0 B9R0.45 C#CCCCCCCOC 34a_100011217361_200000210301 [0,0,0,0,0,0|2,0,2]=4 1 B9R0.45 C#CCCCCCCOC 34a_100138415774_100012276617 [0,0,0,0,0,0|2,0,2]=4 2 B9R0.45 C#CCCCCCCOC 7a_100011217361_200000210301 [0,0,0,0,0,0|2,0,2]=4 3 B9R0.45 C#CCCCCCCO[13CH3] 34a_100011217361_200025704644 [0,0,0,0,0,0|2,0,2]=4 4 B9R0.45 C#CCCCCCCO[13CH3] 7a_100011217361_200025704644 [0,0,0,0,0,0|2,0,2]=4 5 B9R0.45 C#CCCCCCNCC 2230a_100015525214_100012094781 [0,0,0,0,0,0|3,0,1]=4 6 B9R0.45 C#CCCCCCOCC 34a_100000766912_100000210202 [0,0,0,0,0,0|2,0,1]=3 7 B9R0.45 C#CCCCCCOCC 34a_100121572206_100012094781 [0,0,0,0,0,0|2,0,1]=3 8 B9R0.45 C#CCCCCCOCC 7a_100000766912_100000210202 [0,0,0,0,0,0|2,0,1]=3 9 B9R0.45 C#CCCCCCOCF 34a_100000766912_100015361967 [0,0,0,0,0,0|3,0,1]=4 10 B9R0.45 C#CCCCCCOCF 7a_100000766912_100015361967 [0,0,0,0,0,0|3,0,1]=4 11 B9R0.45 C#CCCCCCSCC 62a_100000210202_100012094781 [0,0,0,0,0,0|2,1,1]=4 12 B9R0.45 C#CCCCCCSCC 62a_100012094781_100000210202 [0,0,0,0,0,0|2,1,1]=4 13 B9R0.45 C#CCCCNCCOC 2230a_100000209980_100000731252 [0,0,0,0,0,0|2,0,2]=4 14 B9R0.45 C#CCCCNCCOC 34a_100000718082_100011201679 [0,0,0,0,0,0|2,0,2]=4 15 B9R0.45 C#CCCCOCCCC 34a_100000210227_100000695029 [0,0,0,0,0,0|2,0,2]=4 16 B9R0.45 C#CCCCOCCCC 34a_100000215630_100000210210 [0,0,0,0,0,0|2,0,2]=4 17 B9R0.45 C#CCCCOCCCC 7a_100000210227_100011215417 [0,0,0,0,0,0|2,0,2]=4 18 B9R0.45 C#CCCCOCCCC 7a_100000215630_100000210211 [0,0,0,0,0,0|2,0,2]=4 19 B9R0.45 C#CCCCOCCOC 34a_100000210237_100000695029 [0,0,0,0,0,0|1,0,2]=3 20 B9R0.45 C#CCCCOCCOC 34a_100000215630_100011201679 [0,0,0,0,0,0|1,0,2]=3 21 B9R0.45 C#CCCCOCCOC 7a_100000215630_100000233755 [0,0,0,0,0,0|1,0,2]=3 22 B9R0.45 C#CCCCOCCON 34a_100000700252_100000695029 [0,0,0,0,0,0|2,0,2]=4 23 B9R0.45 C#CCCCOCCSC 34a_100000215630_100000212216 [0,0,0,0,0,0|1,1,2]=4 24 B9R0.45 C#CCCCOCCSC 34a_100000230434_100000695029 [0,0,0,0,0,0|1,1,2]=4 25 B9R0.45 C#CCCCOCCSC 7a_100000215630_100000212216 [0,0,0,0,0,0|1,1,2]=4 26 B9R0.45 C#CCCCOCCSC 7a_100000230434_100011215417 [0,0,0,0,0,0|1,1,2]=4 27 B9R0.45 C#CCCCSCCOC 62a_100000233755_100011215417 [0,0,0,0,0,0|1,1,2]=4 28 B9R0.45 C#CCCCSCCOC 62a_100011215417_100000233755 [0,0,0,0,0,0|1,1,2]=4 29 B9R0.45 C#CCCCSCOCC 62a_100000739092_100011215417 [0,0,0,0,0,0|3,0,1]=4 30 B9R0.45 C#CCCCSCOCC 62a_100011215417_100000739092 [0,0,0,0,0,0|3,0,1]=4 31 B9R0.45 C#CCCNCCCCC 2230a_100000209983_100000688953 [0,0,0,0,0,0|3,0,1]=4 32 B9R0.45 C#CCCNCCCCC 34a_100000755551_100000718602 [0,0,0,0,0,0|3,0,1]=4 33 B9R0.45 C#CCCNCCOCC 2230a_102516460346_100000688953 [0,0,0,0,0,0|2,0,1]=3 34 B9R0.45 C#CCCNCCOCC 34a_100000755551_100000210147 [0,0,0,0,0,0|2,0,1]=3 35 B9R0.45 C#CCCNCCOCC 34a_102516460346_100000688953 [0,0,0,0,0,0|2,0,1]=3 36 B9R0.45 C#CCCNCCSCC 2230a_100000106463_100000688953 [0,0,0,0,0,0|2,1,1]=4 37 B9R0.45 C#CCCNCCSCC 34a_100000755551_100000757381 [0,0,0,0,0,0|2,1,1]=4 38 B9R0.45 C#CCCOC/C=C\CC 34a_100011215631_100103147603 [0,0,0,0,0,0|2,0,2]=4 39 B9R0.45 C#CCCOC/C=C\CC 34a_100016268518_100000688953 [0,0,0,0,0,0|2,0,2]=4 40 B9R0.45 C#CCCOCC#CCC 34a_100000032950_100000688953 [0,0,0,0,0,0|2,0,2]=4 41 B9R0.45 C#CCCOCC#CCC 34a_100011215631_100009813939 [0,0,0,0,0,0|2,0,2]=4 42 B9R0.45 C#CCCOCC/C=C/C 34a_100016278192_100000688953 [0,0,0,0,0,0|2,0,2]=4 43 B9R0.45 C#CCCOCCC#CC 34a_100000750427_100000688953 [0,0,0,0,0,0|2,0,2]=4 44 B9R0.45 C#CCCOCCCCBr 34a_100011216708_100000688953 [0,0,0,0,0,0|3,0,1]=4 45 B9R0.45 C#CCCOCCCCC 34a_100000210253_100000688953 [0,0,0,0,0,0|2,0,1]=3 46 B9R0.45 C#CCCOCCCCC 34a_100011215631_100000718602 [0,0,0,0,0,0|2,0,1]=3 47 B9R0.45 C#CCCOCCCCC 7a_100000210253_100000688953 [0,0,0,0,0,0|2,0,1]=3 48 B9R0.45 C#CCCOCCCCCl 34a_100000210776_100000688953 [0,0,0,0,0,0|3,0,1]=4 49 B9R0.45 C#CCCOCCCCCl 7a_100000210776_100000688953 [0,0,0,0,0,0|3,0,1]=4 50 B9R0.45 C#CCCOCCCCF 34a_100011215631_100000729493 [0,0,0,0,0,0|3,0,1]=4 51 B9R0.45 C#CCCOCCCCF 34a_100011995726_100000688953 [0,0,0,0,0,0|3,0,1]=4 52 B9R0.45 C#CCCOCCCCF 7a_100011995726_100000688953 [0,0,0,0,0,0|3,0,1]=4 53 B9R0.45 C#CCCOCCCCI 34a_200012148704_100000688953 [0,0,0,0,0,0|3,0,1]=4 54 B9R0.45 C#CCCOCCCCN 34a_100000750430_100000688953 [0,0,0,0,0,0|3,0,1]=4 55 B9R0.45 C#CCCOCCCCO 34a_100011215631_100011216708 [0,0,0,0,0,0|3,0,1]=4 56 B9R0.45 C#CCCOCCCNC 34a_100000213112_100000688953 [0,0,0,0,0,0|3,0,1]=4 57 B9R0.45 C#CCCOCCCOC 34a_100000740835_100000688953 [0,0,0,0,0,0|3,0,1]=4 58 B9R0.45 C#CCCOCCCOC 34a_100011215631_100000740836 [0,0,0,0,0,0|3,0,1]=4 59 B9R0.45 C#CCCOCCCSC 34a_100000690336_100000688953 [0,0,0,0,0,0|3,0,1]=4 60 B9R0.45 C#CCCOCCCSC 7a_100000690336_100000688953 [0,0,0,0,0,0|3,0,1]=4 61 B9R0.45 C#CCCOCCOC=C 34a_100000033082_100000688953 [0,0,0,0,0,0|1,0,3]=4 62 B9R0.45 C#CCCOCCOC=C 34a_100011215631_100000039644 [0,0,0,0,0,0|1,0,3]=4 63 B9R0.45 C#CCCOCCOCC 34a_100000210136_100000688953 [0,0,0,0,0,0|1,0,1]=2 64 B9R0.45 C#CCCOCCOCC 34a_100011215631_100000210147 [0,0,0,0,0,0|1,0,1]=2 65 B9R0.45 C#CCCOCCOCC 7a_100000210136_100000688953 [0,0,0,0,0,0|1,0,1]=2 66 B9R0.45 C#CCCOCCSCC 34a_100000212035_100000688953 [0,0,0,0,0,0|1,1,1]=3 67 B9R0.45 C#CCCOCCSCC 34a_100011215631_100000757381 [0,0,0,0,0,0|1,1,1]=3 68 B9R0.45 C#CCCOCCSCC 7a_100000212035_100000688953 [0,0,0,0,0,0|1,1,1]=3 69 B9R0.45 C#CCCSCCCCC 62a_100000210326_100000688953 [0,0,0,0,0,0|2,1,1]=4 70 B9R0.45 C#CCCSCCCCC 62a_100000688953_100000210326 [0,0,0,0,0,0|2,1,1]=4 71 B9R0.45 C#CCCSCCOCC 62a_100000210147_100000688953 [0,0,0,0,0,0|1,1,1]=3 72 B9R0.45 C#CCCSCCOCC 62a_100000688953_100011215890 [0,0,0,0,0,0|1,1,1]=3 73 B9R0.45 C#CCCSCCSCC 62a_100000688953_100000757381 [0,0,0,0,0,0|1,2,1]=4 74 B9R0.45 C#CCCSCCSCC 62a_100000757381_100000688953 [0,0,0,0,0,0|1,2,1]=4 75 B9R0.45 C#CCNCCCOCC 2230a_100000210961_100000038162 [0,0,0,0,0,0|3,0,1]=4 76 B9R0.45 C#CCNCCCOCC 34a_100000210961_100000184674 [0,0,0,0,0,0|3,0,1]=4 77 B9R0.45 C#CCNCCCOCC 34a_100000212058_100012232248 [0,0,0,0,0,0|3,0,1]=4 78 B9R0.45 C#CCOCCCOCC 34a_100000210247_100012232248 [0,0,0,0,0,0|3,0,1]=4 79 B9R0.45 C#CCOCCCOCC 34a_100000757476_100000184674 [0,0,0,0,0,0|3,0,1]=4 80 B9R0.45 C#CCOCCCOCC 7a_100000757476_100000038162 [0,0,0,0,0,0|3,0,1]=4 81 B9R0.45 C#CCSCCCOCC 62a_100000038162_100012232248 [0,0,0,0,0,0|3,0,1]=4 82 B9R0.45 C#CCSCOCCOC 62a_100000038162_100000231047 [0,0,0,0,0,0|2,0,2]=4 83 B9R0.45 C/C=C/CCOC/C=C/C 34a_100016278192_100102629194 [0,0,0,0,0,0|2,0,2]=4 84 B9R0.45 C/C=C/CCOCCCC 34a_100016278192_100000210210 [0,0,0,0,0,0|2,0,1]=3 85 B9R0.45 C/C=C/CCOCCCF 34a_100016278192_100011934791 [0,0,0,0,0,0|3,0,1]=4 86 B9R0.45 C/C=C/CCOCCCO 34a_100016278192_100000230001 [0,0,0,0,0,0|3,0,1]=4 87 B9R0.45 C/C=C/CCOCCOC 34a_100016278192_100011201679 [0,0,0,0,0,0|1,0,1]=2 88 B9R0.45 C/C=C/CCOCCSC 34a_100016278192_100000212216 [0,0,0,0,0,0|1,1,1]=3 89 B9R0.45 C/C=C/CNCCCOC 34a_100150723488_100102629194 [0,0,0,0,0,0|3,0,1]=4 90 B9R0.45 C/C=C/CNCCOCC 34a_102516460346_100102629194 [0,0,0,0,0,0|2,0,1]=3 91 B9R0.45 C/C=C/COC/C=C\CC 34a_100016268518_100102629194 [0,0,0,0,0,0|2,0,2]=4 92 B9R0.45 C/C=C/COC/C=C\CC 34a_100016270725_100103147603 [0,0,0,0,0,0|2,0,2]=4 93 B9R0.45 C/C=C/COCC#CCC 34a_100000032950_100102629194 [0,0,0,0,0,0|2,0,2]=4 94 B9R0.45 C/C=C/COCC#CCC 34a_100016270725_100009813939 [0,0,0,0,0,0|2,0,2]=4 95 B9R0.45 C/C=C/COCCCCBr 34a_100011216708_100102629194 [0,0,0,0,0,0|3,0,1]=4 96 B9R0.45 C/C=C/COCCCCC 34a_100000210253_100102629194 [0,0,0,0,0,0|2,0,1]=3 97 B9R0.45 C/C=C/COCCCCC 34a_100016270725_100000718602 [0,0,0,0,0,0|2,0,1]=3 98 B9R0.45 C/C=C/COCCCCC 7a_100000210253_100102629194 [0,0,0,0,0,0|2,0,1]=3 99 B9R0.45 C/C=C/COCCCCCl 34a_100000210776_100102629194 [0,0,0,0,0,0|3,0,1]=4 100 B9R0.45 C/C=C/COCCCCCl 7a_100000210776_100102629194 [0,0,0,0,0,0|3,0,1]=4 101 B9R0.45 C/C=C/COCCCCF 34a_100011995726_100102629194 [0,0,0,0,0,0|3,0,1]=4 102 B9R0.45 C/C=C/COCCCCF 34a_100016270725_100000729493 [0,0,0,0,0,0|3,0,1]=4 103 B9R0.45 C/C=C/COCCCCF 7a_100011995726_100102629194 [0,0,0,0,0,0|3,0,1]=4 104 B9R0.45 C/C=C/COCCCCI 34a_200012148704_100102629194 [0,0,0,0,0,0|3,0,1]=4 105 B9R0.45 C/C=C/COCCCCN 34a_100000750430_100102629194 [0,0,0,0,0,0|3,0,1]=4 106 B9R0.45 C/C=C/COCCCCO 34a_100016270725_100011216708 [0,0,0,0,0,0|3,0,1]=4 107 B9R0.45 C/C=C/COCCCNC 34a_100000213112_100102629194 [0,0,0,0,0,0|3,0,1]=4 108 B9R0.45 C/C=C/COCCCOC 34a_100000740835_100102629194 [0,0,0,0,0,0|3,0,1]=4 109 B9R0.45 C/C=C/COCCCOC 34a_100016270725_100000740836 [0,0,0,0,0,0|3,0,1]=4 110 B9R0.45 C/C=C/COCCCSC 34a_100000690336_100102629194 [0,0,0,0,0,0|3,0,1]=4 111 B9R0.45 C/C=C/COCCCSC 7a_100000690336_100102629194 [0,0,0,0,0,0|3,0,1]=4 112 B9R0.45 C/C=C/COCCOCC 34a_100000210136_100102629194 [0,0,0,0,0,0|1,0,1]=2 113 B9R0.45 C/C=C/COCCOCC 34a_100016270725_100000210147 [0,0,0,0,0,0|1,0,1]=2 114 B9R0.45 C/C=C/COCCOCC 7a_100000210136_100102629194 [0,0,0,0,0,0|1,0,1]=2 115 B9R0.45 C/C=C/COCCSCC 34a_100000212035_100102629194 [0,0,0,0,0,0|1,1,1]=3 116 B9R0.45 C/C=C/COCCSCC 34a_100016270725_100000757381 [0,0,0,0,0,0|1,1,1]=3 117 B9R0.45 C/C=C/COCCSCC 7a_100000212035_100102629194 [0,0,0,0,0,0|1,1,1]=3 118 B9R0.45 C/C=C/CSCCCCC 62a_100000210326_100102629194 [0,0,0,0,0,0|2,1,1]=4 119 B9R0.45 C/C=C/CSCCCCC 62a_100102629194_100000210326 [0,0,0,0,0,0|2,1,1]=4 120 B9R0.45 C/C=C/CSCCCOC 62a_100000709357_100102629194 [0,0,0,0,0,0|3,0,1]=4 121 B9R0.45 C/C=C/CSCCCOC 62a_100102629194_100000709357 [0,0,0,0,0,0|3,0,1]=4 122 B9R0.45 C/C=C/CSCCOCC 62a_100000210147_100102629194 [0,0,0,0,0,0|1,1,1]=3 123 B9R0.45 C/C=C/CSCCOCC 62a_100102629194_100011215890 [0,0,0,0,0,0|1,1,1]=3 124 B9R0.45 C/C=C/CSCCSCC 62a_100000757381_100102629194 [0,0,0,0,0,0|1,2,1]=4 125 B9R0.45 C/C=C/CSCCSCC 62a_100102629194_100000757381 [0,0,0,0,0,0|1,2,1]=4 126 B9R0.45 C=CCCCCCCOC 34a_100138415774_100011215473 [0,0,0,0,0,0|2,0,2]=4 127 B9R0.45 C=CCCCCCCOC 34a_200011216477_200000210301 [0,0,0,0,0,0|2,0,2]=4 128 B9R0.45 C=CCCCCCCOC 7a_200011216477_200000210301 [0,0,0,0,0,0|2,0,2]=4 129 B9R0.45 C=CCCCCCCO[13CH3] 34a_200011216477_200025704644 [0,0,0,0,0,0|2,0,2]=4 130 B9R0.45 C=CCCCCCCO[13CH3] 7a_200011216477_200025704644 [0,0,0,0,0,0|2,0,2]=4 131 B9R0.45 C=CCCCCCNCC 2230a_100015525214_100000700193 [0,0,0,0,0,0|3,0,1]=4 132 B9R0.45 C=CCCCCCOCC 34a_100011216702_100000210202 [0,0,0,0,0,0|2,0,1]=3 133 B9R0.45 C=CCCCCCOCC 34a_100121572206_100000700193 [0,0,0,0,0,0|2,0,1]=3 134 B9R0.45 C=CCCCCCOCC 7a_100011216702_100000210202 [0,0,0,0,0,0|2,0,1]=3 135 B9R0.45 C=CCCCCCOCF 34a_100011216702_100015361967 [0,0,0,0,0,0|3,0,1]=4 136 B9R0.45 C=CCCCCCOCF 7a_100011216702_100015361967 [0,0,0,0,0,0|3,0,1]=4 137 B9R0.45 C=CCCCCCSCC 62a_100000210202_100000700193 [0,0,0,0,0,0|2,1,1]=4 138 B9R0.45 C=CCCCCCSCC 62a_100000700193_100000210202 [0,0,0,0,0,0|2,1,1]=4 139 B9R0.45 C=CCCCNCCOC 2230a_100000209980_100011713584 [0,0,0,0,0,0|2,0,2]=4 140 B9R0.45 C=CCCCNCCOC 2230a_100000700776_100011201679 [0,0,0,0,0,0|2,0,2]=4 141 B9R0.45 C=CCCCNCCOC 34a_100000700776_100011201679 [0,0,0,0,0,0|2,0,2]=4 142 B9R0.45 C=CCCCOCCCC 34a_100000210227_100000757094 [0,0,0,0,0,0|2,0,2]=4 143 B9R0.45 C=CCCCOCCCC 34a_100000758997_100000210210 [0,0,0,0,0,0|2,0,2]=4 144 B9R0.45 C=CCCCOCCCC 7a_100000210227_100000757094 [0,0,0,0,0,0|2,0,2]=4 145 B9R0.45 C=CCCCOCCCC 7a_100000758997_100000210211 [0,0,0,0,0,0|2,0,2]=4 146 B9R0.45 C=CCCCOCCOC 34a_100000210237_100000757094 [0,0,0,0,0,0|1,0,2]=3 147 B9R0.45 C=CCCCOCCOC 34a_100000758997_100011201679 [0,0,0,0,0,0|1,0,2]=3 148 B9R0.45 C=CCCCOCCOC 7a_100000758997_100000233755 [0,0,0,0,0,0|1,0,2]=3 149 B9R0.45 C=CCCCOCCON 34a_100000700252_100000757094 [0,0,0,0,0,0|2,0,2]=4 150 B9R0.45 C=CCCCOCCSC 34a_100000230434_100000757094 [0,0,0,0,0,0|1,1,2]=4 151 B9R0.45 C=CCCCOCCSC 34a_100000758997_100000212216 [0,0,0,0,0,0|1,1,2]=4 152 B9R0.45 C=CCCCOCCSC 7a_100000230434_100000757094 [0,0,0,0,0,0|1,1,2]=4 153 B9R0.45 C=CCCCOCCSC 7a_100000758997_100000212216 [0,0,0,0,0,0|1,1,2]=4 154 B9R0.45 C=CCCCSCCOC 62a_100000233755_100000757094 [0,0,0,0,0,0|1,1,2]=4 155 B9R0.45 C=CCCCSCCOC 62a_100011713584_100000233755 [0,0,0,0,0,0|1,1,2]=4 156 B9R0.45 C=CCCCSCOCC 62a_100000739092_100000757094 [0,0,0,0,0,0|3,0,1]=4 157 B9R0.45 C=CCCCSCOCC 62a_100011713584_100000739092 [0,0,0,0,0,0|3,0,1]=4 158 B9R0.45 C=CCCNCCCCC 2230a_100000209983_100000754431 [0,0,0,0,0,0|3,0,1]=4 159 B9R0.45 C=CCCNCCCCC 2230a_100015191253_100000210326 [0,0,0,0,0,0|3,0,1]=4 160 B9R0.45 C=CCCNCCOCC 2230a_100015191253_100011215890 [0,0,0,0,0,0|2,0,1]=3 161 B9R0.45 C=CCCNCCOCC 2230a_102516460346_100000754431 [0,0,0,0,0,0|2,0,1]=3 162 B9R0.45 C=CCCNCCOCC 34a_102516460346_100000754431 [0,0,0,0,0,0|2,0,1]=3 163 B9R0.45 C=CCCNCCSCC 2230a_100000106463_100000754431 [0,0,0,0,0,0|2,1,1]=4 164 B9R0.45 C=CCCNCCSCC 2230a_100015191253_100000757381 [0,0,0,0,0,0|2,1,1]=4 165 B9R0.45 C=CCCOC/C=C\CC 34a_100011205117_100103147603 [0,0,0,0,0,0|2,0,2]=4 166 B9R0.45 C=CCCOC/C=C\CC 34a_100016268518_100000754431 [0,0,0,0,0,0|2,0,2]=4 167 B9R0.45 C=CCCOCC#CCC 34a_100000032950_100000754431 [0,0,0,0,0,0|2,0,2]=4 168 B9R0.45 C=CCCOCC#CCC 34a_100011205117_100009813939 [0,0,0,0,0,0|2,0,2]=4 169 B9R0.45 C=CCCOCC/C=C/C 34a_100016278192_100000754431 [0,0,0,0,0,0|2,0,2]=4 170 B9R0.45 C=CCCOCCC#CC 34a_100000750427_100000754431 [0,0,0,0,0,0|2,0,2]=4 171 B9R0.45 C=CCCOCCCCBr 34a_100011216708_100000754431 [0,0,0,0,0,0|3,0,1]=4 172 B9R0.45 C=CCCOCCCCC 34a_100000210253_100000754431 [0,0,0,0,0,0|2,0,1]=3 173 B9R0.45 C=CCCOCCCCC 34a_100011205117_100000718602 [0,0,0,0,0,0|2,0,1]=3 174 B9R0.45 C=CCCOCCCCC 7a_100000210253_100000754431 [0,0,0,0,0,0|2,0,1]=3 175 B9R0.45 C=CCCOCCCCCl 34a_100000210776_100000754431 [0,0,0,0,0,0|3,0,1]=4 176 B9R0.45 C=CCCOCCCCCl 7a_100000210776_100000754431 [0,0,0,0,0,0|3,0,1]=4 177 B9R0.45 C=CCCOCCCCF 34a_100011205117_100000729493 [0,0,0,0,0,0|3,0,1]=4 178 B9R0.45 C=CCCOCCCCF 34a_100011995726_100000754431 [0,0,0,0,0,0|3,0,1]=4 179 B9R0.45 C=CCCOCCCCF 7a_100011995726_100000754431 [0,0,0,0,0,0|3,0,1]=4 180 B9R0.45 C=CCCOCCCCI 34a_200012148704_100000754431 [0,0,0,0,0,0|3,0,1]=4 181 B9R0.45 C=CCCOCCCCN 34a_100000750430_100000754431 [0,0,0,0,0,0|3,0,1]=4 182 B9R0.45 C=CCCOCCCCO 34a_100011205117_100011216708 [0,0,0,0,0,0|3,0,1]=4 183 B9R0.45 C=CCCOCCCNC 34a_100000213112_100000754431 [0,0,0,0,0,0|3,0,1]=4 184 B9R0.45 C=CCCOCCCOC 34a_100000740835_100000754431 [0,0,0,0,0,0|3,0,1]=4 185 B9R0.45 C=CCCOCCCOC 34a_100011205117_100000740836 [0,0,0,0,0,0|3,0,1]=4 186 B9R0.45 C=CCCOCCCSC 34a_100000690336_100000754431 [0,0,0,0,0,0|3,0,1]=4 187 B9R0.45 C=CCCOCCCSC 7a_100000690336_100000754431 [0,0,0,0,0,0|3,0,1]=4 188 B9R0.45 C=CCCOCCOC=C 34a_100000033082_100000754431 [0,0,0,0,0,0|1,0,3]=4 189 B9R0.45 C=CCCOCCOC=C 34a_100011205117_100000039644 [0,0,0,0,0,0|1,0,3]=4 190 B9R0.45 C=CCCOCCOCC 34a_100000210136_100000754431 [0,0,0,0,0,0|1,0,1]=2 191 B9R0.45 C=CCCOCCOCC 34a_100011205117_100000210147 [0,0,0,0,0,0|1,0,1]=2 192 B9R0.45 C=CCCOCCOCC 7a_100000210136_100000754431 [0,0,0,0,0,0|1,0,1]=2 193 B9R0.45 C=CCCOCCSCC 34a_100000212035_100000754431 [0,0,0,0,0,0|1,1,1]=3 194 B9R0.45 C=CCCOCCSCC 34a_100011205117_100000757381 [0,0,0,0,0,0|1,1,1]=3 195 B9R0.45 C=CCCOCCSCC 7a_100000212035_100000754431 [0,0,0,0,0,0|1,1,1]=3 196 B9R0.45 C=CCCSCCCCC 62a_100000210326_100000754431 [0,0,0,0,0,0|2,1,1]=4 197 B9R0.45 C=CCCSCCCCC 62a_100000754431_100000210326 [0,0,0,0,0,0|2,1,1]=4 198 B9R0.45 C=CCCSCCOCC 62a_100000210147_100000754431 [0,0,0,0,0,0|1,1,1]=3 199 B9R0.45 C=CCCSCCOCC 62a_100000754431_100011215890 [0,0,0,0,0,0|1,1,1]=3 200 B9R0.45 C=CCCSCCSCC 62a_100000754431_100000757381 [0,0,0,0,0,0|1,2,1]=4 201 B9R0.45 C=CCCSCCSCC 62a_100000757381_100000754431 [0,0,0,0,0,0|1,2,1]=4 202 B9R0.45 C=CCNCCCOCC 2230a_100000210961_100000210623 [0,0,0,0,0,0|3,0,1]=4 203 B9R0.45 C=CCNCCCOCC 2230a_100020586998_100012232248 [0,0,0,0,0,0|3,0,1]=4 204 B9R0.45 C=CCNCCCOCC 34a_100000210961_100015514636 [0,0,0,0,0,0|3,0,1]=4 205 B9R0.45 C=CCNCOCCOC 2230a_100020586998_100000231047 [0,0,0,0,0,0|2,0,2]=4 206 B9R0.45 C=CCOCCCOCC 34a_100000757476_100015514636 [0,0,0,0,0,0|3,0,1]=4 207 B9R0.45 C=CCOCCCOCC 34a_200000210373_100012232248 [0,0,0,0,0,0|3,0,1]=4 208 B9R0.45 C=CCOCCCOCC 7a_100000757476_100015514636 [0,0,0,0,0,0|3,0,1]=4 209 B9R0.45 C=CCSCCCOCC 62a_100000210623_100012232248 [0,0,0,0,0,0|3,0,1]=4 210 B9R0.45 C=CCSCCCOCC 62a_100012232248_100000210623 [0,0,0,0,0,0|3,0,1]=4 211 B9R0.45 C=CCSCOCCOC 62a_100000210623_100000231047 [0,0,0,0,0,0|2,0,2]=4 212 B9R0.45 C=CCSCOCCOC 62a_100000231047_100000210623 [0,0,0,0,0,0|2,0,2]=4 213 B9R0.45 C=COCCCCOCC 34a_100000031558_100000210202 [0,0,0,0,0,0|3,0,1]=4 214 B9R0.45 C=COCCCCOCC 7a_100000031558_100000210202 [0,0,0,0,0,0|3,0,1]=4 215 B9R0.45 C=COCCCNCOC 2230a_100000210767_100000766300 [0,0,0,0,0,0|2,0,2]=4 216 B9R0.45 C=COCCNCCCC 2230a_100000102301_100000039644 [0,0,0,0,0,0|2,0,2]=4 217 B9R0.45 C=COCCNCCCC 7a_106832991798_100000039644 [0,0,0,0,0,0|2,0,2]=4 218 B9R0.45 C=COCCNCCOC 2230a_100000209980_100000039644 [0,0,0,0,0,0|1,0,2]=3 219 B9R0.45 C=COCCNCCSC 2230a_100020590264_100000039644 [0,0,0,0,0,0|1,1,2]=4 220 B9R0.45 C=COCCOC/C=C/C 34a_100000033082_100102629194 [0,0,0,0,0,0|1,0,3]=4 221 B9R0.45 C=COCCOC/C=C/C 34a_100016270725_100000039644 [0,0,0,0,0,0|1,0,3]=4 222 B9R0.45 C=COCCOCC#CC 34a_100000033082_100000748600 [0,0,0,0,0,0|1,0,3]=4 223 B9R0.45 C=COCCOCC#CC 34a_100000761923_100000039644 [0,0,0,0,0,0|1,0,3]=4 224 B9R0.45 C=COCCOCC=CC 34a_100000033082_100000070051 [0,0,0,0,0,0|1,0,3]=4 225 B9R0.45 C=COCCOCCCBr 34a_100011217188_100000039644 [0,0,0,0,0,0|2,0,2]=4 226 B9R0.45 C=COCCOCCCC 34a_100000033082_100000210210 [0,0,0,0,0,0|1,0,2]=3 227 B9R0.45 C=COCCOCCCC 34a_100000210227_100000039644 [0,0,0,0,0,0|1,0,2]=3 228 B9R0.45 C=COCCOCCCC 7a_100000210227_100000039644 [0,0,0,0,0,0|1,0,2]=3 229 B9R0.45 C=COCCOCCCCl 34a_100000230001_100000039644 [0,0,0,0,0,0|2,0,2]=4 230 B9R0.45 C=COCCOCCCF 34a_100000033082_100011934791 [0,0,0,0,0,0|2,0,2]=4 231 B9R0.45 C=COCCOCCCF 34a_100000759539_100000039644 [0,0,0,0,0,0|2,0,2]=4 232 B9R0.45 C=COCCOCCCN 34a_100000182051_100000039644 [0,0,0,0,0,0|2,0,2]=4 233 B9R0.45 C=COCCOCCCO 34a_100000033082_100000230001 [0,0,0,0,0,0|2,0,2]=4 234 B9R0.45 C=COCCOCCOC 34a_100000033082_100011201679 [0,0,0,0,0,0|0,0,2]=2 235 B9R0.45 C=COCCOCCOC 34a_100000039918_200000210301 [0,0,0,0,0,0|0,0,2]=2 236 B9R0.45 C=COCCOCCOC 34a_100000210237_100000039644 [0,0,0,0,0,0|0,0,2]=2 237 B9R0.45 C=COCCOCCOC 7a_100000039918_200000210301 [0,0,0,0,0,0|0,0,2]=2 238 B9R0.45 C=COCCOCCON 34a_100000700252_100000039644 [0,0,0,0,0,0|1,0,2]=3 239 B9R0.45 C=COCCOCCO[13CH3] 34a_100000039918_200025704644 [0,0,0,0,0,0|0,0,2]=2 240 B9R0.45 C=COCCOCCO[13CH3] 7a_100000039918_200025704644 [0,0,0,0,0,0|0,0,2]=2 241 B9R0.45 C=COCCOCCSC 34a_100000033082_100000212216 [0,0,0,0,0,0|0,1,2]=3 242 B9R0.45 C=COCCOCCSC 34a_100000230434_100000039644 [0,0,0,0,0,0|0,1,2]=3 243 B9R0.45 C=COCCOCCSC 7a_100000230434_100000039644 [0,0,0,0,0,0|0,1,2]=3 244 B9R0.45 C=COCCSCCCC 62a_100000039644_100000210210 [0,0,0,0,0,0|1,1,2]=4 245 B9R0.45 C=COCCSCCCC 62a_100000210211_100000039644 [0,0,0,0,0,0|1,1,2]=4 246 B9R0.45 C=COCCSCCOC 62a_100000039644_100000233755 [0,0,0,0,0,0|0,1,2]=3 247 B9R0.45 C=COCCSCCOC 62a_100000233755_100000039644 [0,0,0,0,0,0|0,1,2]=3 248 B9R0.45 C=COCCSCCSC 62a_100000039644_100000751147 [0,0,0,0,0,0|0,2,2]=4 249 B9R0.45 C=COCCSCCSC 62a_100000212216_100000039644 [0,0,0,0,0,0|0,2,2]=4 250 B9R0.45 CC#CCCOC/C=C/C 34a_100000750427_100102629194 [0,0,0,0,0,0|2,0,2]=4 251 B9R0.45 CC#CCCOCC#CC 34a_100000750427_100000748600 [0,0,0,0,0,0|2,0,2]=4 252 B9R0.45 CC#CCCOCC=CC 34a_100000750427_100000070051 [0,0,0,0,0,0|2,0,2]=4 253 B9R0.45 CC#CCCOCCCC 34a_100000750427_100000210210 [0,0,0,0,0,0|2,0,1]=3 254 B9R0.45 CC#CCCOCCCF 34a_100000750427_100011934791 [0,0,0,0,0,0|3,0,1]=4 255 B9R0.45 CC#CCCOCCCO 34a_100000750427_100000230001 [0,0,0,0,0,0|3,0,1]=4 256 B9R0.45 CC#CCCOCCOC 34a_100000750427_100011201679 [0,0,0,0,0,0|1,0,1]=2 257 B9R0.45 CC#CCCOCCSC 34a_100000750427_100000212216 [0,0,0,0,0,0|1,1,1]=3 258 B9R0.45 CC#CCNCCCCC 2230a_100000209983_100000748600 [0,0,0,0,0,0|3,0,1]=4 259 B9R0.45 CC#CCNCCCCC 2230a_100000685387_100000210326 [0,0,0,0,0,0|3,0,1]=4 260 B9R0.45 CC#CCNCCCCC 34a_100000685387_100000718602 [0,0,0,0,0,0|3,0,1]=4 261 B9R0.45 CC#CCNCCCOC 2230a_100000685387_100000740836 [0,0,0,0,0,0|3,0,1]=4 262 B9R0.45 CC#CCNCCCOC 34a_100000685387_100000740836 [0,0,0,0,0,0|3,0,1]=4 263 B9R0.45 CC#CCNCCCOC 34a_100150723488_100000748600 [0,0,0,0,0,0|3,0,1]=4 264 B9R0.45 CC#CCNCCOCC 2230a_100000685387_100011215890 [0,0,0,0,0,0|2,0,1]=3 265 B9R0.45 CC#CCNCCOCC 2230a_102516460346_100000748600 [0,0,0,0,0,0|2,0,1]=3 266 B9R0.45 CC#CCNCCOCC 34a_100000685387_100000210147 [0,0,0,0,0,0|2,0,1]=3 267 B9R0.45 CC#CCNCCOCC 34a_102516460346_100000748600 [0,0,0,0,0,0|2,0,1]=3 268 B9R0.45 CC#CCNCCSCC 2230a_100000106463_100000748600 [0,0,0,0,0,0|2,1,1]=4 269 B9R0.45 CC#CCNCCSCC 2230a_100000685387_100000757381 [0,0,0,0,0,0|2,1,1]=4 270 B9R0.45 CC#CCNCCSCC 34a_100000685387_100000757381 [0,0,0,0,0,0|2,1,1]=4 271 B9R0.45 CC#CCOC/C=C\CC 34a_100000761923_100103147603 [0,0,0,0,0,0|2,0,2]=4 272 B9R0.45 CC#CCOC/C=C\CC 34a_100016268518_100000748600 [0,0,0,0,0,0|2,0,2]=4 273 B9R0.45 CC#CCOCC#CCC 34a_100000032950_100000748600 [0,0,0,0,0,0|2,0,2]=4 274 B9R0.45 CC#CCOCC#CCC 34a_100000761923_100009813939 [0,0,0,0,0,0|2,0,2]=4 275 B9R0.45 CC#CCOCC/C=C/C 34a_100016278192_100000748600 [0,0,0,0,0,0|2,0,2]=4 276 B9R0.45 CC#CCOCCCCBr 34a_100011216708_100000748600 [0,0,0,0,0,0|3,0,1]=4 277 B9R0.45 CC#CCOCCCCC 34a_100000210253_100000748600 [0,0,0,0,0,0|2,0,1]=3 278 B9R0.45 CC#CCOCCCCC 34a_100000761923_100000718602 [0,0,0,0,0,0|2,0,1]=3 279 B9R0.45 CC#CCOCCCCC 7a_100000210253_100000748600 [0,0,0,0,0,0|2,0,1]=3 280 B9R0.45 CC#CCOCCCCCl 34a_100000210776_100000748600 [0,0,0,0,0,0|3,0,1]=4 281 B9R0.45 CC#CCOCCCCCl 7a_100000210776_100000748600 [0,0,0,0,0,0|3,0,1]=4 282 B9R0.45 CC#CCOCCCCF 34a_100000761923_100000729493 [0,0,0,0,0,0|3,0,1]=4 283 B9R0.45 CC#CCOCCCCF 34a_100011995726_100000748600 [0,0,0,0,0,0|3,0,1]=4 284 B9R0.45 CC#CCOCCCCF 7a_100011995726_100000748600 [0,0,0,0,0,0|3,0,1]=4 285 B9R0.45 CC#CCOCCCCI 34a_200012148704_100000748600 [0,0,0,0,0,0|3,0,1]=4 286 B9R0.45 CC#CCOCCCCN 34a_100000750430_100000748600 [0,0,0,0,0,0|3,0,1]=4 287 B9R0.45 CC#CCOCCCCO 34a_100000761923_100011216708 [0,0,0,0,0,0|3,0,1]=4 288 B9R0.45 CC#CCOCCCNC 34a_100000213112_100000748600 [0,0,0,0,0,0|3,0,1]=4 289 B9R0.45 CC#CCOCCCOC 34a_100000740835_100000748600 [0,0,0,0,0,0|3,0,1]=4 290 B9R0.45 CC#CCOCCCOC 34a_100000761923_100000740836 [0,0,0,0,0,0|3,0,1]=4 291 B9R0.45 CC#CCOCCCSC 34a_100000690336_100000748600 [0,0,0,0,0,0|3,0,1]=4 292 B9R0.45 CC#CCOCCCSC 7a_100000690336_100000748600 [0,0,0,0,0,0|3,0,1]=4 293 B9R0.45 CC#CCOCCOCC 34a_100000210136_100000748600 [0,0,0,0,0,0|1,0,1]=2 294 B9R0.45 CC#CCOCCOCC 34a_100000761923_100000210147 [0,0,0,0,0,0|1,0,1]=2 295 B9R0.45 CC#CCOCCOCC 7a_100000210136_100000748600 [0,0,0,0,0,0|1,0,1]=2 296 B9R0.45 CC#CCOCCSCC 34a_100000212035_100000748600 [0,0,0,0,0,0|1,1,1]=3 297 B9R0.45 CC#CCOCCSCC 34a_100000761923_100000757381 [0,0,0,0,0,0|1,1,1]=3 298 B9R0.45 CC#CCOCCSCC 7a_100000212035_100000748600 [0,0,0,0,0,0|1,1,1]=3 299 B9R0.45 CC#CCSCCCCC 62a_100000210326_100000748600 [0,0,0,0,0,0|2,1,1]=4 300 B9R0.45 CC#CCSCCCCC 62a_100000748600_100000210326 [0,0,0,0,0,0|2,1,1]=4 301 B9R0.45 CC#CCSCCCOC 62a_100000709357_100000748600 [0,0,0,0,0,0|3,0,1]=4 302 B9R0.45 CC#CCSCCCOC 62a_100000748600_100000709357 [0,0,0,0,0,0|3,0,1]=4 303 B9R0.45 CC#CCSCCOCC 62a_100000210147_100000748600 [0,0,0,0,0,0|1,1,1]=3 304 B9R0.45 CC#CCSCCOCC 62a_100000748600_100011215890 [0,0,0,0,0,0|1,1,1]=3 305 B9R0.45 CC#CCSCCSCC 62a_100000748600_100000757381 [0,0,0,0,0,0|1,2,1]=4 306 B9R0.45 CC#CCSCCSCC 62a_100000757381_100000748600 [0,0,0,0,0,0|1,2,1]=4 307 B9R0.45 CC/C=C/CCCOCC 34a_100016287902_100000210202 [0,0,0,0,0,0|2,0,2]=4 308 B9R0.45 CC/C=C/CCCOCC 7a_100016287902_100000210202 [0,0,0,0,0,0|2,0,2]=4 309 B9R0.45 CC/C=C\CCCCOC 34a_100016287862_200000210301 [0,0,0,0,0,0|2,0,1]=3 310 B9R0.45 CC/C=C\CCCCOC 7a_100016287862_200000210301 [0,0,0,0,0,0|2,0,1]=3 311 B9R0.45 CC/C=C\CCCCO[13CH3] 34a_100016287862_200025704644 [0,0,0,0,0,0|2,0,1]=3 312 B9R0.45 CC/C=C\CCCCO[13CH3] 7a_100016287862_200025704644 [0,0,0,0,0,0|2,0,1]=3 313 B9R0.45 CC/C=C\CCSCOC 62a_100000766300_100015370543 [0,0,0,0,0,0|3,0,1]=4 314 B9R0.45 CC/C=C\CCSCOC 62a_100015370543_100000766300 [0,0,0,0,0,0|3,0,1]=4 315 B9R0.45 CC/C=C\CNCCCC 2230a_100000102301_100103147603 [0,0,0,0,0,0|3,0,1]=4 316 B9R0.45 CC/C=C\CNCCCC 7a_106832991798_100103147603 [0,0,0,0,0,0|3,0,1]=4 317 B9R0.45 CC/C=C\CNCCOC 2230a_100000209980_100103147603 [0,0,0,0,0,0|2,0,1]=3 318 B9R0.45 CC/C=C\CNCCSC 2230a_100020590264_100103147603 [0,0,0,0,0,0|2,1,1]=4 319 B9R0.45 CC/C=C\COCCCBr 34a_100011217188_100103147603 [0,0,0,0,0,0|3,0,1]=4 320 B9R0.45 CC/C=C\COCCCC 34a_100000210227_100103147603 [0,0,0,0,0,0|2,0,1]=3 321 B9R0.45 CC/C=C\COCCCC 34a_100016268518_100000210210 [0,0,0,0,0,0|2,0,1]=3 322 B9R0.45 CC/C=C\COCCCC 7a_100000210227_100103147603 [0,0,0,0,0,0|2,0,1]=3 323 B9R0.45 CC/C=C\COCCCCl 34a_100000230001_100103147603 [0,0,0,0,0,0|3,0,1]=4 324 B9R0.45 CC/C=C\COCCCF 34a_100000759539_100103147603 [0,0,0,0,0,0|3,0,1]=4 325 B9R0.45 CC/C=C\COCCCF 34a_100016268518_100011934791 [0,0,0,0,0,0|3,0,1]=4 326 B9R0.45 CC/C=C\COCCCN 34a_100000182051_100103147603 [0,0,0,0,0,0|3,0,1]=4 327 B9R0.45 CC/C=C\COCCCO 34a_100016268518_100000230001 [0,0,0,0,0,0|3,0,1]=4 328 B9R0.45 CC/C=C\COCCOC 34a_100000210237_100103147603 [0,0,0,0,0,0|1,0,1]=2 329 B9R0.45 CC/C=C\COCCOC 34a_100016268518_100011201679 [0,0,0,0,0,0|1,0,1]=2 330 B9R0.45 CC/C=C\COCCON 34a_100000700252_100103147603 [0,0,0,0,0,0|2,0,1]=3 331 B9R0.45 CC/C=C\COCCSC 34a_100000230434_100103147603 [0,0,0,0,0,0|1,1,1]=3 332 B9R0.45 CC/C=C\COCCSC 34a_100016268518_100000212216 [0,0,0,0,0,0|1,1,1]=3 333 B9R0.45 CC/C=C\COCCSC 7a_100000230434_100103147603 [0,0,0,0,0,0|1,1,1]=3 334 B9R0.45 CC/C=C\CSCCCC 62a_100000210211_100103147603 [0,0,0,0,0,0|2,1,1]=4 335 B9R0.45 CC/C=C\CSCCCC 62a_100103147603_100000210210 [0,0,0,0,0,0|2,1,1]=4 336 B9R0.45 CC/C=C\CSCCOC 62a_100000233755_100103147603 [0,0,0,0,0,0|1,1,1]=3 337 B9R0.45 CC/C=C\CSCCOC 62a_100103147603_100000233755 [0,0,0,0,0,0|1,1,1]=3 338 B9R0.45 CC/C=C\CSCCSC 62a_100000212216_100103147603 [0,0,0,0,0,0|1,2,1]=4 339 B9R0.45 CC/C=C\CSCCSC 62a_100103147603_100000751147 [0,0,0,0,0,0|1,2,1]=4 340 B9R0.45 CC=CCNCCCCC 2230a_100000209983_100000070051 [0,0,0,0,0,0|3,0,1]=4 341 B9R0.45 CC=CCNCCCOC 34a_100150723488_100000070051 [0,0,0,0,0,0|3,0,1]=4 342 B9R0.45 CC=CCNCCOCC 2230a_102516460346_100000070051 [0,0,0,0,0,0|2,0,1]=3 343 B9R0.45 CC=CCNCCOCC 34a_102516460346_100000070051 [0,0,0,0,0,0|2,0,1]=3 344 B9R0.45 CC=CCNCCSCC 2230a_100000106463_100000070051 [0,0,0,0,0,0|2,1,1]=4 345 B9R0.45 CC=CCOC/C=C\CC 34a_100016268518_100000070051 [0,0,0,0,0,0|2,0,2]=4 346 B9R0.45 CC=CCOCC#CCC 34a_100000032950_100000070051 [0,0,0,0,0,0|2,0,2]=4 347 B9R0.45 CC=CCOCC/C=C/C 34a_100016278192_100000070051 [0,0,0,0,0,0|2,0,2]=4 348 B9R0.45 CC=CCOCCCCBr 34a_100011216708_100000070051 [0,0,0,0,0,0|3,0,1]=4 349 B9R0.45 CC=CCOCCCCC 34a_100000210253_100000070051 [0,0,0,0,0,0|2,0,1]=3 350 B9R0.45 CC=CCOCCCCC 7a_100000210253_100000070051 [0,0,0,0,0,0|2,0,1]=3 351 B9R0.45 CC=CCOCCCCCl 34a_100000210776_100000070051 [0,0,0,0,0,0|3,0,1]=4 352 B9R0.45 CC=CCOCCCCCl 7a_100000210776_100000070051 [0,0,0,0,0,0|3,0,1]=4 353 B9R0.45 CC=CCOCCCCF 34a_100011995726_100000070051 [0,0,0,0,0,0|3,0,1]=4 354 B9R0.45 CC=CCOCCCCF 7a_100011995726_100000070051 [0,0,0,0,0,0|3,0,1]=4 355 B9R0.45 CC=CCOCCCCI 34a_200012148704_100000070051 [0,0,0,0,0,0|3,0,1]=4 356 B9R0.45 CC=CCOCCCCN 34a_100000750430_100000070051 [0,0,0,0,0,0|3,0,1]=4 357 B9R0.45 CC=CCOCCCNC 34a_100000213112_100000070051 [0,0,0,0,0,0|3,0,1]=4 358 B9R0.45 CC=CCOCCCOC 34a_100000740835_100000070051 [0,0,0,0,0,0|3,0,1]=4 359 B9R0.45 CC=CCOCCCSC 34a_100000690336_100000070051 [0,0,0,0,0,0|3,0,1]=4 360 B9R0.45 CC=CCOCCCSC 7a_100000690336_100000070051 [0,0,0,0,0,0|3,0,1]=4 361 B9R0.45 CC=CCOCCOCC 34a_100000210136_100000070051 [0,0,0,0,0,0|1,0,1]=2 362 B9R0.45 CC=CCOCCOCC 7a_100000210136_100000070051 [0,0,0,0,0,0|1,0,1]=2 363 B9R0.45 CC=CCOCCSCC 34a_100000212035_100000070051 [0,0,0,0,0,0|1,1,1]=3 364 B9R0.45 CC=CCOCCSCC 7a_100000212035_100000070051 [0,0,0,0,0,0|1,1,1]=3 365 B9R0.45 CC=CCSCCCCC 62a_100000070051_100000210326 [0,0,0,0,0,0|2,1,1]=4 366 B9R0.45 CC=CCSCCCCC 62a_100000210326_100000070051 [0,0,0,0,0,0|2,1,1]=4 367 B9R0.45 CC=CCSCCCOC 62a_100000070051_100000709357 [0,0,0,0,0,0|3,0,1]=4 368 B9R0.45 CC=CCSCCCOC 62a_100000709357_100000070051 [0,0,0,0,0,0|3,0,1]=4 369 B9R0.45 CC=CCSCCOCC 62a_100000070051_100011215890 [0,0,0,0,0,0|1,1,1]=3 370 B9R0.45 CC=CCSCCOCC 62a_100000210147_100000070051 [0,0,0,0,0,0|1,1,1]=3 371 B9R0.45 CC=CCSCCSCC 62a_100000070051_100000757381 [0,0,0,0,0,0|1,2,1]=4 372 B9R0.45 CC=CCSCCSCC 62a_100000757381_100000070051 [0,0,0,0,0,0|1,2,1]=4 373 B9R0.45 CCC#CCNCCCC 2230a_100000102301_100009813939 [0,0,0,0,0,0|3,0,1]=4 374 B9R0.45 CCC#CCNCCCC 7a_106832991798_100009813939 [0,0,0,0,0,0|3,0,1]=4 375 B9R0.45 CCC#CCNCCOC 2230a_100000209980_100009813939 [0,0,0,0,0,0|2,0,1]=3 