16R1.596 NC(=O)COCCSCCC1CCCCC1 62a_100000076697_100012355289 [0,1,0,1,0,0|2,0,0]=4 20951 B16R1.596 NC(=O)COCCSCCC1CCCCC1 62a_100012355289_100000076697 [0,1,0,1,0,0|2,0,0]=4 20952 B16R1.596 NC(=O)NCCNCCCC1CCCCC1 2230a_100011211642_200000034859 [0,1,0,1,0,0|2,0,0]=4 20953 B16R1.596 NC(=O)NCCNCCCC1CCCCC1 34a_100020590234_100011713725 [0,1,0,1,0,0|2,0,0]=4 20954 B16R1.596 NC(=O)NCCOCCCC1CCCCC1 34a_100000181757_100011713725 [0,1,0,1,0,0|2,0,0]=4 20955 B16R1.596 NC(=O)NCCOCCCC1CCCCC1 7a_100000198086_200000034859 [0,1,0,1,0,0|2,0,0]=4 20956 B16R1.596 NC(=O)NCCSCCCC1CCCCC1 62a_100011713725_200000034859 [0,1,0,1,0,0|2,0,0]=4 20957 B16R1.596 NC(=O)NCCSCCCC1CCCCC1 62a_200000034859_100011713725 [0,1,0,1,0,0|2,0,0]=4 20958 B16R1.596 NC(=O)OCCNCCCC1CCCCC1 34a_100011211642_200011214921 [0,1,0,1,0,0|2,0,0]=4 20959 B16R1.596 NC(=O)OCCOCCCC1CCCCC1 34a_100000198086_200011214921 [0,1,0,1,0,0|2,0,0]=4 20960 B16R1.596 NC(=O)OCCOCCCC1CCCCC1 7a_100000198086_200011214921 [0,1,0,1,0,0|2,0,0]=4 20961 B16R1.596 NC(=O)OCCOCCCC1CCCCC1 7a_100000766696_100011713725 [0,1,0,1,0,0|2,0,0]=4 20962 B16R1.596 NC(=O)OCCSCCCC1CCCCC1 62a_100011713725_200011214921 [0,1,0,1,0,0|2,0,0]=4 20963 B16R1.596 NC(=O)OCCSCCCC1CCCCC1 62a_200011214921_100011713725 [0,1,0,1,0,0|2,0,0]=4 20964 B16R1.596 O=C(O)COCCNCCC1CCCCC1 269956a_100000700818_100011273959 [0,1,0,1,0,0|2,0,0]=4 20965 B16R1.596 O=C([O-])CCCCCOCC1CCCCC1 7a_100102619762_100000211423 [0,1,0,1,0,0|1,0,0]=3 20966 B16R1.596 O=C([O-])CCCCCOCC1CCCCO1 7a_100102619762_100000211543 [0,1,0,1,0,0|2,0,0]=4 20967 B16R1.596 O=C([O-])CCCCCOCC1CCCOC1 7a_100102619762_100000741521 [0,1,0,1,0,0|2,0,0]=4 20968 B16R1.596 O=C([O-])CCCCCOCC1CCOCC1 7a_100102619762_100000754603 [0,1,0,1,0,0|2,0,0]=4 20969 B16R1.596 O=C([O-])COCCCCCN1CCCCC1 34a_100011216611_100020667443 [0,1,0,1,0,0|2,0,0]=4 20970 B16R1.596 O=[N+]([O-])CCCCOCCC1CCCCC1 34a_200015379883_100011209188 [0,1,0,1,0,0|2,0,0]=4 20971 B16R1.596 O=[N+]([O-])CCCCOCCC1CCCCC1 7a_200015379883_100011273959 [0,1,0,1,0,0|2,0,0]=4 20972 B16R1.596 O=[N+]([O-])CCCOCCCC1CCCCC1 34a_200000037920_100011713725 [0,1,0,1,0,0|2,0,0]=4 20973 B16R1.695 C=CCC1CCCCC1NCCCC(C)C 269862a_200000737386_100011214939 [0,1,0,1,0,0|2,0,0]=4 20974 B16R1.695 C=CCC1CCCCC1NCCCC(C)C 270004a_200000737386_100011214939 [0,1,0,1,0,0|2,0,0]=4 20975 B16R1.695 CC(=O)CCCCN1CCCCC1CCO 269982a_100000211664_100000735457 [0,1,0,1,0,0|2,0,0]=4 20976 B16R1.695 CC(=O)CCCCN1CCCCC1CCO 34a_100000211664_100009817362 [0,1,0,1,0,0|2,0,0]=4 20977 B16R1.695 CCCC1CCCCC1NCCCC(=O)N 269862a_100000739312_100011218038 [0,1,0,1,0,0|1,0,0]=3 20978 B16R1.695 CCCC1CCCCC1NCCCS(=O)C 270004a_200000753449_100011218038 [0,1,0,1,0,0|2,0,0]=4 20979 B16R1.695 CCCC1CCCCC1NCCNC(=O)C 269862a_100000209853_100011218038 [0,1,0,1,0,0|2,0,0]=4 20980 B16R1.695 CCCC1CCCCC1NCCNC(=O)N 269862a_100020590234_100011218038 [0,1,0,1,0,0|2,0,0]=4 20981 B16R1.695 CCCC1CCCCC1NCCSC(=O)C 269862a_100020647217_100011218038 [0,1,0,1,0,0|2,0,0]=4 20982 B16R1.695 CCCC1CCCCC1OCCCC(=O)C 34a_100011217265_100000685027 [0,1,0,1,0,0|1,0,0]=3 20983 B16R1.695 CCCC1CCCCC1OCCCC(=O)C 7a_100011217265_100011215641 [0,1,0,1,0,0|1,0,0]=3 20984 B16R1.695 CCCC1CCCCC1OCCCC(=O)N 34a_100011217265_100102525003 [0,1,0,1,0,0|1,0,0]=3 20985 B16R1.695 CCCC1CCCCC1OCCCC(=O)N 7a_100011217265_100102525003 [0,1,0,1,0,0|1,0,0]=3 20986 B16R1.695 CCCC1CCCCC1OCCNC(=O)C 7a_100011217265_100000189650 [0,1,0,1,0,0|2,0,0]=4 20987 B16R1.695 CCCC1CCCCC1OCCNC(=O)N 7a_100011217265_200000034859 [0,1,0,1,0,0|2,0,0]=4 20988 B16R1.695 CCCC1CCCCC1OCCOC(=O)C 34a_100011217265_100009814007 [0,1,0,1,0,0|2,0,0]=4 20989 B16R1.695 CCCC1CCCCC1OCCOC(=O)C 7a_100011217265_100009814007 [0,1,0,1,0,0|2,0,0]=4 20990 B16R1.695 CCCC1CCCCC1OCCOC(=O)N 34a_100011217265_200011214921 [0,1,0,1,0,0|2,0,0]=4 20991 B16R1.695 CCCC1CCCCC1OCCOC(=O)N 7a_100011217265_200011214921 [0,1,0,1,0,0|2,0,0]=4 20992 B16R1.695 CCCC1CCCCN1CCCCC(=O)C 269982a_100000701414_100000735457 [0,1,0,1,0,0|1,0,0]=3 20993 B16R1.695 CCCC1CCCCN1CCCCC(=O)C 34a_100000701414_100009817362 [0,1,0,1,0,0|1,0,0]=3 20994 B16R1.695 CCCC1CCCCN1CCCOC(=O)C 269982a_100000701414_100000042594 [0,1,0,1,0,0|2,0,0]=4 20995 B16R1.695 CCCC1CCCCN1CCCOC(=O)C 34a_100000701414_100000042594 [0,1,0,1,0,0|2,0,0]=4 20996 B16R1.695 CCCC1CCCCN1CCCSC(=O)C 2230a_100000701414_100000038929 [0,1,0,1,0,0|2,0,0]=4 20997 B16R1.695 CCCC1CCCCN1CCCSC(=O)C 269982a_100000701414_100000038929 [0,1,0,1,0,0|2,0,0]=4 20998 B16R1.695 CCCC1CCCCN1CCCSC(=O)C 34a_100000701414_100000038929 [0,1,0,1,0,0|2,0,0]=4 20999 B16R1.695 CCCC1CCCCN1CCOCC(=O)N 2230a_100000701414_100000076697 [0,1,0,1,0,0|2,0,0]=4 21000 B16R1.695 CCCC1CCCCN1CCOCC(=O)N 269982a_100000701414_100000076697 [0,1,0,1,0,0|2,0,0]=4 21001 B16R1.695 CCCC1CCCCN1CCOCC(=O)N 34a_100000701414_100000076697 [0,1,0,1,0,0|2,0,0]=4 21002 B16R1.695 CCCC1COCCN1CCCCC(=O)C 269982a_102495339903_100000735457 [0,1,0,1,0,0|2,0,0]=4 21003 B16R1.695 CCCC1COCCN1CCCCC(=O)C 34a_102495339903_100009817362 [0,1,0,1,0,0|2,0,0]=4 21004 B16R1.695 COCC1CCCCN1CCCCC(=O)C 269982a_100015184032_100000735457 [0,1,0,1,0,0|2,0,0]=4 21005 B16R1.695 COCC1CCCCN1CCCCC(=O)C 34a_100015184032_100009817362 [0,1,0,1,0,0|2,0,0]=4 21006 B16R1.708 CCCC1CCCC1NCCCCC(=O)N 269862a_100000696515_100000723119 [0,1,0,1,0,0|1,0,0]=3 21007 B16R1.708 CCCC1CCCC1NCCCCC(=O)N 270004a_100000696515_100000723119 [0,1,0,1,0,0|1,0,0]=3 21008 B16R1.708 CCCC1CCCC1NCCCNC(=O)C 269862a_100000736810_100000723119 [0,1,0,1,0,0|2,0,0]=4 21009 B16R1.708 CCCC1CCCC1NCCCNC(=O)C 270004a_100000736810_100000723119 [0,1,0,1,0,0|2,0,0]=4 21010 B16R1.708 CCCN1CCCC1COCCCC(=O)C 34a_200000694710_100000685027 [0,1,0,1,0,0|2,0,0]=4 21011 B16R1.708 CCCN1CCCC1COCCCC(=O)C 7a_200000694710_100011215641 [0,1,0,1,0,0|2,0,0]=4 21012 B16R1.708 CCCN1CCCC1COCCCC(=O)N 34a_200000694710_100102525003 [0,1,0,1,0,0|2,0,0]=4 21013 B16R1.708 CCCN1CCCC1COCCCC(=O)N 7a_200000694710_100102525003 [0,1,0,1,0,0|2,0,0]=4 21014 B16R1.708 COC[C@@H]1CCCN1CCCCCC(=O)N 2230a_100020646714_100009817443 [0,1,0,1,0,0|2,0,0]=4 21015 B16R1.708 COC[C@@H]1CCCN1CCCCCC(=O)N 269982a_100020646714_100009817443 [0,1,0,1,0,0|2,0,0]=4 21016 B16R1.708 COC[C@@H]1CCCN1CCCCCC(=O)N 34a_100020646714_100009817443 [0,1,0,1,0,0|2,0,0]=4 21017 B16R1.1255 CC(=O)CCCN1CCCCC1CCCO 269982a_100011934581_100011215641 [0,1,0,1,0,0|2,0,0]=4 21018 B16R1.1255 CC(=O)CCCN1CCCCC1CCCO 34a_100011934581_100000685027 [0,1,0,1,0,0|2,0,0]=4 21019 B16R1.1255 CCCCN1CCCCC1CCNC(=O)C 2230a_200011221479_100000210211 [0,1,0,1,0,0|2,0,0]=4 21020 B16R1.1255 CCCCN1CCCCC1CCNC(=O)C 269982a_200011221479_100000210211 [0,1,0,1,0,0|2,0,0]=4 21021 B16R1.1255 CCCCN1CCCCC1CCNC(=O)C 34a_200011221479_100000210210 [0,1,0,1,0,0|2,0,0]=4 21022 B16R1.1255 COCCC1CCCCN1CCCC(=O)C 269982a_100015186528_100011215641 [0,1,0,1,0,0|2,0,0]=4 21023 B16R1.1255 COCCC1CCCCN1CCCC(=O)C 34a_100015186528_100000685027 [0,1,0,1,0,0|2,0,0]=4 21024 B16R1.1255 COCCC1CCCCN1CCCC(=O)N 269982a_100015186528_100102525003 [0,1,0,1,0,0|2,0,0]=4 21025 B16R1.1255 COCCC1CCCCN1CCCC(=O)N 34a_100015186528_100102525003 [0,1,0,1,0,0|2,0,0]=4 21026 B16R1.1255 NC(=O)CCCN1CCCCC1CCCO 269982a_100011934581_100102525003 [0,1,0,1,0,0|2,0,0]=4 21027 B16R1.1255 NC(=O)CCCN1CCCCC1CCCO 34a_100011934581_100102525003 [0,1,0,1,0,0|2,0,0]=4 21028 B16R1.1270 CCCCC1CCCC1NCCCC(=O)N 269862a_100000739312_100000750825 [0,1,0,1,0,0|1,0,0]=3 21029 B16R1.1270 CCCCC1CCCC1NCCCS(=O)C 270004a_200000753449_100000750825 [0,1,0,1,0,0|2,0,0]=4 21030 B16R1.1270 CCCCC1CCCC1NCCNC(=O)C 269862a_100000209853_100000750825 [0,1,0,1,0,0|2,0,0]=4 21031 B16R1.1270 CCCCC1CCCC1NCCNC(=O)N 269862a_100020590234_100000750825 [0,1,0,1,0,0|2,0,0]=4 21032 B16R1.1270 CCCCC1CCCC1NCCSC(=O)C 269862a_100020647217_100000750825 [0,1,0,1,0,0|2,0,0]=4 21033 B16R1.1275 CC(=O)CCCCNCCCC1CCCC1 34a_100000736752_100009817362 [0,1,0,1,0,0|1,0,0]=3 21034 B16R1.1275 CC(=O)CCCCNCCOC1CCCC1 34a_100000741755_100009817362 [0,1,0,1,0,0|2,0,0]=4 21035 B16R1.1275 CC(=O)CCCCOCCCC1CCCC1 34a_100011215328_100009817362 [0,1,0,1,0,0|1,0,0]=3 21036 B16R1.1275 CC(=O)CCCCOCCCC1CCCC1 7a_100011215328_100000735457 [0,1,0,1,0,0|1,0,0]=3 21037 B16R1.1275 CC(=O)CCCCOCCNC1CCCC1 34a_200000200444_100009817362 [0,1,0,1,0,0|2,0,0]=4 21038 B16R1.1275 CC(=O)CCCCOCCOC1CCCC1 34a_100000738311_100009817362 [0,1,0,1,0,0|2,0,0]=4 21039 B16R1.1275 CC(=O)CCCCOCCOC1CCCC1 7a_100000738311_100000735457 [0,1,0,1,0,0|2,0,0]=4 21040 B16R1.1275 CC(=O)CCCCSCCCC1CCCC1 62a_100000735457_100011713738 [0,1,0,1,0,0|1,0,0]=3 21041 B16R1.1275 CC(=O)CCCCSCCCC1CCCC1 62a_100011713738_100000735457 [0,1,0,1,0,0|1,0,0]=3 21042 B16R1.1275 CC(=O)CCCCSCCCN1CCCC1 62a_100000735457_100011445909 [0,1,0,1,0,0|2,0,0]=4 21043 B16R1.1275 CC(=O)CCCCSCCCN1CCCC1 62a_100016991639_100000735457 [0,1,0,1,0,0|2,0,0]=4 21044 B16R1.1275 CC(=O)CCCNCCCOC1CCCC1 34a_100000747560_100000685027 [0,1,0,1,0,0|2,0,0]=4 21045 B16R1.1275 CC(=O)NCCCCCCNC1CCCC1 2230a_200011996284_100000179811 [0,1,0,1,0,0|2,0,0]=4 21046 B16R1.1275 CC(=O)NCCCCCCNC1CCCC1 270004a_200011996284_100000210133 [0,1,0,1,0,0|2,0,0]=4 21047 B16R1.1275 CC(=O)NCCCCCCNC1CCCC1 34a_200011996284_100000179811 [0,1,0,1,0,0|2,0,0]=4 21048 B16R1.1275 CC(=O)NCCCCCNCC1CCCC1 2230a_200012022750_100000740388 [0,1,0,1,0,0|2,0,0]=4 21049 B16R1.1275 CC(=O)NCCCCCNCC1CCCC1 269862a_200012022750_100000746403 [0,1,0,1,0,0|2,0,0]=4 21050 B16R1.1275 CC(=O)NCCCCCNCC1CCCC1 34a_200012022750_100000740388 [0,1,0,1,0,0|2,0,0]=4 21051 B16R1.1275 CC(=O)NCCCCNCCC1CCCC1 2230a_200011368371_100000760354 [0,1,0,1,0,0|2,0,0]=4 21052 B16R1.1275 CC(=O)NCCCCNCCC1CCCC1 34a_200011368371_100000760354 [0,1,0,1,0,0|2,0,0]=4 21053 B16R1.1275 CC(=O)NCCCNCCCC1CCCC1 34a_100000736810_100011713738 [0,1,0,1,0,0|2,0,0]=4 21054 B16R1.1275 CC(=O)NCCCOCCCC1CCCC1 34a_100000752032_100011713738 [0,1,0,1,0,0|2,0,0]=4 21055 B16R1.1275 CC(=O)OCCCCCNCC1CCCC1 2230a_100000737975_100009813381 [0,1,0,1,0,0|2,0,0]=4 21056 B16R1.1275 CC(=O)OCCCCCNCC1CCCC1 34a_100000737975_100000033007 [0,1,0,1,0,0|2,0,0]=4 21057 B16R1.1275 CC(=O)OCCCCCOCC1CCCC1 34a_100000742336_100000033007 [0,1,0,1,0,0|2,0,0]=4 21058 B16R1.1275 CC(=O)OCCCCCOCC1CCCC1 7a_100000742336_100000033007 [0,1,0,1,0,0|2,0,0]=4 21059 B16R1.1275 CC(=O)OCCCCCSCC1CCCC1 62a_100000033007_100000740388 [0,1,0,1,0,0|2,0,0]=4 21060 B16R1.1275 CC(=O)OCCCCCSCC1CCCC1 62a_100000740388_100000033007 [0,1,0,1,0,0|2,0,0]=4 21061 B16R1.1275 CC(=O)OCCCCNCCC1CCCC1 34a_100000739158_100000033659 [0,1,0,1,0,0|2,0,0]=4 21062 B16R1.1275 CC(=O)OCCCCOCCC1CCCC1 34a_100000073216_100000760354 [0,1,0,1,0,0|2,0,0]=4 21063 B16R1.1275 CC(=O)OCCCCOCCC1CCCC1 34a_100000749090_100000033659 [0,1,0,1,0,0|2,0,0]=4 21064 B16R1.1275 CC(=O)OCCCCOCCC1CCCC1 7a_100000073216_100000760354 [0,1,0,1,0,0|2,0,0]=4 21065 B16R1.1275 CC(=O)OCCCCOCCC1CCCC1 7a_100000749090_100000033659 [0,1,0,1,0,0|2,0,0]=4 21066 B16R1.1275 CC(=O)OCCCCSCCC1CCCC1 62a_100000033659_100000760354 [0,1,0,1,0,0|2,0,0]=4 21067 B16R1.1275 CC(=O)OCCCCSCCC1CCCC1 62a_100000760354_100000033659 [0,1,0,1,0,0|2,0,0]=4 21068 B16R1.1275 CC(=O)OCCCNCCCC1CCCC1 34a_100000736752_100000042594 [0,1,0,1,0,0|2,0,0]=4 21069 B16R1.1275 CC(=O)OCCCOCCCC1CCCC1 34a_100011215328_100000042594 [0,1,0,1,0,0|2,0,0]=4 21070 B16R1.1275 CC(=O)OCCCOCCCC1CCCC1 7a_100011215328_100000042594 [0,1,0,1,0,0|2,0,0]=4 21071 B16R1.1275 CC(=O)OCCCSCCCC1CCCC1 62a_100000042594_100011713738 [0,1,0,1,0,0|2,0,0]=4 21072 B16R1.1275 CC(=O)OCCCSCCCC1CCCC1 62a_100011713738_100000042594 [0,1,0,1,0,0|2,0,0]=4 21073 B16R1.1275 CC(=O)SCCCCCCNC1CCCC1 270004a_100000704104_100000210133 [0,1,0,1,0,0|2,0,0]=4 21074 B16R1.1275 CC(=O)SCCCCNCCC1CCCC1 2230a_100000739158_200010402107 [0,1,0,1,0,0|2,0,0]=4 21075 B16R1.1275 CC(=O)SCCCCNCCC1CCCC1 34a_100000739158_200010402107 [0,1,0,1,0,0|2,0,0]=4 21076 B16R1.1275 CC(=O)SCCCCOCCC1CCCC1 34a_100000749090_200010402107 [0,1,0,1,0,0|2,0,0]=4 21077 B16R1.1275 CC(=O)SCCCCOCCC1CCCC1 7a_100000749090_200010402107 [0,1,0,1,0,0|2,0,0]=4 21078 B16R1.1275 CC(=O)SCCCCSCCC1CCCC1 62a_100000760354_200010402107 [0,1,0,1,0,0|2,0,0]=4 21079 B16R1.1275 CC(=O)SCCCCSCCC1CCCC1 62a_200010402107_100000760354 [0,1,0,1,0,0|2,0,0]=4 21080 B16R1.1275 CC(=O)SCCCNCCCC1CCCC1 2230a_100000736752_100000038929 [0,1,0,1,0,0|2,0,0]=4 21081 B16R1.1275 CC(=O)SCCCNCCCC1CCCC1 34a_100000736752_100000038929 [0,1,0,1,0,0|2,0,0]=4 21082 B16R1.1275 CC(=O)SCCCOCCCC1CCCC1 34a_100011215328_100000038929 [0,1,0,1,0,0|2,0,0]=4 21083 B16R1.1275 CC(=O)SCCCOCCCC1CCCC1 7a_100011215328_100000038929 [0,1,0,1,0,0|2,0,0]=4 21084 B16R1.1275 CC(=O)SCCCSCCCC1CCCC1 62a_100000038929_100011713738 [0,1,0,1,0,0|2,0,0]=4 21085 B16R1.1275 CC(=O)SCCCSCCCC1CCCC1 62a_100011713738_100000038929 [0,1,0,1,0,0|2,0,0]=4 21086 B16R1.1275 NC(=O)CCCCCNCCC1CCCC1 2230a_100000739158_100009817443 [0,1,0,1,0,0|1,0,0]=3 21087 B16R1.1275 NC(=O)CCCCCNCCC1CCCC1 34a_100000739158_100009817443 [0,1,0,1,0,0|1,0,0]=3 21088 B16R1.1275 NC(=O)CCCCCOCCC1CCCC1 34a_100000123541_100000760354 [0,1,0,1,0,0|1,0,0]=3 21089 B16R1.1275 NC(=O)CCCCCOCCC1CCCC1 34a_100000749090_100009817443 [0,1,0,1,0,0|1,0,0]=3 21090 B16R1.1275 NC(=O)CCCCCOCCC1CCCC1 7a_100000123541_100000760354 [0,1,0,1,0,0|1,0,0]=3 21091 B16R1.1275 NC(=O)CCCCCOCCC1CCCC1 7a_100000749090_100009817443 [0,1,0,1,0,0|1,0,0]=3 21092 B16R1.1275 NC(=O)CCCCCOCCC1CCNC1 34a_100016987287_100009817443 [0,1,0,1,0,0|2,0,0]=4 21093 B16R1.1275 NC(=O)CCCCCOCCC1CCOC1 34a_100011879284_100009817443 [0,1,0,1,0,0|2,0,0]=4 21094 B16R1.1275 NC(=O)CCCCCOCCN1CCCC1 7a_100000123541_100000004467 [0,1,0,1,0,0|2,0,0]=4 21095 B16R1.1275 NC(=O)CCCCCSCCC1CCCC1 62a_100000760354_100009817443 [0,1,0,1,0,0|1,0,0]=3 21096 B16R1.1275 NC(=O)CCCCCSCCC1CCCC1 62a_100009817443_100000760354 [0,1,0,1,0,0|1,0,0]=3 21097 B16R1.1275 NC(=O)CCCCCSCCN1CCCC1 62a_100000700749_100009817443 [0,1,0,1,0,0|2,0,0]=4 21098 B16R1.1275 NC(=O)CCCCCSCCN1CCCC1 62a_100009817443_100000004467 [0,1,0,1,0,0|2,0,0]=4 21099 B16R1.1275 NC(=O)CCCCNCCCC1CCCC1 34a_100000696515_100011713738 [0,1,0,1,0,0|1,0,0]=3 21100 B16R1.1275 NC(=O)CCCCNCCCN1CCCC1 34a_100000696515_100016991639 [0,1,0,1,0,0|2,0,0]=4 21101 B16R1.1275 NC(=O)CCCCOCCCC1CCCC1 34a_100012022536_100011713738 [0,1,0,1,0,0|1,0,0]=3 21102 B16R1.1275 NC(=O)CCCCOCCCC1CCCC1 7a_100012022536_100011713738 [0,1,0,1,0,0|1,0,0]=3 21103 B16R1.1275 NC(=O)CCCCOCCCN1CCCC1 34a_100012022536_100016991639 [0,1,0,1,0,0|2,0,0]=4 21104 B16R1.1275 NC(=O)CCCCOCCCN1CCCC1 7a_100012022536_100011445909 [0,1,0,1,0,0|2,0,0]=4 21105 B16R1.1275 NC(=O)CCCNCCCOC1CCCC1 34a_100000747560_100102525003 [0,1,0,1,0,0|2,0,0]=4 21106 B16R1.1275 NC(=O)COCCNCCCC1CCCC1 2230a_100000736752_100000076697 [0,1,0,1,0,0|2,0,0]=4 21107 B16R1.1275 NC(=O)COCCNCCCC1CCCC1 34a_100000736752_100000076697 [0,1,0,1,0,0|2,0,0]=4 21108 B16R1.1275 NC(=O)COCCOCCCC1CCCC1 34a_100011215328_100000076697 [0,1,0,1,0,0|2,0,0]=4 21109 B16R1.1275 NC(=O)COCCOCCCC1CCCC1 7a_100011215328_100000076697 [0,1,0,1,0,0|2,0,0]=4 21110 B16R1.1275 NC(=O)COCCSCCCC1CCCC1 62a_100000076697_100011713738 [0,1,0,1,0,0|2,0,0]=4 21111 B16R1.1275 NC(=O)COCCSCCCC1CCCC1 