376 B9R0.45 CCC#CCNCCSC 2230a_100020590264_100009813939 [0,0,0,0,0,0|2,1,1]=4 377 B9R0.45 CCC#CCOCCCBr 34a_100011217188_100009813939 [0,0,0,0,0,0|3,0,1]=4 378 B9R0.45 CCC#CCOCCCC 34a_100000032950_100000210210 [0,0,0,0,0,0|2,0,1]=3 379 B9R0.45 CCC#CCOCCCC 34a_100000210227_100009813939 [0,0,0,0,0,0|2,0,1]=3 380 B9R0.45 CCC#CCOCCCC 7a_100000210227_100009813939 [0,0,0,0,0,0|2,0,1]=3 381 B9R0.45 CCC#CCOCCCCl 34a_100000230001_100009813939 [0,0,0,0,0,0|3,0,1]=4 382 B9R0.45 CCC#CCOCCCF 34a_100000032950_100011934791 [0,0,0,0,0,0|3,0,1]=4 383 B9R0.45 CCC#CCOCCCF 34a_100000759539_100009813939 [0,0,0,0,0,0|3,0,1]=4 384 B9R0.45 CCC#CCOCCCN 34a_100000182051_100009813939 [0,0,0,0,0,0|3,0,1]=4 385 B9R0.45 CCC#CCOCCCO 34a_100000032950_100000230001 [0,0,0,0,0,0|3,0,1]=4 386 B9R0.45 CCC#CCOCCOC 34a_100000032950_100011201679 [0,0,0,0,0,0|1,0,1]=2 387 B9R0.45 CCC#CCOCCOC 34a_100000210237_100009813939 [0,0,0,0,0,0|1,0,1]=2 388 B9R0.45 CCC#CCOCCON 34a_100000700252_100009813939 [0,0,0,0,0,0|2,0,1]=3 389 B9R0.45 CCC#CCOCCSC 34a_100000032950_100000212216 [0,0,0,0,0,0|1,1,1]=3 390 B9R0.45 CCC#CCOCCSC 34a_100000230434_100009813939 [0,0,0,0,0,0|1,1,1]=3 391 B9R0.45 CCC#CCOCCSC 7a_100000230434_100009813939 [0,0,0,0,0,0|1,1,1]=3 392 B9R0.45 CCC#CCSCCCC 62a_100000210211_100009813939 [0,0,0,0,0,0|2,1,1]=4 393 B9R0.45 CCC#CCSCCCC 62a_100009813939_100000210210 [0,0,0,0,0,0|2,1,1]=4 394 B9R0.45 CCC#CCSCCOC 62a_100000233755_100009813939 [0,0,0,0,0,0|1,1,1]=3 395 B9R0.45 CCC#CCSCCOC 62a_100009813939_100000233755 [0,0,0,0,0,0|1,1,1]=3 396 B9R0.45 CCC#CCSCCSC 62a_100000212216_100009813939 [0,0,0,0,0,0|1,2,1]=4 397 B9R0.45 CCC#CCSCCSC 62a_100009813939_100000751147 [0,0,0,0,0,0|1,2,1]=4 398 B9R0.45 CCC=NNCCOCC 4a_100000732670_100000210100 [0,0,0,0,0,0|3,0,1]=4 399 B9R0.45 CCCC#CCCOCC 34a_100000042726_100000210202 [0,0,0,0,0,0|2,0,1]=3 400 B9R0.45 CCCC#CCCOCC 7a_100000042726_100000210202 [0,0,0,0,0,0|2,0,1]=3 401 B9R0.45 CCCC#CCCOCF 34a_100000042726_100015361967 [0,0,0,0,0,0|3,0,1]=4 402 B9R0.45 CCCC#CCCOCF 7a_100000042726_100015361967 [0,0,0,0,0,0|3,0,1]=4 403 B9R0.45 CCCC/C=C/COCC 34a_200016272032_100000210202 [0,0,0,0,0,0|2,0,1]=3 404 B9R0.45 CCCC/C=C/COCC 7a_200016272032_100000210202 [0,0,0,0,0,0|2,0,1]=3 405 B9R0.45 CCCC/C=C/COCF 34a_200016272032_100015361967 [0,0,0,0,0,0|3,0,1]=4 406 B9R0.45 CCCC/C=C/COCF 7a_200016272032_100015361967 [0,0,0,0,0,0|3,0,1]=4 407 B9R0.45 CCCC/C=C\CCOC 34a_200016286491_200000210301 [0,0,0,0,0,0|2,0,1]=3 408 B9R0.45 CCCC/C=C\CCOC 7a_200016286491_200000210301 [0,0,0,0,0,0|2,0,1]=3 409 B9R0.45 CCCC/C=C\CCO[13CH3] 34a_200016286491_200025704644 [0,0,0,0,0,0|2,0,1]=3 410 B9R0.45 CCCC/C=C\CCO[13CH3] 7a_200016286491_200025704644 [0,0,0,0,0,0|2,0,1]=3 411 B9R0.45 CCCCC#CCCOC 34a_100000037610_200000210301 [0,0,0,0,0,0|2,0,1]=3 412 B9R0.45 CCCCC#CCCOC 7a_100000037610_200000210301 [0,0,0,0,0,0|2,0,1]=3 413 B9R0.45 CCCCC#CCCO[13CH3] 34a_100000037610_200025704644 [0,0,0,0,0,0|2,0,1]=3 414 B9R0.45 CCCCC#CCCO[13CH3] 7a_100000037610_200025704644 [0,0,0,0,0,0|2,0,1]=3 415 B9R0.45 CCCCC#CCOCC 34a_200000034558_100000210202 [0,0,0,0,0,0|2,0,1]=3 416 B9R0.45 CCCCC#CCOCC 7a_200000034558_100000210202 [0,0,0,0,0,0|2,0,1]=3 417 B9R0.45 CCCCC#CCOCF 34a_200000034558_100015361967 [0,0,0,0,0,0|3,0,1]=4 418 B9R0.45 CCCCC#CCOCF 7a_200000034558_100015361967 [0,0,0,0,0,0|3,0,1]=4 419 B9R0.45 CCCCC/C=C/COC 34a_100016258190_200000210301 [0,0,0,0,0,0|2,0,1]=3 420 B9R0.45 CCCCC/C=C/COC 7a_100016258190_200000210301 [0,0,0,0,0,0|2,0,1]=3 421 B9R0.45 CCCCC/C=C/CO[13CH3] 34a_100016258190_200025704644 [0,0,0,0,0,0|2,0,1]=3 422 B9R0.45 CCCCC/C=C/CO[13CH3] 7a_100016258190_200025704644 [0,0,0,0,0,0|2,0,1]=3 423 B9R0.45 CCCCCC#CCNC 2230a_106832991635_100009816472 [0,0,0,0,0,0|3,0,1]=4 424 B9R0.45 CCCCCC#CCNC 34a_100102657272_100009816472 [0,0,0,0,0,0|3,0,1]=4 425 B9R0.45 CCCCCC#CCNC 7a_106832991635_100009816472 [0,0,0,0,0,0|3,0,1]=4 426 B9R0.45 CCCCCC#CCOC 34a_100138415774_100009816472 [0,0,0,0,0,0|2,0,1]=3 427 B9R0.45 CCCCCC#CCOC 34a_200000033628_200000210301 [0,0,0,0,0,0|2,0,1]=3 428 B9R0.45 CCCCCC#CCOC 7a_200000033628_200000210301 [0,0,0,0,0,0|2,0,1]=3 429 B9R0.45 CCCCCC#CCO[13CH3] 34a_200000033628_200025704644 [0,0,0,0,0,0|2,0,1]=3 430 B9R0.45 CCCCCC#CCO[13CH3] 7a_200000033628_200025704644 [0,0,0,0,0,0|2,0,1]=3 431 B9R0.45 CCCCCC#CCSC 62a_100009816472_200000210301 [0,0,0,0,0,0|2,1,1]=4 432 B9R0.45 CCCCCC#CCSC 62a_200000210301_100009816472 [0,0,0,0,0,0|2,1,1]=4 433 B9R0.45 CCCCCC#CCS[13CH3] 62a_100009816472_200025704644 [0,0,0,0,0,0|2,1,1]=4 434 B9R0.45 CCCCCC#CCS[13CH3] 62a_200025704644_100009816472 [0,0,0,0,0,0|2,1,1]=4 435 B9R0.45 CCCCCCCCNC 2230a_100000229939_200000210301 [0,0,0,0,0,0|3,0,0]=3 436 B9R0.45 CCCCCCCCNC 2230a_106832991635_100000210759 [0,0,0,0,0,0|3,0,0]=3 437 B9R0.45 CCCCCCCCNC 34a_100000229939_200000210301 [0,0,0,0,0,0|3,0,0]=3 438 B9R0.45 CCCCCCCCNC 34a_100102657272_100000210759 [0,0,0,0,0,0|3,0,0]=3 439 B9R0.45 CCCCCCCCNC 7a_106832991635_100000210759 [0,0,0,0,0,0|3,0,0]=3 440 B9R0.45 CCCCCCCCN[13CH3] 2230a_100000229939_200025704644 [0,0,0,0,0,0|3,0,0]=3 441 B9R0.45 CCCCCCCCN[13CH3] 34a_100000229939_200025704644 [0,0,0,0,0,0|3,0,0]=3 442 B9R0.45 CCCCCCCCOC 34a_100000210232_200000210301 [0,0,0,0,0,0|2,0,0]=2 443 B9R0.45 CCCCCCCCOC 34a_100138415774_100000210759 [0,0,0,0,0,0|2,0,0]=2 444 B9R0.45 CCCCCCCCOC 7a_100000210232_200000210301 [0,0,0,0,0,0|2,0,0]=2 445 B9R0.45 CCCCCCCCO[13CH3] 34a_100000210232_200025704644 [0,0,0,0,0,0|2,0,0]=2 446 B9R0.45 CCCCCCCCO[13CH3] 7a_100000210232_200025704644 [0,0,0,0,0,0|2,0,0]=2 447 B9R0.45 CCCCCCCCSC 62a_100000210759_200000210301 [0,0,0,0,0,0|2,1,0]=3 448 B9R0.45 CCCCCCCCSC 62a_200000210301_100000210317 [0,0,0,0,0,0|2,1,0]=3 449 B9R0.45 CCCCCCCCS[13CH3] 62a_100000210759_200025704644 [0,0,0,0,0,0|2,1,0]=3 450 B9R0.45 CCCCCCCCS[13CH3] 62a_200025704644_100000210317 [0,0,0,0,0,0|2,1,0]=3 451 B9R0.45 CCCCCCCNCC 2230a_100000229938_100000210202 [0,0,0,0,0,0|3,0,0]=3 452 B9R0.45 CCCCCCCNCC 2230a_100015525214_100000210681 [0,0,0,0,0,0|3,0,0]=3 453 B9R0.45 CCCCCCCOCC 34a_100000210272_100000210202 [0,0,0,0,0,0|2,0,0]=2 454 B9R0.45 CCCCCCCOCC 34a_100121572206_100000210614 [0,0,0,0,0,0|2,0,0]=2 455 B9R0.45 CCCCCCCOCC 7a_100000210272_100000210202 [0,0,0,0,0,0|2,0,0]=2 456 B9R0.45 CCCCCCCOCF 34a_100000210272_100015361967 [0,0,0,0,0,0|3,0,0]=3 457 B9R0.45 CCCCCCCOCF 7a_100000210272_100015361967 [0,0,0,0,0,0|3,0,0]=3 458 B9R0.45 CCCCCCCSCC 62a_100000210202_100000210316 [0,0,0,0,0,0|2,1,0]=3 459 B9R0.45 CCCCCCCSCC 62a_100000210614_100000210202 [0,0,0,0,0,0|2,1,0]=3 460 B9R0.45 CCCCCCCSCF 62a_100000210614_100015361967 [0,0,0,0,0,0|3,1,0]=4 461 B9R0.45 CCCCCCCSCF 62a_100015361967_100000210316 [0,0,0,0,0,0|3,1,0]=4 462 B9R0.45 CCCCCCNCCC 2230a_100000210581_100000210303 [0,0,0,0,0,0|4,0,0]=4 463 B9R0.45 CCCCCCNCOC 2230a_100000210581_100000766300 [0,0,0,0,0,0|3,0,0]=3 464 B9R0.45 CCCCCCNCSC 2230a_100000210581_100011218213 [0,0,0,0,0,0|3,1,0]=4 465 B9R0.45 CCCCCCOCCC 34a_100000210258_100000210314 [0,0,0,0,0,0|4,0,0]=4 466 B9R0.45 CCCCCCOCCC 34a_100000210259_100000210303 [0,0,0,0,0,0|4,0,0]=4 467 B9R0.45 CCCCCCOCCC 7a_100000210259_100000210303 [0,0,0,0,0,0|4,0,0]=4 468 B9R0.45 CCCCCCOCSC 34a_100000210259_100011218213 [0,0,0,0,0,0|3,1,0]=4 469 B9R0.45 CCCCCCSCCC 62a_100000210303_100000210757 [0,0,0,0,0,0|4,0,0]=4 470 B9R0.45 CCCCCCSCCC 62a_100000210314_100000210303 [0,0,0,0,0,0|4,0,0]=4 471 B9R0.45 CCCCCCSCOC 62a_100000210314_100000766300 [0,0,0,0,0,0|3,0,0]=3 472 B9R0.45 CCCCCCSCOC 62a_100000766300_100000210757 [0,0,0,0,0,0|3,0,0]=3 473 B9R0.45 CCCCCCSCSC 62a_100000210314_100011218213 [0,0,0,0,0,0|3,1,0]=4 474 B9R0.45 CCCCCCSCSC 62a_100011218213_100000210757 [0,0,0,0,0,0|3,1,0]=4 475 B9R0.45 CCCCCNCCC#N 2230a_100000209983_100011215226 [0,0,0,0,0,0|4,0,0]=4 476 B9R0.45 CCCCCNCCCC 2230a_100000102301_100000210326 [0,0,0,0,0,0|3,0,0]=3 477 B9R0.45 CCCCCNCCCC 2230a_100000209983_100000210211 [0,0,0,0,0,0|3,0,0]=3 478 B9R0.45 CCCCCNCCCC 7a_106832991798_100000210326 [0,0,0,0,0,0|3,0,0]=3 479 B9R0.45 CCCCCNCCCF 2230a_100000209983_100011934791 [0,0,0,0,0,0|4,0,0]=4 480 B9R0.45 CCCCCNCCCF 2230a_100015189416_100000210326 [0,0,0,0,0,0|4,0,0]=4 481 B9R0.45 CCCCCNCCCF 34a_100015189416_100000718602 [0,0,0,0,0,0|4,0,0]=4 482 B9R0.45 CCCCCNCCCO 2230a_100000209983_100000230001 [0,0,0,0,0,0|4,0,0]=4 483 B9R0.45 CCCCCNCCOC 2230a_100000209980_100000210326 [0,0,0,0,0,0|2,0,0]=2 484 B9R0.45 CCCCCNCCOC 2230a_100000209983_100011201679 [0,0,0,0,0,0|2,0,0]=2 485 B9R0.45 CCCCCNCCOC 34a_100000224656_200000210301 [0,0,0,0,0,0|2,0,0]=2 486 B9R0.45 CCCCCNCCO[13CH3] 34a_100000224656_200025704644 [0,0,0,0,0,0|2,0,0]=2 487 B9R0.45 CCCCCNCCSC 2230a_100000209983_100000751147 [0,0,0,0,0,0|2,1,0]=3 488 B9R0.45 CCCCCNCCSC 2230a_100020590264_100000210326 [0,0,0,0,0,0|2,1,0]=3 489 B9R0.45 CCCCCOCCC#N 7a_100000210253_100000184422 [0,0,0,0,0,0|3,0,0]=3 490 B9R0.45 CCCCCOCCCBr 34a_100011217188_100000718602 [0,0,0,0,0,0|3,0,0]=3 491 B9R0.45 CCCCCOCCCC 34a_100000210227_100000718602 [0,0,0,0,0,0|2,0,0]=2 492 B9R0.45 CCCCCOCCCC 34a_100000210253_100000210210 [0,0,0,0,0,0|2,0,0]=2 493 B9R0.45 CCCCCOCCCC 7a_100000210227_100000210326 [0,0,0,0,0,0|2,0,0]=2 494 B9R0.45 CCCCCOCCCC 7a_100000210253_100000210211 [0,0,0,0,0,0|2,0,0]=2 495 B9R0.45 CCCCCOCCCCl 34a_100000230001_100000718602 [0,0,0,0,0,0|3,0,0]=3 496 B9R0.45 CCCCCOCCCF 34a_100000210253_100011934791 [0,0,0,0,0,0|3,0,0]=3 497 B9R0.45 CCCCCOCCCF 34a_100000759539_100000718602 [0,0,0,0,0,0|3,0,0]=3 498 B9R0.45 CCCCCOCCCF 7a_100000210253_100011934791 [0,0,0,0,0,0|3,0,0]=3 499 B9R0.45 CCCCCOCCCN 34a_100000182051_100000718602 [0,0,0,0,0,0|3,0,0]=3 500 B9R0.45 CCCCCOCCCO 34a_100000210253_100000230001 [0,0,0,0,0,0|3,0,0]=3 501 B9R0.45 CCCCCOCCCO 7a_100000210253_100011215043 [0,0,0,0,0,0|3,0,0]=3 502 B9R0.45 CCCCCOCCOC 34a_100000210237_100000718602 [0,0,0,0,0,0|1,0,0]=1 503 B9R0.45 CCCCCOCCOC 34a_100000210253_100011201679 [0,0,0,0,0,0|1,0,0]=1 504 B9R0.45 CCCCCOCCOC 34a_100011215259_200000210301 [0,0,0,0,0,0|1,0,0]=1 505 B9R0.45 CCCCCOCCOC 7a_100000210253_100000233755 [0,0,0,0,0,0|1,0,0]=1 506 B9R0.45 CCCCCOCCOC 7a_100011215259_200000210301 [0,0,0,0,0,0|1,0,0]=1 507 B9R0.45 CCCCCOCCON 34a_100000700252_100000718602 [0,0,0,0,0,0|2,0,0]=2 508 B9R0.45 CCCCCOCCO[13CH3] 34a_100011215259_200025704644 [0,0,0,0,0,0|1,0,0]=1 509 B9R0.45 CCCCCOCCO[13CH3] 7a_100011215259_200025704644 [0,0,0,0,0,0|1,0,0]=1 510 B9R0.45 CCCCCOCCSC 34a_100000210253_100000212216 [0,0,0,0,0,0|1,1,0]=2 511 B9R0.45 CCCCCOCCSC 34a_100000230434_100000718602 [0,0,0,0,0,0|1,1,0]=2 512 B9R0.45 CCCCCOCCSC 7a_100000210253_100000212216 [0,0,0,0,0,0|1,1,0]=2 513 B9R0.45 CCCCCOCCSC 7a_100000230434_100000210326 [0,0,0,0,0,0|1,1,0]=2 514 B9R0.45 CCCCCSCCC#N 62a_100000210326_100011215226 [0,0,0,0,0,0|3,1,0]=4 515 B9R0.45 CCCCCSCCC#N 62a_100011215226_100000210326 [0,0,0,0,0,0|3,1,0]=4 516 B9R0.45 CCCCCSCCCC 62a_100000210211_100000210326 [0,0,0,0,0,0|2,1,0]=3 517 B9R0.45 CCCCCSCCCC 62a_100000210326_100000210210 [0,0,0,0,0,0|2,1,0]=3 518 B9R0.45 CCCCCSCCCF 62a_100000210326_100011934791 [0,0,0,0,0,0|3,1,0]=4 519 B9R0.45 CCCCCSCCCF 62a_100011934791_100000210326 [0,0,0,0,0,0|3,1,0]=4 520 B9R0.45 CCCCCSCCCO 62a_100000210326_100011215043 [0,0,0,0,0,0|3,1,0]=4 521 B9R0.45 CCCCCSCCCO 62a_100011215043_100000210326 [0,0,0,0,0,0|3,1,0]=4 522 B9R0.45 CCCCCSCCOC 62a_100000210326_100000233755 [0,0,0,0,0,0|1,1,0]=2 523 B9R0.45 CCCCCSCCOC 62a_100000233755_100000210326 [0,0,0,0,0,0|1,1,0]=2 524 B9R0.45 CCCCCSCCSC 62a_100000210326_100000751147 [0,0,0,0,0,0|1,2,0]=3 525 B9R0.45 CCCCCSCCSC 62a_100000212216_100000210326 [0,0,0,0,0,0|1,2,0]=3 526 B9R0.45 CCCCCSCOCC 62a_100000210326_100000739092 [0,0,0,0,0,0|3,0,0]=3 527 B9R0.45 CCCCCSCOCC 62a_100000739092_100000210326 [0,0,0,0,0,0|3,0,0]=3 528 B9R0.45 CCCCNCCCCF 2230a_100000102301_100000729493 [0,0,0,0,0,0|4,0,0]=4 529 B9R0.45 CCCCNCCCCF 7a_106832991798_100000729493 [0,0,0,0,0,0|4,0,0]=4 530 B9R0.45 CCCCNCCCCO 2230a_100000102301_100000210776 [0,0,0,0,0,0|4,0,0]=4 531 B9R0.45 CCCCNCCCCO 2230a_100000750430_100000210211 [0,0,0,0,0,0|4,0,0]=4 532 B9R0.45 CCCCNCCCCO 34a_100000750430_100000210210 [0,0,0,0,0,0|4,0,0]=4 533 B9R0.45 CCCCNCCCCO 7a_106832991798_100000210776 [0,0,0,0,0,0|4,0,0]=4 534 B9R0.45 CCCCNCCCOC 2230a_100000102301_100000740836 [0,0,0,0,0,0|3,0,0]=3 535 B9R0.45 CCCCNCCCOC 34a_100150723488_100000210210 [0,0,0,0,0,0|3,0,0]=3 536 B9R0.45 CCCCNCCCOC 7a_106832991798_100000740836 [0,0,0,0,0,0|3,0,0]=3 537 B9R0.45 CCCCNCCCSC 2230a_100000749238_100000210211 [0,0,0,0,0,0|3,1,0]=4 538 B9R0.45 CCCCNCCOCC 2230a_100000102301_100011215890 [0,0,0,0,0,0|2,0,0]=2 539 B9R0.45 CCCCNCCOCC 2230a_102516460346_100000210211 [0,0,0,0,0,0|2,0,0]=2 540 B9R0.45 CCCCNCCOCC 34a_102516460346_100000210210 [0,0,0,0,0,0|2,0,0]=2 541 B9R0.45 CCCCNCCOCC 7a_106832991798_100011215890 [0,0,0,0,0,0|2,0,0]=2 542 B9R0.45 CCCCNCCSCC 2230a_100000102301_100000757381 [0,0,0,0,0,0|2,1,0]=3 543 B9R0.45 CCCCNCCSCC 2230a_100000106463_100000210211 [0,0,0,0,0,0|2,1,0]=3 544 B9R0.45 CCCCNCCSCC 7a_106832991798_100000757381 [0,0,0,0,0,0|2,1,0]=3 545 B9R0.45 CCCCOCC#CCCl 34a_200000047223_100000210210 [0,0,0,0,0,0|3,0,1]=4 546 B9R0.45 CCCCOCC#CCO 34a_100000210227_200000047223 [0,0,0,0,0,0|3,0,1]=4 547 B9R0.45 CCCCOCC#CCO 7a_100000210227_200000047223 [0,0,0,0,0,0|3,0,1]=4 548 B9R0.45 CCCCOCCCC#N 7a_100000210227_100000687738 [0,0,0,0,0,0|3,0,1]=4 549 B9R0.45 CCCCOCCCC=O 7a_100000210227_200011292268 [0,0,0,0,0,0|3,0,1]=4 550 B9R0.45 CCCCOCCCCBr 34a_100011216708_100000210210 [0,0,0,0,0,0|3,0,0]=3 551 B9R0.45 CCCCOCCCCCl 34a_100000210776_100000210210 [0,0,0,0,0,0|3,0,0]=3 552 B9R0.45 CCCCOCCCCCl 7a_100000210776_100000210211 [0,0,0,0,0,0|3,0,0]=3 553 B9R0.45 CCCCOCCCCF 34a_100000210227_100000729493 [0,0,0,0,0,0|3,0,0]=3 554 B9R0.45 CCCCOCCCCF 34a_100011995726_100000210210 [0,0,0,0,0,0|3,0,0]=3 555 B9R0.45 CCCCOCCCCF 7a_100000210227_100000729493 [0,0,0,0,0,0|3,0,0]=3 556 B9R0.45 CCCCOCCCCF 7a_100011995726_100000210211 [0,0,0,0,0,0|3,0,0]=3 557 B9R0.45 CCCCOCCCCI 34a_200012148704_100000210210 [0,0,0,0,0,0|3,0,0]=3 558 B9R0.45 CCCCOCCCCN 34a_100000750430_100000210210 [0,0,0,0,0,0|3,0,0]=3 559 B9R0.45 CCCCOCCCCO 34a_100000210227_100011216708 [0,0,0,0,0,0|3,0,0]=3 560 B9R0.45 CCCCOCCCCO 7a_100000210227_100000210776 [0,0,0,0,0,0|3,0,0]=3 561 B9R0.45 CCCCOCCCNC 2230a_200000211371_200000210301 [0,0,0,0,0,0|3,0,0]=3 562 B9R0.45 CCCCOCCCNC 34a_100000213112_100000210210 [0,0,0,0,0,0|3,0,0]=3 563 B9R0.45 CCCCOCCCNC 34a_200000211371_200000210301 [0,0,0,0,0,0|3,0,0]=3 564 B9R0.45 CCCCOCCCN[13CH3] 2230a_200000211371_200025704644 [0,0,0,0,0,0|3,0,0]=3 565 B9R0.45 CCCCOCCCN[13CH3] 34a_200000211371_200025704644 [0,0,0,0,0,0|3,0,0]=3 566 B9R0.45 CCCCOCCCOC 34a_100000210227_100000740836 [0,0,0,0,0,0|3,0,0]=3 567 B9R0.45 CCCCOCCCOC 34a_100000740835_100000210210 [0,0,0,0,0,0|3,0,0]=3 568 B9R0.45 CCCCOCCCOC 34a_200011215613_200000210301 [0,0,0,0,0,0|3,0,0]=3 569 B9R0.45 CCCCOCCCOC 7a_100000210227_100000740836 [0,0,0,0,0,0|3,0,0]=3 570 B9R0.45 CCCCOCCCOC 7a_200011215613_200000210301 [0,0,0,0,0,0|3,0,0]=3 571 B9R0.45 CCCCOCCCO[13CH3] 34a_200011215613_200025704644 [0,0,0,0,0,0|3,0,0]=3 572 B9R0.45 CCCCOCCCO[13CH3] 7a_200011215613_200025704644 [0,0,0,0,0,0|3,0,0]=3 573 B9R0.45 CCCCOCCCSC 34a_100000690336_100000210210 [0,0,0,0,0,0|3,0,0]=3 574 B9R0.45 CCCCOCCCSC 7a_100000690336_100000210211 [0,0,0,0,0,0|3,0,0]=3 575 B9R0.45 CCCCOCCNCC 2230a_100015525214_100000743108 [0,0,0,0,0,0|2,0,0]=2 576 B9R0.45 CCCCOCCOCC 34a_100000210136_100000210210 [0,0,0,0,0,0|1,0,0]=1 577 B9R0.45 CCCCOCCOCC 34a_100000210227_100000210147 [0,0,0,0,0,0|1,0,0]=1 578 B9R0.45 CCCCOCCOCC 34a_100000210238_100000210202 [0,0,0,0,0,0|1,0,0]=1 579 B9R0.45 CCCCOCCOCC 34a_100121572206_100000743108 [0,0,0,0,0,0|1,0,0]=1 580 B9R0.45 CCCCOCCOCC 7a_100000210136_100000210211 [0,0,0,0,0,0|1,0,0]=1 581 B9R0.45 CCCCOCCOCC 7a_100000210227_100011215890 [0,0,0,0,0,0|1,0,0]=1 582 B9R0.45 CCCCOCCOCC 7a_100000210238_100000210202 [0,0,0,0,0,0|1,0,0]=1 583 B9R0.45 CCCCOCCOCF 34a_100000210238_100015361967 [0,0,0,0,0,0|2,0,0]=2 584 B9R0.45 CCCCOCCOCF 7a_100000210238_100015361967 [0,0,0,0,0,0|2,0,0]=2 585 B9R0.45 CCCCOCCSCC 34a_100000210227_100000757381 [0,0,0,0,0,0|1,1,0]=2 586 B9R0.45 CCCCOCCSCC 34a_100000212035_100000210210 [0,0,0,0,0,0|1,1,0]=2 587 B9R0.45 CCCCOCCSCC 62a_100000210202_100000743108 [0,0,0,0,0,0|1,1,0]=2 588 B9R0.45 CCCCOCCSCC 62a_100000743108_100000210202 [0,0,0,0,0,0|1,1,0]=2 589 B9R0.45 CCCCOCCSCC 7a_100000210227_100000757381 [0,0,0,0,0,0|1,1,0]=2 590 B9R0.45 CCCCOCCSCC 7a_100000212035_100000210211 [0,0,0,0,0,0|1,1,0]=2 591 B9R0.45 CCCCOCCSCF 62a_100000743108_100015361967 [0,0,0,0,0,0|2,1,0]=3 592 B9R0.45 CCCCOCCSCF 62a_100015361967_100000743108 [0,0,0,0,0,0|2,1,0]=3 593 B9R0.45 CCCCOCNCCF 34a_100000724931_100011995733 [0,0,0,0,0,0|4,0,0]=4 594 B9R0.45 CCCCOCNCCO 2230a_100016997473_100011995733 [0,0,0,0,0,0|4,0,0]=4 595 B9R0.45 CCCCOCNCCO 34a_100016990907_100011995733 [0,0,0,0,0,0|4,0,0]=4 596 B9R0.45 CCCCOCOCCBr 34a_100000211926_100011995733 [0,0,0,0,0,0|4,0,0]=4 597 B9R0.45 CCCCOCOCCC 34a_100000210258_100011995733 [0,0,0,0,0,0|3,0,0]=3 598 B9R0.45 CCCCOCOCCN 34a_100000210304_100011995733 [0,0,0,0,0,0|4,0,0]=4 599 B9R0.45 CCCCOCSCCC 62a_100000210303_100011995733 [0,0,0,0,0,0|3,0,0]=3 600 B9R0.45 CCCCOCSCCC 62a_100011995733_100000210303 [0,0,0,0,0,0|3,0,0]=3 601 B9R0.45 CCCCOCSCCF 62a_100011217306_100011995733 [0,0,0,0,0,0|4,0,0]=4 602 B9R0.45 CCCCOCSCCF 62a_100011995733_100011217306 [0,0,0,0,0,0|4,0,0]=4 603 B9R0.45 CCCCOCSCCO 62a_100000211926_100011995733 [0,0,0,0,0,0|4,0,0]=4 604 B9R0.45 CCCCOCSCCO 62a_100011995733_100000211926 [0,0,0,0,0,0|4,0,0]=4 605 B9R0.45 CCCCOCSCOC 62a_100000766300_100011995733 [0,0,0,0,0,0|4,0,0]=4 606 B9R0.45 CCCCOCSCOC 62a_100011995733_100000766300 [0,0,0,0,0,0|4,0,0]=4 607 B9R0.45 CCCCOCSCSC 62a_100011218213_100011995733 [0,0,0,0,0,0|4,0,0]=4 608 B9R0.45 CCCCOCSCSC 62a_100011995733_100011218213 [0,0,0,0,0,0|4,0,0]=4 609 B9R0.45 CCCCSCCCCF 62a_100000210211_100000729493 [0,0,0,0,0,0|3,1,0]=4 610 B9R0.45 CCCCSCCCCF 62a_100000729493_100000210210 [0,0,0,0,0,0|3,1,0]=4 611 B9R0.45 CCCCSCCCCO 62a_100000210211_100000210776 [0,0,0,0,0,0|3,1,0]=4 612 B9R0.45 CCCCSCCCCO 62a_100000210776_100000210210 [0,0,0,0,0,0|3,1,0]=4 613 B9R0.45 CCCCSCCCOC 62a_100000210211_100000709357 [0,0,0,0,0,0|3,0,0]=3 614 B9R0.45 CCCCSCCCOC 62a_100000709357_100000210210 [0,0,0,0,0,0|3,0,0]=3 615 B9R0.45 CCCCSCCNCC 2230a_100025743550_100000210202 [0,0,0,0,0,0|2,1,0]=3 616 B9R0.45 CCCCSCCOCC 34a_200000230436_100000210202 [0,0,0,0,0,0|1,1,0]=2 617 B9R0.45 CCCCSCCOCC 62a_100000210147_100000210210 [0,0,0,0,0,0|1,1,0]=2 618 B9R0.45 CCCCSCCOCC 62a_100000210211_100011215890 [0,0,0,0,0,0|1,1,0]=2 619 B9R0.45 CCCCSCCOCC 7a_200000230436_100000210202 [0,0,0,0,0,0|1,1,0]=2 620 B9R0.45 CCCCSCCOCF 34a_200000230436_100015361967 [0,0,0,0,0,0|2,1,0]=3 621 B9R0.45 CCCCSCCOCF 7a_200000230436_100015361967 [0,0,0,0,0,0|2,1,0]=3 622 B9R0.45 CCCCSCCSCC 62a_100000210211_100000757381 [0,0,0,0,0,0|1,2,0]=3 623 B9R0.45 CCCCSCCSCC 62a_100000757381_100000210210 [0,0,0,0,0,0|1,2,0]=3 624 B9R0.45 CCCNCCCOCC 2230a_100000210961_100000210303 [0,0,0,0,0,0|3,0,0]=3 625 B9R0.45 CCCNCCCOCC 34a_100000210961_100000210303 [0,0,0,0,0,0|3,0,0]=3 626 B9R0.45 CCCOCCCCOC 34a_100000210258_100000755781 [0,0,0,0,0,0|3,0,0]=3 627 B9R0.45 CCCOCCCCOC 34a_100000740925_100000210303 [0,0,0,0,0,0|3,0,0]=3 628 B9R0.45 CCCOCCCCSC 34a_100011217163_100000210303 [0,0,0,0,0,0|3,1,0]=4 629 B9R0.45 CCCOCCCCSC 7a_100011217163_100000210303 [0,0,0,0,0,0|3,1,0]=4 630 B9R0.45 CCCOCCCNCC 2230a_100011217757_100000210202 [0,0,0,0,0,0|4,0,0]=4 631 B9R0.45 CCCOCCCNCC 34a_100011217757_100000210202 [0,0,0,0,0,0|4,0,0]=4 632 B9R0.45 CCCOCCCOCC 34a_100000210258_100012232248 [0,0,0,0,0,0|3,0,0]=3 633 B9R0.45 CCCOCCCOCC 34a_100000757476_100000210303 [0,0,0,0,0,0|3,0,0]=3 634 B9R0.45 CCCOCCCOCC 7a_100000757476_100000210303 [0,0,0,0,0,0|3,0,0]=3 635 B9R0.45 CCCOCCCSCC 34a_100011216438_100000210303 [0,0,0,0,0,0|3,1,0]=4 636 B9R0.45 CCCOCCCSCC 7a_100011216438_100000210303 [0,0,0,0,0,0|3,1,0]=4 637 B9R0.45 CCCOCCNCOC 2230a_100161115042_100000766300 [0,0,0,0,0,0|4,0,0]=4 638 B9R0.45 CCCOCCSCOC 62a_100000766300_100011215938 [0,0,0,0,0,0|4,0,0]=4 639 B9R0.45 CCCOCCSCOC 62a_100011215938_100000766300 [0,0,0,0,0,0|4,0,0]=4 640 B9R0.45 CCCSCCCCOC 62a_100000210303_100000730899 [0,0,0,0,0,0|3,0,0]=3 641 B9R0.45 CCCSCCCCOC 62a_100000730899_100000210303 [0,0,0,0,0,0|3,0,0]=3 642 B9R0.45 CCCSCCCOCC 62a_100000210303_100012232248 [0,0,0,0,0,0|3,0,0]=3 643 B9R0.45 CCCSCCCOCC 62a_100012232248_100000210303 [0,0,0,0,0,0|3,0,0]=3 644 B9R0.45 CCCSCCNCOC 2230a_100020603323_100000766300 [0,0,0,0,0,0|4,0,0]=4 645 B9R0.45 CCCSCOCCOC 62a_100000210303_100000231047 [0,0,0,0,0,0|2,0,0]=2 646 B9R0.45 CCCSCOCCOC 62a_100000231047_100000210303 [0,0,0,0,0,0|2,0,0]=2 647 B9R0.45 CCNCCCCCC#N 2230a_100015525214_100009813376 [0,0,0,0,0,0|4,0,0]=4 648 B9R0.45 CCNCCCCCC=O 2230a_100015525214_100000139337 [0,0,0,0,0,0|4,0,0]=4 649 B9R0.45 CCNCCCCCCF 2230a_100015525214_100015922095 [0,0,0,0,0,0|4,0,0]=4 650 B9R0.45 CCNCCCCCCO 2230a_100000686447_100000210202 [0,0,0,0,0,0|4,0,0]=4 651 B9R0.45 CCNCCCCCCO 2230a_100015525214_100000766143 [0,0,0,0,0,0|4,0,0]=4 652 B9R0.45 CCNCCCCCCO 34a_100000686447_100000210202 [0,0,0,0,0,0|4,0,0]=4 653 B9R0.45 CCNCCCCCOC 2230a_100000747528_100000210202 [0,0,0,0,0,0|2,0,0]=2 654 B9R0.45 CCNCCCCCOC 34a_100000747528_100000210202 [0,0,0,0,0,0|2,0,0]=2 655 B9R0.45 CCNCCOCCOC 2230a_100000745349_100000210202 [0,0,0,0,0,0|1,0,0]=1 656 B9R0.45 CCNCCOCCOC 2230a_100015525214_100000695917 [0,0,0,0,0,0|1,0,0]=1 657 B9R0.45 CCNCCOCCOC 34a_100000745349_100000210202 [0,0,0,0,0,0|1,0,0]=1 658 B9R0.45 CCOCCCCCCBr 34a_100011215345_100000210202 [0,0,0,0,0,0|3,0,0]=3 659 B9R0.45 CCOCCCCCCBr 7a_100011215345_100000210202 [0,0,0,0,0,0|3,0,0]=3 660 B9R0.45 CCOCCCCCCCl 34a_100000766143_100000210202 [0,0,0,0,0,0|3,0,0]=3 661 B9R0.45 CCOCCCCCCCl 7a_100000766143_100000210202 [0,0,0,0,0,0|3,0,0]=3 662 B9R0.45 CCOCCCCCCF 34a_100000732779_100000210202 [0,0,0,0,0,0|3,0,0]=3 663 B9R0.45 CCOCCCCCCF 34a_100121572206_100015922095 [0,0,0,0,0,0|3,0,0]=3 664 B9R0.45 CCOCCCCCCF 7a_100000732779_100000210202 [0,0,0,0,0,0|3,0,0]=3 665 B9R0.45 CCOCCCCCCN 34a_100000686447_100000210202 [0,0,0,0,0,0|3,0,0]=3 666 B9R0.45 CCOCCCCCCO 34a_100121572206_100000766143 [0,0,0,0,0,0|3,0,0]=3 667 B9R0.45 CCOCCCCCNC 34a_100000722520_100000210202 [0,0,0,0,0,0|2,0,0]=2 668 B9R0.45 CCOCCCNCC#N 2230a_100000210961_100011215382 [0,0,0,0,0,0|4,0,0]=4 669 B9R0.45 CCOCCCNCC=O 2230a_100000210961_200015260668 [0,0,0,0,0,0|4,0,0]=4 670 B9R0.45 CCOCCCNCC=O 34a_100000210961_200009817547 [0,0,0,0,0,0|4,0,0]=4 671 B9R0.45 CCOCCCNCCF 2230a_100000210961_100011217306 [0,0,0,0,0,0|4,0,0]=4 672 B9R0.45 CCOCCCNCCF 34a_100000210961_100011217306 [0,0,0,0,0,0|4,0,0]=4 673 B9R0.45 CCOCCCNCCF 34a_100000724931_100012232248 [0,0,0,0,0,0|4,0,0]=4 674 B9R0.45 CCOCCCNCCO 2230a_100000210961_100000211926 [0,0,0,0,0,0|4,0,0]=4 675 B9R0.45 CCOCCCNCCO 2230a_100016997473_100012232248 [0,0,0,0,0,0|4,0,0]=4 676 B9R0.45 CCOCCCNCCO 34a_100000210961_100000211926 [0,0,0,0,0,0|4,0,0]=4 677 B9R0.45 CCOCCCNCCO 34a_100016990907_100012232248 [0,0,0,0,0,0|4,0,0]=4 678 B9R0.45 CCOCCCNCOC 2230a_100000210961_100000766300 [0,0,0,0,0,0|2,0,0]=2 679 B9R0.45 CCOCCCNCSC 2230a_100000210961_100011218213 [0,0,0,0,0,0|2,1,0]=3 680 B9R0.45 CCOCCCNCSC 34a_100000210961_100011218213 [0,0,0,0,0,0|2,1,0]=3 681 B9R0.45 CCOCCCOCC#N 7a_100000757476_100011215382 [0,0,0,0,0,0|4,0,0]=4 682 B9R0.45 CCOCCCOCC=O 34a_100000757476_200009817547 [0,0,0,0,0,0|4,0,0]=4 683 B9R0.45 CCOCCCOCC=O 7a_100000757476_200015260668 [0,0,0,0,0,0|4,0,0]=4 684 B9R0.45 CCOCCCOCCBr 34a_100000211926_100012232248 [0,0,0,0,0,0|4,0,0]=4 685 B9R0.45 CCOCCCOCCF 34a_100000757476_100011217306 [0,0,0,0,0,0|4,0,0]=4 686 B9R0.45 CCOCCCOCCF 7a_100000757476_100011217306 [0,0,0,0,0,0|4,0,0]=4 687 B9R0.45 CCOCCCOCCN 34a_100000210304_100012232248 [0,0,0,0,0,0|4,0,0]=4 688 B9R0.45 CCOCCCOCCO 34a_100000757476_100000211926 [0,0,0,0,0,0|4,0,0]=4 689 B9R0.45 CCOCCCOCCO 7a_100000757476_100000211926 [0,0,0,0,0,0|4,0,0]=4 690 B9R0.45 CCOCCCOCSC 34a_100000757476_100011218213 [0,0,0,0,0,0|2,1,0]=3 691 B9R0.45 CCOCCCSCC#N 62a_100011215382_100012232248 [0,0,0,0,0,0|4,0,0]=4 692 B9R0.45 CCOCCCSCC#N 62a_100012232248_100011215382 [0,0,0,0,0,0|4,0,0]=4 693 B9R0.45 CCOCCCSCC=O 62a_100012232248_200015260668 [0,0,0,0,0,0|4,0,0]=4 694 B9R0.45 CCOCCCSCC=O 62a_200015260668_100012232248 [0,0,0,0,0,0|4,0,0]=4 695 B9R0.45 CCOCCCSCCF 62a_100011217306_100012232248 [0,0,0,0,0,0|4,0,0]=4 696 B9R0.45 CCOCCCSCCF 62a_100012232248_100011217306 [0,0,0,0,0,0|4,0,0]=4 697 B9R0.45 CCOCCCSCCO 62a_100000211926_100012232248 [0,0,0,0,0,0|4,0,0]=4 698 B9R0.45 CCOCCCSCCO 62a_100012232248_100000211926 [0,0,0,0,0,0|4,0,0]=4 699 B9R0.45 CCOCCCSCOC 62a_100000766300_100012232248 [0,0,0,0,0,0|2,0,0]=2 700 B9R0.45 CCOCCCSCOC 62a_100012232248_100000766300 [0,0,0,0,0,0|2,0,0]=2 701 B9R0.45 CCOCCCSCSC 62a_100011218213_100012232248 [0,0,0,0,0,0|2,1,0]=3 702 B9R0.45 CCOCCCSCSC 62a_100012232248_100011218213 [0,0,0,0,0,0|2,1,0]=3 703 B9R0.45 CCOCCNCCC#N 2230a_102516460346_100011215226 [0,0,0,0,0,0|3,0,0]=3 704 B9R0.45 CCOCCNCCCF 2230a_100015189416_100011215890 [0,0,0,0,0,0|3,0,0]=3 705 B9R0.45 CCOCCNCCCF 2230a_102516460346_100011934791 [0,0,0,0,0,0|3,0,0]=3 706 B9R0.45 CCOCCNCCCF 34a_100015189416_100000210147 [0,0,0,0,0,0|3,0,0]=3 707 B9R0.45 CCOCCNCCCF 34a_102516460346_100011934791 [0,0,0,0,0,0|3,0,0]=3 708 B9R0.45 CCOCCNCCCO 2230a_102516460346_100000230001 [0,0,0,0,0,0|3,0,0]=3 709 B9R0.45 CCOCCNCCCO 34a_102516460346_100000230001 [0,0,0,0,0,0|3,0,0]=3 710 B9R0.45 CCOCCNCCOC 2230a_100000209980_100011215890 [0,0,0,0,0,0|1,0,0]=1 711 B9R0.45 CCOCCNCCOC 2230a_102516460346_100011201679 [0,0,0,0,0,0|1,0,0]=1 712 B9R0.45 CCOCCNCCOC 34a_102516460346_100011201679 [0,0,0,0,0,0|1,0,0]=1 713 B9R0.45 CCOCCNCCSC 2230a_100020590264_100011215890 [0,0,0,0,0,0|1,1,0]=2 714 B9R0.45 CCOCCNCCSC 2230a_102516460346_100000751147 [0,0,0,0,0,0|1,1,0]=2 715 B9R0.45 CCOCCNCCSC 34a_102516460346_100000212216 [0,0,0,0,0,0|1,1,0]=2 716 B9R0.45 CCOCCOCCC#N 7a_100000210136_100000184422 [0,0,0,0,0,0|2,0,0]=2 717 B9R0.45 CCOCCOCCCBr 34a_100011217188_100000210147 [0,0,0,0,0,0|2,0,0]=2 718 B9R0.45 CCOCCOCCCCl 34a_100000230001_100000210147 [0,0,0,0,0,0|2,0,0]=2 719 B9R0.45 CCOCCOCCCF 34a_100000210136_100011934791 [0,0,0,0,0,0|2,0,0]=2 720 B9R0.45 CCOCCOCCCF 34a_100000759539_100000210147 [0,0,0,0,0,0|2,0,0]=2 721 B9R0.45 CCOCCOCCCF 7a_100000210136_100011934791 [0,0,0,0,0,0|2,0,0]=2 722 B9R0.45 CCOCCOCCCN 34a_100000182051_100000210147 [0,0,0,0,0,0|2,0,0]=2 723 B9R0.45 CCOCCOCCCO 34a_100000210136_100000230001 [0,0,0,0,0,0|2,0,0]=2 724 B9R0.45 CCOCCOCCCO 7a_100000210136_100011215043 [0,0,0,0,0,0|2,0,0]=2 725 B9R0.45 CCOCCOCCNC 2230a_100102712874_200000210301 [0,0,0,0,0,0|1,0,0]=1 726 B9R0.45 CCOCCOCCNC 2230a_106832991635_100011211534 [0,0,0,0,0,0|1,0,0]=1 727 B9R0.45 CCOCCOCCNC 34a_100000228057_100000210202 [0,0,0,0,0,0|1,0,0]=1 728 B9R0.45 CCOCCOCCNC 34a_100102657272_100011211534 [0,0,0,0,0,0|1,0,0]=1 729 B9R0.45 CCOCCOCCNC 34a_100102712874_200000210301 [0,0,0,0,0,0|1,0,0]=1 730 B9R0.45 CCOCCOCCNC 7a_106832991635_100011211534 [0,0,0,0,0,0|1,0,0]=1 731 B9R0.45 CCOCCOCCN[13CH3] 2230a_100102712874_200025704644 [0,0,0,0,0,0|1,0,0]=1 732 B9R0.45 CCOCCOCCN[13CH3] 34a_100102712874_200025704644 [0,0,0,0,0,0|1,0,0]=1 733 B9R0.45 CCOCCOCCOC 34a_100000210136_100011201679 [0,0,0,0,0,0|0,0,0]=0 734 B9R0.45 CCOCCOCCOC 34a_100000210237_100000210147 [0,0,0,0,0,0|0,0,0]=0 735 B9R0.45 CCOCCOCCOC 34a_100000210240_200000210301 [0,0,0,0,0,0|0,0,0]=0 736 B9R0.45 CCOCCOCCOC 34a_100011215163_100000210202 [0,0,0,0,0,0|0,0,0]=0 737 B9R0.45 CCOCCOCCOC 34a_100121572206_100000695917 [0,0,0,0,0,0|0,0,0]=0 738 B9R0.45 CCOCCOCCOC 34a_100138415774_100011211534 [0,0,0,0,0,0|0,0,0]=0 739 B9R0.45 CCOCCOCCOC 7a_100000210136_100000233755 [0,0,0,0,0,0|0,0,0]=0 740 B9R0.45 CCOCCOCCOC 7a_100000210240_200000210301 [0,0,0,0,0,0|0,0,0]=0 741 B9R0.45 CCOCCOCCOC 7a_100011215163_100000210202 [0,0,0,0,0,0|0,0,0]=0 742 B9R0.45 CCOCCOCCON 34a_100000700252_100000210147 [0,0,0,0,0,0|1,0,0]=1 743 B9R0.45 CCOCCOCCO[13CH3] 34a_100000210240_200025704644 [0,0,0,0,0,0|0,0,0]=0 744 B9R0.45 CCOCCOCCO[13CH3] 7a_100000210240_200025704644 [0,0,0,0,0,0|0,0,0]=0 745 B9R0.45 CCOCCOCCSC 34a_100000210136_100000212216 [0,0,0,0,0,0|0,1,0]=1 746 B9R0.45 CCOCCOCCSC 34a_100000230434_100000210147 [0,0,0,0,0,0|0,1,0]=1 747 B9R0.45 CCOCCOCCSC 62a_100011211534_200000210301 [0,0,0,0,0,0|0,1,0]=1 748 B9R0.45 CCOCCOCCSC 62a_200000210301_100011211534 [0,0,0,0,0,0|0,1,0]=1 749 B9R0.45 CCOCCOCCSC 7a_100000210136_100000212216 [0,0,0,0,0,0|0,1,0]=1 750 B9R0.45 CCOCCOCCSC 7a_100000230434_100011215890 [0,0,0,0,0,0|0,1,0]=1 751 B9R0.45 CCOCCOCCS[13CH3] 62a_100011211534_200025704644 [0,0,0,0,0,0|0,1,0]=1 752 B9R0.45 CCOCCOCCS[13CH3] 62a_200025704644_100011211534 [0,0,0,0,0,0|0,1,0]=1 753 B9R0.45 CCOCCSCCC#N 62a_100000210147_100011215226 [0,0,0,0,0,0|2,1,0]=3 754 B9R0.45 CCOCCSCCC#N 62a_100011215226_100011215890 [0,0,0,0,0,0|2,1,0]=3 755 B9R0.45 CCOCCSCCCF 62a_100000210147_100011934791 [0,0,0,0,0,0|2,1,0]=3 756 B9R0.45 CCOCCSCCCF 62a_100011934791_100011215890 [0,0,0,0,0,0|2,1,0]=3 757 B9R0.45 CCOCCSCCCO 62a_100000210147_100011215043 [0,0,0,0,0,0|2,1,0]=3 758 B9R0.45 CCOCCSCCCO 62a_100011215043_100011215890 [0,0,0,0,0,0|2,1,0]=3 759 B9R0.45 CCOCCSCCOC 62a_100000210147_100000233755 [0,0,0,0,0,0|0,1,0]=1 760 B9R0.45 CCOCCSCCOC 62a_100000233755_100011215890 [0,0,0,0,0,0|0,1,0]=1 761 B9R0.45 CCOCCSCCSC 62a_100000210147_100000751147 [0,0,0,0,0,0|0,2,0]=2 762 B9R0.45 CCOCCSCCSC 62a_100000212216_100011215890 [0,0,0,0,0,0|0,2,0]=2 763 B9R0.45 CCOCCSCOCC 62a_100000210147_100000739092 [0,0,0,0,0,0|2,1,0]=3 764 B9R0.45 CCOCCSCOCC 62a_100000739092_100011215890 [0,0,0,0,0,0|2,1,0]=3 765 B9R0.45 CCOCCSCSC#N 62a_100000210147_100000211825 [0,0,0,0,0,0|3,1,0]=4 766 B9R0.45 CCOCCSCSC#N 62a_100000211825_100011215890 [0,0,0,0,0,0|3,1,0]=4 767 B9R0.45 CCOCSCCCC#N 62a_100000687738_100000739092 [0,0,0,0,0,0|4,0,0]=4 768 B9R0.45 CCOCSCCCC#N 62a_100000739092_100000687738 [0,0,0,0,0,0|4,0,0]=4 769 B9R0.45 CCOCSCCCC=O 62a_100000739092_200011292268 [0,0,0,0,0,0|4,0,0]=4 770 B9R0.45 CCOCSCCCC=O 62a_200011292268_100000739092 [0,0,0,0,0,0|4,0,0]=4 771 B9R0.45 CCOCSCCCCF 62a_100000729493_100000739092 [0,0,0,0,0,0|4,0,0]=4 772 B9R0.45 CCOCSCCCCF 62a_100000739092_100000729493 [0,0,0,0,0,0|4,0,0]=4 773 B9R0.45 CCOCSCCCCO 62a_100000210776_100000739092 [0,0,0,0,0,0|4,0,0]=4 774 B9R0.45 CCOCSCCCCO 62a_100000739092_100000210776 [0,0,0,0,0,0|4,0,0]=4 775 B9R0.45 CCOCSCCCOC 62a_100000709357_100000739092 [0,0,0,0,0,0|2,0,0]=2 776 B9R0.45 CCOCSCCCOC 62a_100000739092_100000709357 [0,0,0,0,0,0|2,0,0]=2 777 B9R0.45 CCOCSCCSCC 62a_100000739092_100000757381 [0,0,0,0,0,0|2,2,0]=4 778 B9R0.45 CCOCSCCSCC 62a_100000757381_100000739092 [0,0,0,0,0,0|2,2,0]=4 779 B9R0.45 CCSCCCCCC#N 62a_100000210202_100009813376 [0,0,0,0,0,0|3,1,0]=4 780 B9R0.45 CCSCCCCCC#N 62a_100009813376_100000210202 [0,0,0,0,0,0|3,1,0]=4 781 B9R0.45 CCSCCCCCC=O 62a_100000139337_100000210202 [0,0,0,0,0,0|3,1,0]=4 782 B9R0.45 CCSCCCCCC=O 62a_100000210202_100000139337 [0,0,0,0,0,0|3,1,0]=4 783 B9R0.45 CCSCCCCCCF 62a_100000210202_100015922095 [0,0,0,0,0,0|3,1,0]=4 784 B9R0.45 CCSCCCCCCF 62a_100015922095_100000210202 [0,0,0,0,0,0|3,1,0]=4 785 B9R0.45 CCSCCCCCCO 62a_100000210202_100000766143 [0,0,0,0,0,0|3,1,0]=4 786 B9R0.45 CCSCCCCCCO 62a_100000766143_100000210202 [0,0,0,0,0,0|3,1,0]=4 787 B9R0.45 CCSCCCOCSC 34a_100011216438_100011218213 [0,0,0,0,0,0|2,2,0]=4 788 B9R0.45 CCSCCNCCC#N 2230a_100000106463_100011215226 [0,0,0,0,0,0|3,1,0]=4 789 B9R0.45 CCSCCNCCCF 2230a_100000106463_100011934791 [0,0,0,0,0,0|3,1,0]=4 790 B9R0.45 CCSCCNCCCF 2230a_100015189416_100000757381 [0,0,0,0,0,0|3,1,0]=4 791 B9R0.45 CCSCCNCCCF 34a_100015189416_100000757381 [0,0,0,0,0,0|3,1,0]=4 792 B9R0.45 CCSCCNCCCO 2230a_100000106463_100000230001 [0,0,0,0,0,0|3,1,0]=4 793 B9R0.45 CCSCCNCCOC 2230a_100000106463_100011201679 [0,0,0,0,0,0|1,1,0]=2 794 B9R0.45 CCSCCNCCOC 2230a_100000209980_100000757381 [0,0,0,0,0,0|1,1,0]=2 795 B9R0.45 CCSCCNCCSC 2230a_100000106463_100000751147 [0,0,0,0,0,0|1,2,0]=3 796 B9R0.45 CCSCCNCCSC 2230a_100020590264_100000757381 [0,0,0,0,0,0|1,2,0]=3 797 B9R0.45 CCSCCOCCC#N 7a_100000212035_100000184422 [0,0,0,0,0,0|2,1,0]=3 798 B9R0.45 CCSCCOCCCBr 34a_100011217188_100000757381 [0,0,0,0,0,0|2,1,0]=3 799 B9R0.45 CCSCCOCCCCl 34a_100000230001_100000757381 [0,0,0,0,0,0|2,1,0]=3 800 B9R0.45 CCSCCOCCCF 34a_100000212035_100011934791 [0,0,0,0,0,0|2,1,0]=3 801 B9R0.45 CCSCCOCCCF 34a_100000759539_100000757381 [0,0,0,0,0,0|2,1,0]=3 802 B9R0.45 CCSCCOCCCF 7a_100000212035_100011934791 [0,0,0,0,0,0|2,1,0]=3 803 B9R0.45 CCSCCOCCCN 34a_100000182051_100000757381 [0,0,0,0,0,0|2,1,0]=3 804 B9R0.45 CCSCCOCCCO 34a_100000212035_100000230001 [0,0,0,0,0,0|2,1,0]=3 805 B9R0.45 CCSCCOCCCO 7a_100000212035_100011215043 [0,0,0,0,0,0|2,1,0]=3 806 B9R0.45 CCSCCOCCOC 34a_100000210237_100000757381 [0,0,0,0,0,0|0,1,0]=1 807 B9R0.45 CCSCCOCCOC 34a_100000212035_100011201679 [0,0,0,0,0,0|0,1,0]=1 808 B9R0.45 CCSCCOCCOC 62a_100000210202_100000695917 [0,0,0,0,0,0|0,1,0]=1 809 B9R0.45 CCSCCOCCOC 62a_100000695917_100000210202 [0,0,0,0,0,0|0,1,0]=1 810 B9R0.45 CCSCCOCCOC 7a_100000212035_100000233755 [0,0,0,0,0,0|0,1,0]=1 811 B9R0.45 CCSCCOCCON 34a_100000700252_100000757381 [0,0,0,0,0,0|1,1,0]=2 812 B9R0.45 CCSCCOCCSC 34a_100000212035_100000212216 [0,0,0,0,0,0|0,2,0]=2 813 B9R0.45 CCSCCOCCSC 34a_100000230434_100000757381 [0,0,0,0,0,0|0,2,0]=2 814 B9R0.45 CCSCCOCCSC 7a_100000212035_100000212216 [0,0,0,0,0,0|0,2,0]=2 815 B9R0.45 CCSCCOCCSC 7a_100000230434_100000757381 [0,0,0,0,0,0|0,2,0]=2 816 B9R0.45 CCSCCSCCC#N 62a_100000757381_100011215226 [0,0,0,0,0,0|2,2,0]=4 817 B9R0.45 CCSCCSCCC#N 62a_100011215226_100000757381 [0,0,0,0,0,0|2,2,0]=4 818 B9R0.45 CCSCCSCCCF 62a_100000757381_100011934791 [0,0,0,0,0,0|2,2,0]=4 819 B9R0.45 CCSCCSCCCF 62a_100011934791_100000757381 [0,0,0,0,0,0|2,2,0]=4 820 B9R0.45 CCSCCSCCCO 62a_100000757381_100011215043 [0,0,0,0,0,0|2,2,0]=4 821 B9R0.45 CCSCCSCCCO 62a_100011215043_100000757381 [0,0,0,0,0,0|2,2,0]=4 822 B9R0.45 CCSCCSCCOC 62a_100000233755_100000757381 [0,0,0,0,0,0|0,2,0]=2 823 B9R0.45 CCSCCSCCOC 62a_100000757381_100000233755 [0,0,0,0,0,0|0,2,0]=2 824 B9R0.45 CCSCCSCCSC 62a_100000212216_100000757381 [0,0,0,0,0,0|0,3,0]=3 825 B9R0.45 CCSCCSCCSC 62a_100000757381_100000751147 [0,0,0,0,0,0|0,3,0]=3 826 B9R0.45 CNCCCCCCCO 2230a_100011996573_200000210301 [0,0,0,0,0,0|4,0,0]=4 827 B9R0.45 CNCCCCCCCO 2230a_106832991635_100000760002 [0,0,0,0,0,0|4,0,0]=4 828 B9R0.45 CNCCCCCCCO 34a_100011996573_200000210301 [0,0,0,0,0,0|4,0,0]=4 829 B9R0.45 CNCCCCCCCO 34a_100102657272_100000760002 [0,0,0,0,0,0|4,0,0]=4 830 B9R0.45 CNCCCCCCCO 7a_106832991635_100000760002 [0,0,0,0,0,0|4,0,0]=4 831 B9R0.45 CNCCCCCCOC 2230a_106832991635_100011998445 [0,0,0,0,0,0|3,0,0]=3 832 B9R0.45 CNCCCCCCOC 34a_100102657272_100011998445 [0,0,0,0,0,0|3,0,0]=3 833 B9R0.45 CNCCCCCCOC 7a_106832991635_100011998445 [0,0,0,0,0,0|3,0,0]=3 834 B9R0.45 CNCCCCCOCF 34a_100000722520_100015361967 [0,0,0,0,0,0|3,0,0]=3 835 B9R0.45 CNCCCOCCCF 34a_100000213112_100011934791 [0,0,0,0,0,0|4,0,0]=4 836 B9R0.45 CNCCCOCCCO 2230a_100011310245_200000210301 [0,0,0,0,0,0|4,0,0]=4 837 B9R0.45 CNCCCOCCCO 34a_100000213112_100000230001 [0,0,0,0,0,0|4,0,0]=4 838 B9R0.45 CNCCCOCCCO 34a_100011310245_200000210301 [0,0,0,0,0,0|4,0,0]=4 839 B9R0.45 CNCCCOCCOC 2230a_100000206027_200000210301 [0,0,0,0,0,0|2,0,0]=2 840 B9R0.45 CNCCCOCCOC 2230a_106832991635_100011216529 [0,0,0,0,0,0|2,0,0]=2 841 B9R0.45 CNCCCOCCOC 34a_100000206027_200000210301 [0,0,0,0,0,0|2,0,0]=2 842 B9R0.45 CNCCCOCCOC 34a_100000213112_100011201679 [0,0,0,0,0,0|2,0,0]=2 843 B9R0.45 CNCCCOCCOC 34a_100102657272_100011216529 [0,0,0,0,0,0|2,0,0]=2 844 B9R0.45 CNCCCOCCOC 7a_106832991635_100011216529 [0,0,0,0,0,0|2,0,0]=2 845 B9R0.45 CNCCCOCCSC 34a_100000213112_100000212216 [0,0,0,0,0,0|2,1,0]=3 846 B9R0.45 CNCCOCCN=[N+]=[N-] 2230a_100102953956_200000210301 [0,0,0,0,0,0|4,0,0]=4 847 B9R0.45 CNCCOCCOCF 34a_100000228057_100015361967 [0,0,0,0,0,0|2,0,0]=2 848 B9R0.45 COCCCCCCCBr 34a_100000760002_200000210301 [0,0,0,0,0,0|3,0,0]=3 849 B9R0.45 COCCCCCCCBr 7a_100000760002_200000210301 [0,0,0,0,0,0|3,0,0]=3 850 B9R0.45 COCCCCCCCN 34a_100011996573_200000210301 [0,0,0,0,0,0|3,0,0]=3 851 B9R0.45 COCCCCCCCO 34a_100138415774_100000760002 [0,0,0,0,0,0|3,0,0]=3 852 B9R0.45 COCCCCCCOC 34a_100138415774_100011998445 [0,0,0,0,0,0|3,0,0]=3 853 B9R0.45 COCCCCCCOC 34a_200012092642_200000210301 [0,0,0,0,0,0|3,0,0]=3 854 B9R0.45 COCCCCCCOC 7a_200012092642_200000210301 [0,0,0,0,0,0|3,0,0]=3 855 B9R0.45 COCCCCCCO[13CH3] 34a_200012092642_200025704644 [0,0,0,0,0,0|3,0,0]=3 856 B9R0.45 COCCCCCCO[13CH3] 7a_200012092642_200025704644 [0,0,0,0,0,0|3,0,0]=3 857 B9R0.45 COCCCCCCSC 62a_100011998445_200000210301 [0,0,0,0,0,0|3,0,0]=3 858 B9R0.45 COCCCCCCSC 62a_200000210301_100011998445 [0,0,0,0,0,0|3,0,0]=3 859 B9R0.45 COCCCCCCS[13CH3] 62a_100011998445_200025704644 [0,0,0,0,0,0|3,0,0]=3 860 B9R0.45 COCCCCCCS[13CH3] 62a_200025704644_100011998445 [0,0,0,0,0,0|3,0,0]=3 861 B9R0.45 COCCCCCNCF 34a_100000747528_100015361967 [0,0,0,0,0,0|3,0,0]=3 862 B9R0.45 COCCCCNCCF 34a_100000724931_100000755781 [0,0,0,0,0,0|4,0,0]=4 863 B9R0.45 COCCCCNCCO 2230a_100016997473_100000730899 [0,0,0,0,0,0|4,0,0]=4 864 B9R0.45 COCCCCNCCO 34a_100016990907_100000755781 [0,0,0,0,0,0|4,0,0]=4 865 B9R0.45 COCCCCOCCBr 34a_100000211926_100000755781 [0,0,0,0,0,0|4,0,0]=4 866 B9R0.45 COCCCCOCCF 34a_100000740925_100011217306 [0,0,0,0,0,0|4,0,0]=4 867 B9R0.45 COCCCCOCCN 34a_100000210304_100000755781 [0,0,0,0,0,0|4,0,0]=4 868 B9R0.45 COCCCCOCCO 34a_100000740925_100000211926 [0,0,0,0,0,0|4,0,0]=4 869 B9R0.45 COCCCCOCSC 34a_100000740925_100011218213 [0,0,0,0,0,0|4,0,0]=4 870 B9R0.45 COCCCCSCCF 62a_100000730899_100011217306 [0,0,0,0,0,0|4,0,0]=4 871 B9R0.45 COCCCCSCCF 62a_100011217306_100000730899 [0,0,0,0,0,0|4,0,0]=4 872 B9R0.45 COCCCCSCCO 62a_100000211926_100000730899 [0,0,0,0,0,0|4,0,0]=4 873 B9R0.45 COCCCCSCCO 62a_100000730899_100000211926 [0,0,0,0,0,0|4,0,0]=4 874 B9R0.45 COCCCCSCOC 62a_100000730899_100000766300 [0,0,0,0,0,0|4,0,0]=4 875 B9R0.45 COCCCCSCOC 62a_100000766300_100000730899 [0,0,0,0,0,0|4,0,0]=4 876 B9R0.45 COCCCCSCSC 62a_100000730899_100011218213 [0,0,0,0,0,0|4,0,0]=4 877 B9R0.45 COCCCCSCSC 62a_100011218213_100000730899 [0,0,0,0,0,0|4,0,0]=4 878 B9R0.45 COCCCNCCCF 2230a_100015189416_100000740836 [0,0,0,0,0,0|4,0,0]=4 879 B9R0.45 COCCCNCCCF 34a_100015189416_100000740836 [0,0,0,0,0,0|4,0,0]=4 880 B9R0.45 COCCCNCCCF 34a_100150723488_100011934791 [0,0,0,0,0,0|4,0,0]=4 881 B9R0.45 COCCCNCCCO 34a_100150723488_100000230001 [0,0,0,0,0,0|4,0,0]=4 882 B9R0.45 COCCCNCCOC 2230a_100000209980_100000740836 [0,0,0,0,0,0|3,0,0]=3 883 B9R0.45 COCCCNCCOC 34a_100150723488_100011201679 [0,0,0,0,0,0|3,0,0]=3 884 B9R0.45 COCCCNCCSC 2230a_100020590264_100000740836 [0,0,0,0,0,0|3,1,0]=4 885 B9R0.45 COCCCNCCSC 34a_100150723488_100000212216 [0,0,0,0,0,0|3,1,0]=4 886 B9R0.45 COCCCOCCCBr 34a_100011217188_100000740836 [0,0,0,0,0,0|4,0,0]=4 887 B9R0.45 COCCCOCCCCl 34a_100000230001_100000740836 [0,0,0,0,0,0|4,0,0]=4 888 B9R0.45 COCCCOCCCF 34a_100000740835_100011934791 [0,0,0,0,0,0|4,0,0]=4 889 B9R0.45 COCCCOCCCF 34a_100000759539_100000740836 [0,0,0,0,0,0|4,0,0]=4 890 B9R0.45 COCCCOCCCN 34a_100000182051_100000740836 [0,0,0,0,0,0|4,0,0]=4 891 B9R0.45 COCCCOCCCN 34a_100011310245_200000210301 [0,0,0,0,0,0|4,0,0]=4 892 B9R0.45 COCCCOCCCO 34a_100000740835_100000230001 [0,0,0,0,0,0|4,0,0]=4 893 B9R0.45 COCCCOCCOC 34a_100000210237_100000740836 [0,0,0,0,0,0|2,0,0]=2 894 B9R0.45 COCCCOCCOC 34a_100000740835_100011201679 [0,0,0,0,0,0|2,0,0]=2 895 B9R0.45 COCCCOCCOC 34a_100138415774_100011216529 [0,0,0,0,0,0|2,0,0]=2 896 B9R0.45 COCCCOCCON 34a_100000700252_100000740836 [0,0,0,0,0,0|3,0,0]=3 897 B9R0.45 COCCCOCCSC 34a_100000230434_100000740836 [0,0,0,0,0,0|2,1,0]=3 898 B9R0.45 COCCCOCCSC 34a_100000740835_100000212216 [0,0,0,0,0,0|2,1,0]=3 899 B9R0.45 COCCCOCCSC 7a_100000230434_100000740836 [0,0,0,0,0,0|2,1,0]=3 900 B9R0.45 COCCCSCCCF 62a_100000709357_100011934791 [0,0,0,0,0,0|4,0,0]=4 901 B9R0.45 COCCCSCCCF 62a_100011934791_100000709357 [0,0,0,0,0,0|4,0,0]=4 902 B9R0.45 COCCCSCCCO 62a_100000709357_100011215043 [0,0,0,0,0,0|4,0,0]=4 903 B9R0.45 COCCCSCCCO 62a_100011215043_100000709357 [0,0,0,0,0,0|4,0,0]=4 904 B9R0.45 COCCCSCCOC 62a_100000233755_100000709357 [0,0,0,0,0,0|2,1,0]=3 905 B9R0.45 COCCCSCCOC 62a_100000709357_100000233755 [0,0,0,0,0,0|2,1,0]=3 906 B9R0.45 COCCCSCCSC 62a_100000212216_100000709357 [0,0,0,0,0,0|2,2,0]=4 907 B9R0.45 COCCCSCCSC 62a_100000709357_100000751147 [0,0,0,0,0,0|2,2,0]=4 908 B9R0.45 COCCNCC#CCO 2230a_100000209980_200000047223 [0,0,0,0,0,0|3,0,1]=4 909 B9R0.45 COCCNCCCC#N 2230a_100000209980_100000687738 [0,0,0,0,0,0|3,0,1]=4 910 B9R0.45 COCCNCCCC=O 2230a_100000209980_200011292268 [0,0,0,0,0,0|3,0,1]=4 911 B9R0.45 COCCNCCCCF 2230a_100000209980_100000729493 [0,0,0,0,0,0|3,0,0]=3 912 B9R0.45 COCCNCCCCO 2230a_100000209980_100000210776 [0,0,0,0,0,0|3,0,0]=3 913 B9R0.45 COCCNCCCCO 2230a_100000750430_100011201679 [0,0,0,0,0,0|3,0,0]=3 914 B9R0.45 COCCNCCCCO 34a_100000750430_100011201679 [0,0,0,0,0,0|3,0,0]=3 915 B9R0.45 COCCNCCCSC 2230a_100000749238_100011201679 [0,0,0,0,0,0|3,0,0]=3 916 B9R0.45 COCCOCC#CCCl 34a_200000047223_100011201679 [0,0,0,0,0,0|2,0,1]=3 917 B9R0.45 COCCOCC#CCO 34a_100000210237_200000047223 [0,0,0,0,0,0|2,0,1]=3 918 B9R0.45 COCCOCCCCBr 34a_100011216708_100011201679 [0,0,0,0,0,0|2,0,0]=2 919 B9R0.45 COCCOCCCCCl 34a_100000210776_100011201679 [0,0,0,0,0,0|2,0,0]=2 920 B9R0.45 COCCOCCCCCl 7a_100000210776_100000233755 [0,0,0,0,0,0|2,0,0]=2 921 B9R0.45 COCCOCCCCF 34a_100000210237_100000729493 [0,0,0,0,0,0|2,0,0]=2 922 B9R0.45 COCCOCCCCF 34a_100011995726_100011201679 [0,0,0,0,0,0|2,0,0]=2 923 B9R0.45 COCCOCCCCF 7a_100011995726_100000233755 [0,0,0,0,0,0|2,0,0]=2 924 B9R0.45 COCCOCCCCI 34a_200012148704_100011201679 [0,0,0,0,0,0|2,0,0]=2 925 B9R0.45 COCCOCCCCN 34a_100000750430_100011201679 [0,0,0,0,0,0|2,0,0]=2 926 B9R0.45 COCCOCCCCO 34a_100000210237_100011216708 [0,0,0,0,0,0|2,0,0]=2 927 B9R0.45 COCCOCCCN[13CH3] 2230a_100000206027_200025704644 [0,0,0,0,0,0|2,0,0]=2 928 B9R0.45 COCCOCCCN[13CH3] 34a_100000206027_200025704644 [0,0,0,0,0,0|2,0,0]=2 929 B9R0.45 COCCOCCCSC 34a_100000690336_100011201679 [0,0,0,0,0,0|2,0,0]=2 930 B9R0.45 COCCOCCCSC 62a_100011216529_200000210301 [0,0,0,0,0,0|2,0,0]=2 931 B9R0.45 COCCOCCCSC 62a_200000210301_100011216529 [0,0,0,0,0,0|2,0,0]=2 932 B9R0.45 COCCOCCCSC 7a_100000690336_100000233755 [0,0,0,0,0,0|2,0,0]=2 933 B9R0.45 COCCOCCCS[13CH3] 62a_100011216529_200025704644 [0,0,0,0,0,0|2,0,0]=2 934 B9R0.45 COCCOCCCS[13CH3] 62a_200025704644_100011216529 [0,0,0,0,0,0|2,0,0]=2 935 B9R0.45 COCCOCCNCF 34a_100000745349_100015361967 [0,0,0,0,0,0|2,0,0]=2 936 B9R0.45 COCCOCCOCF 34a_100011215163_100015361967 [0,0,0,0,0,0|1,0,0]=1 937 B9R0.45 COCCOCCOCF 7a_100011215163_100015361967 [0,0,0,0,0,0|1,0,0]=1 938 B9R0.45 COCCOCCSCF 62a_100000695917_100015361967 [0,0,0,0,0,0|1,1,0]=2 939 B9R0.45 COCCOCCSCF 62a_100015361967_100000695917 [0,0,0,0,0,0|1,1,0]=2 940 B9R0.45 COCCOCNCCO 2230a_100016997473_100000231047 [0,0,0,0,0,0|3,0,0]=3 941 B9R0.45 COCCOCSCC#N 62a_100000231047_100011215382 [0,0,0,0,0,0|3,0,1]=4 942 B9R0.45 COCCOCSCC#N 62a_100011215382_100000231047 [0,0,0,0,0,0|3,0,1]=4 943 B9R0.45 COCCOCSCC=O 62a_100000231047_200015260668 [0,0,0,0,0,0|3,0,1]=4 944 B9R0.45 COCCOCSCC=O 62a_200015260668_100000231047 [0,0,0,0,0,0|3,0,1]=4 