62a_100011713738_100000076697 [0,1,0,1,0,0|2,0,0]=4 21112 B16R1.1275 O=C(O)COCCNCCCC1CCCC1 269956a_100000700818_100011713738 [0,1,0,1,0,0|2,0,0]=4 21113 B16R1.1275 O=C([O-])CCCCCOCCC1CCCC1 7a_100102619762_100000760354 [0,1,0,1,0,0|1,0,0]=3 21114 B16R1.1275 O=C([O-])CCCCCOCCN1CCCC1 7a_100102619762_100000004467 [0,1,0,1,0,0|2,0,0]=4 21115 B16R1.1275 O=[N+]([O-])CCCCOCCCC1CCCC1 34a_200015379883_100011713738 [0,1,0,1,0,0|2,0,0]=4 21116 B16R1.1275 O=[N+]([O-])CCCCOCCCC1CCCC1 7a_200015379883_100011713738 [0,1,0,1,0,0|2,0,0]=4 21117 B16R1.1352 CCC1CCCC1NCCCCNC(=O)C 269862a_200011368371_100000749056 [0,1,0,1,0,0|2,0,0]=4 21118 B16R1.1352 CCC1CCCC1NCCCCNC(=O)C 270004a_200011368371_100000749056 [0,1,0,1,0,0|2,0,0]=4 21119 B16R1.1352 CCC1CCCN1CCCCCOC(=O)C 2230a_100000754278_100009813381 [0,1,0,1,0,0|2,0,0]=4 21120 B16R1.1352 CCC1CCCN1CCCCCOC(=O)C 269982a_100000754278_100000033007 [0,1,0,1,0,0|2,0,0]=4 21121 B16R1.1352 CCC1CCCN1CCCCCOC(=O)C 34a_100000754278_100000033007 [0,1,0,1,0,0|2,0,0]=4 21122 B16R1.1352 CCN1CCC[C@@H]1COCCCCC(=O)C 34a_100011739246_100009817362 [0,1,0,1,0,0|2,0,0]=4 21123 B16R1.1352 CCN1CCC[C@@H]1COCCCCC(=O)C 7a_100011739246_100000735457 [0,1,0,1,0,0|2,0,0]=4 21124 B16R1.1424 CCCCCN1CCCCC1CCC(=O)O 269956a_100000694054_100000210326 [0,1,0,1,0,0|1,0,0]=3 21125 B16R1.1424 CCOCCN1CCCCC1CCC(=O)O 269956a_100000694054_100000210147 [0,1,0,1,0,0|2,0,0]=4 21126 B16R1.1424 CCSCCN1CCCCC1CCC(=O)O 269956a_100000694054_100000757381 [0,1,0,1,0,0|2,0,0]=4 21127 B16R1.1424 CN(C)CCC1CCCCN1CCCC=O 269982a_100000243220_200011292268 [0,1,0,1,0,0|2,0,0]=4 21128 B16R1.1424 COCCCC1CCCCN1CCC(=O)C 269982a_100011804088_100000053229 [0,1,0,1,0,0|2,0,0]=4 21129 B16R1.1424 COCCCC1CCCCN1CCC(=O)N 2230a_100011804088_100000744528 [0,1,0,1,0,0|2,0,0]=4 21130 B16R1.1424 COCCCC1CCCCN1CCC(=O)N 269982a_100011804088_100000744528 [0,1,0,1,0,0|2,0,0]=4 21131 B16R1.1424 COCCCC1CCCCN1CCC(=O)N 34a_100011804088_100000731001 [0,1,0,1,0,0|2,0,0]=4 21132 B16R1.1424 COCCCN1CCCCC1CCC(=O)O 269956a_100000694054_100000740836 [0,1,0,1,0,0|2,0,0]=4 21133 B16R1.1424 O=C(O)CCC1CCCCN1CCCCF 269956a_100000694054_100000729493 [0,1,0,1,0,0|2,0,0]=4 21134 B16R1.1424 O=C(O)CCC1CCCCN1CCCCO 269956a_100000694054_100000210776 [0,1,0,1,0,0|2,0,0]=4 21135 B16R1.1442 CCCCCC1CCCC1NCCC(=O)N 269862a_100000740010_200000198059 [0,1,0,1,0,0|1,0,0]=3 21136 B16R1.3900 C=CCCCCCN1CCCCC1C(C)C 2230a_100000757267_100000700193 [0,1,0,1,0,0|2,0,0]=4 21137 B16R1.3900 C=CCCCCCN1CCCCC1C(C)C 269982a_100000757267_100000700193 [0,1,0,1,0,0|2,0,0]=4 21138 B16R1.3900 C=CCCCCCN1CCCCC1C(C)C 34a_100000757267_100000700193 [0,1,0,1,0,0|2,0,0]=4 21139 B16R1.3900 C=CCCCCOC1CCCCC1C(C)C 34a_100011709184_100011215482 [0,1,0,1,0,0|2,0,0]=4 21140 B16R1.3900 C=CCCCCOC1CCCCC1C(C)C 7a_100011709184_100011215482 [0,1,0,1,0,0|2,0,0]=4 21141 B16R1.3900 CC(C)C1CCCCC1OCCCCC=O 7a_100011709184_100000139335 [0,1,0,1,0,0|1,0,0]=3 21142 B16R1.3900 CC(C)C1CCCCN1CCCCCC=O 2230a_100000757267_100000139337 [0,1,0,1,0,0|1,0,0]=3 21143 B16R1.3900 CC(C)C1CCCCN1CCCCCC=O 269982a_100000757267_100000139337 [0,1,0,1,0,0|1,0,0]=3 21144 B16R1.3900 CC(C)[C@H]1COCCN1CCCCCC=O 2230a_100025712635_100000139337 [0,1,0,1,0,0|2,0,0]=4 21145 B16R1.3900 CC(C)[C@H]1COCCN1CCCCCC=O 269982a_100025712635_100000139337 [0,1,0,1,0,0|2,0,0]=4 21146 B16R1.3900 CCCCCCCN1CCCCC1C(=O)N 2230a_100000181395_100000210681 [0,1,0,1,0,0|1,0,0]=3 21147 B16R1.3900 CCCCCCCN1CCCCC1C(=O)N 269982a_100000181395_100000210681 [0,1,0,1,0,0|1,0,0]=3 21148 B16R1.3900 CCCCCCCN1CCCCC1C(=O)N 34a_100000181395_100000210614 [0,1,0,1,0,0|1,0,0]=3 21149 B16R1.3900 CCCCCCCN1CCCC[C@@H]1C(=O)O 269956a_100000763471_100000210614 [0,1,0,1,0,0|1,0,0]=3 21150 B16R1.3900 CCCCCCCN1CCOC[C@@H]1C(=O)O 269956a_100016993156_100000210614 [0,1,0,1,0,0|2,0,0]=4 21151 B16R1.3900 CCCCCCCN1CCSCC1C(=O)O 269956a_100011346106_100000210614 [0,1,0,1,0,0|2,0,0]=4 21152 B16R1.3900 CCCCCCCN1CSCCC1C(=O)O 269956a_100015185162_100000210614 [0,1,0,1,0,0|2,0,0]=4 21153 B16R1.3900 CCCCCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100000210757 [0,1,0,1,0,0|1,0,0]=3 21154 B16R1.3900 CCCCOCCN1CCCCC1C(=O)N 2230a_100000181395_100000743108 [0,1,0,1,0,0|2,0,0]=4 21155 B16R1.3900 CCCCOCCN1CCCCC1C(=O)N 269982a_100000181395_100000743108 [0,1,0,1,0,0|2,0,0]=4 21156 B16R1.3900 CCCCOCCN1CCCCC1C(=O)N 34a_100000181395_100000743108 [0,1,0,1,0,0|2,0,0]=4 21157 B16R1.3900 CCCCOCCN1CCCC[C@@H]1C(=O)O 269956a_100000763471_100000743108 [0,1,0,1,0,0|2,0,0]=4 21158 B16R1.3900 CCCCOCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100011995733 [0,1,0,1,0,0|2,0,0]=4 21159 B16R1.3900 CCCOCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100011215938 [0,1,0,1,0,0|2,0,0]=4 21160 B16R1.3900 CCOCCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100012232248 [0,1,0,1,0,0|2,0,0]=4 21161 B16R1.3900 COCCCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100000730899 [0,1,0,1,0,0|2,0,0]=4 21162 B16R1.3900 NC(=O)C1CCCCN1CCCCCCF 2230a_100000181395_100015922095 [0,1,0,1,0,0|2,0,0]=4 21163 B16R1.3900 NC(=O)C1CCCCN1CCCCCCF 269982a_100000181395_100015922095 [0,1,0,1,0,0|2,0,0]=4 21164 B16R1.3900 NC(=O)C1CCCCN1CCCCCCF 34a_100000181395_100015922095 [0,1,0,1,0,0|2,0,0]=4 21165 B16R1.3900 NC(=O)C1CCCCN1CCCCCCO 2230a_100000181395_100000766143 [0,1,0,1,0,0|2,0,0]=4 21166 B16R1.3900 NC(=O)C1CCCCN1CCCCCCO 269982a_100000181395_100000766143 [0,1,0,1,0,0|2,0,0]=4 21167 B16R1.3900 NC(=O)C1CCCCN1CCCCCCO 34a_100000181395_100000766143 [0,1,0,1,0,0|2,0,0]=4 21168 B16R1.3900 O=C(O)[C@@H]1CCCC[C@H]1NCCCCCF 269956a_100009816435_100000729378 [0,1,0,1,0,0|2,0,0]=4 21169 B16R1.3900 O=C(O)[C@@H]1CCCC[C@H]1NCCCCCO 269956a_100009816435_100000746330 [0,1,0,1,0,0|2,0,0]=4 21170 B16R1.3900 O=C(O)[C@H]1CCCCN1CCCCCCF 269956a_100000763471_100015922095 [0,1,0,1,0,0|2,0,0]=4 21171 B16R1.3900 O=C(O)[C@H]1CCCCN1CCCCCCO 269956a_100000763471_100000766143 [0,1,0,1,0,0|2,0,0]=4 21172 B16R1.3904 C=CCCCCCN1CCCC1CC(C)C 2230a_100000748429_100000700193 [0,1,0,1,0,0|2,0,0]=4 21173 B16R1.3904 C=CCCCCCN1CCCC1CC(C)C 269982a_100000748429_100000700193 [0,1,0,1,0,0|2,0,0]=4 21174 B16R1.3904 C=CCCCCCN1CCCC1CC(C)C 34a_100000748429_100000700193 [0,1,0,1,0,0|2,0,0]=4 21175 B16R1.3904 CC(C)CC1CCCN1CCCCCC=O 2230a_100000748429_100000139337 [0,1,0,1,0,0|1,0,0]=3 21176 B16R1.3904 CC(C)CC1CCCN1CCCCCC=O 269982a_100000748429_100000139337 [0,1,0,1,0,0|1,0,0]=3 21177 B16R1.3904 CN(C)C[C@H]1CCCN1CCCCCC=O 269982a_200020645772_100000139337 [0,1,0,1,0,0|2,0,0]=4 21178 B16R1.4248 C=CCCCN1CCCCCC1CC(C)C 2230a_100000759364_100011713584 [0,1,0,1,0,0|2,0,0]=4 21179 B16R1.4248 C=CCCCN1CCCCCC1CC(C)C 269982a_100000759364_100000757094 [0,1,0,1,0,0|2,0,0]=4 21180 B16R1.4248 C=CCCCN1CCCCCC1CC(C)C 34a_100000759364_100000757094 [0,1,0,1,0,0|2,0,0]=4 21181 B16R1.4248 CC(C)CC1CCCCCN1CCCC=O 2230a_100000759364_200011292268 [0,1,0,1,0,0|1,0,0]=3 21182 B16R1.4248 CC(C)CC1CCCCCN1CCCC=O 269982a_100000759364_200011292268 [0,1,0,1,0,0|1,0,0]=3 21183 B16R1.4698 C=CCCCCCCCN1CCCC1(C)C 2230a_100000761399_100012355270 [0,1,0,1,0,0|2,0,0]=4 21184 B16R1.4698 C=CCCCCCCCN1CCCC1(C)C 269982a_100000761399_100012355270 [0,1,0,1,0,0|2,0,0]=4 21185 B16R1.4698 C=CCCCCCCCN1CCCC1(C)C 34a_100000761399_100012355270 [0,1,0,1,0,0|2,0,0]=4 21186 B16R1.4698 C=CCCCCCCN[C@@H]1CCC[C@@]1(C)O 2230a_100015977457_100011215473 [0,1,0,1,0,0|2,0,0]=4 21187 B16R1.4698 C=CCCCCCCN[C@@H]1CCC[C@@]1(C)O 34a_100015977457_100011215473 [0,1,0,1,0,0|2,0,0]=4 21188 B16R1.4698 C=CCCCCCCOC1CCCC1(C)C 34a_100000726220_100011215473 [0,1,0,1,0,0|2,0,0]=4 21189 B16R1.4698 C=CCCCCCCOC1CCCC1(C)C 7a_100000726220_100011215473 [0,1,0,1,0,0|2,0,0]=4 21190 B16R1.4698 CC1(CCCN1CCNCCCCC=O)C 2230a_100015204988_100000139335 [0,1,0,1,0,0|2,0,0]=4 21191 B16R1.5450 CCCCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000210211 [0,1,0,1,0,0|1,0,0]=3 21192 B16R1.5450 CCOCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000739092 [0,1,0,1,0,0|2,0,0]=4 21193 B16R1.5450 COCCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000233755 [0,1,0,1,0,0|2,0,0]=4 21194 B16R1.5450 CSCCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000212216 [0,1,0,1,0,0|2,0,0]=4 21195 B16R1.5450 O=C(O)[C@H]1CCCCCC[C@H]1NCCCF 269956a_200049070474_100011934791 [0,1,0,1,0,0|2,0,0]=4 21196 B16R1.5450 O=C(O)[C@H]1CCCCCC[C@H]1NCCCO 269956a_200049070474_100011215043 [0,1,0,1,0,0|2,0,0]=4 21197 B16R1.6689 O=CCCCCCNC1CCCCC1(F)F 2230a_100000686509_100000139337 [0,1,0,1,0,0|2,0,0]=4 21198 B16R1.6689 O=CCCCCCSC1CCCCC1(F)F 62a_100000139337_200009832135 [0,1,0,1,0,0|2,0,0]=4 21199 B16R1.6689 O=CCCCCCSC1CCCCC1(F)F 62a_200009832135_100000139337 [0,1,0,1,0,0|2,0,0]=4 21200 B16R1.6690 C=CCCCCCCN1CCCC1C(C)C 2230a_100000762757_100011215473 [0,1,0,1,0,0|2,0,0]=4 21201 B16R1.6690 C=CCCCCCCN1CCCC1C(C)C 269982a_100000762757_100011215473 [0,1,0,1,0,0|2,0,0]=4 21202 B16R1.6690 C=CCCCCCCN1CCCC1C(C)C 34a_100000762757_100011215473 [0,1,0,1,0,0|2,0,0]=4 21203 B16R1.6690 CCCCCCCCN1CCC[C@H]1C(=O)N 2230a_100000003125_100000210759 [0,1,0,1,0,0|1,0,0]=3 21204 B16R1.6690 CCCCCCCCN1CCC[C@H]1C(=O)O 269956a_100000743916_100000210759 [0,1,0,1,0,0|1,0,0]=3 21205 B16R1.6690 CCCCCCCCN1CCSC1C(=O)O 269956a_100000035718_100000210759 [0,1,0,1,0,0|2,0,0]=4 21206 B16R1.6690 CCCCCCCCN1CSC[C@H]1C(=O)O 269956a_100000743924_100000210759 [0,1,0,1,0,0|2,0,0]=4 21207 B16R1.6690 CCCCCCOC[C@@H]1CCCN1C(=O)N 34a_100012022907_100000210314 [0,1,0,1,0,0|2,0,0]=4 21208 B16R1.6690 CCCCCCOC[C@@H]1CCCN1C(=O)N 7a_100012022907_100000210314 [0,1,0,1,0,0|2,0,0]=4 21209 B16R1.6690 CCCCCCOC[C@H]1CCCN1C(=O)C 34a_100012242843_100000210314 [0,1,0,1,0,0|2,0,0]=4 21210 B16R1.6690 CCCCCCOC[C@H]1CCCN1C(=O)C 7a_100012242843_100000210314 [0,1,0,1,0,0|2,0,0]=4 21211 B16R1.6690 COCCCCCCN1CCC[C@H]1C(=O)N 2230a_100000003125_100011998445 [0,1,0,1,0,0|2,0,0]=4 21212 B16R1.6690 COCCCCCCN1CCC[C@H]1C(=O)O 269956a_100000743916_100011998445 [0,1,0,1,0,0|2,0,0]=4 21213 B16R1.6690 NC(=O)[C@@H]1CCCN1CCCCCCCO 2230a_100000003125_100000760002 [0,1,0,1,0,0|2,0,0]=4 21214 B16R1.6690 O=C(O)[C@@H]1CCCN1CCCCCCCO 269956a_100000743916_100000760002 [0,1,0,1,0,0|2,0,0]=4 21215 B16R1.7037 C=CCCCCN1CCCCCC1C(C)C 2230a_100000697956_100011215482 [0,1,0,1,0,0|2,0,0]=4 21216 B16R1.7037 C=CCCCCN1CCCCCC1C(C)C 269982a_100000697956_100011215482 [0,1,0,1,0,0|2,0,0]=4 21217 B16R1.7037 C=CCCCCN1CCCCCC1C(C)C 34a_100000697956_100011215482 [0,1,0,1,0,0|2,0,0]=4 21218 B16R1.7037 CC(C)C1CCCCCN1CCCCC=O 2230a_100000697956_100000139335 [0,1,0,1,0,0|1,0,0]=3 21219 B16R1.7037 CC(C)C1CCCCCN1CCCCC=O 269982a_100000697956_100000139335 [0,1,0,1,0,0|1,0,0]=3 21220 B16R1.7037 CCCCCCN1CCCCCC1C(=O)O 269956a_100000758484_100000210757 [0,1,0,1,0,0|1,0,0]=3 21221 B16R1.7037 CCCCOCN1CCCCCC1C(=O)O 269956a_100000758484_100011995733 [0,1,0,1,0,0|2,0,0]=4 21222 B16R1.7037 CCCOCCN1CCCCCC1C(=O)O 269956a_100000758484_100011215938 [0,1,0,1,0,0|2,0,0]=4 21223 B16R1.7037 CCOCCCN1CCCCCC1C(=O)O 269956a_100000758484_100012232248 [0,1,0,1,0,0|2,0,0]=4 21224 B16R1.7037 COCCCCN1CCCCCC1C(=O)O 269956a_100000758484_100000730899 [0,1,0,1,0,0|2,0,0]=4 21225 B16R1.7037 O=C(O)C1CCCCCN1CCCCCF 269956a_100000758484_100000729378 [0,1,0,1,0,0|2,0,0]=4 21226 B16R1.7037 O=C(O)C1CCCCCN1CCCCCO 269956a_100000758484_100000746330 [0,1,0,1,0,0|2,0,0]=4 21227 B16R1.7318 CC(C)CCCCCCCOC1CCC1=O 34a_200000210741_100009892977 [0,1,0,1,0,0|1,0,0]=3 21228 B16R1.7318 CC(C)CCCCCCCOC1CCC1=O 7a_200000210741_100009892977 [0,1,0,1,0,0|1,0,0]=3 21229 B16R1.7318 CC(C)CCCCCNCCC1CCC1=O 2230a_100011290863_200016118888 [0,1,0,1,0,0|1,0,0]=3 21230 B16R1.7318 CC(C)CCCCCOCCC1CCC1=O 7a_100011995859_200016118888 [0,1,0,1,0,0|1,0,0]=3 21231 B16R1.7318 CC(C)CCCCCSCCC1CCC1=O 62a_100000210682_200016118888 [0,1,0,1,0,0|1,0,0]=3 21232 B16R1.7318 CC(C)CCCCCSCCC1CCC1=O 62a_200016118888_100000210682 [0,1,0,1,0,0|1,0,0]=3 21233 B16R1.7318 CC(C)COCCCNCCC1CCC1=O 2230a_100000205972_200016118888 [0,1,0,1,0,0|2,0,0]=4 21234 B16R1.8402 C=CCCCCCCCOCC1CC1(C)C 34a_100000728257_100012355270 [0,1,0,1,0,0|2,0,0]=4 21235 B16R1.8402 C=CCCCCCCCOCC1CC1(C)C 7a_100000728257_100012355270 [0,1,0,1,0,0|2,0,0]=4 21236 B16R1.10873 CC(=O)C1CCCCCCCCCCC1=O 1458a_100000070787_200009990614 [0,1,0,1,0,0|0,0,1]=3 21237 B16R1.10873 CN(C)C1CCCCCCCCCCC1=O 2230a_100102631434_200009990614 [0,1,0,1,0,0|1,0,0]=3 21238 B16R1.10873 CN(C)C1CCCCCCCCCCC1=O 269982a_100102631434_200009990614 [0,1,0,1,0,0|1,0,0]=3 21239 B16R1.12272 CC(=O)CCCCN1CCCCCCCC1 269982a_100000039187_100000735457 [0,1,0,1,0,0|1,0,0]=3 21240 B16R1.12272 CC(=O)CCCCN1CCCCCCCC1 34a_100000039187_100009817362 [0,1,0,1,0,0|1,0,0]=3 21241 B16R1.12272 CC(=O)OCCCN1CCCCCCCC1 269982a_100000039187_100000042594 [0,1,0,1,0,0|2,0,0]=4 21242 B16R1.12272 CC(=O)OCCCN1CCCCCCCC1 34a_100000039187_100000042594 [0,1,0,1,0,0|2,0,0]=4 21243 B16R1.12272 CC(=O)SCCCN1CCCCCCCC1 2230a_100000039187_100000038929 [0,1,0,1,0,0|2,0,0]=4 21244 B16R1.12272 CC(=O)SCCCN1CCCCCCCC1 269982a_100000039187_100000038929 [0,1,0,1,0,0|2,0,0]=4 21245 B16R1.12272 CC(=O)SCCCN1CCCCCCCC1 34a_100000039187_100000038929 [0,1,0,1,0,0|2,0,0]=4 21246 B16R1.12272 CS(=O)CCCNC1CCCCCCCC1 270004a_200000753449_100000038600 [0,1,0,1,0,0|2,0,0]=4 21247 B16R1.12272 NC(=O)COCCN1CCCCCCCC1 2230a_100000039187_100000076697 [0,1,0,1,0,0|2,0,0]=4 21248 B16R1.12272 NC(=O)COCCN1CCCCCCCC1 269982a_100000039187_100000076697 [0,1,0,1,0,0|2,0,0]=4 21249 B16R1.12272 NC(=O)COCCN1CCCCCCCC1 34a_100000039187_100000076697 [0,1,0,1,0,0|2,0,0]=4 21250 B16R1.12321 CC(=O)NCCCCCCNCC1CCC1 2230a_200011996284_100000763275 [0,1,0,1,0,0|2,0,0]=4 21251 B16R1.12321 CC(=O)NCCCCCCNCC1CCC1 269862a_200011996284_100000753134 [0,1,0,1,0,0|2,0,0]=4 21252 B16R1.12321 CC(=O)NCCCCCCNCC1CCC1 34a_200011996284_100000763275 [0,1,0,1,0,0|2,0,0]=4 21253 B16R1.12321 CC(=O)SCCCCCCNCC1CCC1 269862a_100000704104_100000753134 [0,1,0,1,0,0|2,0,0]=4 21254 B16R1.12354 C=C(C)CCNCCC1CCCCCCC1 2230a_100011532352_100000730704 [0,1,0,1,0,0|2,0,0]=4 21255 B16R1.12354 C=C(C)CCNCCC1CCCCCCC1 34a_100011532352_100000730704 [0,1,0,1,0,0|2,0,0]=4 21256 B16R1.12354 CC(=O)CCCCNC1CCCCCCC1 34a_100000211152_100009817362 [0,1,0,1,0,0|1,0,0]=3 21257 B16R1.12354 CC(=O)CCCCOC1CCCCCCC1 34a_100000210054_100009817362 [0,1,0,1,0,0|1,0,0]=3 21258 B16R1.12354 CC(=O)CCCCOC1CCCCCCC1 7a_100000210054_100000735457 [0,1,0,1,0,0|1,0,0]=3 21259 B16R1.12354 CC(=O)CCCOCC1CCCCCCC1 34a_100011216312_100000685027 [0,1,0,1,0,0|1,0,0]=3 21260 B16R1.12354 CC(=O)CCCOCC1CCCCCCC1 7a_100011216312_100011215641 [0,1,0,1,0,0|1,0,0]=3 21261 B16R1.12354 CC(=O)NCCCNC1CCCCCCC1 270004a_100000736810_100000210524 [0,1,0,1,0,0|2,0,0]=4 21262 B16R1.12354 CC(=O)NCCOCC1CCCCCCC1 7a_100011216312_100000189650 [0,1,0,1,0,0|2,0,0]=4 21263 B16R1.12354 CC(=O)OCCCCN1CCCCCCC1 269982a_100000211400_100000033659 [0,1,0,1,0,0|2,0,0]=4 21264 B16R1.12354 CC(=O)OCCCCN1CCCCCCC1 34a_100000211400_100000033659 [0,1,0,1,0,0|2,0,0]=4 21265 B16R1.12354 CC(=O)OCCCNC1CCCCCCC1 34a_100000211152_100000042594 [0,1,0,1,0,0|2,0,0]=4 21266 B16R1.12354 CC(=O)OCCCOC1CCCCCCC1 34a_100000210054_100000042594 [0,1,0,1,0,0|2,0,0]=4 21267 B16R1.12354 CC(=O)OCCCOC1CCCCCCC1 7a_100000210054_100000042594 [0,1,0,1,0,0|2,0,0]=4 21268 B16R1.12354 CC(=O)OCCOCC1CCCCCCC1 34a_100011216312_100009814007 [0,1,0,1,0,0|2,0,0]=4 21269 B16R1.12354 CC(=O)OCCOCC1CCCCCCC1 7a_100011216312_100009814007 [0,1,0,1,0,0|2,0,0]=4 21270 B16R1.12354 CC(=O)OCNCCC1CCCCCCC1 34a_100011532352_100009813279 [0,1,0,1,0,0|2,0,0]=4 21271 B16R1.12354 CC(=O)SCCCCN1CCCCCCC1 2230a_100000211400_200010402107 [0,1,0,1,0,0|2,0,0]=4 21272 B16R1.12354 CC(=O)SCCCCN1CCCCCCC1 269982a_100000211400_200010402107 [0,1,0,1,0,0|2,0,0]=4 21273 B16R1.12354 CC(=O)SCCCCN1CCCCCCC1 34a_100000211400_200010402107 [0,1,0,1,0,0|2,0,0]=4 21274 B16R1.12354 CC(=O)SCCCNC1CCCCCCC1 2230a_100000211152_100000038929 [0,1,0,1,0,0|2,0,0]=4 21275 B16R1.12354 CC(=O)SCCCNC1CCCCCCC1 34a_100000211152_100000038929 [0,1,0,1,0,0|2,0,0]=4 21276 B16R1.12354 CC(=O)SCCCOC1CCCCCCC1 34a_100000210054_100000038929 [0,1,0,1,0,0|2,0,0]=4 21277 B16R1.12354 CC(=O)SCCCOC1CCCCCCC1 7a_100000210054_100000038929 [0,1,0,1,0,0|2,0,0]=4 21278 B16R1.12354 CC(C)CCCCOC1C=CCCCCC1 34a_100000688657_100011216152 [0,1,0,1,0,0|2,0,0]=4 21279 B16R1.12354 NC(=O)CCCCCN1CCCCCCC1 2230a_100000211400_100009817443 [0,1,0,1,0,0|1,0,0]=3 21280 B16R1.12354 NC(=O)CCCCCN1CCCCCCC1 269982a_100000211400_100009817443 [0,1,0,1,0,0|1,0,0]=3 21281 B16R1.12354 NC(=O)CCCCCN1CCCCCCC1 34a_100000211400_100009817443 [0,1,0,1,0,0|1,0,0]=3 21282 B16R1.12354 NC(=O)CCCCNC1CCCCCCC1 270004a_100000696515_100000210524 [0,1,0,1,0,0|1,0,0]=3 21283 B16R1.12354 NC(=O)CCCOCC1CCCCCCC1 34a_100011216312_100102525003 [0,1,0,1,0,0|1,0,0]=3 21284 B16R1.12354 NC(=O)CCCOCC1CCCCCCC1 7a_100011216312_100102525003 [0,1,0,1,0,0|1,0,0]=3 21285 B16R1.12354 NC(=O)CCNCCC1CCCCCCC1 2230a_100011532352_100000744528 [0,1,0,1,0,0|1,0,0]=3 21286 B16R1.12354 NC(=O)CCNCCC1CCCCCCC1 34a_100011532352_100000731001 [0,1,0,1,0,0|1,0,0]=3 21287 B16R1.12354 NC(=O)COCCNC1CCCCCCC1 2230a_100000211152_100000076697 [0,1,0,1,0,0|2,0,0]=4 21288 B16R1.12354 NC(=O)COCCNC1CCCCCCC1 34a_100000211152_100000076697 [0,1,0,1,0,0|2,0,0]=4 21289 B16R1.12354 NC(=O)COCCOC1CCCCCCC1 34a_100000210054_100000076697 [0,1,0,1,0,0|2,0,0]=4 21290 B16R1.12354 NC(=O)COCCOC1CCCCCCC1 7a_100000210054_100000076697 [0,1,0,1,0,0|2,0,0]=4 21291 B16R1.12354 NC(=O)NCCOCC1CCCCCCC1 7a_100011216312_200000034859 [0,1,0,1,0,0|2,0,0]=4 21292 B16R1.12354 NC(=O)OCCOCC1CCCCCCC1 34a_100011216312_200011214921 [0,1,0,1,0,0|2,0,0]=4 21293 B16R1.12354 NC(=O)OCCOCC1CCCCCCC1 7a_100011216312_200011214921 [0,1,0,1,0,0|2,0,0]=4 21294 B16R1.17540 CCCCCCCCCN1CCC1C(=O)O 269956a_100000021838_100000210670 [0,1,0,1,0,0|1,0,0]=3 21295 B16R1.17540 O=C(O)C1CCN1CCCCCCCCO 269956a_100000021838_100000033203 [0,1,0,1,0,0|2,0,0]=4 21296 B16R1.18063 CC(=O)NCCCCCCNCCC1CC1 2230a_200011996284_100000694398 [0,1,0,1,0,0|2,0,0]=4 21297 B16R1.18063 CC(=O)NCCCCCCNCCC1CC1 34a_200011996284_100000694398 [0,1,0,1,0,0|2,0,0]=4 21298 B16R1.18095 CC(=O)CCCCNCC1CCCCCC1 34a_100015204231_100009817362 [0,1,0,1,0,0|1,0,0]=3 21299 B16R1.18095 CC(=O)CCCCOCC1CCCCCC1 34a_100000699130_100009817362 [0,1,0,1,0,0|1,0,0]=3 21300 B16R1.18095 CC(=O)CCCCOCC1CCCCCC1 7a_100000699130_100000735457 [0,1,0,1,0,0|1,0,0]=3 21301 B16R1.18095 CC(=O)CCCCSCC1CCCCCC1 62a_100000735457_200000696569 [0,1,0,1,0,0|1,0,0]=3 21302 B16R1.18095 CC(=O)CCCCSCC1CCCCCC1 62a_200000696569_100000735457 [0,1,0,1,0,0|1,0,0]=3 21303 B16R1.18095 CC(=O)CCCNCCC1CCCCCC1 34a_100011532351_100000685027 [0,1,0,1,0,0|1,0,0]=3 21304 B16R1.18095 CC(=O)CCCOCCN1CCCCCC1 34a_100000238007_100000685027 [0,1,0,1,0,0|2,0,0]=4 21305 B16R1.18095 CC(=O)CCCOCCN1CCCCCC1 7a_100000759063_100000722644 [0,1,0,1,0,0|2,0,0]=4 21306 B16R1.18095 CC(=O)CCCSCCN1CCCCCC1 62a_100000722644_100011215641 [0,1,0,1,0,0|2,0,0]=4 21307 B16R1.18095 CC(=O)CCCSCCN1CCCCCC1 62a_100011215641_100000722644 [0,1,0,1,0,0|2,0,0]=4 21308 B16R1.18095 CC(=O)CCOCCCN1CCCCCC1 7a_100102886287_100000053229 [0,1,0,1,0,0|2,0,0]=4 21309 B16R1.18095 CC(=O)NCCCCNC1CCCCCC1 270004a_200011368371_100000210131 [0,1,0,1,0,0|2,0,0]=4 21310 B16R1.18095 CC(=O)NCCCCNC1CCCCCC1 34a_200011368371_100011217769 [0,1,0,1,0,0|2,0,0]=4 21311 B16R1.18095 CC(=O)NCCCNCC1CCCCCC1 269862a_100000736810_200000763224 [0,1,0,1,0,0|2,0,0]=4 21312 B16R1.18095 CC(=O)NCCCNCC1CCCCCC1 34a_100000736810_200000696569 [0,1,0,1,0,0|2,0,0]=4 21313 B16R1.18095 CC(=O)NCCCOCC1CCCCCC1 34a_100000752032_200000696569 [0,1,0,1,0,0|2,0,0]=4 21314 B16R1.18095 CC(=O)NCCNCCC1CCCCCC1 2230a_100011532351_100000189650 [0,1,0,1,0,0|2,0,0]=4 21315 B16R1.18095 CC(=O)OCCCCCN1CCCCCC1 2230a_100000185865_100009813381 [0,1,0,1,0,0|2,0,0]=4 21316 B16R1.18095 CC(=O)OCCCCCN1CCCCCC1 269982a_100000185865_100000033007 [0,1,0,1,0,0|2,0,0]=4 21317 B16R1.18095 CC(=O)OCCCCCN1CCCCCC1 34a_100000185865_100000033007 [0,1,0,1,0,0|2,0,0]=4 21318 B16R1.18095 CC(=O)OCCCCNC1CCCCCC1 34a_100000210984_100000033659 [0,1,0,1,0,0|2,0,0]=4 21319 B16R1.18095 CC(=O)OCCCCOC1CCCCCC1 34a_100000073216_100011217769 [0,1,0,1,0,0|2,0,0]=4 21320 B16R1.18095 CC(=O)OCCCCOC1CCCCCC1 34a_100000210887_100000033659 [0,1,0,1,0,0|2,0,0]=4 21321 B16R1.18095 CC(=O)OCCCCOC1CCCCCC1 7a_100000210887_100000033659 [0,1,0,1,0,0|2,0,0]=4 21322 B16R1.18095 CC(=O)OCCCCSC1CCCCCC1 62a_100000033659_100011217769 [0,1,0,1,0,0|2,0,0]=4 21323 B16R1.18095 CC(=O)OCCCCSC1CCCCCC1 62a_100011217769_100000033659 [0,1,0,1,0,0|2,0,0]=4 21324 B16R1.18095 CC(=O)OCCCNCC1CCCCCC1 34a_100015204231_100000042594 [0,1,0,1,0,0|2,0,0]=4 21325 B16R1.18095 CC(=O)OCCCOCC1CCCCCC1 34a_100000699130_100000042594 [0,1,0,1,0,0|2,0,0]=4 21326 B16R1.18095 CC(=O)OCCCOCC1CCCCCC1 7a_100000699130_100000042594 [0,1,0,1,0,0|2,0,0]=4 21327 B16R1.18095 CC(=O)OCCCSCC1CCCCCC1 62a_100000042594_200000696569 [0,1,0,1,0,0|2,0,0]=4 21328 B16R1.18095 CC(=O)OCCCSCC1CCCCCC1 62a_200000696569_100000042594 [0,1,0,1,0,0|2,0,0]=4 21329 B16R1.18095 CC(=O)OCCNCCC1CCCCCC1 34a_100011532351_100009814007 [0,1,0,1,0,0|2,0,0]=4 21330 B16R1.18095 CC(=O)SCCCCNC1CCCCCC1 2230a_100000210984_200010402107 [0,1,0,1,0,0|2,0,0]=4 21331 B16R1.18095 CC(=O)SCCCCNC1CCCCCC1 34a_100000210984_200010402107 [0,1,0,1,0,0|2,0,0]=4 21332 B16R1.18095 CC(=O)SCCCCOC1CCCCCC1 34a_100000210887_200010402107 [0,1,0,1,0,0|2,0,0]=4 21333 B16R1.18095 CC(=O)SCCCCOC1CCCCCC1 7a_100000210887_200010402107 [0,1,0,1,0,0|2,0,0]=4 21334 B16R1.18095 CC(=O)SCCCCSC1CCCCCC1 62a_100011217769_200010402107 [0,1,0,1,0,0|2,0,0]=4 21335 B16R1.18095 CC(=O)SCCCCSC1CCCCCC1 62a_200010402107_100011217769 [0,1,0,1,0,0|2,0,0]=4 21336 B16R1.18095 CC(=O)SCCCNCC1CCCCCC1 2230a_100015204231_100000038929 [0,1,0,1,0,0|2,0,0]=4 21337 B16R1.18095 CC(=O)SCCCNCC1CCCCCC1 34a_100015204231_100000038929 [0,1,0,1,0,0|2,0,0]=4 21338 B16R1.18095 CC(=O)SCCCOCC1CCCCCC1 34a_100000699130_100000038929 [0,1,0,1,0,0|2,0,0]=4 21339 B16R1.18095 CC(=O)SCCCOCC1CCCCCC1 7a_100000699130_100000038929 [0,1,0,1,0,0|2,0,0]=4 21340 B16R1.18095 CC(=O)SCCCSCC1CCCCCC1 62a_100000038929_200000696569 [0,1,0,1,0,0|2,0,0]=4 21341 B16R1.18095 CC(=O)SCCCSCC1CCCCCC1 62a_200000696569_100000038929 [0,1,0,1,0,0|2,0,0]=4 21342 B16R1.18095 NC(=O)CCCCCNC1CCCCCC1 2230a_100000210984_100009817443 [0,1,0,1,0,0|1,0,0]=3 21343 B16R1.18095 NC(=O)CCCCCNC1CCCCCC1 34a_100000210984_100009817443 [0,1,0,1,0,0|1,0,0]=3 21344 B16R1.18095 NC(=O)CCCCCOC1CCCCCC1 34a_100000123541_100011217769 [0,1,0,1,0,0|1,0,0]=3 21345 B16R1.18095 NC(=O)CCCCCOC1CCCCCC1 34a_100000210887_100009817443 [0,1,0,1,0,0|1,0,0]=3 21346 B16R1.18095 NC(=O)CCCCCOC1CCCCCC1 7a_100000210887_100009817443 [0,1,0,1,0,0|1,0,0]=3 21347 B16R1.18095 NC(=O)CCCCCSC1CCCCCC1 62a_100009817443_100011217769 [0,1,0,1,0,0|1,0,0]=3 21348 B16R1.18095 NC(=O)CCCCCSC1CCCCCC1 62a_100011217769_100009817443 [0,1,0,1,0,0|1,0,0]=3 21349 B16R1.18095 NC(=O)CCCCNCC1CCCCCC1 269862a_100000696515_200000763224 [0,1,0,1,0,0|1,0,0]=3 21350 B16R1.18095 NC(=O)CCCCNCC1CCCCCC1 34a_100000696515_200000696569 [0,1,0,1,0,0|1,0,0]=3 21351 B16R1.18095 NC(=O)CCCCOCC1CCCCCC1 34a_100012022536_200000696569 [0,1,0,1,0,0|1,0,0]=3 21352 B16R1.18095 NC(=O)CCCCOCC1CCCCCC1 7a_100012022536_200000696569 [0,1,0,1,0,0|1,0,0]=3 21353 B16R1.18095 NC(=O)CCCNCCC1CCCCCC1 34a_100011532351_100102525003 [0,1,0,1,0,0|1,0,0]=3 21354 B16R1.18095 NC(=O)CCCOCCN1CCCCCC1 34a_100000238007_100102525003 [0,1,0,1,0,0|2,0,0]=4 21355 B16R1.18095 NC(=O)CCCSCCN1CCCCCC1 62a_100000722644_100102525003 [0,1,0,1,0,0|2,0,0]=4 21356 B16R1.18095 NC(=O)CCCSCCN1CCCCCC1 62a_100102525003_100000722644 [0,1,0,1,0,0|2,0,0]=4 21357 B16R1.18095 NC(=O)CCOCCCN1CCCCCC1 34a_100102886287_100000731001 [0,1,0,1,0,0|2,0,0]=4 21358 B16R1.18095 NC(=O)CCOCCCN1CCCCCC1 7a_100102886287_100000744528 [0,1,0,1,0,0|2,0,0]=4 21359 B16R1.18095 NC(=O)COCCCCN1CCCCCC1 34a_100011305542_100000187820 [0,1,0,1,0,0|2,0,0]=4 21360 B16R1.18095 NC(=O)COCCNCC1CCCCCC1 2230a_100015204231_100000076697 [0,1,0,1,0,0|2,0,0]=4 21361 B16R1.18095 NC(=O)COCCNCC1CCCCCC1 34a_100015204231_100000076697 [0,1,0,1,0,0|2,0,0]=4 21362 B16R1.18095 NC(=O)COCCOCC1CCCCCC1 34a_100000699130_100000076697 [0,1,0,1,0,0|2,0,0]=4 21363 B16R1.18095 NC(=O)COCCOCC1CCCCCC1 7a_100000699130_100000076697 [0,1,0,1,0,0|2,0,0]=4 21364 B16R1.18095 NC(=O)COCCSCC1CCCCCC1 62a_100000076697_200000696569 [0,1,0,1,0,0|2,0,0]=4 21365 B16R1.18095 NC(=O)COCCSCC1CCCCCC1 62a_200000696569_100000076697 [0,1,0,1,0,0|2,0,0]=4 21366 B16R1.18095 NC(=O)NCCNCCC1CCCCCC1 2230a_100011532351_200000034859 [0,1,0,1,0,0|2,0,0]=4 21367 B16R1.18095 NC(=O)OCCNCCC1CCCCCC1 34a_100011532351_200011214921 [0,1,0,1,0,0|2,0,0]=4 21368 B16R1.18095 O=C(O)COCCNCC1CCCCCC1 269956a_100000700818_200000696569 [0,1,0,1,0,0|2,0,0]=4 21369 B16R1.18095 O=C([O-])COCCCCN1CCCCCC1 34a_100011305542_100020667443 [0,1,0,1,0,0|2,0,0]=4 21370 B16R1.18095 O=[N+]([O-])CCCCOCC1CCCCCC1 34a_200015379883_200000696569 [0,1,0,1,0,0|2,0,0]=4 21371 B16R1.18095 O=[N+]([O-])CCCCOCC1CCCCCC1 7a_200015379883_200000696569 [0,1,0,1,0,0|2,0,0]=4 21372 B16R1.18167 CC(=O)NC1CCCCCCCCCCC1 11a_100011194316_100015343762 [0,1,0,1,0,0|1,0,0]=3 21373 B16R1.18167 CC(=O)NC1CCCCCCCCCCC1 1626a_100011194316_100015343762 [0,1,0,1,0,0|1,0,0]=3 21374 B16R1.18167 CC(=O)NC1CCCCCCCCCCC1 240690a_100011194316_100015343762 [0,1,0,1,0,0|1,0,0]=3 21375 B16R1.18167 CC(=O)NC1CCCCCCCCCCC1 527a_100011194316_100103153847 [0,1,0,1,0,0|1,0,0]=3 21376 B16R1.709 C=CCCCCCCCC(=O)C1CCCC1 1458a_100000210718_100012355270 [0,1,0,1,0,0|1,0,1]=4 21377 B16R1.709 C=CCCCCCCCC(=O)C1CCCC1 1458a_100011216160_100000179811 [0,1,0,1,0,0|1,0,1]=4 21378 B16R1.709 C=CCCCCCCCN(C)C1CCCC1 2230a_100000207505_100012355270 [0,1,0,1,0,0|2,0,0]=4 21379 B16R1.709 C=CCCCCCCCN(C)C1CCCC1 269982a_100000207505_100012355270 [0,1,0,1,0,0|2,0,0]=4 21380 B16R1.709 C=CCCCCCCCN(C)C1CCCC1 34a_100000207505_100012355270 [0,1,0,1,0,0|2,0,0]=4 21381 B16R1.709 C=CCCCCCCNC(C)C1CCCC1 2230a_100015185923_100011215473 [0,1,0,1,0,0|2,0,0]=4 21382 B16R1.709 C=CCCCCCCNC(C)C1CCCC1 34a_100015185923_100011215473 [0,1,0,1,0,0|2,0,0]=4 21383 B16R1.709 C=CCCCCCCOC(C)C1CCCC1 34a_100011216366_100011215473 [0,1,0,1,0,0|2,0,0]=4 21384 B16R1.709 C=CCCCCCCOC(C)C1CCCC1 7a_100011216366_100011215473 [0,1,0,1,0,0|2,0,0]=4 21385 B16R1.709 CC(CCOCCCCC=O)N1CCCC1 7a_100011935070_100000139335 [0,1,0,1,0,0|2,0,0]=4 21386 B16R1.709 CC(CSCCCCCC=O)N1CCCC1 62a_100000139337_200015187269 [0,1,0,1,0,0|2,0,0]=4 21387 B16R1.709 CC(CSCCCCCC=O)N1CCCC1 62a_200015187269_100000139337 [0,1,0,1,0,0|2,0,0]=4 21388 B16R1.1409 COCCCC1CCCN(C1)CCCC=O 2230a_200011934583_200011292268 [0,1,0,1,0,0|2,0,0]=4 21389 B16R1.1409 COCCCC1CCCN(C1)CCCC=O 269982a_200011934583_200011292268 [0,1,0,1,0,0|2,0,0]=4 21390 B16R1.1694 C=CCCCC(=O)CCCC1CCCCC1 1458a_100000211478_100000757094 [0,1,0,1,0,0|1,0,1]=4 21391 B16R1.1694 C=CCCCC(=O)CCCC1CCCCC1 1458a_100000766728_100011713725 [0,1,0,1,0,0|1,0,1]=4 21392 B16R1.1695 CCCCCC(=O)CN1CCCCCC1=O 1458a_100000181294_100000210326 [0,1,0,1,0,0|1,0,1]=4 21393 B16R1.1695 CCCCCC(C)NC1CCCCNC1=O 2230a_100000211957_100000735217 [0,1,0,1,0,0|2,0,0]=4 21394 B16R1.1695 CCCCCC(C)NC1CCCCNC1=O 2230a_100000698827_200011218191 [0,1,0,1,0,0|2,0,0]=4 21395 B16R1.1695 CCCCCC(C)NC1CCCCNC1=O 270004a_100000698827_100000211708 [0,1,0,1,0,0|2,0,0]=4 21396 B16R1.1695 CCCCCC(C)NC1CCCCNC1=O 34a_100000698827_200011218191 [0,1,0,1,0,0|2,0,0]=4 21397 B16R1.1695 CCCCCC(C)OC1CCCCCC1=O 7a_100011215632_100000243696 [0,1,0,1,0,0|1,0,0]=3 21398 B16R1.1695 CCCCCC(C)OC1CCCCNC1=O 7a_100011215632_100000735217 [0,1,0,1,0,0|2,0,0]=4 21399 B16R1.1695 CCCCCC(C)SC1CCCCCC1=O 62a_100000243696_200011218191 [0,1,0,1,0,0|1,0,0]=3 21400 B16R1.1695 CCCCCC(C)SC1CCCCCC1=O 62a_200011218191_100000243696 [0,1,0,1,0,0|1,0,0]=3 21401 B16R1.1695 CCCCCC(C)SC1CCCCNC1=O 62a_100000735217_200011218191 [0,1,0,1,0,0|2,0,0]=4 21402 B16R1.1695 CCCCCC(C)SC1CCCCNC1=O 62a_200011218191_100000735217 [0,1,0,1,0,0|2,0,0]=4 21403 B16R1.1695 COCCCC(C)OC1CCCCCC1=O 7a_200011539412_100000243696 [0,1,0,1,0,0|2,0,0]=4 21404 B16R1.1696 CC1CCCCN1CCN(C)CCCC=O 2230a_200011233311_200011292268 [0,1,0,1,0,0|2,0,0]=4 21405 B16R1.1696 CC1CCCCN1CCN(C)CCCC=O 269982a_200011233311_200011292268 [0,1,0,1,0,0|2,0,0]=4 21406 B16R1.1696 CCCCCC(=O)CCN1CCCCC1=O 1458a_100011236303_100000210326 [0,1,0,1,0,0|1,0,1]=4 21407 B16R1.1696 CCCCCC(=O)COC1CCCCC1=O 34a_100011214950_200012276598 [0,1,0,1,0,0|1,0,1]=4 21408 B16R1.1696 CCCCCC(=O)CSC1CCCCC1=O 62a_100000204591_200012276598 [0,1,0,1,0,0|1,0,1]=4 21409 B16R1.1696 CCCCCC(=O)CSC1CCCCC1=O 62a_200012276598_100000204591 [0,1,0,1,0,0|1,0,1]=4 21410 B16R1.1696 CCCCCC(C)OCC1CCCCC1=O 34a_100009861125_200011218191 [0,1,0,1,0,0|1,0,0]=3 21411 B16R1.1696 CCCCCC(C)OCC1CCCCC1=O 7a_100009861125_200011218191 [0,1,0,1,0,0|1,0,0]=3 21412 B16R1.1696 NCCCC[C@H](N)COC1CCCCC1=O 34a_100016993712_100000754470 [0,1,0,1,0,0|2,0,0]=4 21413 B16R1.1731 C=CCC1CCCCC1N(C)CCCCC 270004a_100000223495_100011214939 [0,1,0,1,0,0|2,0,0]=4 21414 B16R1.3424 CN(CCCC=O)CCN1CCCCCC1 269982a_106744473495_200011292268 [0,1,0,1,0,0|2,0,0]=4 21415 B16R1.3660 CCCCCC(C)OC1C=CCCCCC1 34a_100000688657_200011218191 [0,1,0,1,0,0|2,0,0]=4 21416 B16R1.7377 CCCCCC(C)NCCN1CCCC1=O 2230a_100000211957_100000739059 [0,1,0,1,0,0|2,0,0]=4 21417 B16R1.7377 CCCCCC(C)NCCN1CCCC1=O 2230a_100011200922_200011218191 [0,1,0,1,0,0|2,0,0]=4 21418 B16R1.7377 CCCCCC(C)NCCN1CCCC1=O 270004a_100011200922_100000211708 [0,1,0,1,0,0|2,0,0]=4 21419 B16R1.7377 CCCCCC(C)OCCN1CCCC1=O 34a_100000211209_200011218191 [0,1,0,1,0,0|2,0,0]=4 21420 B16R1.7377 CCCCCC(C)OCCN1CCCC1=O 34a_100011215632_100000739059 [0,1,0,1,0,0|2,0,0]=4 21421 B16R1.7377 CCCCCC(C)OCCN1CCCC1=O 7a_100000211209_200011218191 [0,1,0,1,0,0|2,0,0]=4 21422 B16R1.7377 CCCCCC(C)OCCN1CCCC1=O 7a_100011215632_100000739059 [0,1,0,1,0,0|2,0,0]=4 21423 B16R1.7377 CCCCCC(C)SCCN1CCCC1=O 62a_100000739059_200011218191 [0,1,0,1,0,0|2,0,0]=4 21424 B16R1.7377 CCCCCC(C)SCCN1CCCC1=O 62a_200011218191_100000739059 [0,1,0,1,0,0|2,0,0]=4 21425 B16R1.7390 CCCCCC(=O)CSCCC1CCC1=O 62a_200012276598_200016118888 [0,1,0,1,0,0|1,0,1]=4 21426 B16R1.7390 CCCCCC(=O)CSCCC1CCC1=O 62a_200016118888_200012276598 [0,1,0,1,0,0|1,0,1]=4 21427 