945 B9R0.45 COCCOCSCCF 62a_100000231047_100011217306 [0,0,0,0,0,0|3,0,0]=3 946 B9R0.45 COCCOCSCCF 62a_100011217306_100000231047 [0,0,0,0,0,0|3,0,0]=3 947 B9R0.45 COCCOCSCCO 62a_100000211926_100000231047 [0,0,0,0,0,0|3,0,0]=3 948 B9R0.45 COCCOCSCCO 62a_100000231047_100000211926 [0,0,0,0,0,0|3,0,0]=3 949 B9R0.45 COCCOCSCOC 62a_100000231047_100000766300 [0,0,0,0,0,0|3,0,0]=3 950 B9R0.45 COCCOCSCOC 62a_100000766300_100000231047 [0,0,0,0,0,0|3,0,0]=3 951 B9R0.45 COCCOCSCSC 62a_100000231047_100011218213 [0,0,0,0,0,0|3,0,0]=3 952 B9R0.45 COCCOCSCSC 62a_100011218213_100000231047 [0,0,0,0,0,0|3,0,0]=3 953 B9R0.45 COCCSCC#CCO 62a_100000233755_200000047223 [0,0,0,0,0,0|2,1,1]=4 954 B9R0.45 COCCSCC#CCO 62a_200000047223_100000233755 [0,0,0,0,0,0|2,1,1]=4 955 B9R0.45 COCCSCCCC#N 62a_100000233755_100000687738 [0,0,0,0,0,0|2,1,1]=4 956 B9R0.45 COCCSCCCC#N 62a_100000687738_100000233755 [0,0,0,0,0,0|2,1,1]=4 957 B9R0.45 COCCSCCCC=O 62a_100000233755_200011292268 [0,0,0,0,0,0|2,1,1]=4 958 B9R0.45 COCCSCCCC=O 62a_200011292268_100000233755 [0,0,0,0,0,0|2,1,1]=4 959 B9R0.45 COCCSCCCCF 62a_100000233755_100000729493 [0,0,0,0,0,0|2,1,0]=3 960 B9R0.45 COCCSCCCCF 62a_100000729493_100000233755 [0,0,0,0,0,0|2,1,0]=3 961 B9R0.45 COCCSCCCCO 62a_100000210776_100000233755 [0,0,0,0,0,0|2,1,0]=3 962 B9R0.45 COCCSCCCCO 62a_100000233755_100000210776 [0,0,0,0,0,0|2,1,0]=3 963 B9R0.45 COCCSCCSC#N 62a_100000034367_100000233755 [0,0,0,0,0,0|1,2,1]=4 964 B9R0.45 COCCSCCSC#N 62a_100000233755_100000034367 [0,0,0,0,0,0|1,2,1]=4 965 B9R0.45 COCNCCCCCO 2230a_100000762737_100000766300 [0,0,0,0,0,0|4,0,0]=4 966 B9R0.45 COCSCCCCCF 62a_100000729378_100000766300 [0,0,0,0,0,0|4,0,0]=4 967 B9R0.45 COCSCCCCCF 62a_100000766300_100000729378 [0,0,0,0,0,0|4,0,0]=4 968 B9R0.45 COCSCCCCCO 62a_100000746330_100000766300 [0,0,0,0,0,0|4,0,0]=4 969 B9R0.45 COCSCCCCCO 62a_100000766300_100000746330 [0,0,0,0,0,0|4,0,0]=4 970 B9R0.45 CSCCCCCCCO 62a_100000760002_200000210301 [0,0,0,0,0,0|3,1,0]=4 971 B9R0.45 CSCCCCCCCO 62a_200000210301_100000760002 [0,0,0,0,0,0|3,1,0]=4 972 B9R0.45 CSCCCNCCSC 2230a_100000749238_100000751147 [0,0,0,0,0,0|3,1,0]=4 973 B9R0.45 CSCCCOCCC#N 7a_100000690336_100000184422 [0,0,0,0,0,0|4,0,0]=4 974 B9R0.45 CSCCCOCCCF 34a_100000690336_100011934791 [0,0,0,0,0,0|4,0,0]=4 975 B9R0.45 CSCCCOCCCF 7a_100000690336_100011934791 [0,0,0,0,0,0|4,0,0]=4 976 B9R0.45 CSCCCOCCCO 34a_100000690336_100000230001 [0,0,0,0,0,0|4,0,0]=4 977 B9R0.45 CSCCCOCCCO 7a_100000690336_100011215043 [0,0,0,0,0,0|4,0,0]=4 978 B9R0.45 CSCCCOCCSC 34a_100000690336_100000212216 [0,0,0,0,0,0|2,1,0]=3 979 B9R0.45 CSCCCOCCSC 7a_100000690336_100000212216 [0,0,0,0,0,0|2,1,0]=3 980 B9R0.45 CSCCNCCCCF 2230a_100020590264_100000729493 [0,0,0,0,0,0|3,1,0]=4 981 B9R0.45 CSCCNCCCCO 2230a_100000750430_100000751147 [0,0,0,0,0,0|3,1,0]=4 982 B9R0.45 CSCCNCCCCO 2230a_100020590264_100000210776 [0,0,0,0,0,0|3,1,0]=4 983 B9R0.45 CSCCNCCCCO 34a_100000750430_100000212216 [0,0,0,0,0,0|3,1,0]=4 984 B9R0.45 CSCCOCC#CCCl 34a_200000047223_100000212216 [0,0,0,0,0,0|2,1,1]=4 985 B9R0.45 CSCCOCC#CCO 34a_100000230434_200000047223 [0,0,0,0,0,0|2,1,1]=4 986 B9R0.45 CSCCOCC#CCO 7a_100000230434_200000047223 [0,0,0,0,0,0|2,1,1]=4 987 B9R0.45 CSCCOCCCC#N 7a_100000230434_100000687738 [0,0,0,0,0,0|2,1,1]=4 988 B9R0.45 CSCCOCCCC=O 7a_100000230434_200011292268 [0,0,0,0,0,0|2,1,1]=4 989 B9R0.45 CSCCOCCCCBr 34a_100011216708_100000212216 [0,0,0,0,0,0|2,1,0]=3 990 B9R0.45 CSCCOCCCCCl 34a_100000210776_100000212216 [0,0,0,0,0,0|2,1,0]=3 991 B9R0.45 CSCCOCCCCCl 7a_100000210776_100000212216 [0,0,0,0,0,0|2,1,0]=3 992 B9R0.45 CSCCOCCCCF 34a_100000230434_100000729493 [0,0,0,0,0,0|2,1,0]=3 993 B9R0.45 CSCCOCCCCF 34a_100011995726_100000212216 [0,0,0,0,0,0|2,1,0]=3 994 B9R0.45 CSCCOCCCCF 7a_100000230434_100000729493 [0,0,0,0,0,0|2,1,0]=3 995 B9R0.45 CSCCOCCCCF 7a_100011995726_100000212216 [0,0,0,0,0,0|2,1,0]=3 996 B9R0.45 CSCCOCCCCI 34a_200012148704_100000212216 [0,0,0,0,0,0|2,1,0]=3 997 B9R0.45 CSCCOCCCCN 34a_100000750430_100000212216 [0,0,0,0,0,0|2,1,0]=3 998 B9R0.45 CSCCOCCCCO 34a_100000230434_100011216708 [0,0,0,0,0,0|2,1,0]=3 999 B9R0.45 CSCCOCCCCO 7a_100000230434_100000210776 [0,0,0,0,0,0|2,1,0]=3 1000 B9R0.45 CSCCSCCCCF 62a_100000212216_100000729493 [0,0,0,0,0,0|2,2,0]=4 1001 B9R0.45 CSCCSCCCCF 62a_100000729493_100000751147 [0,0,0,0,0,0|2,2,0]=4 1002 B9R0.45 CSCCSCCCCO 62a_100000210776_100000751147 [0,0,0,0,0,0|2,2,0]=4 1003 B9R0.45 CSCCSCCCCO 62a_100000212216_100000210776 [0,0,0,0,0,0|2,2,0]=4 1004 B9R0.45 FCCCCCCOCF 34a_100000732779_100015361967 [0,0,0,0,0,0|4,0,0]=4 1005 B9R0.45 FCCCCCCOCF 7a_100000732779_100015361967 [0,0,0,0,0,0|4,0,0]=4 1006 B9R0.45 FCCCCOCCCBr 34a_100011217188_100000729493 [0,0,0,0,0,0|4,0,0]=4 1007 B9R0.45 FCCCCOCCCCl 34a_100000230001_100000729493 [0,0,0,0,0,0|4,0,0]=4 1008 B9R0.45 FCCCCOCCCF 34a_100000759539_100000729493 [0,0,0,0,0,0|4,0,0]=4 1009 B9R0.45 FCCCCOCCCF 34a_100011995726_100011934791 [0,0,0,0,0,0|4,0,0]=4 1010 B9R0.45 FCCCCOCCCF 7a_100011995726_100011934791 [0,0,0,0,0,0|4,0,0]=4 1011 B9R0.45 FCCCOCCCCBr 34a_100011216708_100011934791 [0,0,0,0,0,0|4,0,0]=4 1012 B9R0.45 FCCCOCCCCCl 34a_100000210776_100011934791 [0,0,0,0,0,0|4,0,0]=4 1013 B9R0.45 FCCCOCCCCCl 7a_100000210776_100011934791 [0,0,0,0,0,0|4,0,0]=4 1014 B9R0.45 FCCCOCCCCI 34a_200012148704_100011934791 [0,0,0,0,0,0|4,0,0]=4 1015 B9R0.45 FCOCCCCCCBr 34a_100011215345_100015361967 [0,0,0,0,0,0|4,0,0]=4 1016 B9R0.45 FCOCCCCCCBr 7a_100011215345_100015361967 [0,0,0,0,0,0|4,0,0]=4 1017 B9R0.45 FCOCCCCCCCl 34a_100000766143_100015361967 [0,0,0,0,0,0|4,0,0]=4 1018 B9R0.45 FCOCCCCCCCl 7a_100000766143_100015361967 [0,0,0,0,0,0|4,0,0]=4 1019 B9R0.45 N#CCCOCCCCCl 7a_100000210776_100000184422 [0,0,0,0,0,0|4,0,0]=4 1020 B9R0.45 N#CCCOCCCCF 7a_100011995726_100000184422 [0,0,0,0,0,0|4,0,0]=4 1021 B9R0.45 NCCCCCCOCF 34a_100000686447_100015361967 [0,0,0,0,0,0|4,0,0]=4 1022 B9R0.45 NCCCCOCCCF 34a_100000750430_100011934791 [0,0,0,0,0,0|4,0,0]=4 1023 B9R0.45 NCCCCOCCCO 34a_100000750430_100000230001 [0,0,0,0,0,0|4,0,0]=4 1024 B9R0.45 NCCCOCCCCF 34a_100000182051_100000729493 [0,0,0,0,0,0|4,0,0]=4 1025 B9R0.45 NCCCOCCCCO 34a_100000182051_100011216708 [0,0,0,0,0,0|4,0,0]=4 1026 B9R0.45 NOCCOCC#CCO 34a_100000700252_200000047223 [0,0,0,0,0,0|3,0,1]=4 1027 B9R0.45 NOCCOCCCCF 34a_100000700252_100000729493 [0,0,0,0,0,0|3,0,0]=3 1028 B9R0.45 NOCCOCCCCO 34a_100000700252_100011216708 [0,0,0,0,0,0|3,0,0]=3 1029 B9R0.45 OCCCCOCCCBr 34a_100011217188_100011216708 [0,0,0,0,0,0|4,0,0]=4 1030 B9R0.45 OCCCCOCCCCl 34a_100000230001_100011216708 [0,0,0,0,0,0|4,0,0]=4 1031 B9R0.45 OCCCCOCCCF 34a_100000759539_100011216708 [0,0,0,0,0,0|4,0,0]=4 1032 B9R0.45 OCCCOCCCCBr 34a_100011216708_100000230001 [0,0,0,0,0,0|4,0,0]=4 1033 B9R0.45 OCCCOCCCCCl 34a_100000210776_100000230001 [0,0,0,0,0,0|4,0,0]=4 1034 B9R0.45 OCCCOCCCCCl 7a_100000210776_100011215043 [0,0,0,0,0,0|4,0,0]=4 1035 B9R0.45 OCCCOCCCCF 34a_100011995726_100000230001 [0,0,0,0,0,0|4,0,0]=4 1036 B9R0.45 OCCCOCCCCF 7a_100011995726_100011215043 [0,0,0,0,0,0|4,0,0]=4 1037 B9R0.45 OCCCOCCCCI 34a_200012148704_100000230001 [0,0,0,0,0,0|4,0,0]=4 1038 B9R0.45 [13CH3]NCCCCCCCO 2230a_100011996573_200025704644 [0,0,0,0,0,0|4,0,0]=4 1039 B9R0.45 [13CH3]NCCCCCCCO 34a_100011996573_200025704644 [0,0,0,0,0,0|4,0,0]=4 1040 B9R0.45 [13CH3]NCCCOCCCO 2230a_100011310245_200025704644 [0,0,0,0,0,0|4,0,0]=4 1041 B9R0.45 [13CH3]NCCCOCCCO 34a_100011310245_200025704644 [0,0,0,0,0,0|4,0,0]=4 1042 B9R0.45 [13CH3]NCCOCCN=[N+]=[N-] 2230a_100102953956_200025704644 [0,0,0,0,0,0|4,0,0]=4 1043 B9R0.45 [13CH3]OCCCCCCCBr 34a_100000760002_200025704644 [0,0,0,0,0,0|3,0,0]=3 1044 B9R0.45 [13CH3]OCCCCCCCBr 7a_100000760002_200025704644 [0,0,0,0,0,0|3,0,0]=3 1045 B9R0.45 [13CH3]OCCCCCCCN 34a_100011996573_200025704644 [0,0,0,0,0,0|3,0,0]=3 1046 B9R0.45 [13CH3]OCCCOCCCN 34a_100011310245_200025704644 [0,0,0,0,0,0|4,0,0]=4 1047 B9R0.45 [13CH3]SCCCCCCCO 62a_100000760002_200025704644 [0,0,0,0,0,0|3,1,0]=4 1048 B9R0.45 [13CH3]SCCCCCCCO 62a_200025704644_100000760002 [0,0,0,0,0,0|3,1,0]=4 1049 B8R0.4 C#CCCCCCOC 34a_100000766912_200000210301 [1,0,0,0,0,0|1,0,2]=4 1050 B8R0.4 C#CCCCCCOC 34a_100138415774_100012094781 [1,0,0,0,0,0|1,0,2]=4 1051 B8R0.4 C#CCCCCCOC 7a_100000766912_200000210301 [1,0,0,0,0,0|1,0,2]=4 1052 B8R0.4 C#CCCCCCO[13CH3] 34a_100000766912_200025704644 [1,0,0,0,0,0|1,0,2]=4 1053 B8R0.4 C#CCCCCCO[13CH3] 7a_100000766912_200025704644 [1,0,0,0,0,0|1,0,2]=4 1054 B8R0.4 C#CCCCCNCC 2230a_100000706060_100000210202 [1,0,0,0,0,0|2,0,1]=4 1055 B8R0.4 C#CCCCCNCC 2230a_100015525214_100010269958 [1,0,0,0,0,0|2,0,1]=4 1056 B8R0.4 C#CCCCCNCC 34a_100000706060_100000210202 [1,0,0,0,0,0|2,0,1]=4 1057 B8R0.4 C#CCCCCOCC 34a_100000766709_100000210202 [1,0,0,0,0,0|1,0,1]=3 1058 B8R0.4 C#CCCCCOCC 34a_100121572206_100010269958 [1,0,0,0,0,0|1,0,1]=3 1059 B8R0.4 C#CCCCCOCC 7a_100000766709_100000210202 [1,0,0,0,0,0|1,0,1]=3 1060 B8R0.4 C#CCCCCOCF 34a_100000766709_100015361967 [1,0,0,0,0,0|2,0,1]=4 1061 B8R0.4 C#CCCCCOCF 7a_100000766709_100015361967 [1,0,0,0,0,0|2,0,1]=4 1062 B8R0.4 C#CCCCCSCC 62a_100000210202_100010269958 [1,0,0,0,0,0|1,1,1]=4 1063 B8R0.4 C#CCCCCSCC 62a_100010269958_100000210202 [1,0,0,0,0,0|1,1,1]=4 1064 B8R0.4 C#CCCCOCCC 34a_100000210258_100000695029 [1,0,0,0,0,0|1,0,2]=4 1065 B8R0.4 C#CCCCOCCC 34a_100000215630_100000210303 [1,0,0,0,0,0|1,0,2]=4 1066 B8R0.4 C#CCCCOCCC 7a_100000215630_100000210303 [1,0,0,0,0,0|1,0,2]=4 1067 B8R0.4 C#CCCCOCCO 34a_100000215630_100000211926 [1,0,0,0,0,0|1,0,2]=4 1068 B8R0.4 C#CCCCOCCO 7a_100000215630_100000211926 [1,0,0,0,0,0|1,0,2]=4 1069 B8R0.4 C#CCCNCCCC 2230a_100000102301_100000688953 [1,0,0,0,0,0|2,0,1]=4 1070 B8R0.4 C#CCCNCCCC 34a_100000755551_100000210210 [1,0,0,0,0,0|2,0,1]=4 1071 B8R0.4 C#CCCNCCCC 7a_106832991798_100000688953 [1,0,0,0,0,0|2,0,1]=4 1072 B8R0.4 C#CCCNCCOC 2230a_100000209980_100000688953 [1,0,0,0,0,0|1,0,2]=4 1073 B8R0.4 C#CCCNCCOC 34a_100000755551_100011201679 [1,0,0,0,0,0|1,0,2]=4 1074 B8R0.4 C#CCCOCCCBr 34a_100011217188_100000688953 [1,0,0,0,0,0|2,0,1]=4 1075 B8R0.4 C#CCCOCCCC 34a_100000210227_100000688953 [1,0,0,0,0,0|1,0,1]=3 1076 B8R0.4 C#CCCOCCCC 34a_100011215631_100000210210 [1,0,0,0,0,0|1,0,1]=3 1077 B8R0.4 C#CCCOCCCC 7a_100000210227_100000688953 [1,0,0,0,0,0|1,0,1]=3 1078 B8R0.4 C#CCCOCCCCl 34a_100000230001_100000688953 [1,0,0,0,0,0|2,0,1]=4 1079 B8R0.4 C#CCCOCCCF 34a_100000759539_100000688953 [1,0,0,0,0,0|2,0,1]=4 1080 B8R0.4 C#CCCOCCCF 34a_100011215631_100011934791 [1,0,0,0,0,0|2,0,1]=4 1081 B8R0.4 C#CCCOCCCN 34a_100000182051_100000688953 [1,0,0,0,0,0|2,0,1]=4 1082 B8R0.4 C#CCCOCCCO 34a_100011215631_100000230001 [1,0,0,0,0,0|2,0,1]=4 1083 B8R0.4 C#CCCOCCOC 34a_100000210237_100000688953 [1,0,0,0,0,0|0,0,2]=3 1084 B8R0.4 C#CCCOCCOC 34a_100011215631_100011201679 [1,0,0,0,0,0|0,0,2]=3 1085 B8R0.4 C#CCCOCCON 34a_100000700252_100000688953 [1,0,0,0,0,0|1,0,2]=4 1086 B8R0.4 C#CCCOCCSC 34a_100000230434_100000688953 [1,0,0,0,0,0|0,1,2]=4 1087 B8R0.4 C#CCCOCCSC 34a_100011215631_100000212216 [1,0,0,0,0,0|0,1,2]=4 1088 B8R0.4 C#CCCOCCSC 7a_100000230434_100000688953 [1,0,0,0,0,0|0,1,2]=4 1089 B8R0.4 C#CCCSCCCC 62a_100000210211_100000688953 [1,0,0,0,0,0|1,1,1]=4 1090 B8R0.4 C#CCCSCCCC 62a_100000688953_100000210210 [1,0,0,0,0,0|1,1,1]=4 1091 B8R0.4 C#CCCSCCOC 62a_100000233755_100000688953 [1,0,0,0,0,0|0,1,2]=4 1092 B8R0.4 C#CCCSCCOC 62a_100000688953_100000233755 [1,0,0,0,0,0|0,1,2]=4 1093 B8R0.4 C#CCCSCOCC 62a_100000688953_100000739092 [1,0,0,0,0,0|1,1,1]=4 1094 B8R0.4 C#CCCSCOCC 62a_100000739092_100000688953 [1,0,0,0,0,0|1,1,1]=4 1095 B8R0.4 C#CCNCCOCC 2230a_102516460346_100000038162 [1,0,0,0,0,0|1,0,2]=4 1096 B8R0.4 C#CCNCCOCC 34a_100000212058_100000210147 [1,0,0,0,0,0|1,0,2]=4 1097 B8R0.4 C#CCNCCOCC 34a_102516460346_100000184674 [1,0,0,0,0,0|1,0,2]=4 1098 B8R0.4 C#CCOCCCCC 34a_100000210247_100000718602 [1,0,0,0,0,0|1,0,2]=4 1099 B8R0.4 C#CCOCCCCC 34a_100000210253_100000184674 [1,0,0,0,0,0|1,0,2]=4 1100 B8R0.4 C#CCOCCCCC 7a_100000210253_100000038162 [1,0,0,0,0,0|1,0,2]=4 1101 B8R0.4 C#CCOCCNCC 2230a_100000700922_100000210202 [1,0,0,0,0,0|1,0,2]=4 1102 B8R0.4 C#CCOCCNCC 2230a_100015525214_100010402529 [1,0,0,0,0,0|1,0,2]=4 1103 B8R0.4 C#CCOCCNCC 34a_100000700922_100000210202 [1,0,0,0,0,0|1,0,2]=4 1104 B8R0.4 C#CCOCCOCC 34a_100000054580_100000210202 [1,0,0,0,0,0|0,0,2]=3 1105 B8R0.4 C#CCOCCOCC 34a_100000210136_100000184674 [1,0,0,0,0,0|0,0,2]=3 1106 B8R0.4 C#CCOCCOCC 34a_100000210247_100000210147 [1,0,0,0,0,0|0,0,2]=3 1107 B8R0.4 C#CCOCCOCC 34a_100121572206_100010402529 [1,0,0,0,0,0|0,0,2]=3 1108 B8R0.4 C#CCOCCOCC 7a_100000054580_100000210202 [1,0,0,0,0,0|0,0,2]=3 1109 B8R0.4 C#CCOCCOCC 7a_100000210136_100000038162 [1,0,0,0,0,0|0,0,2]=3 1110 B8R0.4 C#CCOCCOCF 34a_100000054580_100015361967 [1,0,0,0,0,0|1,0,2]=4 1111 B8R0.4 C#CCOCCOCF 7a_100000054580_100015361967 [1,0,0,0,0,0|1,0,2]=4 1112 B8R0.4 C#CCOCCSCC 34a_100000210247_100000757381 [1,0,0,0,0,0|0,1,2]=4 1113 B8R0.4 C#CCOCCSCC 34a_100000212035_100000184674 [1,0,0,0,0,0|0,1,2]=4 1114 B8R0.4 C#CCOCCSCC 62a_100000210202_100010402529 [1,0,0,0,0,0|0,1,2]=4 1115 B8R0.4 C#CCOCCSCC 62a_100010402529_100000210202 [1,0,0,0,0,0|0,1,2]=4 1116 B8R0.4 C#CCOCCSCC 7a_100000212035_100000038162 [1,0,0,0,0,0|0,1,2]=4 1117 B8R0.4 C#CCSCCOCC 62a_100000038162_100011215890 [1,0,0,0,0,0|0,1,2]=4 1118 B8R0.4 C/C=C/CCOCCC 34a_100016278192_100000210303 [1,0,0,0,0,0|1,0,1]=3 1119 B8R0.4 C/C=C/CCOCCF 34a_100016278192_100011217306 [1,0,0,0,0,0|2,0,1]=4 1120 B8R0.4 C/C=C/CCOCCO 34a_100016278192_100000211926 [1,0,0,0,0,0|1,0,1]=3 1121 B8R0.4 C/C=C/CCOCSC 34a_100016278192_100011218213 [1,0,0,0,0,0|1,1,1]=4 1122 B8R0.4 C/C=C/CNCCCC 7a_106832991798_100102629194 [1,0,0,0,0,0|2,0,1]=4 1123 B8R0.4 C/C=C/COCCCBr 34a_100011217188_100102629194 [1,0,0,0,0,0|2,0,1]=4 1124 B8R0.4 C/C=C/COCCCC 34a_100000210227_100102629194 [1,0,0,0,0,0|1,0,1]=3 1125 B8R0.4 C/C=C/COCCCC 34a_100016270725_100000210210 [1,0,0,0,0,0|1,0,1]=3 1126 B8R0.4 C/C=C/COCCCC 7a_100000210227_100102629194 [1,0,0,0,0,0|1,0,1]=3 1127 B8R0.4 C/C=C/COCCCCl 34a_100000230001_100102629194 [1,0,0,0,0,0|2,0,1]=4 1128 B8R0.4 C/C=C/COCCCF 34a_100000759539_100102629194 [1,0,0,0,0,0|2,0,1]=4 1129 B8R0.4 C/C=C/COCCCF 34a_100016270725_100011934791 [1,0,0,0,0,0|2,0,1]=4 1130 B8R0.4 C/C=C/COCCCN 34a_100000182051_100102629194 [1,0,0,0,0,0|2,0,1]=4 1131 B8R0.4 C/C=C/COCCCO 34a_100016270725_100000230001 [1,0,0,0,0,0|2,0,1]=4 1132 B8R0.4 C/C=C/COCCOC 34a_100000210237_100102629194 [1,0,0,0,0,0|0,0,2]=3 1133 B8R0.4 C/C=C/COCCOC 34a_100016270725_100011201679 [1,0,0,0,0,0|0,0,2]=3 