B16R1.13656 C=CCCCCCCCC(=O)C1CC1CC 1458a_200011661523_100012355270 [0,1,0,1,0,0|1,0,1]=4 21428 B16R1.13658 C=CCCCCCCCC(=O)CC1CCC1 1458a_100000763092_100012355270 [0,1,0,1,0,0|1,0,1]=4 21429 B16R1.13658 C=CCCCCCCCC(=O)CC1CCC1 1458a_100011216160_100000763275 [0,1,0,1,0,0|1,0,1]=4 21430 B16R1.13658 C=CCCCCCCCN(C)CC1CCC1 2230a_200000750244_100012355270 [0,1,0,1,0,0|2,0,0]=4 21431 B16R1.13658 C=CCCCCCCCN(C)CC1CCC1 269982a_200000750244_100012355270 [0,1,0,1,0,0|2,0,0]=4 21432 B16R1.13658 C=CCCCCCCCN(C)CC1CCC1 34a_200000750244_100012355270 [0,1,0,1,0,0|2,0,0]=4 21433 B16R1.13659 C=CCCCCCCCC(=O)CCC1CC1 1458a_100000756386_100012355270 [0,1,0,1,0,0|1,0,1]=4 21434 B16R1.13659 C=CCCCCCCCC(=O)CCC1CC1 1458a_100011216160_100000694398 [0,1,0,1,0,0|1,0,1]=4 21435 B16R1.13660 CCCCCCCCCC(=O)C1CCC1=O 1458a_100000210558_100009892977 [0,1,0,1,0,0|0,0,1]=3 21436 B16R1.13660 CCCCCCCCCN(C)C1CCC1=O 269982a_100000232482_100009892977 [0,1,0,1,0,0|1,0,0]=3 21437 B16R1.27197 C=CCCCCCCNC1(CCCCC1)C 2230a_100000741114_100011215473 [0,1,0,1,0,0|2,0,0]=4 21438 B16R1.27197 C=CCCCCCCNC1(CCCCC1)C 34a_100000741114_100011215473 [0,1,0,1,0,0|2,0,0]=4 21439 B16R1.27197 C=CCCCCCCOC1(CCCCC1)C 34a_100011215885_100011215473 [0,1,0,1,0,0|2,0,0]=4 21440 B16R1.27197 C=CCCCCCCOC1(CCCCC1)C 7a_100011215885_100011215473 [0,1,0,1,0,0|2,0,0]=4 21441 B16R1.27197 C=CCCCCCNCC1(CCCCC1)C 2230a_100000706052_100000700193 [0,1,0,1,0,0|2,0,0]=4 21442 B16R1.27197 C=CCCCCCNCC1(CCCCC1)C 34a_100000706052_100000700193 [0,1,0,1,0,0|2,0,0]=4 21443 B16R1.27197 C=CCCCCCNCC1(CCCCC1)O 2230a_100000748649_100000700193 [0,1,0,1,0,0|2,0,0]=4 21444 B16R1.27197 C=CCCCCCNCC1(CCCCC1)O 34a_100000748649_100000700193 [0,1,0,1,0,0|2,0,0]=4 21445 B16R1.27197 C=CCCCCCOCC1(CCCCC1)C 34a_100000688186_100000700193 [0,1,0,1,0,0|2,0,0]=4 21446 B16R1.27197 C=CCCCCCOCC1(CCCCC1)C 7a_100000688186_100000700193 [0,1,0,1,0,0|2,0,0]=4 21447 B16R1.27197 C=CCCCCCOCC1(CCCCC1)F 34a_100000090305_100000700193 [0,1,0,1,0,0|2,0,0]=4 21448 B16R1.27197 C=CCCCCCOCC1(CCCCC1)F 7a_100000090305_100000700193 [0,1,0,1,0,0|2,0,0]=4 21449 B16R1.27197 C=CCCCCCOCC1(CCCCC1)N 34a_100000740034_100000700193 [0,1,0,1,0,0|2,0,0]=4 21450 B16R1.27197 C=CCCCCNCCC1(CCCCC1)O 2230a_100102740465_100011215482 [0,1,0,1,0,0|2,0,0]=4 21451 B16R1.27197 C=CCCCCNCCC1(CCCCC1)O 34a_100102740465_100011215482 [0,1,0,1,0,0|2,0,0]=4 21452 B16R1.27197 CC1(CCCCC1)CNCCCCCC=O 2230a_100000706052_100000139337 [0,1,0,1,0,0|1,0,0]=3 21453 B16R1.27197 CC1(CCCCC1)COCCCCCC=O 7a_100000688186_100000139337 [0,1,0,1,0,0|1,0,0]=3 21454 B16R1.27197 CC1(CCOCC1)CNCCCCCC=O 2230a_100000695556_100000139337 [0,1,0,1,0,0|2,0,0]=4 21455 B16R1.27197 CC1(CCOCC1)COCCCCCC=O 7a_100000704393_100000139337 [0,1,0,1,0,0|2,0,0]=4 21456 B16R1.27197 O=CCCCCCNCC1(CCCCC1)O 2230a_100000748649_100000139337 [0,1,0,1,0,0|1,0,0]=3 21457 B16R1.27197 O=CCCCCCNCC1(CCOCC1)F 2230a_100016991512_100000139337 [0,1,0,1,0,0|2,0,0]=4 21458 B16R1.27197 O=CCCCCCNCC1(CCOCC1)O 2230a_100000704115_100000139337 [0,1,0,1,0,0|2,0,0]=4 21459 B16R1.27197 O=CCCCCCNCC1(CCSCC1)O 2230a_100000758141_100000139337 [0,1,0,1,0,0|2,0,0]=4 21460 B16R1.27197 O=CCCCCCOCC1(CCCCC1)F 7a_100000090305_100000139337 [0,1,0,1,0,0|1,0,0]=3 21461 B16R1.27197 O=CCCCCNCCC1(CCCCC1)O 2230a_100102740465_100000139335 [0,1,0,1,0,0|1,0,0]=3 21462 B16R1.43510 C=CCCCCCCN1C(CCCC1C)C 2230a_100000210447_100011215473 [0,1,0,1,0,0|2,0,0]=4 21463 B16R1.43510 C=CCCCCCCN1C(CCCC1C)C 269982a_100000210447_100011215473 [0,1,0,1,0,0|2,0,0]=4 21464 B16R1.43510 C=CCCCCCCN1C(CCCC1C)C 34a_100000210447_100011215473 [0,1,0,1,0,0|2,0,0]=4 21465 B16R1.43510 C=CCCCCCOC1C(CCCC1C)C 34a_100011218088_100000700193 [0,1,0,1,0,0|2,0,0]=4 21466 B16R1.43510 C=CCCCCCOC1C(CCCC1C)C 7a_100011218088_100000700193 [0,1,0,1,0,0|2,0,0]=4 21467 B16R1.43510 CC1CCCC(C1OCCCCCC=O)C 7a_100011218088_100000139337 [0,1,0,1,0,0|1,0,0]=3 21468 B16R1.43510 CC1CCCC(N1CCNCCCC=O)C 2230a_100000749955_200011292268 [0,1,0,1,0,0|2,0,0]=4 21469 B16R1.43510 CC1CCCC(N1CCOCCCC=O)C 7a_100011305576_200011292268 [0,1,0,1,0,0|2,0,0]=4 21470 B16R1.43510 CCCCCCCNC1C(=O)CCCC1=O 2230a_100000229938_100009814513 [0,1,0,1,0,0|1,0,1]=4 21471 B16R1.43510 CCCCCCCOC1C(=O)CCCC1=O 7a_100000210272_100009814513 [0,1,0,1,0,0|1,0,1]=4 21472 B16R1.43510 CCCCCCCSC1C(=O)CCCC1=O 62a_100000210614_100009814513 [0,1,0,1,0,0|1,0,1]=4 21473 B16R1.43510 CCCCCCCSC1C(=O)CCCC1=O 62a_100009814513_100000210316 [0,1,0,1,0,0|1,0,1]=4 21474 B16R1.258 C=CCCCCCOC1CCC(CC1C)C 34a_100011539931_100000700193 [0,1,0,1,0,0|2,0,0]=4 21475 B16R1.258 C=CCCCCCOC1CCC(CC1C)C 7a_100011539931_100000700193 [0,1,0,1,0,0|2,0,0]=4 21476 B16R1.258 CC1CCC(C(C1)C)OCCCCCC=O 7a_100011539931_100000139337 [0,1,0,1,0,0|1,0,0]=3 21477 B16R1.889 CCCC(C)CCCOC1CCCCC1=O 34a_100011713154_100000754470 [0,1,0,1,0,0|1,0,0]=3 21478 B16R1.889 CCCC(C)CCCOC1CCCCC1=O 7a_100011713154_100000204591 [0,1,0,1,0,0|1,0,0]=3 21479 B16R1.889 CCCC(C)CCCOC1CCCNC1=O 34a_100011713154_100000687798 [0,1,0,1,0,0|2,0,0]=4 21480 B16R1.889 CCCC(C)CCCOC1CCCNC1=O 7a_100011713154_100000687798 [0,1,0,1,0,0|2,0,0]=4 21481 B16R1.889 CCCC(C)CCCOC1COCCC1=O 34a_100011713154_100012180262 [0,1,0,1,0,0|2,0,0]=4 21482 B16R1.889 CCCC(C)CCCOC1COCCC1=O 7a_100011713154_100012180262 [0,1,0,1,0,0|2,0,0]=4 21483 B16R1.889 CCCC(C)CNCCN1CCCCC1=O 2230a_100160573077_100011216630 [0,1,0,1,0,0|2,0,0]=4 21484 B16R1.889 CCCC(C)CNCCN1CCCCC1=O 270004a_100160573077_100000243154 [0,1,0,1,0,0|2,0,0]=4 21485 B16R1.889 CCCC(C)CNCCN1CCCCC1=O 34a_100160573077_100011216630 [0,1,0,1,0,0|2,0,0]=4 21486 B16R1.932 C=CCC(C)COCCCC1CCCCC1 34a_100009832082_100011713725 [0,1,0,1,0,0|2,0,0]=4 21487 B16R1.932 C=CCC(C)COCCCC1CCCCC1 7a_100009832082_100011713725 [0,1,0,1,0,0|2,0,0]=4 21488 B16R1.932 C=CC[C@@H](N)COCCCC1CCCCC1 34a_100020615467_100011713725 [0,1,0,1,0,0|2,0,0]=4 21489 B16R1.947 CCCC(C)CCOC1CCCCCC1=O 7a_100011217855_100000243696 [0,1,0,1,0,0|1,0,0]=3 21490 B16R1.947 CCCC(C)CCOC1CCCCNC1=O 7a_100011217855_100000735217 [0,1,0,1,0,0|2,0,0]=4 21491 B16R1.4695 CCCCCCCCNC1CC(OC1=O)C 2230a_100000229939_200000216747 [0,1,0,1,0,0|2,0,0]=4 21492 B16R1.4695 CCCCCCCCNC1CC(OC1=O)C 34a_100000229939_200000216747 [0,1,0,1,0,0|2,0,0]=4 21493 B16R1.4695 CCCCCCCCOC1CC(OC1=O)C 34a_100000210232_200000216747 [0,1,0,1,0,0|2,0,0]=4 21494 B16R1.4695 CCCCCCCCOC1CC(OC1=O)C 7a_100000210232_200000216747 [0,1,0,1,0,0|2,0,0]=4 21495 B16R1.4695 CCCCCCCCSC1CC(OC1=O)C 62a_100000210759_200000216747 [0,1,0,1,0,0|2,0,0]=4 21496 B16R1.4695 CCCCCCCCSC1CC(OC1=O)C 62a_200000216747_100000210317 [0,1,0,1,0,0|2,0,0]=4 21497 B16R1.14009 CCCC(C)CCOCCN1CCCC1=O 34a_100011217855_100000739059 [0,1,0,1,0,0|2,0,0]=4 21498 B16R1.14009 CCCC(C)CCOCCN1CCCC1=O 7a_100011217855_100000739059 [0,1,0,1,0,0|2,0,0]=4 21499 B16R1.14009 CCCC(C)CNCCCN1CCCC1=O 2230a_100000210347_100011216630 [0,1,0,1,0,0|2,0,0]=4 21500 B16R1.14009 CCCC(C)CNCCCN1CCCC1=O 270004a_100000210347_100000243154 [0,1,0,1,0,0|2,0,0]=4 21501 B16R1.14009 CCCC(C)CNCCCN1CCCC1=O 34a_100000210347_100011216630 [0,1,0,1,0,0|2,0,0]=4 21502 B16R1.14009 CCCC(C)COCCCN1CCCC1=O 34a_100011216539_100011216630 [0,1,0,1,0,0|2,0,0]=4 21503 B16R1.14009 CCCC(C)COCCCN1CCCC1=O 7a_100011216539_100011216630 [0,1,0,1,0,0|2,0,0]=4 21504 B16R1.14009 CCC[C@H](N)CCOCCN1CCCC1=O 34a_100015193777_100000739059 [0,1,0,1,0,0|2,0,0]=4 21505 B16R1.14018 CCCC(C)CCCOCCC1CCC1=O 7a_100011713154_200016118888 [0,1,0,1,0,0|1,0,0]=3 21506 B16R1.17465 C=CCN(C)C1CCCC1CCCCCC 270004a_100000225617_100000189428 [0,1,0,1,0,0|2,0,0]=4 21507 B16R1.20656 C=CCCCCCCCCCC(=O)C1CC1 1458a_100000210395_100009814027 [0,1,0,1,0,0|1,0,1]=4 21508 B16R1.20656 C=CCCCCCCCCCN(C)C1CC1 2230a_100000226674_100009814027 [0,1,0,1,0,0|2,0,0]=4 21509 B16R1.20656 C=CCCCCCCCCCN(C)C1CC1 269982a_100000226674_100009814027 [0,1,0,1,0,0|2,0,0]=4 21510 B16R1.20656 C=CCCCCCCCCNC(C)C1CC1 2230a_100000700016_100011933949 [0,1,0,1,0,0|2,0,0]=4 21511 B16R1.20656 C=CCCCCCCCCNC(C)C1CC1 34a_100000700016_100011933949 [0,1,0,1,0,0|2,0,0]=4 21512 B16R1.20656 C=CCCCCCCCCOC(C)C1CC1 34a_100000744524_100011933949 [0,1,0,1,0,0|2,0,0]=4 21513 B16R1.20656 C=CCCCCCCCCOC(C)C1CC1 7a_100000744524_100011933949 [0,1,0,1,0,0|2,0,0]=4 21514 B16R1.20656 C=CCCCCCCCNCC(O)C1CC1 2230a_100000751198_100012355270 [0,1,0,1,0,0|2,0,0]=4 21515 B16R1.20656 C=CCCCCCCCNCC(O)C1CC1 34a_100000751198_100012355270 [0,1,0,1,0,0|2,0,0]=4 21516 B16R1.20656 C=CCCCCCCCOC[C@H](N)C1CC1 34a_100020623730_100012355270 [0,1,0,1,0,0|2,0,0]=4 21517 B16R1.27196 C=CCCCCCCCCNC1(CCC1)C 2230a_100000692455_100011933949 [0,1,0,1,0,0|2,0,0]=4 21518 B16R1.27196 C=CCCCCCCCCNC1(CCC1)C 34a_100000692455_100011933949 [0,1,0,1,0,0|2,0,0]=4 21519 B16R1.27196 C=CCCCCCCCCOC1(CCC1)C 34a_100000759064_100011933949 [0,1,0,1,0,0|2,0,0]=4 21520 B16R1.27196 C=CCCCCCCCCOC1(CCC1)C 7a_100000759064_100011933949 [0,1,0,1,0,0|2,0,0]=4 21521 B16R1.27196 C=CCCCCCCCNCC1(CCC1)C 2230a_100000706607_100012355270 [0,1,0,1,0,0|2,0,0]=4 21522 B16R1.27196 C=CCCCCCCCNCC1(CCC1)O 2230a_100000752638_100012355270 [0,1,0,1,0,0|2,0,0]=4 21523 B16R1.27196 C=CCCCCCCCOCC1(CCC1)C 34a_100000730831_100000726658 [0,1,0,1,0,0|2,0,0]=4 21524 B16R1.27196 C=CCCCCCCCOCC1(CCC1)C 7a_100000730831_100000726658 [0,1,0,1,0,0|2,0,0]=4 21525 B16R1.27196 C=CCCCCCCCSCC1(CCC1)C 62a_100000726658_100012355270 [0,1,0,1,0,0|2,0,0]=4 21526 B16R1.27196 C=CCCCCCCCSCC1(CCC1)C 62a_100012355270_100000726658 [0,1,0,1,0,0|2,0,0]=4 21527 B16R1.88294 CC1CN(CCCN1CCCCCC=O)C 269982a_100011935175_100000139337 [0,1,0,1,0,0|2,0,0]=4 21528 B16R1.1401 CCC1CN(CCN1CCCCCC=O)C 2230a_100011941019_100000139337 [0,1,0,1,0,0|2,0,0]=4 21529 B16R1.1401 CCC1CN(CCN1CCCCCC=O)C 269982a_100011941019_100000139337 [0,1,0,1,0,0|2,0,0]=4 21530 B16R1.1453 CCCCC(=O)CCN1CCCCCC1=O 1458a_200011207554_100000210211 [0,1,0,1,0,0|1,0,1]=4 21531 B16R1.1453 CCCCC(C)COC1CCCCCC1=O 7a_100011995851_100000243696 [0,1,0,1,0,0|1,0,0]=3 21532 B16R1.1453 CCCCC(C)COC1CCCCNC1=O 7a_100011995851_100000735217 [0,1,0,1,0,0|2,0,0]=4 21533 B16R1.1465 C=CCCC(=O)CCCCC1CCCCC1 1458a_200011215547_100000754431 [0,1,0,1,0,0|1,0,1]=4 21534 B16R1.1465 C=CCCC(C)NCCCC1CCCCC1 270004a_100011211642_100000762624 [0,1,0,1,0,0|2,0,0]=4 21535 B16R1.1465 C=CCCC(C)OCCCC1CCCCC1 34a_100000765329_100011713725 [0,1,0,1,0,0|2,0,0]=4 21536 B16R1.1465 C=CCCC(C)OCCCC1CCCCC1 7a_100000765329_100011713725 [0,1,0,1,0,0|2,0,0]=4 21537 B16R1.1973 C=CCC1CCCCC1NC(C)CCCC 269862a_100000126638_100011214939 [0,1,0,1,0,0|2,0,0]=4 21538 B16R1.1973 C=CCC1CCCCC1NC(C)CCCC 270004a_100000126638_100011214939 [0,1,0,1,0,0|2,0,0]=4 21539 B16R1.4237 C=CCCN(C)C1CCCC1CCCCC 270004a_100020639649_200000198059 [0,1,0,1,0,0|2,0,0]=4 21540 B16R1.4473 CCCCC(=O)CCCN1CCCCC1=O 1458a_100011236284_100000210211 [0,1,0,1,0,0|1,0,1]=4 21541 B16R1.4473 CCCCC(C)NCCN1CCCCC1=O 2230a_100160573077_200011215066 [0,1,0,1,0,0|2,0,0]=4 21542 B16R1.4473 CCCCC(C)NCCN1CCCCC1=O 270004a_100160573077_100000210087 [0,1,0,1,0,0|2,0,0]=4 21543 B16R1.4473 CCCCC(C)NCCN1CCCCC1=O 34a_100160573077_200011215066 [0,1,0,1,0,0|2,0,0]=4 21544 B16R1.6681 C=CCCCCCOC1CC(CCC1C)C 34a_100011217446_100000700193 [0,1,0,1,0,0|2,0,0]=4 21545 B16R1.6681 C=CCCCCCOC1CC(CCC1C)C 7a_100011217446_100000700193 [0,1,0,1,0,0|2,0,0]=4 21546 B16R1.6681 CC1CCC(C(C1)OCCCCCC=O)C 7a_100011217446_100000139337 [0,1,0,1,0,0|1,0,0]=3 21547 B16R1.7333 CCCCC(C)COCCN1CCCC1=O 34a_100011995851_100000739059 [0,1,0,1,0,0|2,0,0]=4 21548 B16R1.7333 CCCCC(C)COCCN1CCCC1=O 7a_100011995851_100000739059 [0,1,0,1,0,0|2,0,0]=4 21549 B16R1.7333 CCCCC(C)NCCCN1CCCC1=O 2230a_100000210347_200011215066 [0,1,0,1,0,0|2,0,0]=4 21550 B16R1.7333 CCCCC(C)NCCCN1CCCC1=O 270004a_100000210347_100000210087 [0,1,0,1,0,0|2,0,0]=4 21551 B16R1.7333 CCCCC(C)NCCCN1CCCC1=O 34a_100000210347_200011215066 [0,1,0,1,0,0|2,0,0]=4 21552 B16R1.7333 CCCCC(C)OCCCN1CCCC1=O 34a_100011216539_200011215066 [0,1,0,1,0,0|2,0,0]=4 21553 B16R1.7333 CCCCC(C)OCCCN1CCCC1=O 7a_100011216539_200011215066 [0,1,0,1,0,0|2,0,0]=4 21554 B16R1.7333 CCCC[C@H](N)COCCN1CCCC1=O 34a_100011934283_100000739059 [0,1,0,1,0,0|2,0,0]=4 21555 B16R1.7343 CCCCC(C)CCCCOC1CCC1=O 34a_200011021034_100009892977 [0,1,0,1,0,0|1,0,0]=3 21556 B16R1.7343 CCCCC(C)CCCCOC1CCC1=O 7a_200011021034_100009892977 [0,1,0,1,0,0|1,0,0]=3 21557 B16R1.8360 C=CCCCCCCCN1C(CCC1C)C 2230a_100000687148_100012355270 [0,1,0,1,0,0|2,0,0]=4 21558 B16R1.8360 C=CCCCCCCCN1C(CCC1C)C 269982a_100000687148_100012355270 [0,1,0,1,0,0|2,0,0]=4 21559 B16R1.8360 C=CCCCCCCCN1C(CCC1C)C 34a_100000687148_100012355270 [0,1,0,1,0,0|2,0,0]=4 21560 B16R1.8360 CCCCCCCCNC1C(=O)CCC1=O 2230a_100000229939_100009820769 [0,1,0,1,0,0|1,0,1]=4 21561 B16R1.8360 CCCCCCCCOC1C(=O)CCC1=O 7a_100000210232_100009820769 [0,1,0,1,0,0|1,0,1]=4 21562 B16R1.8360 CCCCCCCCSC1C(=O)CCC1=O 62a_100000210759_100009820769 [0,1,0,1,0,0|1,0,1]=4 21563 B16R1.8360 CCCCCCCCSC1C(=O)CCC1=O 62a_100009820769_100000210317 [0,1,0,1,0,0|1,0,1]=4 21564 B16R1.18042 C=CCCCCCCCCC(=O)C1CCC1 1458a_100000209988_100011933949 [0,1,0,1,0,0|1,0,1]=4 21565 B16R1.18042 C=CCCCCCCCCC(=O)C1CCC1 1458a_100000211349_100000749161 [0,1,0,1,0,0|1,0,1]=4 21566 B16R1.18042 C=CCCCCCCCCN(C)C1CCC1 2230a_100000758072_100011933949 [0,1,0,1,0,0|2,0,0]=4 21567 B16R1.18042 C=CCCCCCCCCN(C)C1CCC1 269982a_100000758072_100011933949 [0,1,0,1,0,0|2,0,0]=4 21568 B16R1.18042 C=CCCCCCCCCN(C)C1CCC1 34a_100000758072_100011933949 [0,1,0,1,0,0|2,0,0]=4 21569 B16R1.18042 C=CCCCCCCCNC(C)C1CCC1 2230a_100016994624_100012355270 [0,1,0,1,0,0|2,0,0]=4 21570 B16R1.18042 C=CCCCCCCCNC(C)C1CCC1 34a_100016994624_100012355270 [0,1,0,1,0,0|2,0,0]=4 21571 B16R1.18042 C=CCCCCCCCOC(C)C1CCC1 34a_100000766398_100012355270 [0,1,0,1,0,0|2,0,0]=4 21572 B16R1.18042 C=CCCCCCCCOC(C)C1CCC1 7a_100000766398_100012355270 [0,1,0,1,0,0|2,0,0]=4 21573 B16R1.18044 C=CCCCCCCCCC(=O)CC1CC1 1458a_100000211349_100000742324 [0,1,0,1,0,0|1,0,1]=4 21574 B16R1.18044 C=CCCCCCCCCC(=O)CC1CC1 1458a_100000738066_100011933949 [0,1,0,1,0,0|1,0,1]=4 21575 B16R1.18044 C=CCCCCCCCCN(C)CC1CC1 2230a_100000741881_100011933949 [0,1,0,1,0,0|2,0,0]=4 21576 B16R1.18044 C=CCCCCCCCCN(C)CC1CC1 269982a_100000741881_100011933949 [0,1,0,1,0,0|2,0,0]=4 21577 B16R1.20903 C=CCCC(C)NCCC1CCCCCC1 270004a_100011532351_100000762624 [0,1,0,1,0,0|2,0,0]=4 21578 B16R1.36992 C=CCCCCCCCOC1(CCCC1)C 34a_100000751722_100012355270 [0,1,0,1,0,0|2,0,0]=4 21579 B16R1.36992 C=CCCCCCCCOC1(CCCC1)C 7a_100000751722_100012355270 [0,1,0,1,0,0|2,0,0]=4 21580 B16R1.36992 C=CCCCCCCNCC1(CCCC1)O 2230a_100000737848_100011215473 [0,1,0,1,0,0|2,0,0]=4 21581 B16R1.36992 C=CCCCCCCOCC1(CCCC1)N 34a_100000749328_100011215473 [0,1,0,1,0,0|2,0,0]=4 21582 B16R1.36992 C=CCCCCCNCCC1(CCCC1)O 34a_100000719956_100000700193 [0,1,0,1,0,0|2,0,0]=4 21583 B16R1.88231 C=CCCCCCCCCC(=O)C1CC1C 1458a_100000211227_100011933949 [0,1,0,1,0,0|1,0,1]=4 21584 B16R2.59 O=CCN1CCCC1CN2CCCCC2 2230a_200000725506_200015260668 [0,0,0,2,0,0|2,0,0]=4 21585 B16R2.59 O=CCN1CCCC1CN2CCCCC2 269982a_200000725506_200015260668 [0,0,0,2,0,0|2,0,0]=4 21586 B16R2.69 O=C1CCCCCC1OC2CCCCC2 7a_100000210231_100000243696 [0,0,0,2,0,0|1,0,0]=3 21587 B16R2.69 O=C1CCCCCC1OC2CCCSC2 7a_100015962668_100000243696 [0,0,0,2,0,0|2,0,0]=4 21588 B16R2.69 O=C1CCCCCC1OC2CCSCC2 7a_100000731022_100000243696 [0,0,0,2,0,0|2,0,0]=4 21589 B16R2.69 O=C1CCCCCC1SC2CCCCC2 62a_100000210327_100000243696 [0,0,0,2,0,0|1,0,0]=3 21590 B16R2.69 O=C1CCCCCC1SC2CCCCC2 62a_100000243696_100000210327 [0,0,0,2,0,0|1,0,0]=3 21591 B16R2.69 O=C1CCCCCC1SC2CCCOC2 62a_100000243696_100000693364 [0,0,0,2,0,0|2,0,0]=4 21592 B16R2.69 O=C1CCCCCC1SC2CCOCC2 62a_100000243696_100011324220 [0,0,0,2,0,0|2,0,0]=4 21593 B16R2.69 O=C1CCCCCC1SC2CCSCC2 62a_100000243696_100000069128 [0,0,0,2,0,0|2,0,0]=4 21594 B16R2.69 O=C1NCCCCC1NC2CCCCC2 2230a_100000182618_100000735217 [0,0,0,2,0,0|2,0,0]=4 21595 B16R2.69 O=C1NCCCCC1NC2CCCCC2 270004a_100000698827_100000210434 [0,0,0,2,0,0|2,0,0]=4 21596 B16R2.69 O=C1NCCCCC1NC2CCCCC2 34a_100000698827_100000210327 [0,0,0,2,0,0|2,0,0]=4 21597 B16R2.69 O=C1NCCCCC1OC2CCCCC2 7a_100000210231_100000735217 [0,0,0,2,0,0|2,0,0]=4 21598 B16R2.69 O=C1NCCCCC1SC2CCCCC2 62a_100000210327_100000735217 [0,0,0,2,0,0|2,0,0]=4 21599 B16R2.69 O=C1NCCCCC1SC2CCCCC2 62a_100000735217_100000210327 [0,0,0,2,0,0|2,0,0]=4 21600 B16R2.71 O=C1CCCCC1COC2CCCCC2 34a_100009861125_100000210327 [0,0,0,2,0,0|1,0,0]=3 21601 B16R2.71 O=C1CCCCC1COC2CCCCC2 7a_100009861125_100000210327 [0,0,0,2,0,0|1,0,0]=3 21602 B16R2.71 O=C1CCCCC1COC2CCCOC2 34a_100009861125_100000693364 [0,0,0,2,0,0|2,0,0]=4 21603 B16R2.71 O=C1CCCCC1COC2CCCOC2 7a_100009861125_100000693364 [0,0,0,2,0,0|2,0,0]=4 21604 B16R2.71 O=C1CCCCC1COC2CCOCC2 7a_100009861125_100000686592 [0,0,0,2,0,0|2,0,0]=4 21605 B16R2.71 O=C1CCCCC1COC2CCSCC2 34a_100009861125_100000069128 [0,0,0,2,0,0|2,0,0]=4 21606 B16R2.71 O=C1CCCCC1COC2CCSCC2 7a_100009861125_100011500858 [0,0,0,2,0,0|2,0,0]=4 21607 B16R2.71 O=C1CCCCC1NCC2CCCCC2 34a_100000210473_100000754470 [0,0,0,2,0,0|1,0,0]=3 21608 B16R2.71 O=C1CCCCC1NCC2CCCCO2 34a_100000174945_100000754470 [0,0,0,2,0,0|2,0,0]=4 21609 B16R2.71 O=C1CCCCC1NCC2CCCOC2 34a_100000720124_100000754470 [0,0,0,2,0,0|2,0,0]=4 21610 B16R2.71 O=C1CCCCC1NCC2CCOCC2 34a_100000746373_100000754470 [0,0,0,2,0,0|2,0,0]=4 21611 B16R2.71 O=C1CCCCC1NCC2CCSCC2 34a_100015188806_100000754470 [0,0,0,2,0,0|2,0,0]=4 21612 B16R2.71 O=C1CCCCC1OCC2CCCCC2 34a_100000212181_100000754470 [0,0,0,2,0,0|1,0,0]=3 21613 B16R2.71 O=C1CCCCC1OCC2CCCCC2 34a_100011214950_100000211423 [0,0,0,2,0,0|1,0,0]=3 21614 B16R2.71 O=C1CCCCC1OCC2CCCCC2 7a_100000212181_100000204591 [0,0,0,2,0,0|1,0,0]=3 21615 B16R2.71 O=C1CCCCC1OCC2CCCCN2 34a_100000210821_100000754470 [0,0,0,2,0,0|2,0,0]=4 21616 B16R2.71 O=C1CCCCC1OCC2CCCCO2 34a_100000211370_100000754470 [0,0,0,2,0,0|2,0,0]=4 21617 B16R2.71 O=C1CCCCC1OCC2CCCCO2 34a_100011214950_100000211543 [0,0,0,2,0,0|2,0,0]=4 21618 B16R2.71 O=C1CCCCC1OCC2CCCCO2 7a_100000211370_100000204591 [0,0,0,2,0,0|2,0,0]=4 21619 B16R2.71 O=C1CCCCC1OCC2CCCNC2 34a_100000211344_100000754470 [0,0,0,2,0,0|2,0,0]=4 21620 B16R2.71 O=C1CCCCC1OCC2CCCOC2 34a_100000741520_100000754470 [0,0,0,2,0,0|2,0,0]=4 21621 B16R2.71 O=C1CCCCC1OCC2CCCOC2 34a_100011214950_100000741521 [0,0,0,2,0,0|2,0,0]=4 21622 B16R2.71 O=C1CCCCC1OCC2CCNCC2 34a_100000738675_100000754470 [0,0,0,2,0,0|2,0,0]=4 21623 B16R2.71 O=C1CCCCC1OCC2CCOCC2 34a_100000749013_100000754470 [0,0,0,2,0,0|2,0,0]=4 21624 B16R2.71 O=C1CCCCC1OCC2CCOCC2 34a_100011214950_100000754603 [0,0,0,2,0,0|2,0,0]=4 21625 B16R2.71 O=C1CCCCC1OCC2CCSCC2 34a_100000070558_100000754470 [0,0,0,2,0,0|2,0,0]=4 21626 B16R2.71 O=C1CCCCC1OCC2CCSCC2 7a_100000070558_100000204591 [0,0,0,2,0,0|2,0,0]=4 21627 B16R2.71 O=C1CCCCC1SCC2CCCCC2 62a_100000204591_100000211423 [0,0,0,2,0,0|1,0,0]=3 21628 B16R2.71 O=C1CCCCC1SCC2CCCCC2 62a_100000211423_100000204591 [0,0,0,2,0,0|1,0,0]=3 21629 B16R2.71 O=C1CCCCC1SCC2CCCCO2 62a_100000204591_100000211543 [0,0,0,2,0,0|2,0,0]=4 21630 B16R2.71 O=C1CCCCC1SCC2CCCCO2 62a_100000211543_100000204591 [0,0,0,2,0,0|2,0,0]=4 21631 B16R2.71 O=C1CCCCC1SCC2CCCOC2 62a_100000204591_100000741521 [0,0,0,2,0,0|2,0,0]=4 21632 B16R2.71 O=C1CCCCC1SCC2CCCOC2 62a_100000741521_100000204591 [0,0,0,2,0,0|2,0,0]=4 21633 B16R2.71 O=C1CCCCC1SCC2CCOCC2 62a_100000204591_100000749018 [0,0,0,2,0,0|2,0,0]=4 21634 B16R2.71 O=C1CCCCC1SCC2CCOCC2 62a_100000754603_100000204591 [0,0,0,2,0,0|2,0,0]=4 21635 B16R2.71 O=C1CCOCC1NCC2CCCCC2 34a_100000210473_100012180262 [0,0,0,2,0,0|2,0,0]=4 21636 B16R2.71 O=C1CCOCC1OCC2CCCCC2 34a_100000212181_100012180262 [0,0,0,2,0,0|2,0,0]=4 21637 B16R2.71 O=C1CCOCC1OCC2CCCCC2 7a_100000212181_100012180262 [0,0,0,2,0,0|2,0,0]=4 21638 B16R2.71 O=C1CCOCC1SCC2CCCCC2 62a_100000211423_100012180262 [0,0,0,2,0,0|2,0,0]=4 21639 B16R2.71 O=C1CCOCC1SCC2CCCCC2 62a_100012180262_100000211423 [0,0,0,2,0,0|2,0,0]=4 21640 B16R2.71 O=C1NCCCC1NCC2CCCCC2 2230a_100000210473_100000687798 [0,0,0,2,0,0|2,0,0]=4 21641 B16R2.71 O=C1NCCCC1NCC2CCCCC2 2230a_100000747585_100000211423 [0,0,0,2,0,0|2,0,0]=4 21642 B16R2.71 O=C1NCCCC1NCC2CCCCC2 34a_100000210473_100000687798 [0,0,0,2,0,0|2,0,0]=4 21643 B16R2.71 O=C1NCCCC1NCC2CCCCC2 34a_100000747585_100000211423 [0,0,0,2,0,0|2,0,0]=4 21644 B16R2.71 O=C1NCCCC1OCC2CCCCC2 34a_100000073722_100000211423 [0,0,0,2,0,0|2,0,0]=4 21645 B16R2.71 O=C1NCCCC1OCC2CCCCC2 34a_100000212181_100000687798 [0,0,0,2,0,0|2,0,0]=4 21646 B16R2.71 O=C1NCCCC1OCC2CCCCC2 7a_100000212181_100000687798 [0,0,0,2,0,0|2,0,0]=4 21647 B16R2.71 O=C1NCCCC1SCC2CCCCC2 62a_100000211423_100000687798 [0,0,0,2,0,0|2,0,0]=4 21648 B16R2.71 O=C1NCCCC1SCC2CCCCC2 62a_100000687798_100000211423 [0,0,0,2,0,0|2,0,0]=4 21649 B16R2.98 C=CCN1CCCCC1C2CCCCC2 2230a_100011219272_100000210623 [0,0,0,2,0,0|2,0,0]=4 21650 B16R2.98 C=CCN1CCCCC1C2CCCCC2 269982a_100011219272_100000210623 [0,0,0,2,0,0|2,0,0]=4 21651 B16R2.98 C=CCN1CCCCC1C2CCCCC2 34a_100011219272_100015514636 [0,0,0,2,0,0|2,0,0]=4 21652 B16R2.98 CCCC1CCCCN1C2C=CCCC2 2230a_100000701414_100000751183 [0,0,0,2,0,0|2,0,0]=4 21653 B16R2.98 CCCC1CCCCN1C2C=CCCC2 269982a_100000701414_100000751183 [0,0,0,2,0,0|2,0,0]=4 21654 B16R2.98 O=CCN1CCCCC1C2CCCCC2 2230a_100011219272_200015260668 [0,0,0,2,0,0|1,0,0]=3 21655 B16R2.98 O=CCN1CCCCC1C2CCCCC2 269982a_100011219272_200015260668 [0,0,0,2,0,0|1,0,0]=3 21656 B16R2.98 O=CCN1CCCCC1C2CCCCC2 34a_100011219272_200009817547 [0,0,0,2,0,0|1,0,0]=3 21657 B16R2.98 O=CCN1CCOC[C@@H]1C2CCCCC2 2230a_100015984746_200015260668 [0,0,0,2,0,0|2,0,0]=4 21658 B16R2.98 O=CCN1CCOC[C@@H]1C2CCCCC2 269982a_100015984746_200015260668 [0,0,0,2,0,0|2,0,0]=4 21659 B16R2.98 O=CCN1CCOC[C@@H]1C2CCCCC2 34a_100015984746_200009817547 [0,0,0,2,0,0|2,0,0]=4 21660 B16R2.156 C=CCCN1CCCC1C2CCCCC2 2230a_100011206067_100000754431 [0,0,0,2,0,0|2,0,0]=4 21661 B16R2.156 C=CCCN1CCCC1C2CCCCC2 269982a_100011206067_100000754431 [0,0,0,2,0,0|2,0,0]=4 21662 B16R2.156 C=CCCN1CCCC1C2CCCCC2 34a_100011206067_100000754431 [0,0,0,2,0,0|2,0,0]=4 21663 B16R2.172 CCC1CCCCC1OC2C=CCCC2 7a_100000210738_100000751183 [0,0,0,2,0,0|2,0,0]=4 21664 B16R2.179 O=CCCCN1CCOC12CCCCC2 269982a_200015422347_200011292268 [0,0,0,2,0,0|2,0,0]=4 21665 B16R2.279 O=C1CCC1CCNCC2CCCCC2 2230a_100000210473_200016118888 [0,0,0,2,0,0|1,0,0]=3 21666 B16R2.279 O=C1CCC1CCNCC2CCCCO2 2230a_100000174945_200016118888 [0,0,0,2,0,0|2,0,0]=4 21667 B16R2.279 O=C1CCC1CCNCC2CCCOC2 2230a_100000720124_200016118888 [0,0,0,2,0,0|2,0,0]=4 21668 B16R2.279 O=C1CCC1CCNCC2CCOCC2 2230a_100000746373_200016118888 [0,0,0,2,0,0|2,0,0]=4 21669 B16R2.279 O=C1CCC1CCNCC2CCSCC2 2230a_100015188806_200016118888 [0,0,0,2,0,0|2,0,0]=4 21670 B16R2.279 O=C1CCC1CCOCC2CCCCC2 7a_100000212181_200016118888 [0,0,0,2,0,0|1,0,0]=3 21671 B16R2.279 O=C1CCC1CCOCC2CCCCO2 7a_100000211370_200016118888 [0,0,0,2,0,0|2,0,0]=4 21672 B16R2.279 O=C1CCC1CCOCC2CCSCC2 7a_100000070558_200016118888 [0,0,0,2,0,0|2,0,0]=4 21673 B16R2.279 O=C1CCC1CCSCC2CCCCC2 62a_100000211423_200016118888 [0,0,0,2,0,0|1,0,0]=3 21674 B16R2.279 O=C1CCC1CCSCC2CCCCC2 62a_200016118888_100000211423 [0,0,0,2,0,0|1,0,0]=3 21675 B16R2.279 O=C1CCC1CCSCC2CCCCO2 62a_100000211543_200016118888 [0,0,0,2,0,0|2,0,0]=4 21676 B16R2.279 O=C1CCC1CCSCC2CCCCO2 62a_200016118888_100000211543 [0,0,0,2,0,0|2,0,0]=4 21677 B16R2.279 O=C1CCC1CCSCC2CCCOC2 62a_100000741521_200016118888 [0,0,0,2,0,0|2,0,0]=4 21678 B16R2.279 O=C1CCC1CCSCC2CCCOC2 62a_200016118888_100000741521 [0,0,0,2,0,0|2,0,0]=4 21679 B16R2.279 O=C1CCC1CCSCC2CCOCC2 62a_100000754603_200016118888 [0,0,0,2,0,0|2,0,0]=4 21680 B16R2.279 O=C1CCC1CCSCC2CCOCC2 62a_200016118888_100000749018 [0,0,0,2,0,0|2,0,0]=4 21681 B16R2.279 O=C1CCC1NCCCC2CCCCC2 34a_100011211642_100009892977 [0,0,0,2,0,0|1,0,0]=3 21682 B16R2.279 O=C1CCC1NCCOC2CCCCC2 34a_100015206981_100009892977 [0,0,0,2,0,0|2,0,0]=4 21683 B16R2.279 O=C1CCC1OCCCC2CCCCC2 34a_100000198086_100009892977 [0,0,0,2,0,0|1,0,0]=3 21684 B16R2.279 O=C1CCC1OCCCC2CCCCC2 7a_100000198086_100009892977 [0,0,0,2,0,0|1,0,0]=3 21685 B16R2.279 O=C1CCC1OCCCC2CCCCN2 34a_100011934581_100009892977 [0,0,0,2,0,0|2,0,0]=4 21686 B16R2.279 O=C1CCC1OCCCC2CCCNC2 34a_100150707839_100009892977 [0,0,0,2,0,0|2,0,0]=4 21687 B16R2.279 O=C1CCC1OCCCC2CCNCC2 34a_100016988962_100009892977 [0,0,0,2,0,0|2,0,0]=4 21688 B16R2.279 O=C1CCC1OCCCN2CCCCC2 34a_100000212458_100009892977 [0,0,0,2,0,0|2,0,0]=4 21689 B16R2.279 O=C1CCC1OCCNC2CCCCC2 34a_100000200466_100009892977 [0,0,0,2,0,0|2,0,0]=4 21690 B16R2.279 O=C1CCC1OCCOC2CCCCC2 34a_100011249652_100009892977 [0,0,0,2,0,0|2,0,0]=4 21691 B16R2.279 O=C1CCC1OCCOC2CCCCC2 7a_100011249652_100009892977 [0,0,0,2,0,0|2,0,0]=4 21692 B16R2.279 O=C1CCC1SCCCC2CCCCC2 62a_100009892977_100011713725 [0,0,0,2,0,0|1,0,0]=3 21693 B16R2.279 O=C1CCC1SCCCC2CCCCC2 62a_100011713725_100009892977 [0,0,0,2,0,0|1,0,0]=3 21694 B16R2.279 O=C1CCC1SCCCN2CCCCC2 62a_100009892977_100000007876 [0,0,0,2,0,0|2,0,0]=4 21695 B16R2.279 O=C1CCC1SCCCN2CCCCC2 62a_100132302099_100009892977 [0,0,0,2,0,0|2,0,0]=4 21696 B16R2.279 O=C1CCC1SCCOC2CCCCC2 62a_100009892977_100011211530 [0,0,0,2,0,0|2,0,0]=4 21697 B16R2.279 O=C1CCC1SCCOC2CCCCC2 62a_100011211530_100009892977 [0,0,0,2,0,0|2,0,0]=4 21698 B16R2.2076 C=CCCCNCC1CC12CCCCC2 2230a_100015185624_100011713584 [0,0,0,2,0,0|2,0,0]=4 21699 B16R2.2076 C=CCCCNCC1CC12CCCCC2 34a_100015185624_100000757094 [0,0,0,2,0,0|2,0,0]=4 21700 B16R2.2076 O=CCCCNCC1CC12CCCCC2 2230a_100015185624_200011292268 [0,0,0,2,0,0|1,0,0]=3 21701 B16R2.2211 C1=CC(CCC1)NC2CCCCCCC2 2230a_100000211152_100000751183 [0,0,0,2,0,0|2,0,0]=4 21702 B16R2.2211 C1=CC(CCC1)OC2CCCCCCC2 7a_100000210054_100000751183 [0,0,0,2,0,0|2,0,0]=4 21703 B16R2.2211 C1=CC(CCCCC1)OC2CCCCC2 34a_100000688657_100000210327 [0,0,0,2,0,0|2,0,0]=4 21704 B16R2.2256 C1=CC(CCC1)NCCC2CCCCC2 2230a_100000738074_100000751183 [0,0,0,2,0,0|2,0,0]=4 21705 B16R2.2256 C1=CC(CCC1)OCCC2CCCCC2 34a_100011215024_100011209188 [0,0,0,2,0,0|2,0,0]=4 21706 B16R2.2256 C1=CC(CCC1)OCCC2CCCCC2 7a_100011217863_100000751183 [0,0,0,2,0,0|2,0,0]=4 21707 B16R2.2256 C1=CC(CCC1)SCCC2CCCCC2 62a_100000751183_100012355289 [0,0,0,2,0,0|2,0,0]=4 21708 B16R2.2256 C1=CC(CCC1)SCCC2CCCCC2 62a_100012355289_100000751183 [0,0,0,2,0,0|2,0,0]=4 21709 B16R2.2257 C1=CC(CCC1)NCCCC2CCCC2 2230a_100000736752_100000751183 [0,0,0,2,0,0|2,0,0]=4 21710 B16R2.2257 C1=CC(CCC1)OCCCC2CCCC2 34a_100011215024_100011713738 [0,0,0,2,0,0|2,0,0]=4 21711 B16R2.2257 C1=CC(CCC1)OCCCC2CCCC2 7a_100011215328_100000751183 [0,0,0,2,0,0|2,0,0]=4 21712 B16R2.2257 C1=CC(CCC1)SCCCC2CCCC2 62a_100000751183_100011713738 [0,0,0,2,0,0|2,0,0]=4 21713 B16R2.2257 C1=CC(CCC1)SCCCC2CCCC2 62a_100011713738_100000751183 [0,0,0,2,0,0|2,0,0]=4 21714 B16R2.3043 C1=CC(CCC1)N2CCCCCCCC2 2230a_100000039187_100000751183 [0,0,0,2,0,0|2,0,0]=4 21715 B16R2.3043 C1=CC(CCC1)N2CCCCCCCC2 269982a_100000039187_100000751183 [0,0,0,2,0,0|2,0,0]=4 21716 B16R2.3250 O=C1CCCC1NCCC2CCCCC2 2230a_100000738074_100000211823 [0,0,0,2,0,0|1,0,0]=3 21717 B16R2.3250 O=C1CCCC1NCCC2CCCCC2 34a_100000738074_100000709159 [0,0,0,2,0,0|1,0,0]=3 21718 B16R2.3250 O=C1CCCC1NCCC2CCCCO2 2230a_100015183643_100000211823 [0,0,0,2,0,0|2,0,0]=4 21719 B16R2.3250 O=C1CCCC1NCCC2CCCCO2 34a_100015183643_100000709159 [0,0,0,2,0,0|2,0,0]=4 21720 B16R2.3250 O=C1CCCC1NCCC2CCOCC2 2230a_100000755988_100000211823 [0,0,0,2,0,0|2,0,0]=4 21721 B16R2.3250 O=C1CCCC1NCCC2CCOCC2 34a_100000755988_100000709159 [0,0,0,2,0,0|2,0,0]=4 21722 B16R2.3250 O=C1CCCC1OCCC2CCCCC2 34a_100011217863_100000709159 [0,0,0,2,0,0|1,0,0]=3 21723 B16R2.3250 O=C1CCCC1OCCC2CCCCC2 34a_200000719330_100011209188 [0,0,0,2,0,0|1,0,0]=3 21724 B16R2.3250 O=C1CCCC1OCCC2CCCCC2 7a_100011217863_100000211823 [0,0,0,2,0,0|1,0,0]=3 21725 B16R2.3250 O=C1CCCC1OCCC2CCCCN2 34a_100000211664_100000709159 [0,0,0,2,0,0|2,0,0]=4 21726 B16R2.3250 O=C1CCCC1OCCC2CCCNC2 34a_100000752241_100000709159 [0,0,0,2,0,0|2,0,0]=4 21727 B16R2.3250 O=C1CCCC1OCCC2CCNCC2 34a_100015190746_100000709159 [0,0,0,2,0,0|2,0,0]=4 21728 B16R2.3250 O=C1CCCC1OCCC2CCOCC2 34a_100011933979_100000709159 [0,0,0,2,0,0|2,0,0]=4 21729 B16R2.3250 O=C1CCCC1OCCC2CCOCC2 34a_200000719330_100011934994 [0,0,0,2,0,0|2,0,0]=4 21730 B16R2.3250 O=C1CCCC1OCCC2CCOCC2 7a_100011933979_100000211823 [0,0,0,2,0,0|2,0,0]=4 21731 B16R2.3250 O=C1CCCC1OCCN2CCCCC2 34a_200000719330_100000739454 [0,0,0,2,0,0|2,0,0]=4 21732 B16R2.3250 O=C1CCCC1OCOC2CCCCC2 34a_200000719330_100011935260 [0,0,0,2,0,0|2,0,0]=4 21733 B16R2.3250 O=C1CCCC1SCCC2CCCCC2 62a_100000211823_100012355289 [0,0,0,2,0,0|1,0,0]=3 21734 B16R2.3250 O=C1CCCC1SCCC2CCCCC2 62a_100012355289_100000211823 [0,0,0,2,0,0|1,0,0]=3 21735 B16R2.3250 O=C1CCCC1SCCC2CCOCC2 62a_100000211823_100011934994 [0,0,0,2,0,0|2,0,0]=4 21736 B16R2.3250 O=C1CCCC1SCCC2CCOCC2 62a_100011934994_100000211823 [0,0,0,2,0,0|2,0,0]=4 21737 B16R2.3250 O=C1CCCC1SCCN2CCCCC2 62a_100000211823_100000739454 [0,0,0,2,0,0|2,0,0]=4 21738 B16R2.3250 O=C1CCCC1SCCN2CCCCC2 62a_100000739454_100000211823 [0,0,0,2,0,0|2,0,0]=4 21739 B16R2.3250 O=C1CCCC1SCOC2CCCCC2 62a_100000211823_100011935260 [0,0,0,2,0,0|2,0,0]=4 21740 B16R2.3250 O=C1CCCC1SCOC2CCCCC2 62a_100011935260_100000211823 [0,0,0,2,0,0|2,0,0]=4 21741 B16R2.3250 O=C1CCCN1CCNC2CCCCC2 2230a_100000182618_100000739059 [0,0,0,2,0,0|2,0,0]=4 21742 B16R2.3250 O=C1CCCN1CCNC2CCCCC2 270004a_100011200922_100000210434 [0,0,0,2,0,0|2,0,0]=4 21743 B16R2.3250 O=C1CCCN1CCNC2CCCCC2 34a_100000182618_100000739059 [0,0,0,2,0,0|2,0,0]=4 21744 B16R2.3250 O=C1CCCN1CCOC2CCCCC2 34a_100000210231_100000739059 [0,0,0,2,0,0|2,0,0]=4 21745 B16R2.3250 O=C1CCCN1CCOC2CCCCC2 34a_100000211209_100000210327 [0,0,0,2,0,0|2,0,0]=4 21746 B16R2.3250 O=C1CCCN1CCOC2CCCCC2 7a_100000210231_100000739059 [0,0,0,2,0,0|2,0,0]=4 21747 B16R2.3250 O=C1CCCN1CCOC2CCCCC2 7a_100000211209_100000210327 [0,0,0,2,0,0|2,0,0]=4 21748 B16R2.3250 O=C1CCCN1CCSC2CCCCC2 62a_100000210327_100000739059 [0,0,0,2,0,0|2,0,0]=4 21749 B16R2.3250 O=C1CCCN1CCSC2CCCCC2 62a_100000739059_100000210327 [0,0,0,2,0,0|2,0,0]=4 21750 B16R2.3250 O=C1CCCN1CSCC2CCCCC2 62a_100000026320_100000211423 [0,0,0,2,0,0|2,0,0]=4 21751 B16R2.3250 O=C1CCCN1CSCC2CCCCC2 62a_100000211423_100000026320 [0,0,0,2,0,0|2,0,0]=4 21752 B16R2.3250 