1134 B8R0.4 C/C=C/COCCON 34a_100000700252_100102629194 [1,0,0,0,0,0|1,0,2]=4 1135 B8R0.4 C/C=C/COCCSC 34a_100000230434_100102629194 [1,0,0,0,0,0|0,1,2]=4 1136 B8R0.4 C/C=C/COCCSC 34a_100016270725_100000212216 [1,0,0,0,0,0|0,1,2]=4 1137 B8R0.4 C/C=C/COCCSC 7a_100000230434_100102629194 [1,0,0,0,0,0|0,1,2]=4 1138 B8R0.4 C/C=C/CSCCCC 62a_100000210211_100102629194 [1,0,0,0,0,0|1,1,1]=4 1139 B8R0.4 C/C=C/CSCCCC 62a_100102629194_100000210210 [1,0,0,0,0,0|1,1,1]=4 1140 B8R0.4 C/C=C/CSCCOC 62a_100000233755_100102629194 [1,0,0,0,0,0|0,1,2]=4 1141 B8R0.4 C/C=C/CSCCOC 62a_100102629194_100000233755 [1,0,0,0,0,0|0,1,2]=4 1142 B8R0.4 C/C=C/CSCOCC 62a_100000739092_100102629194 [1,0,0,0,0,0|1,1,1]=4 1143 B8R0.4 C/C=C/CSCOCC 62a_100102629194_100000739092 [1,0,0,0,0,0|1,1,1]=4 1144 B8R0.4 C=CCCCCCOC 34a_100011216702_200000210301 [1,0,0,0,0,0|1,0,2]=4 1145 B8R0.4 C=CCCCCCOC 34a_100138415774_100000700193 [1,0,0,0,0,0|1,0,2]=4 1146 B8R0.4 C=CCCCCCOC 7a_100011216702_200000210301 [1,0,0,0,0,0|1,0,2]=4 1147 B8R0.4 C=CCCCCCO[13CH3] 34a_100011216702_200025704644 [1,0,0,0,0,0|1,0,2]=4 1148 B8R0.4 C=CCCCCCO[13CH3] 7a_100011216702_200025704644 [1,0,0,0,0,0|1,0,2]=4 1149 B8R0.4 C=CCCCCNCC 2230a_100000703577_100000210202 [1,0,0,0,0,0|2,0,1]=4 1150 B8R0.4 C=CCCCCNCC 2230a_100015525214_100011215482 [1,0,0,0,0,0|2,0,1]=4 1151 B8R0.4 C=CCCCCNCC 34a_100000703577_100000210202 [1,0,0,0,0,0|2,0,1]=4 1152 B8R0.4 C=CCCCCOCC 34a_100000766645_100000210202 [1,0,0,0,0,0|1,0,1]=3 1153 B8R0.4 C=CCCCCOCC 34a_100121572206_100011215482 [1,0,0,0,0,0|1,0,1]=3 1154 B8R0.4 C=CCCCCOCC 7a_100000766645_100000210202 [1,0,0,0,0,0|1,0,1]=3 1155 B8R0.4 C=CCCCCOCF 34a_100000766645_100015361967 [1,0,0,0,0,0|2,0,1]=4 1156 B8R0.4 C=CCCCCOCF 7a_100000766645_100015361967 [1,0,0,0,0,0|2,0,1]=4 1157 B8R0.4 C=CCCCCSCC 62a_100000210202_100011215482 [1,0,0,0,0,0|1,1,1]=4 1158 B8R0.4 C=CCCCCSCC 62a_100011215482_100000210202 [1,0,0,0,0,0|1,1,1]=4 1159 B8R0.4 C=CCCCOCCC 34a_100000210258_100000757094 [1,0,0,0,0,0|1,0,2]=4 1160 B8R0.4 C=CCCCOCCC 34a_100000758997_100000210303 [1,0,0,0,0,0|1,0,2]=4 1161 B8R0.4 C=CCCCOCCC 7a_100000758997_100000210303 [1,0,0,0,0,0|1,0,2]=4 1162 B8R0.4 C=CCCCOCCO 34a_100000758997_100000211926 [1,0,0,0,0,0|1,0,2]=4 1163 B8R0.4 C=CCCCOCCO 7a_100000758997_100000211926 [1,0,0,0,0,0|1,0,2]=4 1164 B8R0.4 C=CCCNCCCC 2230a_100000102301_100000754431 [1,0,0,0,0,0|2,0,1]=4 1165 B8R0.4 C=CCCNCCCC 2230a_100015191253_100000210211 [1,0,0,0,0,0|2,0,1]=4 1166 B8R0.4 C=CCCNCCCC 7a_106832991798_100000754431 [1,0,0,0,0,0|2,0,1]=4 1167 B8R0.4 C=CCCNCCOC 2230a_100000209980_100000754431 [1,0,0,0,0,0|1,0,2]=4 1168 B8R0.4 C=CCCNCCOC 2230a_100015191253_100011201679 [1,0,0,0,0,0|1,0,2]=4 1169 B8R0.4 C=CCCOCCCBr 34a_100011217188_100000754431 [1,0,0,0,0,0|2,0,1]=4 1170 B8R0.4 C=CCCOCCCC 34a_100000210227_100000754431 [1,0,0,0,0,0|1,0,1]=3 1171 B8R0.4 C=CCCOCCCC 34a_100011205117_100000210210 [1,0,0,0,0,0|1,0,1]=3 1172 B8R0.4 C=CCCOCCCC 7a_100000210227_100000754431 [1,0,0,0,0,0|1,0,1]=3 1173 B8R0.4 C=CCCOCCCCl 34a_100000230001_100000754431 [1,0,0,0,0,0|2,0,1]=4 1174 B8R0.4 C=CCCOCCCF 34a_100000759539_100000754431 [1,0,0,0,0,0|2,0,1]=4 1175 B8R0.4 C=CCCOCCCF 34a_100011205117_100011934791 [1,0,0,0,0,0|2,0,1]=4 1176 B8R0.4 C=CCCOCCCN 34a_100000182051_100000754431 [1,0,0,0,0,0|2,0,1]=4 1177 B8R0.4 C=CCCOCCCO 34a_100011205117_100000230001 [1,0,0,0,0,0|2,0,1]=4 1178 B8R0.4 C=CCCOCCOC 34a_100000210237_100000754431 [1,0,0,0,0,0|0,0,2]=3 1179 B8R0.4 C=CCCOCCOC 34a_100011205117_100011201679 [1,0,0,0,0,0|0,0,2]=3 1180 B8R0.4 C=CCCOCCON 34a_100000700252_100000754431 [1,0,0,0,0,0|1,0,2]=4 1181 B8R0.4 C=CCCOCCSC 34a_100000230434_100000754431 [1,0,0,0,0,0|0,1,2]=4 1182 B8R0.4 C=CCCOCCSC 34a_100011205117_100000212216 [1,0,0,0,0,0|0,1,2]=4 1183 B8R0.4 C=CCCOCCSC 7a_100000230434_100000754431 [1,0,0,0,0,0|0,1,2]=4 1184 B8R0.4 C=CCCSCCCC 62a_100000210211_100000754431 [1,0,0,0,0,0|1,1,1]=4 1185 B8R0.4 C=CCCSCCCC 62a_100000754431_100000210210 [1,0,0,0,0,0|1,1,1]=4 1186 B8R0.4 C=CCCSCCOC 62a_100000233755_100000754431 [1,0,0,0,0,0|0,1,2]=4 1187 B8R0.4 C=CCCSCCOC 62a_100000754431_100000233755 [1,0,0,0,0,0|0,1,2]=4 1188 B8R0.4 C=CCCSCOCC 62a_100000739092_100000754431 [1,0,0,0,0,0|1,1,1]=4 1189 B8R0.4 C=CCCSCOCC 62a_100000754431_100000739092 [1,0,0,0,0,0|1,1,1]=4 1190 B8R0.4 C=CCNCCOCC 2230a_100020586998_100011215890 [1,0,0,0,0,0|1,0,2]=4 1191 B8R0.4 C=CCNCCOCC 2230a_102516460346_100000210623 [1,0,0,0,0,0|1,0,2]=4 1192 B8R0.4 C=CCNCCOCC 34a_102516460346_100015514636 [1,0,0,0,0,0|1,0,2]=4 1193 B8R0.4 C=CCOCCCCC 34a_100000210253_100015514636 [1,0,0,0,0,0|1,0,2]=4 1194 B8R0.4 C=CCOCCCCC 34a_200000210373_100000718602 [1,0,0,0,0,0|1,0,2]=4 1195 B8R0.4 C=CCOCCCCC 7a_100000210253_100015514636 [1,0,0,0,0,0|1,0,2]=4 1196 B8R0.4 C=CCOCCOCC 34a_100000037705_100000210202 [1,0,0,0,0,0|0,0,2]=3 1197 B8R0.4 C=CCOCCOCC 34a_100000210136_100015514636 [1,0,0,0,0,0|0,0,2]=3 1198 B8R0.4 C=CCOCCOCC 34a_200000210373_100000210147 [1,0,0,0,0,0|0,0,2]=3 1199 B8R0.4 C=CCOCCOCC 7a_100000037705_100000210202 [1,0,0,0,0,0|0,0,2]=3 1200 B8R0.4 C=CCOCCOCC 7a_100000210136_100015514636 [1,0,0,0,0,0|0,0,2]=3 1201 B8R0.4 C=CCOCCOCF 34a_100000037705_100015361967 [1,0,0,0,0,0|1,0,2]=4 1202 B8R0.4 C=CCOCCOCF 7a_100000037705_100015361967 [1,0,0,0,0,0|1,0,2]=4 1203 B8R0.4 C=CCOCCSCC 34a_100000212035_100015514636 [1,0,0,0,0,0|0,1,2]=4 1204 B8R0.4 C=CCOCCSCC 34a_200000210373_100000757381 [1,0,0,0,0,0|0,1,2]=4 1205 B8R0.4 C=CCOCCSCC 7a_100000212035_100015514636 [1,0,0,0,0,0|0,1,2]=4 1206 B8R0.4 C=CCSCCOCC 62a_100000210147_100000210623 [1,0,0,0,0,0|0,1,2]=4 1207 B8R0.4 C=CCSCCOCC 62a_100000210623_100011215890 [1,0,0,0,0,0|0,1,2]=4 1208 B8R0.4 C=COCCCCOC 34a_100000031558_200000210301 [1,0,0,0,0,0|0,0,2]=3 1209 B8R0.4 C=COCCCCOC 7a_100000031558_200000210301 [1,0,0,0,0,0|0,0,2]=3 1210 B8R0.4 C=COCCCCO[13CH3] 34a_100000031558_200025704644 [1,0,0,0,0,0|0,0,2]=3 1211 B8R0.4 C=COCCCCO[13CH3] 7a_100000031558_200025704644 [1,0,0,0,0,0|0,0,2]=3 1212 B8R0.4 C=COCCNCCO 2230a_100016997473_100000039644 [1,0,0,0,0,0|1,0,2]=4 1213 B8R0.4 C=COCCNCCO 34a_100016990907_100000039644 [1,0,0,0,0,0|1,0,2]=4 1214 B8R0.4 C=COCCOCCBr 34a_100000211926_100000039644 [1,0,0,0,0,0|1,0,2]=4 1215 B8R0.4 C=COCCOCCC 34a_100000033082_100000210303 [1,0,0,0,0,0|0,0,2]=3 1216 B8R0.4 C=COCCOCCC 34a_100000210258_100000039644 [1,0,0,0,0,0|0,0,2]=3 1217 B8R0.4 C=COCCOCCF 34a_100000033082_100011217306 [1,0,0,0,0,0|1,0,2]=4 1218 B8R0.4 C=COCCOCCN 34a_100000210304_100000039644 [1,0,0,0,0,0|1,0,2]=4 1219 B8R0.4 C=COCCOCCO 34a_100000033082_100000211926 [1,0,0,0,0,0|0,0,2]=3 1220 B8R0.4 C=COCCOCSC 34a_100000033082_100011218213 [1,0,0,0,0,0|0,1,2]=4 1221 B8R0.4 C=COCCSCCC 62a_100000039644_100000210303 [1,0,0,0,0,0|0,1,2]=4 1222 B8R0.4 C=COCCSCCC 62a_100000210303_100000039644 [1,0,0,0,0,0|0,1,2]=4 1223 B8R0.4 C=COCCSCCO 62a_100000039644_100000211926 [1,0,0,0,0,0|0,1,2]=4 1224 B8R0.4 C=COCCSCCO 62a_100000211926_100000039644 [1,0,0,0,0,0|0,1,2]=4 1225 B8R0.4 C=COCCSCOC 62a_100000039644_100000766300 [1,0,0,0,0,0|0,1,2]=4 1226 B8R0.4 C=COCCSCOC 62a_100000766300_100000039644 [1,0,0,0,0,0|0,1,2]=4 1227 B8R0.4 CC#CCCOCCC 34a_100000750427_100000210303 [1,0,0,0,0,0|1,0,1]=3 1228 B8R0.4 CC#CCCOCCF 34a_100000750427_100011217306 [1,0,0,0,0,0|2,0,1]=4 1229 B8R0.4 CC#CCCOCCO 34a_100000750427_100000211926 [1,0,0,0,0,0|1,0,1]=3 1230 B8R0.4 CC#CCCOCSC 34a_100000750427_100011218213 [1,0,0,0,0,0|1,1,1]=4 1231 B8R0.4 CC#CCNCCCC 2230a_100000102301_100000748600 [1,0,0,0,0,0|2,0,1]=4 1232 B8R0.4 CC#CCNCCCC 2230a_100000685387_100000210211 [1,0,0,0,0,0|2,0,1]=4 1233 B8R0.4 CC#CCNCCCC 34a_100000685387_100000210210 [1,0,0,0,0,0|2,0,1]=4 1234 B8R0.4 CC#CCNCCCC 7a_106832991798_100000748600 [1,0,0,0,0,0|2,0,1]=4 1235 B8R0.4 CC#CCNCCOC 2230a_100000209980_100000748600 [1,0,0,0,0,0|1,0,2]=4 1236 B8R0.4 CC#CCNCCOC 2230a_100000685387_100011201679 [1,0,0,0,0,0|1,0,2]=4 1237 B8R0.4 CC#CCNCCOC 34a_100000685387_100011201679 [1,0,0,0,0,0|1,0,2]=4 1238 B8R0.4 CC#CCOCCCBr 34a_100011217188_100000748600 [1,0,0,0,0,0|2,0,1]=4 1239 B8R0.4 CC#CCOCCCC 34a_100000210227_100000748600 [1,0,0,0,0,0|1,0,1]=3 1240 B8R0.4 CC#CCOCCCC 34a_100000761923_100000210210 [1,0,0,0,0,0|1,0,1]=3 1241 B8R0.4 CC#CCOCCCC 7a_100000210227_100000748600 [1,0,0,0,0,0|1,0,1]=3 1242 B8R0.4 CC#CCOCCCCl 34a_100000230001_100000748600 [1,0,0,0,0,0|2,0,1]=4 1243 B8R0.4 CC#CCOCCCF 34a_100000759539_100000748600 [1,0,0,0,0,0|2,0,1]=4 1244 B8R0.4 CC#CCOCCCF 34a_100000761923_100011934791 [1,0,0,0,0,0|2,0,1]=4 1245 B8R0.4 CC#CCOCCCN 34a_100000182051_100000748600 [1,0,0,0,0,0|2,0,1]=4 1246 B8R0.4 CC#CCOCCCO 34a_100000761923_100000230001 [1,0,0,0,0,0|2,0,1]=4 1247 B8R0.4 CC#CCOCCOC 34a_100000210237_100000748600 [1,0,0,0,0,0|0,0,2]=3 1248 B8R0.4 CC#CCOCCOC 34a_100000761923_100011201679 [1,0,0,0,0,0|0,0,2]=3 1249 B8R0.4 CC#CCOCCON 34a_100000700252_100000748600 [1,0,0,0,0,0|1,0,2]=4 1250 B8R0.4 CC#CCOCCSC 34a_100000230434_100000748600 [1,0,0,0,0,0|0,1,2]=4 1251 B8R0.4 CC#CCOCCSC 34a_100000761923_100000212216 [1,0,0,0,0,0|0,1,2]=4 1252 B8R0.4 CC#CCOCCSC 7a_100000230434_100000748600 [1,0,0,0,0,0|0,1,2]=4 1253 B8R0.4 CC#CCSCCCC 62a_100000210211_100000748600 [1,0,0,0,0,0|1,1,1]=4 1254 B8R0.4 CC#CCSCCCC 62a_100000748600_100000210210 [1,0,0,0,0,0|1,1,1]=4 1255 B8R0.4 CC#CCSCCOC 62a_100000233755_100000748600 [1,0,0,0,0,0|0,1,2]=4 1256 B8R0.4 CC#CCSCCOC 62a_100000748600_100000233755 [1,0,0,0,0,0|0,1,2]=4 1257 B8R0.4 CC#CCSCOCC 62a_100000739092_100000748600 [1,0,0,0,0,0|1,1,1]=4 1258 B8R0.4 CC#CCSCOCC 62a_100000748600_100000739092 [1,0,0,0,0,0|1,1,1]=4 1259 B8R0.4 CC/C=C/CCCOC 34a_100016287902_200000210301 [1,0,0,0,0,0|1,0,1]=3 1260 B8R0.4 CC/C=C/CCCOC 7a_100016287902_200000210301 [1,0,0,0,0,0|1,0,1]=3 1261 B8R0.4 CC/C=C/CCCO[13CH3] 34a_100016287902_200025704644 [1,0,0,0,0,0|1,0,1]=3 1262 B8R0.4 CC/C=C/CCCO[13CH3] 7a_100016287902_200025704644 [1,0,0,0,0,0|1,0,1]=3 1263 B8R0.4 CC/C=C\CCNCC 2230a_100015525214_100015370543 [1,0,0,0,0,0|2,0,1]=4 1264 B8R0.4 CC/C=C\CCOCC 34a_100016288707_100000210202 [1,0,0,0,0,0|1,0,1]=3 1265 B8R0.4 CC/C=C\CCOCC 34a_100121572206_100015370543 [1,0,0,0,0,0|1,0,1]=3 1266 B8R0.4 CC/C=C\CCOCC 7a_100016288707_100000210202 [1,0,0,0,0,0|1,0,1]=3 1267 B8R0.4 CC/C=C\CCOCF 34a_100016288707_100015361967 [1,0,0,0,0,0|2,0,1]=4 1268 B8R0.4 CC/C=C\CCOCF 7a_100016288707_100015361967 [1,0,0,0,0,0|2,0,1]=4 1269 B8R0.4 CC/C=C\CCSCC 62a_100000210202_100015370543 [1,0,0,0,0,0|1,1,1]=4 1270 B8R0.4 CC/C=C\CCSCC 62a_100015370543_100000210202 [1,0,0,0,0,0|1,1,1]=4 1271 B8R0.4 CC/C=C\CNCCO 2230a_100016997473_100103147603 [1,0,0,0,0,0|2,0,1]=4 1272 B8R0.4 CC/C=C\CNCCO 34a_100016990907_100103147603 [1,0,0,0,0,0|2,0,1]=4 1273 B8R0.4 CC/C=C\COCCBr 34a_100000211926_100103147603 [1,0,0,0,0,0|2,0,1]=4 1274 B8R0.4 CC/C=C\COCCC 34a_100000210258_100103147603 [1,0,0,0,0,0|1,0,1]=3 1275 B8R0.4 CC/C=C\COCCC 34a_100016268518_100000210303 [1,0,0,0,0,0|1,0,1]=3 1276 B8R0.4 CC/C=C\COCCF 34a_100016268518_100011217306 [1,0,0,0,0,0|2,0,1]=4 1277 B8R0.4 CC/C=C\COCCN 34a_100000210304_100103147603 [1,0,0,0,0,0|2,0,1]=4 1278 B8R0.4 CC/C=C\COCCO 34a_100016268518_100000211926 [1,0,0,0,0,0|1,0,1]=3 1279 B8R0.4 CC/C=C\COCSC 34a_100016268518_100011218213 [1,0,0,0,0,0|1,1,1]=4 1280 B8R0.4 CC/C=C\CSCCC 62a_100000210303_100103147603 [1,0,0,0,0,0|1,1,1]=4 1281 B8R0.4 CC/C=C\CSCCC 62a_100103147603_100000210303 [1,0,0,0,0,0|1,1,1]=4 1282 B8R0.4 CC/C=C\CSCCO 62a_100000211926_100103147603 [1,0,0,0,0,0|1,1,1]=4 1283 B8R0.4 CC/C=C\CSCCO 62a_100103147603_100000211926 [1,0,0,0,0,0|1,1,1]=4 1284 B8R0.4 CC/C=C\CSCOC 62a_100000766300_100103147603 [1,0,0,0,0,0|1,1,1]=4 1285 B8R0.4 CC/C=C\CSCOC 62a_100103147603_100000766300 [1,0,0,0,0,0|1,1,1]=4 1286 B8R0.4 CC=C=CCCOCC 34a_100011020354_100000210202 [1,0,0,0,0,0|1,0,2]=4 1287 B8R0.4 CC=CCCCOCC 34a_100020645299_100000210202 [1,0,0,0,0,0|1,0,1]=3 1288 B8R0.4 CC=CCCCOCF 34a_100020645299_100015361967 [1,0,0,0,0,0|2,0,1]=4 1289 B8R0.4 CC=CCNCCCC 2230a_100000102301_100000070051 [1,0,0,0,0,0|2,0,1]=4 1290 B8R0.4 CC=CCNCCCC 7a_106832991798_100000070051 [1,0,0,0,0,0|2,0,1]=4 1291 B8R0.4 CC=CCNCCOC 2230a_100000209980_100000070051 [1,0,0,0,0,0|1,0,2]=4 1292 B8R0.4 CC=CCOCCCBr 34a_100011217188_100000070051 [1,0,0,0,0,0|2,0,1]=4 1293 B8R0.4 CC=CCOCCCC 34a_100000210227_100000070051 [1,0,0,0,0,0|1,0,1]=3 1294 B8R0.4 CC=CCOCCCC 7a_100000210227_100000070051 [1,0,0,0,0,0|1,0,1]=3 1295 B8R0.4 CC=CCOCCCCl 34a_100000230001_100000070051 [1,0,0,0,0,0|2,0,1]=4 1296 B8R0.4 CC=CCOCCCF 34a_100000759539_100000070051 [1,0,0,0,0,0|2,0,1]=4 1297 B8R0.4 CC=CCOCCCN 34a_100000182051_100000070051 [1,0,0,0,0,0|2,0,1]=4 1298 B8R0.4 CC=CCOCCOC 34a_100000210237_100000070051 [1,0,0,0,0,0|0,0,2]=3 1299 B8R0.4 CC=CCOCCON 34a_100000700252_100000070051 [1,0,0,0,0,0|1,0,2]=4 1300 B8R0.4 CC=CCOCCSC 34a_100000230434_100000070051 [1,0,0,0,0,0|0,1,2]=4 1301 B8R0.4 CC=CCOCCSC 7a_100000230434_100000070051 [1,0,0,0,0,0|0,1,2]=4 1302 B8R0.4 CC=CCSCCCC 62a_100000070051_100000210210 [1,0,0,0,0,0|1,1,1]=4 1303 B8R0.4 CC=CCSCCCC 62a_100000210211_100000070051 [1,0,0,0,0,0|1,1,1]=4 1304 B8R0.4 CC=CCSCCOC 62a_100000070051_100000233755 [1,0,0,0,0,0|0,1,2]=4 1305 B8R0.4 CC=CCSCCOC 62a_100000233755_100000070051 [1,0,0,0,0,0|0,1,2]=4 1306 B8R0.4 CC=CCSCOCC 62a_100000070051_100000739092 [1,0,0,0,0,0|1,1,1]=4 1307 B8R0.4 CC=CCSCOCC 62a_100000739092_100000070051 [1,0,0,0,0,0|1,1,1]=4 1308 B8R0.4 CC=NNCCOCC 4a_100000732670_200000210099 [1,0,0,0,0,0|2,0,1]=4 1309 B8R0.4 CCC#CCCOCC 34a_100000036655_100000210202 [1,0,0,0,0,0|1,0,1]=3 1310 B8R0.4 CCC#CCCOCC 7a_100000036655_100000210202 [1,0,0,0,0,0|1,0,1]=3 1311 B8R0.4 CCC#CCCOCF 34a_100000036655_100015361967 [1,0,0,0,0,0|2,0,1]=4 1312 B8R0.4 CCC#CCCOCF 7a_100000036655_100015361967 [1,0,0,0,0,0|2,0,1]=4 1313 B8R0.4 CCC#CCNCCO 2230a_100016997473_100009813939 [1,0,0,0,0,0|2,0,1]=4 1314 B8R0.4 CCC#CCNCCO 34a_100016990907_100009813939 [1,0,0,0,0,0|2,0,1]=4 1315 B8R0.4 CCC#CCOCCBr 34a_100000211926_100009813939 [1,0,0,0,0,0|2,0,1]=4 1316 B8R0.4 CCC#CCOCCC 34a_100000032950_100000210303 [1,0,0,0,0,0|1,0,1]=3 1317 B8R0.4 CCC#CCOCCC 34a_100000210258_100009813939 [1,0,0,0,0,0|1,0,1]=3 1318 B8R0.4 CCC#CCOCCF 34a_100000032950_100011217306 [1,0,0,0,0,0|2,0,1]=4 1319 B8R0.4 CCC#CCOCCN 34a_100000210304_100009813939 [1,0,0,0,0,0|2,0,1]=4 1320 B8R0.4 CCC#CCOCCO 34a_100000032950_100000211926 [1,0,0,0,0,0|1,0,1]=3 1321 B8R0.4 CCC#CCOCSC 34a_100000032950_100011218213 [1,0,0,0,0,0|1,1,1]=4 1322 B8R0.4 CCC#CCSCCC 62a_100000210303_100009813939 [1,0,0,0,0,0|1,1,1]=4 1323 B8R0.4 CCC#CCSCCC 62a_100009813939_100000210303 [1,0,0,0,0,0|1,1,1]=4 