O=C1NCCC1COCC2CCCCC2 34a_100000133458_100000211423 [0,0,0,2,0,0|2,0,0]=4 21753 B16R2.3250 O=C1NCCC1NCCC2CCCCC2 2230a_100016995588_100012355289 [0,0,0,2,0,0|2,0,0]=4 21754 B16R2.3250 O=C1NCCC1NCCC2CCCCC2 270004a_100016995588_100011713444 [0,0,0,2,0,0|2,0,0]=4 21755 B16R2.3250 O=C1NCCC1NCCC2CCCCC2 34a_100016995588_100011209188 [0,0,0,2,0,0|2,0,0]=4 21756 B16R2.3250 O=C1NCC[C@@H]1OCCC2CCCCC2 34a_100000688343_100011209188 [0,0,0,2,0,0|2,0,0]=4 21757 B16R2.3250 O=C1OCCC1NCCC2CCCCC2 2230a_100000738074_100000211211 [0,0,0,2,0,0|2,0,0]=4 21758 B16R2.3250 O=C1OCCC1NCCC2CCCCC2 34a_100000738074_100000211211 [0,0,0,2,0,0|2,0,0]=4 21759 B16R2.3250 O=C1OCCC1OCCC2CCCCC2 34a_100011217863_100000211211 [0,0,0,2,0,0|2,0,0]=4 21760 B16R2.3250 O=C1OCCC1OCCC2CCCCC2 7a_100011217863_100000211211 [0,0,0,2,0,0|2,0,0]=4 21761 B16R2.3250 O=C1OCCC1SCCC2CCCCC2 62a_100000211211_100012355289 [0,0,0,2,0,0|2,0,0]=4 21762 B16R2.3250 O=C1OCCC1SCCC2CCCCC2 62a_100012355289_100000211211 [0,0,0,2,0,0|2,0,0]=4 21763 B16R2.5334 C1=CC(CCC1)NCC2CCCCCC2 2230a_100015204231_100000751183 [0,0,0,2,0,0|2,0,0]=4 21764 B16R2.5334 C1=CC(CCC1)OCC2CCCCCC2 34a_100011215024_200000696569 [0,0,0,2,0,0|2,0,0]=4 21765 B16R2.5334 C1=CC(CCC1)OCC2CCCCCC2 7a_100000699130_100000751183 [0,0,0,2,0,0|2,0,0]=4 21766 B16R2.5334 C1=CC(CCC1)SCC2CCCCCC2 62a_100000751183_200000696569 [0,0,0,2,0,0|2,0,0]=4 21767 B16R2.5334 C1=CC(CCC1)SCC2CCCCCC2 62a_200000696569_100000751183 [0,0,0,2,0,0|2,0,0]=4 21768 B16R2.13336 O=CCCCCN1CCN2CCC1CC2 269982a_100000027273_100000139335 [0,0,0,2,0,0|2,0,0]=4 21769 B16R2.13351 C=CCCCCCCCN1CC2CC2C1 2230a_100000741873_100012355270 [0,0,0,2,0,0|2,0,0]=4 21770 B16R2.13351 C=CCCCCCCCN1CC2CC2C1 269982a_100000741873_100012355270 [0,0,0,2,0,0|2,0,0]=4 21771 B16R2.13351 C=CCCCCCCCN1CC2CC2C1 34a_100000741873_100012355270 [0,0,0,2,0,0|2,0,0]=4 21772 B16R2.27999 C=CCCCCCCN1C2CCC1CC2 2230a_100000735658_100011215473 [0,0,0,2,0,0|2,0,0]=4 21773 B16R2.27999 C=CCCCCCCN1C2CCC1CC2 269982a_100000735658_100011215473 [0,0,0,2,0,0|2,0,0]=4 21774 B16R2.27999 C=CCCCCCCN1C2CCC1CC2 34a_100000735658_100011215473 [0,0,0,2,0,0|2,0,0]=4 21775 B16R2.27999 C=CCCCCCOC1C2CCC1CC2 34a_100011216702_100009813300 [0,0,0,2,0,0|2,0,0]=4 21776 B16R2.27999 C=CCCCCCSC1C2CCC1CC2 62a_100000700193_100009813300 [0,0,0,2,0,0|2,0,0]=4 21777 B16R2.27999 C=CCCCCCSC1C2CCC1CC2 62a_100009813300_100000700193 [0,0,0,2,0,0|2,0,0]=4 21778 B16R2.27999 O=CCCCCCSC1C2CCC1CC2 62a_100000139337_100009813300 [0,0,0,2,0,0|1,0,0]=3 21779 B16R2.27999 O=CCCCCCSC1C2CCC1CC2 62a_100009813300_100000139337 [0,0,0,2,0,0|1,0,0]=3 21780 B16R2.34598 C=CCCCCCN1CC2CCC1CC2 2230a_100000750499_100000700193 [0,0,0,2,0,0|2,0,0]=4 21781 B16R2.34598 C=CCCCCCN1CC2CCC1CC2 269982a_100000750499_100000700193 [0,0,0,2,0,0|2,0,0]=4 21782 B16R2.34598 C=CCCCCCN1CC2CCC1CC2 34a_100000750499_100000700193 [0,0,0,2,0,0|2,0,0]=4 21783 B16R2.34598 CCCCCNCC1CC2C=CC1CC2 269862a_100000209983_100010619355 [0,0,0,2,0,0|2,0,0]=4 21784 B16R2.34598 O=CCCCCCN1CC2CCC1CC2 2230a_100000750499_100000139337 [0,0,0,2,0,0|1,0,0]=3 21785 B16R2.34598 O=CCCCCCN1CC2CCC1CC2 269982a_100000750499_100000139337 [0,0,0,2,0,0|1,0,0]=3 21786 B16R2.34598 O=CCCCCN[C@H]1CN2CCC1CC2 2230a_100016987387_100000139335 [0,0,0,2,0,0|2,0,0]=4 21787 B16R2.50359 C=CCCCN1CCCC2C1CCCC2 2230a_100000211887_100011713584 [0,0,0,2,0,0|2,0,0]=4 21788 B16R2.50359 C=CCCCN1CCCC2C1CCCC2 269982a_100000211887_100000757094 [0,0,0,2,0,0|2,0,0]=4 21789 B16R2.50359 C=CCCCN1CCCC2C1CCCC2 34a_100000211887_100000757094 [0,0,0,2,0,0|2,0,0]=4 21790 B16R2.50359 C=CCCNC1CCCC2C1CCCC2 269862a_100015191253_100000032293 [0,0,0,2,0,0|2,0,0]=4 21791 B16R2.50359 C=CCCOC1CCCC2C1CCCC2 34a_100000042559_100000754431 [0,0,0,2,0,0|2,0,0]=4 21792 B16R2.50359 C=CCCOC1CCCC2C1CCCC2 7a_100000042559_100000754431 [0,0,0,2,0,0|2,0,0]=4 21793 B16R2.50359 O=CCCCN1CCCC2C1CCCC2 2230a_100000211887_200011292268 [0,0,0,2,0,0|1,0,0]=3 21794 B16R2.50359 O=CCCCN1CCCC2C1CCCC2 269982a_100000211887_200011292268 [0,0,0,2,0,0|1,0,0]=3 21795 B16R2.50359 O=CCCCN1CCOC2C1CCCC2 2230a_200000741227_200011292268 [0,0,0,2,0,0|2,0,0]=4 21796 B16R2.50359 O=CCCCN1CCOC2C1CCCC2 269982a_200000741227_200011292268 [0,0,0,2,0,0|2,0,0]=4 21797 B16R2.50359 O=CCNC[C@@H]1CCCN2[C@@H]1CCCC2 34a_100015187183_200009817547 [0,0,0,2,0,0|2,0,0]=4 21798 B16R2.50359 O=CCOC[C@@H]1CCCN2[C@@H]1CCCC2 34a_200009815849_200009817547 [0,0,0,2,0,0|2,0,0]=4 21799 B16R2.50359 O=CCOC[C@@H]1CCCN2[C@@H]1CCCC2 7a_200009815849_200015260668 [0,0,0,2,0,0|2,0,0]=4 21800 B16R2.53150 C=CCCCCCCOC1CCC2C1C2 34a_200012295571_100011215473 [0,0,0,2,0,0|2,0,0]=4 21801 B16R2.3305 O=C1CCCCCC1OCC2CCCC2 7a_100000742336_100000243696 [0,0,0,2,0,0|1,0,0]=3 21802 B16R2.3305 O=C1CCCCCC1OCC2CCCO2 7a_100000210270_100000243696 [0,0,0,2,0,0|2,0,0]=4 21803 B16R2.3305 O=C1CCCCCC1SCC2CCCC2 62a_100000243696_100000740388 [0,0,0,2,0,0|1,0,0]=3 21804 B16R2.3305 O=C1CCCCCC1SCC2CCCC2 62a_100000740388_100000243696 [0,0,0,2,0,0|1,0,0]=3 21805 B16R2.3305 O=C1CCCCCC1SCC2CCCO2 62a_100000203698_100000243696 [0,0,0,2,0,0|2,0,0]=4 21806 B16R2.3305 O=C1CCCCCC1SCC2CCCO2 62a_100000243696_100000203698 [0,0,0,2,0,0|2,0,0]=4 21807 B16R2.3305 O=C1CCCCCC1SCC2CCOC2 62a_100000243696_100000702531 [0,0,0,2,0,0|2,0,0]=4 21808 B16R2.3305 O=C1CCCCCC1SCC2CCOC2 62a_100000702531_100000243696 [0,0,0,2,0,0|2,0,0]=4 21809 B16R2.3305 O=C1NCCCCC1NCC2CCCC2 2230a_100000698827_100000740388 [0,0,0,2,0,0|2,0,0]=4 21810 B16R2.3305 O=C1NCCCCC1NCC2CCCC2 2230a_100000737975_100000735217 [0,0,0,2,0,0|2,0,0]=4 21811 B16R2.3305 O=C1NCCCCC1NCC2CCCC2 269862a_100000698827_100000746403 [0,0,0,2,0,0|2,0,0]=4 21812 B16R2.3305 O=C1NCCCCC1NCC2CCCC2 34a_100000698827_100000740388 [0,0,0,2,0,0|2,0,0]=4 21813 B16R2.3305 O=C1NCCCCC1OCC2CCCC2 7a_100000742336_100000735217 [0,0,0,2,0,0|2,0,0]=4 21814 B16R2.3305 O=C1NCCCCC1SCC2CCCC2 62a_100000735217_100000740388 [0,0,0,2,0,0|2,0,0]=4 21815 B16R2.3305 O=C1NCCCCC1SCC2CCCC2 62a_100000740388_100000735217 [0,0,0,2,0,0|2,0,0]=4 21816 B16R2.3983 CC1CCCCN1C2CCCCCC2=O 269982a_100000211376_100000243696 [0,0,0,2,0,0|1,0,0]=3 21817 B16R2.3983 CC1CCCCN1C2CCCCNC2=O 2230a_100000211376_100000735217 [0,0,0,2,0,0|2,0,0]=4 21818 B16R2.3983 CC1CCCCN1C2CCCCNC2=O 269982a_100000211376_100000735217 [0,0,0,2,0,0|2,0,0]=4 21819 B16R2.3983 C[C@H]1COCCN1C2CCCCCC2=O 269982a_100009815349_100000243696 [0,0,0,2,0,0|2,0,0]=4 21820 B16R2.3986 CC1CCCC1NC2CCCCNC2=O 269862a_100000698827_100000752053 [0,0,0,2,0,0|2,0,0]=4 21821 B16R2.3986 CC1CCCC1OC2CCCCCC2=O 7a_100011216460_100000243696 [0,0,0,2,0,0|1,0,0]=3 21822 B16R2.3986 CC1CCCC1OC2CCCCNC2=O 7a_100011216460_100000735217 [0,0,0,2,0,0|2,0,0]=4 21823 B16R2.3986 O=C1CCCCCC1S[C@@H]2CCC[C@H]2O 62a_100000243696_200016002552 [0,0,0,2,0,0|2,0,0]=4 21824 B16R2.3986 O=C1CCCCCC1S[C@@H]2CCC[C@H]2O 62a_200016002552_100000243696 [0,0,0,2,0,0|2,0,0]=4 21825 B16R2.8585 CCC1CCCN1C2CCCCCC2=O 269982a_100000754278_100000243696 [0,0,0,2,0,0|1,0,0]=3 21826 B16R2.8585 CCC1CCCN1C2CCCCNC2=O 2230a_100000754278_100000735217 [0,0,0,2,0,0|2,0,0]=4 21827 B16R2.8585 CCC1CCCN1C2CCCCNC2=O 269982a_100000754278_100000735217 [0,0,0,2,0,0|2,0,0]=4 21828 B16R2.8585 O=C1CCCCCC1N2CCC[C@@H]2CO 269982a_100000745186_100000243696 [0,0,0,2,0,0|2,0,0]=4 21829 B16R2.17489 COCC1CCN1C2CCCCCC2=O 269982a_100015195929_100000243696 [0,0,0,2,0,0|2,0,0]=4 21830 B16R2.23273 O=C1CCCCCC1N2CCCCCC2 269982a_100000185865_100000243696 [0,0,0,2,0,0|1,0,0]=3 21831 B16R2.23273 O=C1CCCCCC1N2CCCOCC2 269982a_100000685342_100000243696 [0,0,0,2,0,0|2,0,0]=4 21832 B16R2.23273 O=C1NCCCCC1N2CCCCCC2 2230a_100000185865_100000735217 [0,0,0,2,0,0|2,0,0]=4 21833 B16R2.23273 O=C1NCCCCC1N2CCCCCC2 269982a_100000185865_100000735217 [0,0,0,2,0,0|2,0,0]=4 21834 B16R2.23286 O=C1CCCCCC1SCCCC2CO2 62a_100000243696_100000733510 [0,0,0,2,0,0|2,0,0]=4 21835 B16R2.23286 O=C1CCCCCC1SCCCC2CO2 62a_100000733510_100000243696 [0,0,0,2,0,0|2,0,0]=4 21836 B16R2.23286 O=C1CCCCCN1CCCNC2CC2 34a_100000195386_100000211595 [0,0,0,2,0,0|2,0,0]=4 21837 B16R2.664 COC[C@@H]1CCCN1C2CCCCC2=O 269982a_100020646714_100000204591 [0,0,0,2,0,0|2,0,0]=4 21838 B16R2.664 COC[C@@H]1CCCN1C2CCCCC2=O 34a_100020646714_100000754470 [0,0,0,2,0,0|2,0,0]=4 21839 B16R2.1632 CCC1CCCC1NC2CCCNC2=O 270004a_100000747585_100000749056 [0,0,0,2,0,0|2,0,0]=4 21840 B16R2.2441 C=CCCCN1CCC2CCCCC2C1 2230a_100000211783_100011713584 [0,0,0,2,0,0|2,0,0]=4 21841 B16R2.2441 C=CCCCN1CCC2CCCCC2C1 269982a_100000211783_100000757094 [0,0,0,2,0,0|2,0,0]=4 21842 B16R2.2441 C=CCCCN1CCC2CCCCC2C1 34a_100000211783_100000757094 [0,0,0,2,0,0|2,0,0]=4 21843 B16R2.2441 C=CCCNC1CCC2CCCCC2C1 270004a_100015191253_100000211418 [0,0,0,2,0,0|2,0,0]=4 21844 B16R2.2441 C=CCCOC1CCC2CCCCC2C1 34a_100000211317_100000754431 [0,0,0,2,0,0|2,0,0]=4 21845 B16R2.2441 C=CCCOC1CCC2CCCCC2C1 7a_100000211317_100000754431 [0,0,0,2,0,0|2,0,0]=4 21846 B16R2.2441 O=CCCCN1CCC2CCCCC2C1 2230a_100000211783_200011292268 [0,0,0,2,0,0|1,0,0]=3 21847 B16R2.2441 O=CCCCN1CCC2CCCCC2C1 269982a_100000211783_200011292268 [0,0,0,2,0,0|1,0,0]=3 21848 B16R2.2441 O=CCCCN1CCN2CCCCC2C1 2230a_100000746566_200011292268 [0,0,0,2,0,0|2,0,0]=4 21849 B16R2.2441 O=CCCCN1CCN2CCCCC2C1 269982a_100000746566_200011292268 [0,0,0,2,0,0|2,0,0]=4 21850 B16R2.2474 CCC1CCCCN1C2CCCCC2=O 269982a_100000210034_100000204591 [0,0,0,2,0,0|1,0,0]=3 21851 B16R2.2474 CCC1CCCCN1C2CCCCC2=O 34a_100000210034_100000754470 [0,0,0,2,0,0|1,0,0]=3 21852 B16R2.2474 CCC1CCCCN1C2CCCNC2=O 2230a_100000210034_100000687798 [0,0,0,2,0,0|2,0,0]=4 21853 B16R2.2474 CCC1CCCCN1C2CCCNC2=O 269982a_100000210034_100000687798 [0,0,0,2,0,0|2,0,0]=4 21854 B16R2.2474 CCC1CCCCN1C2CCCNC2=O 34a_100000210034_100000687798 [0,0,0,2,0,0|2,0,0]=4 21855 B16R2.2474 CCC1CCCCN1C2COCCC2=O 34a_100000210034_100012180262 [0,0,0,2,0,0|2,0,0]=4 21856 B16R2.2474 CC[C@H]1COCCN1C2CCCCC2=O 269982a_100016988097_100000204591 [0,0,0,2,0,0|2,0,0]=4 21857 B16R2.2474 CC[C@H]1COCCN1C2CCCCC2=O 34a_100016988097_100000754470 [0,0,0,2,0,0|2,0,0]=4 21858 B16R2.2474 O=C1CCCCC1N2CCCCC2CO 269982a_100000210821_100000204591 [0,0,0,2,0,0|2,0,0]=4 21859 B16R2.2474 O=C1CCCCC1N2CCCCC2CO 34a_100000210821_100000754470 [0,0,0,2,0,0|2,0,0]=4 21860 B16R2.2875 C=CCCCCN1C[C@H]2CCCC[C@H]2C1 2230a_100015204113_100011215482 [0,0,0,2,0,0|2,0,0]=4 21861 B16R2.2875 C=CCCCCN1C[C@H]2CCCC[C@H]2C1 269982a_100015204113_100011215482 [0,0,0,2,0,0|2,0,0]=4 21862 B16R2.2875 C=CCCCCN1C[C@H]2CCCC[C@H]2C1 34a_100015204113_100011215482 [0,0,0,2,0,0|2,0,0]=4 21863 B16R2.2875 O=CCCCCN1C[C@H]2CCCC[C@H]2C1 2230a_100015204113_100000139335 [0,0,0,2,0,0|1,0,0]=3 21864 B16R2.2875 O=CCCCCN1C[C@H]2CCCC[C@H]2C1 269982a_100015204113_100000139335 [0,0,0,2,0,0|1,0,0]=3 21865 B16R2.2959 O=C1CCCCC1COCC2CCCC2 34a_100009861125_100000740388 [0,0,0,2,0,0|1,0,0]=3 21866 B16R2.2959 O=C1CCCCC1COCC2CCCC2 7a_100009861125_100000740388 [0,0,0,2,0,0|1,0,0]=3 21867 B16R2.2959 O=C1CCCCC1COCC2CCCO2 7a_100009861125_100000203698 [0,0,0,2,0,0|2,0,0]=4 21868 B16R2.2959 O=C1CCCCC1COCC2CCOC2 34a_100009861125_100011261433 [0,0,0,2,0,0|2,0,0]=4 21869 B16R2.2959 O=C1CCCCC1COCC2CCOC2 7a_100009861125_100000702531 [0,0,0,2,0,0|2,0,0]=4 21870 B16R2.2959 O=C1CCCCC1NCCC2CCCC2 34a_100000739158_100000754470 [0,0,0,2,0,0|1,0,0]=3 21871 B16R2.2959 O=C1CCCCC1OCCC2CCCC2 34a_100000749090_100000754470 [0,0,0,2,0,0|1,0,0]=3 21872 B16R2.2959 O=C1CCCCC1OCCC2CCCC2 34a_100011214950_100000760354 [0,0,0,2,0,0|1,0,0]=3 21873 B16R2.2959 O=C1CCCCC1OCCC2CCCC2 7a_100000749090_100000204591 [0,0,0,2,0,0|1,0,0]=3 21874 B16R2.2959 O=C1CCCCC1OCCC2CCNC2 34a_100016987287_100000754470 [0,0,0,2,0,0|2,0,0]=4 21875 B16R2.2959 O=C1CCCCC1OCCC2CCOC2 34a_100011879284_100000754470 [0,0,0,2,0,0|2,0,0]=4 21876 B16R2.2959 O=C1CCCCC1SCCC2CCCC2 62a_100000204591_100000760354 [0,0,0,2,0,0|1,0,0]=3 21877 B16R2.2959 O=C1CCCCC1SCCC2CCCC2 62a_100000760354_100000204591 [0,0,0,2,0,0|1,0,0]=3 21878 B16R2.2959 O=C1CCCCC1SCCN2CCCC2 62a_100000204591_100000004467 [0,0,0,2,0,0|2,0,0]=4 21879 B16R2.2959 O=C1CCCCC1SCCN2CCCC2 62a_100000700749_100000204591 [0,0,0,2,0,0|2,0,0]=4 21880 B16R2.2959 O=C1CCCCN1CCNC2CCCC2 2230a_100160573077_100000179811 [0,0,0,2,0,0|2,0,0]=4 21881 B16R2.2959 O=C1CCCCN1CCNC2CCCC2 270004a_100160573077_100000210133 [0,0,0,2,0,0|2,0,0]=4 21882 B16R2.2959 O=C1CCCCN1CCNC2CCCC2 34a_100160573077_100000179811 [0,0,0,2,0,0|2,0,0]=4 21883 B16R2.2959 O=C1CCOCC1NCCC2CCCC2 34a_100000739158_100012180262 [0,0,0,2,0,0|2,0,0]=4 21884 B16R2.2959 O=C1CCOCC1OCCC2CCCC2 34a_100000749090_100012180262 [0,0,0,2,0,0|2,0,0]=4 21885 B16R2.2959 O=C1CCOCC1OCCC2CCCC2 7a_100000749090_100012180262 [0,0,0,2,0,0|2,0,0]=4 21886 B16R2.2959 O=C1CCOCC1SCCC2CCCC2 62a_100000760354_100012180262 [0,0,0,2,0,0|2,0,0]=4 21887 B16R2.2959 O=C1CCOCC1SCCC2CCCC2 62a_100012180262_100000760354 [0,0,0,2,0,0|2,0,0]=4 21888 B16R2.2959 O=C1NCCCC1NCCC2CCCC2 2230a_100000739158_100000687798 [0,0,0,2,0,0|2,0,0]=4 21889 B16R2.2959 O=C1NCCCC1NCCC2CCCC2 2230a_100000747585_100000760354 [0,0,0,2,0,0|2,0,0]=4 21890 B16R2.2959 O=C1NCCCC1NCCC2CCCC2 34a_100000739158_100000687798 [0,0,0,2,0,0|2,0,0]=4 21891 B16R2.2959 O=C1NCCCC1NCCC2CCCC2 34a_100000747585_100000760354 [0,0,0,2,0,0|2,0,0]=4 21892 B16R2.2959 O=C1NCCCC1OCCC2CCCC2 34a_100000073722_100000760354 [0,0,0,2,0,0|2,0,0]=4 21893 B16R2.2959 O=C1NCCCC1OCCC2CCCC2 34a_100000749090_100000687798 [0,0,0,2,0,0|2,0,0]=4 21894 B16R2.2959 O=C1NCCCC1OCCC2CCCC2 7a_100000749090_100000687798 [0,0,0,2,0,0|2,0,0]=4 21895 B16R2.2959 O=C1NCCCC1SCCC2CCCC2 62a_100000687798_100000760354 [0,0,0,2,0,0|2,0,0]=4 21896 B16R2.2959 O=C1NCCCC1SCCC2CCCC2 62a_100000760354_100000687798 [0,0,0,2,0,0|2,0,0]=4 21897 B16R2.2966 CC1CCCCN1CCN2CCCC2=O 2230a_100000211376_100000739059 [0,0,0,2,0,0|2,0,0]=4 21898 B16R2.2966 CC1CCCCN1CCN2CCCC2=O 269982a_100000211376_100000739059 [0,0,0,2,0,0|2,0,0]=4 21899 B16R2.2966 CC1CCCCN1CCN2CCCC2=O 34a_100000211376_100000739059 [0,0,0,2,0,0|2,0,0]=4 21900 B16R2.2966 CN1CCCC1COC2CCCCC2=O 34a_100000743107_100000754470 [0,0,0,2,0,0|2,0,0]=4 21901 B16R2.2966 CN1CCCCC1CCN2CCCC2=O 2230a_200011221494_200000210301 [0,0,0,2,0,0|2,0,0]=4 21902 B16R2.2966 CN1CCCCC1CCN2CCCC2=O 269982a_200011221494_200000210301 [0,0,0,2,0,0|2,0,0]=4 21903 B16R2.2966 CN1CCCCC1CCN2CCCC2=O 34a_200011221494_200000210301 [0,0,0,2,0,0|2,0,0]=4 21904 B16R2.2966 CN1CCCCC1CNC2CCCC2=O 34a_100011228421_100000709159 [0,0,0,2,0,0|2,0,0]=4 21905 B16R2.2966 CN1CCCCC1COC2CCCC2=O 34a_100000225079_100000709159 [0,0,0,2,0,0|2,0,0]=4 21906 B16R2.2966 CN1CCCCC1COC2CCCC2=O 34a_200000719330_100015186950 [0,0,0,2,0,0|2,0,0]=4 21907 B16R2.2966 CN1CCCCC1CSC2CCCC2=O 62a_100000211823_100015185383 [0,0,0,2,0,0|2,0,0]=4 21908 B16R2.2966 CN1CCCCC1CSC2CCCC2=O 62a_100015185383_100000211823 [0,0,0,2,0,0|2,0,0]=4 21909 B16R2.2966 O=C1CCCC1NCC2CCCCC2O 34a_100011216029_100000709159 [0,0,0,2,0,0|2,0,0]=4 21910 B16R2.2966 [13CH3]N1CCCCC1CCN2CCCC2=O 2230a_200011221494_200025704644 [0,0,0,2,0,0|2,0,0]=4 21911 B16R2.2966 [13CH3]N1CCCCC1CCN2CCCC2=O 269982a_200011221494_200025704644 [0,0,0,2,0,0|2,0,0]=4 21912 B16R2.2966 [13CH3]N1CCCCC1CCN2CCCC2=O 34a_200011221494_200025704644 [0,0,0,2,0,0|2,0,0]=4 21913 B16R2.3271 CC1CCCCC1NCCC2CCC2=O 2230a_100000211402_200016118888 [0,0,0,2,0,0|1,0,0]=3 21914 B16R2.3271 CC1CCCCC1OCCC2CCC2=O 7a_100000211207_200016118888 [0,0,0,2,0,0|1,0,0]=3 21915 B16R2.3271 CC1CCCCN1CCNC2CCC2=O 34a_100000739827_100009892977 [0,0,0,2,0,0|2,0,0]=4 21916 B16R2.3271 CC1CCCCN1CCOC2CCC2=O 34a_100011305533_100009892977 [0,0,0,2,0,0|2,0,0]=4 21917 B16R2.3271 CN1CCCCC1CCSC2CCC2=O 62a_100000211948_100009892977 [0,0,0,2,0,0|2,0,0]=4 21918 B16R2.3271 CN1CCCCC1CCSC2CCC2=O 62a_100009892977_100000211948 [0,0,0,2,0,0|2,0,0]=4 21919 B16R2.3271 O=C1CCC1CCN[C@@H]2CCCC[C@H]2F 2230a_100015195156_200016118888 [0,0,0,2,0,0|2,0,0]=4 21920 B16R2.3271 O=C1CCC1CCOC2CCCCC2Cl 7a_100000038908_200016118888 [0,0,0,2,0,0|2,0,0]=4 21921 B16R2.3271 O=C1CCC1CCO[C@@H]2CCCC[C@H]2F 7a_100009816020_200016118888 [0,0,0,2,0,0|2,0,0]=4 21922 B16R2.3271 O=C1CCC1CCSC2CCCCC2F 62a_100015423560_200016118888 [0,0,0,2,0,0|2,0,0]=4 21923 B16R2.3271 O=C1CCC1CCSC2CCCCC2F 62a_200016118888_100015423560 [0,0,0,2,0,0|2,0,0]=4 21924 B16R2.3271 O=C1CCC1CCSC2CCCCC2O 62a_100000038908_200016118888 [0,0,0,2,0,0|2,0,0]=4 21925 B16R2.3271 O=C1CCC1CCSC2CCCCC2O 62a_200016118888_100000038908 [0,0,0,2,0,0|2,0,0]=4 21926 B16R2.4062 CC1CCCCC1NC2CCCCC2=O 34a_100000211402_100000754470 [0,0,0,2,0,0|1,0,0]=3 21927 B16R2.4062 CC1CCCCC1NC2CCCNC2=O 2230a_100000211402_100000687798 [0,0,0,2,0,0|2,0,0]=4 21928 B16R2.4062 CC1CCCCC1NC2CCCNC2=O 270004a_100000747585_100000210921 [0,0,0,2,0,0|2,0,0]=4 21929 B16R2.4062 CC1CCCCC1NC2CCCNC2=O 34a_100000211402_100000687798 [0,0,0,2,0,0|2,0,0]=4 21930 B16R2.4062 CC1CCCCC1NC2COCCC2=O 34a_100000211402_100012180262 [0,0,0,2,0,0|2,0,0]=4 21931 B16R2.4062 CC1CCCCC1OC2CCCCC2=O 34a_100000211207_100000754470 [0,0,0,2,0,0|1,0,0]=3 21932 B16R2.4062 CC1CCCCC1OC2CCCCC2=O 7a_100000211207_100000204591 [0,0,0,2,0,0|1,0,0]=3 21933 B16R2.4062 CC1CCCCC1OC2CCCNC2=O 34a_100000211207_100000687798 [0,0,0,2,0,0|2,0,0]=4 21934 B16R2.4062 CC1CCCCC1OC2CCCNC2=O 7a_100000211207_100000687798 [0,0,0,2,0,0|2,0,0]=4 21935 B16R2.4062 CC1CCCCC1OC2COCCC2=O 34a_100000211207_100012180262 [0,0,0,2,0,0|2,0,0]=4 21936 B16R2.4062 CC1CCCCC1OC2COCCC2=O 7a_100000211207_100012180262 [0,0,0,2,0,0|2,0,0]=4 21937 B16R2.4062 CC1CCNCC1OC2CCCCC2=O 34a_100000696640_100000754470 [0,0,0,2,0,0|2,0,0]=4 21938 B16R2.4062 CC1CNCCC1OC2CCCCC2=O 34a_100011998114_100000754470 [0,0,0,2,0,0|2,0,0]=4 21939 B16R2.4062 N[C@@H]1CCCC[C@@H]1OC2CCCCC2=O 34a_100015191688_100000754470 [0,0,0,2,0,0|2,0,0]=4 21940 B16R2.4062 O=C1CCCCC1N[C@@H]2CCCC[C@H]2F 34a_100015195156_100000754470 [0,0,0,2,0,0|2,0,0]=4 21941 B16R2.4062 O=C1CCCCC1OC2CCCCC2Cl 34a_100000038908_100000754470 [0,0,0,2,0,0|2,0,0]=4 21942 B16R2.4062 O=C1CCCCC1OC2CCCCC2Cl 7a_100000038908_100000204591 [0,0,0,2,0,0|2,0,0]=4 21943 B16R2.4062 O=C1CCCCC1OC2CCCCC2F 34a_100011214950_100015423560 [0,0,0,2,0,0|2,0,0]=4 21944 B16R2.4062 O=C1CCCCC1OC2CCCCC2O 34a_100011214950_100000038908 [0,0,0,2,0,0|2,0,0]=4 21945 B16R2.4062 O=C1CCCCC1O[C@@H]2CCCC[C@H]2F 34a_100009816020_100000754470 [0,0,0,2,0,0|2,0,0]=4 21946 B16R2.4062 O=C1CCCCC1O[C@@H]2CCCC[C@H]2F 7a_100009816020_100000204591 [0,0,0,2,0,0|2,0,0]=4 21947 B16R2.4062 O=C1CCCCC1SC2CCCCC2F 62a_100000204591_100015423560 [0,0,0,2,0,0|2,0,0]=4 21948 B16R2.4062 O=C1CCCCC1SC2CCCCC2F 62a_100015423560_100000204591 [0,0,0,2,0,0|2,0,0]=4 21949 B16R2.4062 O=C1CCCCC1SC2CCCCC2O 62a_100000038908_100000204591 [0,0,0,2,0,0|2,0,0]=4 21950 B16R2.4062 O=C1CCCCC1SC2CCCCC2O 62a_100000204591_100000038908 [0,0,0,2,0,0|2,0,0]=4 21951 B16R2.4335 C=CCCCCCCN1CC2CCC1C2 2230a_100000743476_100011215473 [0,0,0,2,0,0|2,0,0]=4 21952 B16R2.4335 C=CCCCCCCN1CC2CCC1C2 269982a_100000743476_100011215473 [0,0,0,2,0,0|2,0,0]=4 21953 B16R2.4335 C=CCCCCCCN1CC2CCC1C2 34a_100000743476_100011215473 [0,0,0,2,0,0|2,0,0]=4 21954 B16R2.4335 C=CCCCCCNC1CC2CCC1C2 2230a_100000758229_100000700193 [0,0,0,2,0,0|2,0,0]=4 21955 B16R2.4335 C=CCCCCCNC1CC2CCC1C2 34a_100000758229_100000700193 [0,0,0,2,0,0|2,0,0]=4 21956 B16R2.4335 C=CCCCCCOC1CC2CCC1C2 34a_100000211339_100000700193 [0,0,0,2,0,0|2,0,0]=4 21957 B16R2.4335 C=CCCCCCOC1CC2CCC1C2 34a_100011216702_100000727232 [0,0,0,2,0,0|2,0,0]=4 21958 B16R2.4335 C=CCCCCCSC1CC2CCC1C2 62a_100000700193_100000727232 [0,0,0,2,0,0|2,0,0]=4 21959 B16R2.4335 C=CCCCCCSC1CC2CCC1C2 62a_100000727232_100000700193 [0,0,0,2,0,0|2,0,0]=4 21960 B16R2.4335 C=CCCCCNCC1CC2CCC1C2 269862a_100000703577_100000697602 [0,0,0,2,0,0|2,0,0]=4 21961 B16R2.4335 C=CCCCCNCC1CC2CCC1C2 270004a_100000703577_100000697602 [0,0,0,2,0,0|2,0,0]=4 21962 B16R2.4335 C=CCCCCOCC1CC2CCC1C2 34a_100000229996_100011215482 [0,0,0,2,0,0|2,0,0]=4 21963 B16R2.4335 CCCCCCCCN1CC2C=CC1C2 2230a_100000732668_100000210759 [0,0,0,2,0,0|2,0,0]=4 21964 B16R2.4335 CCCCCCCCN1CC2C=CC1C2 269982a_100000732668_100000210759 [0,0,0,2,0,0|2,0,0]=4 21965 B16R2.4335 CCCCCCCCN1CC2C=CC1C2 34a_100000732668_100000210759 [0,0,0,2,0,0|2,0,0]=4 21966 B16R2.4335 CCCCCCCOC1CC2C=CC1C2 34a_100000043678_100000210614 [0,0,0,2,0,0|2,0,0]=4 21967 B16R2.4335 CCCCCCNCC1CC2C=CC1C2 2230a_100000189500_100000210314 [0,0,0,2,0,0|2,0,0]=4 21968 B16R2.4335 CCCCCCNCC1CC2C=CC1C2 2230a_100000210581_200009814271 [0,0,0,2,0,0|2,0,0]=4 21969 B16R2.4335 CCCCCCNCC1CC2C=CC1C2 34a_100000189500_100000210314 [0,0,0,2,0,0|2,0,0]=4 21970 B16R2.4335 CCCCCCOCC1CC2C=CC1C2 34a_100000210259_200009814271 [0,0,0,2,0,0|2,0,0]=4 21971 B16R2.4335 CCCCCCOCC1CC2C=CC1C2 34a_100011215361_100000210314 [0,0,0,2,0,0|2,0,0]=4 21972 B16R2.4335 CCCCCCOCC1CC2C=CC1C2 7a_100000210259_100000139495 [0,0,0,2,0,0|2,0,0]=4 21973 B16R2.4335 CCCCCCSCC1CC2C=CC1C2 62a_100000139495_100000210757 [0,0,0,2,0,0|2,0,0]=4 21974 B16R2.4335 CCCCCCSCC1CC2C=CC1C2 62a_100000210314_100000139495 [0,0,0,2,0,0|2,0,0]=4 21975 B16R2.4335 O=CCCCCCNC1CC2CCC1C2 2230a_100000758229_100000139337 [0,0,0,2,0,0|1,0,0]=3 21976 B16R2.4335 O=CCCCCCSC1CC2CCC1C2 62a_100000139337_100000727232 [0,0,0,2,0,0|1,0,0]=3 21977 B16R2.4335 O=CCCCCCSC1CC2CCC1C2 62a_100000727232_100000139337 [0,0,0,2,0,0|1,0,0]=3 21978 B16R2.12475 O=C1CCCCC1COCCCC2CO2 34a_100009861125_100000733510 [0,0,0,2,0,0|2,0,0]=4 21979 B16R2.12475 O=C1CCCCC1COCCCC2CO2 7a_100009861125_100000733510 [0,0,0,2,0,0|2,0,0]=4 21980 B16R2.12475 O=C1CCCCN1CCNCCC2CC2 2230a_100160573077_100000694398 [0,0,0,2,0,0|2,0,0]=4 21981 B16R2.12475 O=C1CCCCN1CCNCCC2CC2 34a_100160573077_100000694398 [0,0,0,2,0,0|2,0,0]=4 21982 B16R2.14656 O=C1CCCCC1N2CCCCCCC2 269982a_100000211400_100000204591 [0,0,0,2,0,0|1,0,0]=3 21983 B16R2.14656 O=C1CCCCC1N2CCCCCCC2 34a_100000211400_100000754470 [0,0,0,2,0,0|1,0,0]=3 21984 B16R2.14656 O=C1CCOCC1N2CCCCCCC2 34a_100000211400_100012180262 [0,0,0,2,0,0|2,0,0]=4 21985 B16R2.14656 O=C1NCCCC1N2CCCCCCC2 2230a_100000211400_100000687798 [0,0,0,2,0,0|2,0,0]=4 21986 B16R2.14656 O=C1NCCCC1N2CCCCCCC2 269982a_100000211400_100000687798 [0,0,0,2,0,0|2,0,0]=4 21987 B16R2.14656 O=C1NCCCC1N2CCCCCCC2 34a_100000211400_100000687798 [0,0,0,2,0,0|2,0,0]=4 21988 B16R2.24848 O=C1CCCCC1NC2CCCCCC2 34a_100000210984_100000754470 [0,0,0,2,0,0|1,0,0]=3 21989 B16R2.24848 O=C1CCCCC1OC2CCCCCC2 34a_100000210887_100000754470 [0,0,0,2,0,0|1,0,0]=3 21990 B16R2.24848 O=C1CCCCC1OC2CCCCCC2 34a_100011214950_100011217769 [0,0,0,2,0,0|1,0,0]=3 21991 B16R2.24848 O=C1CCCCC1OC2CCCCCC2 7a_100000210887_100000204591 [0,0,0,2,0,0|1,0,0]=3 21992 B16R2.24848 O=C1CCCCC1SC2CCCCCC2 62a_100000204591_100011217769 [0,0,0,2,0,0|1,0,0]=3 21993 B16R2.24848 O=C1CCCCC1SC2CCCCCC2 62a_100011217769_100000204591 [0,0,0,2,0,0|1,0,0]=3 21994 B16R2.24848 O=C1CCOCC1NC2CCCCCC2 34a_100000210984_100012180262 [0,0,0,2,0,0|2,0,0]=4 21995 B16R2.24848 O=C1CCOCC1OC2CCCCCC2 34a_100000210887_100012180262 [0,0,0,2,0,0|2,0,0]=4 21996 B16R2.24848 O=C1CCOCC1OC2CCCCCC2 7a_100000210887_100012180262 [0,0,0,2,0,0|2,0,0]=4 21997 B16R2.24848 O=C1CCOCC1SC2CCCCCC2 62a_100011217769_100012180262 [0,0,0,2,0,0|2,0,0]=4 21998 B16R2.24848 O=C1CCOCC1SC2CCCCCC2 62a_100012180262_100011217769 [0,0,0,2,0,0|2,0,0]=4 21999 B16R2.24848 O=C1NCCCC1NC2CCCCCC2 2230a_100000210984_100000687798 [0,0,0,2,0,0|2,0,0]=4 22000 B16R2.24848 O=C1NCCCC1NC2CCCCCC2 270004a_100000747585_100000210131 [0,0,0,2,0,0|2,0,0]=4 22001 B16R2.24848 O=C1NCCCC1NC2CCCCCC2 34a_100000210984_100000687798 [0,0,0,2,0,0|2,0,0]=4 22002 B16R2.24848 O=C1NCCCC1NC2CCCCCC2 34a_100000747585_100011217769 [0,0,0,2,0,0|2,0,0]=4 22003 B16R2.24848 O=C1NCCCC1OC2CCCCCC2 34a_100000073722_100011217769 [0,0,0,2,0,0|2,0,0]=4 22004 B16R2.24848 O=C1NCCCC1OC2CCCCCC2 34a_100000210887_100000687798 [0,0,0,2,0,0|2,0,0]=4 22005 B16R2.24848 O=C1NCCCC1OC2CCCCCC2 7a_100000210887_100000687798 [0,0,0,2,0,0|2,0,0]=4 22006 B16R2.24848 O=C1NCCCC1SC2CCCCCC2 62a_100000687798_100011217769 [0,0,0,2,0,0|2,0,0]=4 22007 B16R2.24848 O=C1NCCCC1SC2CCCCCC2 62a_100011217769_100000687798 [0,0,0,2,0,0|2,0,0]=4 22008 B16R2.24865 O=C1CCCCN1CCNCC2CCC2 2230a_100160573077_100000763275 [0,0,0,2,0,0|2,0,0]=4 22009 B16R2.24865 O=C1CCCCN1CCNCC2CCC2 269862a_100160573077_100000753134 [0,0,0,2,0,0|2,0,0]=4 22010 B16R2.24865 O=C1CCCCN1CCNCC2CCC2 34a_100160573077_100000763275 [0,0,0,2,0,0|2,0,0]=4 22011 B16R2.28409 C=CCC1CCCCC1NCC2CCC2 269862a_100000738700_100011214939 [0,0,0,2,0,0|2,0,0]=4 22012 B16R2.28409 C=CCC1CCCCC1NCC2CCC2 270004a_100000738700_100011214939 [0,0,0,2,0,0|2,0,0]=4 22013 B16R2.85184 O=C1CCCN1CCCNCC2CCC2 2230a_100000210347_100000763275 [0,0,0,2,0,0|2,0,0]=4 22014 B16R2.85184 O=C1CCCN1CCCNCC2CCC2 269862a_100000210347_100000753134 [0,0,0,2,0,0|2,0,0]=4 22015 B16R2.85184 O=C1CCCN1CCCNCC2CCC2 34a_100000210347_100000763275 [0,0,0,2,0,0|2,0,0]=4 22016 B16R2.85184 O=C1CCCN1CCCOCC2CCC2 34a_100011216539_100000763275 [0,0,0,2,0,0|2,0,0]=4 22017 B16R2.85184 O=C1CCCN1CCCOCC2CCC2 7a_100011216539_100000763275 [0,0,0,2,0,0|2,0,0]=4 22018 B16R2.602 CCCC1CCCCC1OC2CCC2=O 34a_100011217265_100009892977 [0,0,0,2,0,0|1,0,0]=3 22019 B16R2.602 CCCC1CCCCC1OC2CCC2=O 7a_100011217265_100009892977 [0,0,0,2,0,0|1,0,0]=3 22020 B16R2.611 C=CCC1CCCCC1N2CCC[C@@H]2C 270004a_100020605311_100011214939 [0,0,0,2,0,0|2,0,0]=4 22021 B16R2.611 C=CCC1CCCCC1N2CCC[C@H]2C 270004a_100015189458_100011214939 [0,0,0,2,0,0|2,0,0]=4 22022 B16R2.611 CCCC1CCCCN1C2CCCC2=O 2230a_100000701414_100000211823 [0,0,0,2,0,0|1,0,0]=3 22023 B16R2.611 CCCC1CCCCN1C2CCCC2=O 269982a_100000701414_100000211823 [0,0,0,2,0,0|1,0,0]=3 22024 B16R2.611 CCCC1CCCCN1C2CCCC2=O 34a_100000701414_100000709159 [0,0,0,2,0,0|1,0,0]=3 22025 B16R2.611 CCCC1CCCCN1C2CCOC2=O 2230a_100000701414_100000211211 [0,0,0,2,0,0|2,0,0]=4 22026 B16R2.611 CCCC1CCCCN1C2CCOC2=O 269982a_100000701414_100000211211 [0,0,0,2,0,0|2,0,0]=4 22027 B16R2.611 CCCC1CCCCN1C2CCOC2=O 34a_100000701414_100000211211 [0,0,0,2,0,0|2,0,0]=4 22028 B16R2.611 CCCC1COCCN1C2CCCC2=O 2230a_102495339903_100000211823 [0,0,0,2,0,0|2,0,0]=4 22029 B16R2.611 CCCC1COCCN1C2CCCC2=O 269982a_102495339903_100000211823 [0,0,0,2,0,0|2,0,0]=4 22030 B16R2.611 CCCC1COCCN1C2CCCC2=O 34a_102495339903_100000709159 [0,0,0,2,0,0|2,0,0]=4 22031 B16R2.611 COCC1CCCCN1C2CCCC2=O 2230a_100015184032_100000211823 [0,0,0,2,0,0|2,0,0]=4 22032 B16R2.611 COCC1CCCCN1C2CCCC2=O 269982a_100015184032_100000211823 [0,0,0,2,0,0|2,0,0]=4 22033 B16R2.611 COCC1CCCCN1C2CCCC2=O 34a_100015184032_100000709159 [0,0,0,2,0,0|2,0,0]=4 22034 B16R2.611 O=C1CCCC1N2CCCCC2CCO 2230a_100000211664_100000211823 [0,0,0,2,0,0|2,0,0]=4 22035 B16R2.611 O=C1CCCC1N2CCCCC2CCO 269982a_100000211664_100000211823 [0,0,0,2,0,0|2,0,0]=4 22036 B16R2.611 O=C1CCCC1N2CCCCC2CCO 34a_100000211664_100000709159 [0,0,0,2,0,0|2,0,0]=4 22037 B16R2.2304 C=CCC1CCCCC1NC2CCCC2 269862a_100000211070_100011214939 [0,0,0,2,0,0|2,0,0]=4 22038 B16R2.2304 C=CCC1CCCCC1NC2CCCC2 270004a_100000211070_100011214939 [0,0,0,2,0,0|2,0,0]=4 22039 B16R2.2304 O=CCN1CCCCC1CN2CCCC2 2230a_200011224931_200015260668 [0,0,0,2,0,0|2,0,0]=4 22040 B16R2.2304 O=CCN1CCCCC1CN2CCCC2 269982a_200011224931_200015260668 [0,0,0,2,0,0|2,0,0]=4 22041 B16R2.28389 C=CCC1CCCCC1NCCC2CC2 269862a_100000764129_100011214939 [0,0,0,2,0,0|2,0,0]=4 22042 B16R2.28389 C=CCC1CCCCC1NCCC2CC2 270004a_100000764129_100011214939 [0,0,0,2,0,0|2,0,0]=4 22043 B16R2.28308 CCN1C[C@H]2C[C@@H]1CN2CCCCC=O 2230a_200016994038_100000139335 [0,0,0,2,0,0|2,0,0]=4 22044 B16R2.28308 CCN1C[C@H]2C[C@@H]1CN2CCCCC=O 269982a_200016994038_100000139335 [0,0,0,2,0,0|2,0,0]=4 22045 B16R2.111 O=CCN[C@@H]1CCCC[C@H]1N2CCCC2 34a_100009820197_200009817547 [0,0,0,2,0,0|2,0,0]=4 22046 B16R2.290 O=C1CCC1CCNCCC2CCCC2 2230a_100000739158_200016118888 [0,0,0,2,0,0|1,0,0]=3 22047 B16R2.290 O=C1CCC1CCOCCC2CCCC2 7a_100000749090_200016118888 [0,0,0,2,0,0|1,0,0]=3 22048 B16R2.290 O=C1CCC1CCSCCC2CCCC2 62a_100000760354_200016118888 [0,0,0,2,0,0|1,0,0]=3 22049 B16R2.290 O=C1CCC1CCSCCC2CCCC2 62a_200016118888_100000760354 [0,0,0,2,0,0|1,0,0]=3 22050 B16R2.290 O=C1CCC1CCSCCN2CCCC2 62a_100000700749_200016118888 [0,0,0,2,0,0|2,0,0]=4 22051 B16R2.290 O=C1CCC1CCSCCN2CCCC2 62a_200016118888_100000004467 [0,0,0,2,0,0|2,0,0]=4 22052 B16R2.290 O=C1CCC1NCCCOC2CCCC2 34a_100000747560_100009892977 [0,0,0,2,0,0|2,0,0]=4 22053 B16R2.533 C=CCCCN1CCCC1C2CCCC2 2230a_100000743374_100011713584 [0,0,0,2,0,0|2,0,0]=4 22054 B16R2.533 C=CCCCN1CCCC1C2CCCC2 269982a_100000743374_100000757094 [0,0,0,2,0,0|2,0,0]=4 22055 B16R2.533 C=CCCCN1CCCC1C2CCCC2 34a_100000743374_100000757094 [0,0,0,2,0,0|2,0,0]=4 22056 B16R2.533 C=CCCNC1CCCC1C2CCCC2 269862a_100015191253_100011216175 [0,0,0,2,0,0|2,0,0]=4 22057 B16R2.533 C=CCCNC1CCCC1C2CCCC2 270004a_100015191253_100011216175 [0,0,0,2,0,0|2,0,0]=4 22058 B16R2.533 O=CCCCN1CCCC1C2CCCC2 2230a_100000743374_200011292268 [0,0,0,2,0,0|1,0,0]=3 22059 B16R2.533 O=CCCCN1CCCC1C2CCCC2 269982a_100000743374_200011292268 [0,0,0,2,0,0|1,0,0]=3 22060 B16R2.3018 O=C1CCCC1NCCCC2CCCC2 2230a_100000736752_100000211823 [0,0,0,2,0,0|1,0,0]=3 22061 B16R2.3018 O=C1CCCC1NCCCC2CCCC2 34a_100000736752_100000709159 [0,0,0,2,0,0|1,0,0]=3 22062 B16R2.3018 O=C1CCCC1NCCOC2CCCC2 34a_100000741755_100000709159 [0,0,0,2,0,0|2,0,0]=4 22063 B16R2.3018 O=C1CCCC1OCCCC2CCCC2 34a_100011215328_100000709159 [0,0,0,2,0,0|1,0,0]=3 22064 B16R2.3018 O=C1CCCC1OCCCC2CCCC2 34a_200000719330_100011713738 [0,0,0,2,0,0|1,0,0]=3 22065 B16R2.3018 O=C1CCCC1OCCCC2CCCC2 7a_100011215328_100000211823 [0,0,0,2,0,0|1,0,0]=3 22066 B16R2.3018 O=C1CCCC1OCCCN2CCCC2 34a_200000719330_100016991639 [0,0,0,2,0,0|2,0,0]=4 22067 B16R2.3018 O=C1CCCC1OCCNC2CCCC2 34a_200000200444_100000709159 [0,0,0,2,0,0|2,0,0]=4 22068 B16R2.3018 O=C1CCCC1OCCOC2CCCC2 34a_100000738311_100000709159 [0,0,0,2,0,0|2,0,0]=4 22069 B16R2.3018 O=C1CCCC1OCCOC2CCCC2 7a_100000738311_100000211823 [0,0,0,2,0,0|2,0,0]=4 22070 B16R2.3018 O=C1CCCC1SCCCC2CCCC2 62a_100000211823_100011713738 [0,0,0,2,0,0|1,0,0]=3 22071 B16R2.3018 O=C1CCCC1SCCCC2CCCC2 62a_100011713738_100000211823 [0,0,0,2,0,0|1,0,0]=3 22072 B16R2.3018 O=C1CCCC1SCCCN2CCCC2 62a_100000211823_100011445909 [0,0,0,2,0,0|2,0,0]=4 22073 B16R2.3018 O=C1CCCC1SCCCN2CCCC2 62a_100016991639_100000211823 [0,0,0,2,0,0|2,0,0]=4 22074 B16R2.3018 O=C1CCCN1CCCNC2CCCC2 2230a_100000210347_100000179811 [0,0,0,2,0,0|2,0,0]=4 22075 B16R2.3018 O=C1CCCN1CCCNC2CCCC2 270004a_100000210347_100000210133 [0,0,0,2,0,0|2,0,0]=4 22076 B16R2.3018 O=C1CCCN1CCCNC2CCCC2 34a_100000210347_100000179811 [0,0,0,2,0,0|2,0,0]=4 22077 B16R2.3018 O=C1CCCN1CCCOC2CCCC2 34a_100011216539_100000179811 [0,0,0,2,0,0|2,0,0]=4 22078 B16R2.3018 O=C1CCCN1CCCOC2CCCC2 7a_100011216539_100000179811 [0,0,0,2,0,0|2,0,0]=4 22079 B16R2.3018 O=C1CCCN1CCNCC2CCCC2 2230a_100000737975_100000739059 [0,0,0,2,0,0|2,0,0]=4 22080 B16R2.3018 O=C1CCCN1CCNCC2CCCC2 2230a_100011200922_100000740388 [0,0,0,2,0,0|2,0,0]=4 22081 B16R2.3018 O=C1CCCN1CCNCC2CCCC2 269862a_100011200922_100000746403 [0,0,0,2,0,0|2,0,0]=4 22082 B16R2.3018 O=C1CCCN1CCNCC2CCCC2 34a_100000737975_100000739059 [0,0,0,2,0,0|2,0,0]=4 22083 B16R2.3018 O=C1CCCN1CCOCC2CCCC2 34a_100000211209_100000740388 [0,0,0,2,0,0|2,0,0]=4 22084 B16R2.3018 O=C1CCCN1CCOCC2CCCC2 34a_100000742336_100000739059 [0,0,0,2,0,0|2,0,0]=4 22085 B16R2.3018 O=C1CCCN1CCOCC2CCCC2 7a_100000211209_100000740388 [0,0,0,2,0,0|2,0,0]=4 22086 B16R2.3018 O=C1CCCN1CCOCC2CCCC2 7a_100000742336_100000739059 [0,0,0,2,0,0|2,0,0]=4 22087 B16R2.3018 O=C1CCCN1CCSCC2CCCC2 62a_100000739059_100000740388 [0,0,0,2,0,0|2,0,0]=4 22088 B16R2.3018 O=C1CCCN1CCSCC2CCCC2 62a_100000740388_100000739059 [0,0,0,2,0,0|2,0,0]=4 22089 B16R2.3018 O=C1CCCN1CSCCC2CCCC2 62a_100000026320_100000760354 [0,0,0,2,0,0|2,0,0]=4 22090 B16R2.3018 O=C1CCCN1CSCCC2CCCC2 62a_100000760354_100000026320 [0,0,0,2,0,0|2,0,0]=4 22091 B16R2.3018 O=C1NCCC1COCCC2CCCC2 34a_100000133458_100000760354 [0,0,0,2,0,0|2,0,0]=4 22092 B16R2.3018 O=C1NCCC1NCCCC2CCCC2 2230a_100016995588_100011713738 [0,0,0,2,0,0|2,0,0]=4 22093 B16R2.3018 O=C1NCCC1NCCCC2CCCC2 34a_100016995588_100011713738 [0,0,0,2,0,0|2,0,0]=4 22094 B16R2.3018 O=C1NCC[C@@H]1OCCCC2CCCC2 34a_100000688343_100011713738 [0,0,0,2,0,0|2,0,0]=4 22095 B16R2.3018 O=C1OCCC1NCCCC2CCCC2 2230a_100000736752_100000211211 [0,0,0,2,0,0|2,0,0]=4 22096 B16R2.3018 O=C1OCCC1NCCCC2CCCC2 34a_100000736752_100000211211 [0,0,0,2,0,0|2,0,0]=4 22097 B16R2.3018 O=C1OCCC1OCCCC2CCCC2 34a_100011215328_100000211211 [0,0,0,2,0,0|2,0,0]=4 22098 B16R2.3018 O=C1OCCC1OCCCC2CCCC2 7a_100011215328_100000211211 [0,0,0,2,0,0|2,0,0]=4 22099 B16R2.3018 O=C1OCCC1SCCCC2CCCC2 62a_100000211211_100011713738 [0,0,0,2,0,0|2,0,0]=4 22100 B16R2.3018 O=C1OCCC1SCCCC2CCCC2 62a_100011713738_100000211211 [0,0,0,2,0,0|2,0,0]=4 22101 B16R2.5333 C1=CC(CCCCC1)OCC2CCCC2 34a_100000688657_100000740388 [0,0,0,2,0,0|2,0,0]=4 22102 B16R2.2089 CC1C2CCCN2CCN1CCCC=O 2230a_200000066283_200011292268 [0,0,0,2,0,0|2,0,0]=4 22103 B16R2.2089 CC1C2CCCN2CCN1CCCC=O 269982a_200000066283_200011292268 [0,0,0,2,0,0|2,0,0]=4 22104 B16R2.2544 CCC1CCCN1CCN2CCCC2=O 2230a_100000754278_100000739059 [0,0,0,2,0,0|2,0,0]=4 22105 B16R2.2544 CCC1CCCN1CCN2CCCC2=O 269982a_100000754278_100000739059 [0,0,0,2,0,0|2,0,0]=4 22106 B16R2.2544 CCC1CCCN1CCN2CCCC2=O 34a_100000754278_100000739059 [0,0,0,2,0,0|2,0,0]=4 22107 B16R2.2544 CCN1CCCC1CNC2CCCC2=O 2230a_100000211693_100000211823 [0,0,0,2,0,0|2,0,0]=4 22108 B16R2.2544 CCN1CCC[C@@H]1COC2CCCC2=O 34a_100011739246_100000709159 [0,0,0,2,0,0|2,0,0]=4 22109 B16R2.2544 CCN1CCC[C@@H]1COC2CCCC2=O 7a_100011739246_100000211823 [0,0,0,2,0,0|2,0,0]=4 22110 B16R2.3136 C=CCCCOC1CCC2CCCC2C1 34a_100000073670_100000757094 [0,0,0,2,0,0|2,0,0]=4 22111 B16R2.3136 C=CCCCOC1CCC2CCCC2C1 7a_100000073670_100000757094 [0,0,0,2,0,0|2,0,0]=4 22112 B16R2.3136 O=CCCCCN1CCN2CCC[C@@H]2C1 2230a_100000008389_100000139335 [0,0,0,2,0,0|2,0,0]=4 22113 B16R2.3136 O=CCCCCN1CCN2CCC[C@@H]2C1 269982a_100000008389_100000139335 [0,0,0,2,0,0|2,0,0]=4 22114 B16R2.3136 O=CCCCOC1CCC2CCCC2C1 7a_100000073670_200011292268 [0,0,0,2,0,0|1,0,0]=3 22115 B16R2.11181 C=CCCCCCCN1CCCC12CC2 2230a_100020620911_100011215473 [0,0,0,2,0,0|2,0,0]=4 22116 B16R2.11181 C=CCCCCCCN1CCCC12CC2 269982a_100020620911_100011215473 [0,0,0,2,0,0|2,0,0]=4 22117 B16R2.11181 C=CCCCCCCN1CCCC12CC2 34a_100020620911_100011215473 [0,0,0,2,0,0|2,0,0]=4 22118 B16R2.30013 C=CCCN1C(CCC2C1CCCC2)C 2230a_100132302184_100000754431 [0,0,0,2,0,0|2,0,0]=4 22119 B16R2.30013 C=CCCN1C(CCC2C1CCCC2)C 269982a_100132302184_100000754431 [0,0,0,2,0,0|2,0,0]=4 22120 B16R2.30013 C=CCCN1C(CCC2C1CCCC2)C 34a_100132302184_100000754431 [0,0,0,2,0,0|2,0,0]=4 22121 B16R2.2451 CCC1CCCCC1NC2CCNC2=O 270004a_100016995588_100000757040 [0,0,0,2,0,0|2,0,0]=4 22122 B16R2.2451 CCC1CCCCC1OC2CCCC2=O 34a_100000210738_100000709159 [0,0,0,2,0,0|1,0,0]=3 22123 B16R2.2451 CCC1CCCCC1OC2CCCC2=O 7a_100000210738_100000211823 [0,0,0,2,0,0|1,0,0]=3 22124 B16R2.2451 CCC1CCCCC1OC2CCOC2=O 34a_100000210738_100000211211 [0,0,0,2,0,0|2,0,0]=4 22125 B16R2.2451 CCC1CCCCC1OC2CCOC2=O 7a_100000210738_100000211211 [0,0,0,2,0,0|2,0,0]=4 22126 B16R2.2451 CCC1CCCCN1CN2CCCC2=O 269982a_100000210034_100000026320 [0,0,0,2,0,0|2,0,0]=4 22127 B16R2.2451 CN[C@@H]1CCCC[C@H]1OC2CCCC2=O 34a_100000708425_100000709159 [0,0,0,2,0,0|2,0,0]=4 22128 B16R2.2451 COC1CCCCC1NC2CCCC2=O 34a_100011208099_100000709159 [0,0,0,2,0,0|2,0,0]=4 22129 B16R2.2451 CO[C@H]1CCCC[C@@H]1OC2CCCC2=O 34a_200009815850_100000709159 [0,0,0,2,0,0|2,0,0]=4 22130 B16R2.2451 CO[C@H]1CCCC[C@@H]1OC2CCCC2=O 7a_200009815850_100000211823 [0,0,0,2,0,0|2,0,0]=4 22131 B16R2.2451 NCC1CCCCC1OC2CCCC2=O 34a_100011216029_100000709159 [0,0,0,2,0,0|2,0,0]=4 22132 B16R2.2468 CCC1CCCCN1CCC2CCC2=O 2230a_100000210034_200016118888 [0,0,0,2,0,0|1,0,0]=3 22133 B16R2.2468 CCC1CCCCN1CCC2CCC2=O 269982a_100000210034_200016118888 [0,0,0,2,0,0|1,0,0]=3 22134 B16R2.2468 CCN1CCCCC1CNC2CCC2=O 34a_100000754393_100009892977 [0,0,0,2,0,0|2,0,0]=4 22135 B16R2.2468 CCN1CCCCC1COC2CCC2=O 34a_100000225091_100009892977 [0,0,0,2,0,0|2,0,0]=4 22136 B16R2.2468 CCN1CCCCC1COC2CCC2=O 7a_100000225091_100009892977 [0,0,0,2,0,0|2,0,0]=4 22137 B16R2.2468 CC[C@H]1COCCN1CCC2CCC2=O 2230a_100016988097_200016118888 [0,0,0,2,0,0|2,0,0]=4 22138 B16R2.2468 CC[C@H]1COCCN1CCC2CCC2=O 269982a_100016988097_200016118888 [0,0,0,2,0,0|2,0,0]=4 22139 B16R2.2468 O=C1CCC1CCN2CCCCC2CO 2230a_100000210821_200016118888 [0,0,0,2,0,0|2,0,0]=4 22140 B16R2.2468 O=C1CCC1CCN2CCCCC2CO 269982a_100000210821_200016118888 [0,0,0,2,0,0|2,0,0]=4 22141 B16R2.4246 O=CCCCCCN1C2CCC1COC2 2230a_100015205251_100000139337 [0,0,0,2,0,0|2,0,0]=4 22142 B16R2.4246 O=CCCCCCN1C2CCC1COC2 269982a_100015205251_100000139337 [0,0,0,2,0,0|2,0,0]=4 22143 B16R2.27834 CC1CN2CCCC2CN1CCCC=O 2230a_200159271516_200011292268 [0,0,0,2,0,0|2,0,0]=4 22144 B16R2.27834 CC1CN2CCCC2CN1CCCC=O 269982a_200159271516_200011292268 [0,0,0,2,0,0|2,0,0]=4 22145 B16R2.885 COCCC1CCCCN1C2CCC2=O 269982a_100015186528_100009892977 [0,0,0,2,0,0|2,0,0]=4 22146 B16R2.885 COCCC1CCCCN1C2CCC2=O 34a_100015186528_100009892977 [0,0,0,2,0,0|2,0,0]=4 22147 B16R2.885 O=C1CCC1N2CCCCC2CCCO 269982a_100011934581_100009892977 [0,0,0,2,0,0|2,0,0]=4 22148 B16R2.885 O=C1CCC1N2CCCCC2CCCO 34a_100011934581_100009892977 [0,0,0,2,0,0|2,0,0]=4 22149 B16R2.639 CCCC1CCCC1NC2CCNC2=O 270004a_100016995588_100000723119 [0,0,0,2,0,0|2,0,0]=4 22150 B16R2.657 CCCN1CCCC1COC2CCC2=O 34a_200000694710_100009892977 [0,0,0,2,0,0|2,0,0]=4 22151 B16R2.657 CCCN1CCCC1COC2CCC2=O 7a_200000694710_100009892977 [0,0,0,2,0,0|2,0,0]=4 22152 B16R2.657 COC[C@@H]1CCCN1CCC2CCC2=O 2230a_100020646714_200016118888 [0,0,0,2,0,0|2,0,0]=4 22153 B16R2.657 COC[C@@H]1CCCN1CCC2CCC2=O 269982a_100020646714_200016118888 [0,0,0,2,0,0|2,0,0]=4 22154 B16R2.4219 C=CCCCCCN1CCCC1C2CC2 2230a_200000757794_100000700193 [0,0,0,2,0,0|2,0,0]=4 22155 B16R2.4219 C=CCCCCCN1CCCC1C2CC2 269982a_200000757794_100000700193 [0,0,0,2,0,0|2,0,0]=4 22156 B16R2.4219 C=CCCCCCN1CCCC1C2CC2 34a_200000757794_100000700193 [0,0,0,2,0,0|2,0,0]=4 22157 B16R2.4219 O=CCCCCCN1CCCC1C2CC2 2230a_200000757794_100000139337 [0,0,0,2,0,0|1,0,0]=3 22158 B16R2.4219 O=CCCCCCN1CCCC1C2CC2 269982a_200000757794_100000139337 [0,0,0,2,0,0|1,0,0]=3 22159 B16R2.34596 CN1C[C@@H]2C[C@H]1CN2CCCCCC=O 2230a_100025763010_100000139337 [0,0,0,2,0,0|2,0,0]=4 22160 B16R2.34596 CN1C[C@@H]2C[C@H]1CN2CCCCCC=O 269982a_100025763010_100000139337 [0,0,0,2,0,0|2,0,0]=4 22161 B16R2.205223 C=CCCCNCC12CCCC1CCC2 2230a_100159271432_100011713584 [0,0,0,2,0,0|2,0,0]=4 22162 B16R2.205223 C=CCCCNCC12CCCC1CCC2 34a_100159271432_100000757094 [0,0,0,2,0,0|2,0,0]=4 22163 B16R2.205223 O=CCCCNCC12CCCC1CCC2 2230a_100159271432_200011292268 [0,0,0,2,0,0|1,0,0]=3 22164 B16R2.205223 O=CCCCOCC12CCCN1CCC2 7a_100000722608_200011292268 [0,0,0,2,0,0|2,0,0]=4 22165 B16R2.1295 C=CCCCCCN1C[C@H]2CCC[C@H]2C1 2230a_100102946302_100000700193 [0,0,0,2,0,0|2,0,0]=4 22166 B16R2.1295 C=CCCCCCN1C[C@H]2CCC[C@H]2C1 269982a_100102946302_100000700193 [0,0,0,2,0,0|2,0,0]=4 22167 B16R2.1295 C=CCCCCCN1C[C@H]2CCC[C@H]2C1 34a_100102946302_100000700193 [0,0,0,2,0,0|2,0,0]=4 22168 B16R2.1295 O=CCCCCCN1C[C@H]2CCC[C@H]2C1 2230a_100102946302_100000139337 [0,0,0,2,0,0|1,0,0]=3 22169 B16R2.1295 O=CCCCCCN1C[C@H]2CCC[C@H]2C1 269982a_100102946302_100000139337 [0,0,0,2,0,0|1,0,0]=3 22170 B16R2.1295 O=CCCCCCN1C[C@H]2COC[C@H]2C1 2230a_100000700037_100000139337 [0,0,0,2,0,0|2,0,0]=4 22171 B16R2.1295 O=CCCCCCN1C[C@H]2COC[C@H]2C1 269982a_100000700037_100000139337 [0,0,0,2,0,0|2,0,0]=4 22172 B16R2.23378 O=C1CCCC1NC2CCCCCCC2 2230a_100000211152_100000211823 [0,0,0,2,0,0|1,0,0]=3 22173 B16R2.23378 O=C1CCCC1NC2CCCCCCC2 34a_100000211152_100000709159 [0,0,0,2,0,0|1,0,0]=3 22174 B16R2.23378 O=C1CCCC1OC2CCCCCCC2 34a_100000210054_100000709159 [0,0,0,2,0,0|1,0,0]=3 22175 B16R2.23378 O=C1CCCC1OC2CCCCCCC2 7a_100000210054_100000211823 [0,0,0,2,0,0|1,0,0]=3 22176 B16R2.23378 O=C1CCCN1CN2CCCCCCC2 269982a_100000211400_100000026320 [0,0,0,2,0,0|2,0,0]=4 22177 B16R2.23378 O=C1NCCC1NC2CCCCCCC2 270004a_100016995588_100000210524 [0,0,0,2,0,0|2,0,0]=4 22178 B16R2.23378 O=C1OCCC1NC2CCCCCCC2 2230a_100000211152_100000211211 [0,0,0,2,0,0|2,0,0]=4 22179 B16R2.23378 O=C1OCCC1NC2CCCCCCC2 34a_100000211152_100000211211 [0,0,0,2,0,0|2,0,0]=4 22180 B16R2.23378 O=C1OCCC1OC2CCCCCCC2 34a_100000210054_100000211211 [0,0,0,2,0,0|2,0,0]=4 22181 B16R2.23378 O=C1OCCC1OC2CCCCCCC2 7a_100000210054_100000211211 [0,0,0,2,0,0|2,0,0]=4 22182 B16R2.26039 O=C1CCC1CCN2CCCCCCC2 2230a_100000211400_200016118888 [0,0,0,2,0,0|1,0,0]=3 22183 B16R2.26039 O=C1CCC1CCN2CCCCCCC2 269982a_100000211400_200016118888 [0,0,0,2,0,0|1,0,0]=3 22184 B16R2.26039 O=C1CCC1OCC2CCCCCCC2 34a_100011216312_100009892977 [0,0,0,2,0,0|1,0,0]=3 22185 B16R2.26039 O=C1CCC1OCC2CCCCCCC2 7a_100011216312_100009892977 [0,0,0,2,0,0|1,0,0]=3 22186 B16R2.3222 CC1CCCC1NCCN2CCCC2=O 269862a_100011200922_100000752053 [0,0,0,2,0,0|2,0,0]=4 22187 B16R2.3222 CC1CCCC1OCCN2CCCC2=O 34a_100011216460_100000739059 [0,0,0,2,0,0|2,0,0]=4 22188 B16R2.3222 CC1CCCC1OCCN2CCCC2=O 7a_100011216460_100000739059 [0,0,0,2,0,0|2,0,0]=4 22189 B16R2.3222 CN1CCCC1CCOC2CCCC2=O 34a_100011215177_100000709159 [0,0,0,2,0,0|2,0,0]=4 22190 B16R2.3222 CN1CCCC1CCOC2CCCC2=O 34a_200000719330_100000005710 [0,0,0,2,0,0|2,0,0]=4 22191 B16R2.3222 CN1CCCC1CCOC2CCCC2=O 7a_100011215177_100000211823 [0,0,0,2,0,0|2,0,0]=4 22192 B16R2.3222 CN1CCCC1CCSC2CCCC2=O 62a_100000005710_100000211823 [0,0,0,2,0,0|2,0,0]=4 22193 B16R2.3222 CN1CCCC1CCSC2CCCC2=O 62a_100000211823_100000005710 [0,0,0,2,0,0|2,0,0]=4 22194 B16R2.12704 O=C1CCCN1CCCNCCC2CC2 2230a_100000210347_100000694398 [0,0,0,2,0,0|2,0,0]=4 22195 B16R2.12704 O=C1CCCN1CCCNCCC2CC2 34a_100000210347_100000694398 [0,0,0,2,0,0|2,0,0]=4 22196 B16R2.12704 O=C1CCCN1CCCOCCC2CC2 34a_100011216539_100000694398 [0,0,0,2,0,0|2,0,0]=4 22197 B16R2.12704 O=C1CCCN1CCCOCCC2CC2 7a_100011216539_100000764125 [0,0,0,2,0,0|2,0,0]=4 22198 B16R2.12829 O=C1CCCC1NCC2CCCCCC2 2230a_100015204231_100000211823 [0,0,0,2,0,0|1,0,0]=3 22199 B16R2.12829 O=C1CCCC1NCC2CCCCCC2 34a_100015204231_100000709159 [0,0,0,2,0,0|1,0,0]=3 22200 B16R2.12829 O=C1CCCC1OCC2CCCCCC2 34a_100000699130_100000709159 [0,0,0,2,0,0|1,0,0]=3 22201 B16R2.12829 O=C1CCCC1OCC2CCCCCC2 34a_200000719330_200000696569 [0,0,0,2,0,0|1,0,0]=3 22202 B16R2.12829 O=C1CCCC1OCC2CCCCCC2 7a_100000699130_100000211823 [0,0,0,2,0,0|1,0,0]=3 22203 B16R2.12829 O=C1CCCC1SCC2CCCCCC2 62a_100000211823_200000696569 [0,0,0,2,0,0|1,0,0]=3 22204 B16R2.12829 O=C1CCCC1SCC2CCCCCC2 62a_200000696569_100000211823 [0,0,0,2,0,0|1,0,0]=3 22205 B16R2.12829 O=C1CCCN1CCN2CCCCCC2 2230a_100000185865_100000739059 [0,0,0,2,0,0|2,0,0]=4 22206 B16R2.12829 O=C1CCCN1CCN2CCCCCC2 269982a_100000185865_100000739059 [0,0,0,2,0,0|2,0,0]=4 22207 B16R2.12829 O=C1CCCN1CCN2CCCCCC2 34a_100000185865_100000739059 [0,0,0,2,0,0|2,0,0]=4 22208 B16R2.12829 O=C1CCCN1CSC2CCCCCC2 62a_100000026320_100011217769 [0,0,0,2,0,0|2,0,0]=4 22209 B16R2.12829 O=C1CCCN1CSC2CCCCCC2 62a_100011217769_100000026320 [0,0,0,2,0,0|2,0,0]=4 22210 B16R2.12829 O=C1NCCC1COC2CCCCCC2 34a_100000133458_100011217769 [0,0,0,2,0,0|2,0,0]=4 22211 B16R2.12829 O=C1NCCC1NCC2CCCCCC2 2230a_100016995588_200000696569 [0,0,0,2,0,0|2,0,0]=4 22212 B16R2.12829 O=C1NCCC1NCC2CCCCCC2 34a_100016995588_200000696569 [0,0,0,2,0,0|2,0,0]=4 22213 B16R2.12829 O=C1NCC[C@@H]1OCC2CCCCCC2 34a_100000688343_200000696569 [0,0,0,2,0,0|2,0,0]=4 22214 B16R2.12829 O=C1OCCC1NCC2CCCCCC2 2230a_100015204231_100000211211 [0,0,0,2,0,0|2,0,0]=4 22215 B16R2.12829 O=C1OCCC1NCC2CCCCCC2 34a_100015204231_100000211211 [0,0,0,2,0,0|2,0,0]=4 22216 B16R2.12829 O=C1OCCC1OCC2CCCCCC2 34a_100000699130_100000211211 [0,0,0,2,0,0|2,0,0]=4 22217 B16R2.12829 O=C1OCCC1OCC2CCCCCC2 7a_100000699130_100000211211 [0,0,0,2,0,0|2,0,0]=4 22218 B16R2.12829 O=C1OCCC1SCC2CCCCCC2 62a_100000211211_200000696569 [0,0,0,2,0,0|2,0,0]=4 22219 B16R2.12829 O=C1OCCC1SCC2CCCCCC2 62a_200000696569_100000211211 [0,0,0,2,0,0|2,0,0]=4 22220 B16R2.12850 O=C1CCCC1N2CCCCCCCC2 2230a_100000039187_100000211823 [0,0,0,2,0,0|1,0,0]=3 22221 B16R2.12850 O=C1CCCC1N2CCCCCCCC2 269982a_100000039187_100000211823 [0,0,0,2,0,0|1,0,0]=3 22222 B16R2.12850 O=C1CCCC1N2CCCCCCCC2 34a_100000039187_100000709159 [0,0,0,2,0,0|1,0,0]=3 22223 B16R2.12850 O=C1OCCC1N2CCCCCCCC2 2230a_100000039187_100000211211 [0,0,0,2,0,0|2,0,0]=4 22224 B16R2.12850 O=C1OCCC1N2CCCCCCCC2 269982a_100000039187_100000211211 [0,0,0,2,0,0|2,0,0]=4 22225 B16R2.12850 O=C1OCCC1N2CCCCCCCC2 34a_100000039187_100000211211 [0,0,0,2,0,0|2,0,0]=4 22226 B16R2.23155 O=C1CCC1CCNC2CCCCCC2 2230a_100000210984_200016118888 [0,0,0,2,0,0|1,0,0]=3 22227 B16R2.23155 O=C1CCC1CCOC2CCCCCC2 7a_100000210887_200016118888 [0,0,0,2,0,0|1,0,0]=3 22228 B16R2.23155 O=C1CCC1CCSC2CCCCCC2 62a_100011217769_200016118888 [0,0,0,2,0,0|1,0,0]=3 22229 B16R2.23155 O=C1CCC1CCSC2CCCCCC2 62a_200016118888_100011217769 [0,0,0,2,0,0|1,0,0]=3 22230 B16R2.23155 O=C1CCC1NCCC2CCCCCC2 34a_100011532351_100009892977 [0,0,0,2,0,0|1,0,0]=3 22231 B16R2.23155 O=C1CCC1OCCN2CCCCCC2 34a_100000238007_100009892977 [0,0,0,2,0,0|2,0,0]=4 22232 B16R2.23155 O=C1CCC1SCCN2CCCCCC2 62a_100000722644_100009892977 [0,0,0,2,0,0|2,0,0]=4 22233 B16R2.23155 O=C1CCC1SCCN2CCCCCC2 62a_100009892977_100000722644 [0,0,0,2,0,0|2,0,0]=4