1324 B8R0.4 CCC#CCSCCO 62a_100000211926_100009813939 [1,0,0,0,0,0|1,1,1]=4 1325 B8R0.4 CCC#CCSCCO 62a_100009813939_100000211926 [1,0,0,0,0,0|1,1,1]=4 1326 B8R0.4 CCC#CCSCOC 62a_100000766300_100009813939 [1,0,0,0,0,0|1,1,1]=4 1327 B8R0.4 CCC#CCSCOC 62a_100009813939_100000766300 [1,0,0,0,0,0|1,1,1]=4 1328 B8R0.4 CCC/C=C/COCC 34a_100016278788_100000210202 [1,0,0,0,0,0|1,0,1]=3 1329 B8R0.4 CCC/C=C/COCC 7a_100016278788_100000210202 [1,0,0,0,0,0|1,0,1]=3 1330 B8R0.4 CCC/C=C/COCF 34a_100016278788_100015361967 [1,0,0,0,0,0|2,0,1]=4 1331 B8R0.4 CCC/C=C/COCF 7a_100016278788_100015361967 [1,0,0,0,0,0|2,0,1]=4 1332 B8R0.4 CCCC#CCCOC 34a_100000042726_200000210301 [1,0,0,0,0,0|1,0,1]=3 1333 B8R0.4 CCCC#CCCOC 7a_100000042726_200000210301 [1,0,0,0,0,0|1,0,1]=3 1334 B8R0.4 CCCC#CCCO[13CH3] 34a_100000042726_200025704644 [1,0,0,0,0,0|1,0,1]=3 1335 B8R0.4 CCCC#CCCO[13CH3] 7a_100000042726_200025704644 [1,0,0,0,0,0|1,0,1]=3 1336 B8R0.4 CCCC#CCOCC 34a_100000034806_100000210202 [1,0,0,0,0,0|1,0,1]=3 1337 B8R0.4 CCCC#CCOCC 7a_100000034806_100000210202 [1,0,0,0,0,0|1,0,1]=3 1338 B8R0.4 CCCC#CCOCF 34a_100000034806_100015361967 [1,0,0,0,0,0|2,0,1]=4 1339 B8R0.4 CCCC#CCOCF 7a_100000034806_100015361967 [1,0,0,0,0,0|2,0,1]=4 1340 B8R0.4 CCCC/C=C/COC 34a_200016272032_200000210301 [1,0,0,0,0,0|1,0,1]=3 1341 B8R0.4 CCCC/C=C/COC 7a_200016272032_200000210301 [1,0,0,0,0,0|1,0,1]=3 1342 B8R0.4 CCCC/C=C/CO[13CH3] 34a_200016272032_200025704644 [1,0,0,0,0,0|1,0,1]=3 1343 B8R0.4 CCCC/C=C/CO[13CH3] 7a_200016272032_200025704644 [1,0,0,0,0,0|1,0,1]=3 1344 B8R0.4 CCCCC#CCOC 34a_200000034558_200000210301 [1,0,0,0,0,0|1,0,1]=3 1345 B8R0.4 CCCCC#CCOC 7a_200000034558_200000210301 [1,0,0,0,0,0|1,0,1]=3 1346 B8R0.4 CCCCC#CCO[13CH3] 34a_200000034558_200025704644 [1,0,0,0,0,0|1,0,1]=3 1347 B8R0.4 CCCCC#CCO[13CH3] 7a_200000034558_200025704644 [1,0,0,0,0,0|1,0,1]=3 1348 B8R0.4 CCCCCCCNC 2230a_100000229938_200000210301 [1,0,0,0,0,0|2,0,0]=3 1349 B8R0.4 CCCCCCCNC 2230a_106832991635_100000210681 [1,0,0,0,0,0|2,0,0]=3 1350 B8R0.4 CCCCCCCNC 34a_100102657272_100000210614 [1,0,0,0,0,0|2,0,0]=3 1351 B8R0.4 CCCCCCCNC 7a_106832991635_100000210614 [1,0,0,0,0,0|2,0,0]=3 1352 B8R0.4 CCCCCCCN[13CH3] 2230a_100000229938_200025704644 [1,0,0,0,0,0|2,0,0]=3 1353 B8R0.4 CCCCCCCOC 34a_100000210272_200000210301 [1,0,0,0,0,0|1,0,0]=2 1354 B8R0.4 CCCCCCCOC 34a_100138415774_100000210614 [1,0,0,0,0,0|1,0,0]=2 1355 B8R0.4 CCCCCCCOC 7a_100000210272_200000210301 [1,0,0,0,0,0|1,0,0]=2 1356 B8R0.4 CCCCCCCO[13CH3] 34a_100000210272_200025704644 [1,0,0,0,0,0|1,0,0]=2 1357 B8R0.4 CCCCCCCO[13CH3] 7a_100000210272_200025704644 [1,0,0,0,0,0|1,0,0]=2 1358 B8R0.4 CCCCCCCSC 62a_100000210614_200000210301 [1,0,0,0,0,0|1,1,0]=3 1359 B8R0.4 CCCCCCCSC 62a_200000210301_100000210316 [1,0,0,0,0,0|1,1,0]=3 1360 B8R0.4 CCCCCCCS[13CH3] 62a_100000210614_200025704644 [1,0,0,0,0,0|1,1,0]=3 1361 B8R0.4 CCCCCCCS[13CH3] 62a_200025704644_100000210316 [1,0,0,0,0,0|1,1,0]=3 1362 B8R0.4 CCCCCCNCC 2230a_100000210581_100000210202 [1,0,0,0,0,0|2,0,0]=3 1363 B8R0.4 CCCCCCNCC 2230a_100015525214_100000210314 [1,0,0,0,0,0|2,0,0]=3 1364 B8R0.4 CCCCCCOCC 34a_100000210259_100000210202 [1,0,0,0,0,0|1,0,0]=2 1365 B8R0.4 CCCCCCOCC 34a_100121572206_100000210314 [1,0,0,0,0,0|1,0,0]=2 1366 B8R0.4 CCCCCCOCC 7a_100000210259_100000210202 [1,0,0,0,0,0|1,0,0]=2 1367 B8R0.4 CCCCCCOCF 34a_100000210259_100015361967 [1,0,0,0,0,0|2,0,0]=3 1368 B8R0.4 CCCCCCOCF 7a_100000210259_100015361967 [1,0,0,0,0,0|2,0,0]=3 1369 B8R0.4 CCCCCCSCC 62a_100000210202_100000210757 [1,0,0,0,0,0|1,1,0]=3 1370 B8R0.4 CCCCCCSCC 62a_100000210314_100000210202 [1,0,0,0,0,0|1,1,0]=3 1371 B8R0.4 CCCCCCSCF 62a_100000210314_100015361967 [1,0,0,0,0,0|2,1,0]=4 1372 B8R0.4 CCCCCCSCF 62a_100015361967_100000210757 [1,0,0,0,0,0|2,1,0]=4 1373 B8R0.4 CCCCCNCCC 2230a_100000209983_100000210303 [1,0,0,0,0,0|2,0,0]=3 1374 B8R0.4 CCCCCNCCF 2230a_100000209983_100011217306 [1,0,0,0,0,0|3,0,0]=4 1375 B8R0.4 CCCCCNCCF 34a_100000724931_100000718602 [1,0,0,0,0,0|3,0,0]=4 1376 B8R0.4 CCCCCNCCO 2230a_100000209983_100000211926 [1,0,0,0,0,0|2,0,0]=3 1377 B8R0.4 CCCCCNCCO 2230a_100016997473_100000210326 [1,0,0,0,0,0|2,0,0]=3 1378 B8R0.4 CCCCCNCCO 34a_100016990907_100000718602 [1,0,0,0,0,0|2,0,0]=3 1379 B8R0.4 CCCCCNCOC 2230a_100000209983_100000766300 [1,0,0,0,0,0|2,0,0]=3 1380 B8R0.4 CCCCCNCSC 2230a_100000209983_100011218213 [1,0,0,0,0,0|2,1,0]=4 1381 B8R0.4 CCCCCOCC#N 7a_100000210253_100011215382 [1,0,0,0,0,0|2,0,1]=4 1382 B8R0.4 CCCCCOCC=O 34a_100000210253_200009817547 [1,0,0,0,0,0|1,0,2]=4 1383 B8R0.4 CCCCCOCC=O 7a_100000210253_200015260668 [1,0,0,0,0,0|1,0,2]=4 1384 B8R0.4 CCCCCOCCBr 34a_100000211926_100000718602 [1,0,0,0,0,0|2,0,0]=3 1385 B8R0.4 CCCCCOCCC 34a_100000210253_100000210303 [1,0,0,0,0,0|1,0,0]=2 1386 B8R0.4 CCCCCOCCC 34a_100000210258_100000718602 [1,0,0,0,0,0|1,0,0]=2 1387 B8R0.4 CCCCCOCCC 7a_100000210253_100000210303 [1,0,0,0,0,0|1,0,0]=2 1388 B8R0.4 CCCCCOCCF 34a_100000210253_100011217306 [1,0,0,0,0,0|2,0,0]=3 1389 B8R0.4 CCCCCOCCF 7a_100000210253_100011217306 [1,0,0,0,0,0|2,0,0]=3 1390 B8R0.4 CCCCCOCCN 34a_100000210304_100000718602 [1,0,0,0,0,0|2,0,0]=3 1391 B8R0.4 CCCCCOCCO 34a_100000210253_100000211926 [1,0,0,0,0,0|1,0,0]=2 1392 B8R0.4 CCCCCOCCO 7a_100000210253_100000211926 [1,0,0,0,0,0|1,0,0]=2 1393 B8R0.4 CCCCCOCSC 34a_100000210253_100011218213 [1,0,0,0,0,0|1,1,0]=3 1394 B8R0.4 CCCCCSCCC 62a_100000210303_100000210326 [1,0,0,0,0,0|1,1,0]=3 1395 B8R0.4 CCCCCSCCC 62a_100000210326_100000210303 [1,0,0,0,0,0|1,1,0]=3 1396 B8R0.4 CCCCCSCCF 62a_100000210326_100011217306 [1,0,0,0,0,0|2,1,0]=4 1397 B8R0.4 CCCCCSCCF 62a_100011217306_100000210326 [1,0,0,0,0,0|2,1,0]=4 1398 B8R0.4 CCCCCSCCO 62a_100000210326_100000211926 [1,0,0,0,0,0|1,1,0]=3 1399 B8R0.4 CCCCCSCCO 62a_100000211926_100000210326 [1,0,0,0,0,0|1,1,0]=3 1400 B8R0.4 CCCCCSCOC 62a_100000210326_100000766300 [1,0,0,0,0,0|1,1,0]=3 1401 B8R0.4 CCCCCSCOC 62a_100000766300_100000210326 [1,0,0,0,0,0|1,1,0]=3 1402 B8R0.4 CCCCCSCSC 62a_100000210326_100011218213 [1,0,0,0,0,0|1,2,0]=4 1403 B8R0.4 CCCCCSCSC 62a_100011218213_100000210326 [1,0,0,0,0,0|1,2,0]=4 1404 B8R0.4 CCCCNCCC#N 2230a_100000102301_100011215226 [1,0,0,0,0,0|3,0,0]=4 1405 B8R0.4 CCCCNCCC#N 7a_106832991798_100000184422 [1,0,0,0,0,0|3,0,0]=4 1406 B8R0.4 CCCCNCCCC 2230a_100000102301_100000210211 [1,0,0,0,0,0|2,0,0]=3 1407 B8R0.4 CCCCNCCCC 7a_106832991798_100000210211 [1,0,0,0,0,0|2,0,0]=3 1408 B8R0.4 CCCCNCCCF 2230a_100000102301_100011934791 [1,0,0,0,0,0|3,0,0]=4 1409 B8R0.4 CCCCNCCCF 2230a_100015189416_100000210211 [1,0,0,0,0,0|3,0,0]=4 1410 B8R0.4 CCCCNCCCF 34a_100015189416_100000210210 [1,0,0,0,0,0|3,0,0]=4 1411 B8R0.4 CCCCNCCCF 7a_106832991798_100011934791 [1,0,0,0,0,0|3,0,0]=4 1412 B8R0.4 CCCCNCCCO 2230a_100000102301_100000230001 [1,0,0,0,0,0|3,0,0]=4 1413 B8R0.4 CCCCNCCCO 7a_106832991798_100011215043 [1,0,0,0,0,0|3,0,0]=4 1414 B8R0.4 CCCCNCCOC 2230a_100000102301_100011201679 [1,0,0,0,0,0|1,0,0]=2 1415 B8R0.4 CCCCNCCOC 2230a_100000209980_100000210211 [1,0,0,0,0,0|1,0,0]=2 1416 B8R0.4 CCCCNCCOC 7a_106832991798_100000233755 [1,0,0,0,0,0|1,0,0]=2 1417 B8R0.4 CCCCNCCSC 2230a_100000102301_100000751147 [1,0,0,0,0,0|1,1,0]=3 1418 B8R0.4 CCCCNCCSC 2230a_100020590264_100000210211 [1,0,0,0,0,0|1,1,0]=3 1419 B8R0.4 CCCCNCCSC 7a_106832991798_100000212216 [1,0,0,0,0,0|1,1,0]=3 1420 B8R0.4 CCCCOCCC#N 7a_100000210227_100000184422 [1,0,0,0,0,0|2,0,0]=3 1421 B8R0.4 CCCCOCCCBr 34a_100011217188_100000210210 [1,0,0,0,0,0|2,0,0]=3 1422 B8R0.4 CCCCOCCCC 34a_100000210227_100000210210 [1,0,0,0,0,0|1,0,0]=2 1423 B8R0.4 CCCCOCCCC 7a_100000210227_100000210211 [1,0,0,0,0,0|1,0,0]=2 1424 B8R0.4 CCCCOCCCCl 34a_100000230001_100000210210 [1,0,0,0,0,0|2,0,0]=3 1425 B8R0.4 CCCCOCCCF 34a_100000210227_100011934791 [1,0,0,0,0,0|2,0,0]=3 1426 B8R0.4 CCCCOCCCF 34a_100000759539_100000210210 [1,0,0,0,0,0|2,0,0]=3 1427 B8R0.4 CCCCOCCCF 7a_100000210227_100011934791 [1,0,0,0,0,0|2,0,0]=3 1428 B8R0.4 CCCCOCCCN 34a_100000182051_100000210210 [1,0,0,0,0,0|2,0,0]=3 1429 B8R0.4 CCCCOCCCO 34a_100000210227_100000230001 [1,0,0,0,0,0|2,0,0]=3 1430 B8R0.4 CCCCOCCCO 7a_100000210227_100011215043 [1,0,0,0,0,0|2,0,0]=3 1431 B8R0.4 CCCCOCCNC 2230a_106832991635_100000743108 [1,0,0,0,0,0|1,0,0]=2 1432 B8R0.4 CCCCOCCNC 34a_100102657272_100000743108 [1,0,0,0,0,0|1,0,0]=2 1433 B8R0.4 CCCCOCCNC 7a_106832991635_100000743108 [1,0,0,0,0,0|1,0,0]=2 1434 B8R0.4 CCCCOCCOC 34a_100000210227_100011201679 [1,0,0,0,0,0|0,0,0]=1 1435 B8R0.4 CCCCOCCOC 34a_100000210237_100000210210 [1,0,0,0,0,0|0,0,0]=1 1436 B8R0.4 CCCCOCCOC 34a_100000210238_200000210301 [1,0,0,0,0,0|0,0,0]=1 1437 B8R0.4 CCCCOCCOC 34a_100138415774_100000743108 [1,0,0,0,0,0|0,0,0]=1 1438 B8R0.4 CCCCOCCOC 7a_100000210227_100000233755 [1,0,0,0,0,0|0,0,0]=1 1439 B8R0.4 CCCCOCCOC 7a_100000210238_200000210301 [1,0,0,0,0,0|0,0,0]=1 1440 B8R0.4 CCCCOCCON 34a_100000700252_100000210210 [1,0,0,0,0,0|1,0,0]=2 1441 B8R0.4 CCCCOCCO[13CH3] 34a_100000210238_200025704644 [1,0,0,0,0,0|0,0,0]=1 1442 B8R0.4 CCCCOCCO[13CH3] 7a_100000210238_200025704644 [1,0,0,0,0,0|0,0,0]=1 1443 B8R0.4 CCCCOCCSC 34a_100000210227_100000212216 [1,0,0,0,0,0|0,1,0]=2 1444 B8R0.4 CCCCOCCSC 34a_100000230434_100000210210 [1,0,0,0,0,0|0,1,0]=2 1445 B8R0.4 CCCCOCCSC 62a_100000743108_200000210301 [1,0,0,0,0,0|0,1,0]=2 1446 B8R0.4 CCCCOCCSC 62a_200000210301_100000743108 [1,0,0,0,0,0|0,1,0]=2 1447 B8R0.4 CCCCOCCSC 7a_100000210227_100000212216 [1,0,0,0,0,0|0,1,0]=2 1448 B8R0.4 CCCCOCCSC 7a_100000230434_100000210211 [1,0,0,0,0,0|0,1,0]=2 1449 B8R0.4 CCCCOCCS[13CH3] 62a_100000743108_200025704644 [1,0,0,0,0,0|0,1,0]=2 1450 B8R0.4 CCCCOCCS[13CH3] 62a_200025704644_100000743108 [1,0,0,0,0,0|0,1,0]=2 1451 B8R0.4 CCCCOCNCC 2230a_100015525214_100011995733 [1,0,0,0,0,0|2,0,0]=3 1452 B8R0.4 CCCCOCOCC 34a_100121572206_100011995733 [1,0,0,0,0,0|1,0,0]=2 1453 B8R0.4 CCCCOCSCC 62a_100000210202_100011995733 [1,0,0,0,0,0|1,1,0]=3 1454 B8R0.4 CCCCOCSCC 62a_100011995733_100000210202 [1,0,0,0,0,0|1,1,0]=3 1455 B8R0.4 CCCCOCSCF 62a_100011995733_100015361967 [1,0,0,0,0,0|2,1,0]=4 1456 B8R0.4 CCCCOCSCF 62a_100015361967_100011995733 [1,0,0,0,0,0|2,1,0]=4 1457 B8R0.4 CCCCSCCC#N 62a_100000210211_100011215226 [1,0,0,0,0,0|2,1,0]=4 1458 B8R0.4 CCCCSCCC#N 62a_100011215226_100000210210 [1,0,0,0,0,0|2,1,0]=4 1459 B8R0.4 CCCCSCCCC 62a_100000210211_100000210210 [1,0,0,0,0,0|1,1,0]=3 1460 B8R0.4 CCCCSCCCF 62a_100000210211_100011934791 [1,0,0,0,0,0|2,1,0]=4 1461 B8R0.4 CCCCSCCCF 62a_100011934791_100000210210 [1,0,0,0,0,0|2,1,0]=4 1462 B8R0.4 CCCCSCCCO 62a_100000210211_100011215043 [1,0,0,0,0,0|2,1,0]=4 1463 B8R0.4 CCCCSCCCO 62a_100011215043_100000210210 [1,0,0,0,0,0|2,1,0]=4 1464 B8R0.4 CCCCSCCNC 2230a_100025743550_200000210301 [1,0,0,0,0,0|1,1,0]=3 1465 B8R0.4 CCCCSCCN[13CH3] 2230a_100025743550_200025704644 [1,0,0,0,0,0|1,1,0]=3 1466 B8R0.4 CCCCSCCOC 34a_200000230436_200000210301 [1,0,0,0,0,0|0,1,0]=2 1467 B8R0.4 CCCCSCCOC 62a_100000210211_100000233755 [1,0,0,0,0,0|0,1,0]=2 1468 B8R0.4 CCCCSCCOC 62a_100000233755_100000210210 [1,0,0,0,0,0|0,1,0]=2 1469 B8R0.4 CCCCSCCOC 7a_200000230436_200000210301 [1,0,0,0,0,0|0,1,0]=2 1470 B8R0.4 CCCCSCCO[13CH3] 34a_200000230436_200025704644 [1,0,0,0,0,0|0,1,0]=2 1471 B8R0.4 CCCCSCCO[13CH3] 7a_200000230436_200025704644 [1,0,0,0,0,0|0,1,0]=2 1472 B8R0.4 CCCCSCCSC 62a_100000210211_100000751147 [1,0,0,0,0,0|0,2,0]=3 1473 B8R0.4 CCCCSCCSC 62a_100000212216_100000210210 [1,0,0,0,0,0|0,2,0]=3 1474 B8R0.4 CCCCSCOCC 62a_100000210211_100000739092 [1,0,0,0,0,0|1,1,0]=3 1475 B8R0.4 CCCCSCOCC 62a_100000739092_100000210210 [1,0,0,0,0,0|1,1,0]=3 1476 B8R0.4 CCCNCCCCO 2230a_100000750430_100000210303 [1,0,0,0,0,0|3,0,0]=4 1477 B8R0.4 CCCNCCCCO 34a_100000750430_100000210303 [1,0,0,0,0,0|3,0,0]=4 1478 B8R0.4 CCCNCCCOC 34a_100150723488_100000210303 [1,0,0,0,0,0|2,0,0]=3 1479 B8R0.4 CCCNCCCSC 2230a_100000749238_100000210303 [1,0,0,0,0,0|2,1,0]=4 1480 B8R0.4 CCCNCCOCC 2230a_102516460346_100000210303 [1,0,0,0,0,0|1,0,0]=2 1481 B8R0.4 CCCNCCOCC 34a_102516460346_100000210303 [1,0,0,0,0,0|1,0,0]=2 1482 B8R0.4 CCCNCCSCC 2230a_100000106463_100000210303 [1,0,0,0,0,0|1,1,0]=3 1483 B8R0.4 CCCOCC#CCCl 34a_200000047223_100000210303 [1,0,0,0,0,0|2,0,1]=4 1484 B8R0.4 CCCOCC#CCO 34a_100000210258_200000047223 [1,0,0,0,0,0|2,0,1]=4 1485 B8R0.4 CCCOCCCCBr 34a_100011216708_100000210303 [1,0,0,0,0,0|2,0,0]=3 1486 B8R0.4 CCCOCCCCCl 34a_100000210776_100000210303 [1,0,0,0,0,0|2,0,0]=3 1487 B8R0.4 CCCOCCCCCl 7a_100000210776_100000210303 [1,0,0,0,0,0|2,0,0]=3 1488 B8R0.4 CCCOCCCCF 34a_100000210258_100000729493 [1,0,0,0,0,0|2,0,0]=3 1489 B8R0.4 CCCOCCCCF 34a_100011995726_100000210303 [1,0,0,0,0,0|2,0,0]=3 1490 B8R0.4 CCCOCCCCF 7a_100011995726_100000210303 [1,0,0,0,0,0|2,0,0]=3 1491 B8R0.4 CCCOCCCCI 34a_200012148704_100000210303 [1,0,0,0,0,0|2,0,0]=3 1492 B8R0.4 CCCOCCCCN 34a_100000750430_100000210303 [1,0,0,0,0,0|2,0,0]=3 1493 B8R0.4 CCCOCCCCO 34a_100000210258_100011216708 [1,0,0,0,0,0|2,0,0]=3 1494 B8R0.4 CCCOCCCNC 2230a_100011217757_200000210301 [1,0,0,0,0,0|2,0,0]=3 1495 B8R0.4 CCCOCCCNC 34a_100000213112_100000210303 [1,0,0,0,0,0|2,0,0]=3 1496 B8R0.4 CCCOCCCNC 34a_100011217757_200000210301 [1,0,0,0,0,0|2,0,0]=3 1497 B8R0.4 CCCOCCCN[13CH3] 2230a_100011217757_200025704644 [1,0,0,0,0,0|2,0,0]=3 1498 B8R0.4 CCCOCCCN[13CH3] 34a_100011217757_200025704644 [1,0,0,0,0,0|2,0,0]=3 1499 B8R0.4 CCCOCCCOC 34a_100000210258_100000740836 [1,0,0,0,0,0|2,0,0]=3 1500 B8R0.4 CCCOCCCOC 34a_100000740835_100000210303 [1,0,0,0,0,0|2,0,0]=3 1501 B8R0.4 CCCOCCCSC 34a_100000690336_100000210303 [1,0,0,0,0,0|2,0,0]=3 1502 B8R0.4 CCCOCCCSC 7a_100000690336_100000210303 [1,0,0,0,0,0|2,0,0]=3 1503 B8R0.4 CCCOCCNCC 2230a_100015525214_100011215938 [1,0,0,0,0,0|1,0,0]=2 1504 B8R0.4 CCCOCCNCC 2230a_100161115042_100000210202 [1,0,0,0,0,0|1,0,0]=2 1505 B8R0.4 CCCOCCNCC 34a_100161115042_100000210202 [1,0,0,0,0,0|1,0,0]=2 1506 B8R0.4 CCCOCCNCF 34a_100161115042_100015361967 [1,0,0,0,0,0|2,0,0]=3 1507 B8R0.4 CCCOCCOCC 34a_100000210136_100000210303 [1,0,0,0,0,0|0,0,0]=1 1508 B8R0.4 CCCOCCOCC 34a_100000210258_100000210147 [1,0,0,0,0,0|0,0,0]=1 1509 B8R0.4 CCCOCCOCC 34a_100000752267_100000210202 [1,0,0,0,0,0|0,0,0]=1 1510 B8R0.4 CCCOCCOCC 34a_100121572206_100011215938 [1,0,0,0,0,0|0,0,0]=1 1511 B8R0.4 CCCOCCOCC 7a_100000210136_100000210303 [1,0,0,0,0,0|0,0,0]=1 1512 B8R0.4 CCCOCCOCC 7a_100000752267_100000210202 [1,0,0,0,0,0|0,0,0]=1 1513 B8R0.4 CCCOCCOCF 34a_100000752267_100015361967 [1,0,0,0,0,0|1,0,0]=2 1514 B8R0.4 CCCOCCOCF 7a_100000752267_100015361967 [1,0,0,0,0,0|1,0,0]=2 1515 B8R0.4 CCCOCCSCC 34a_100000210258_100000757381 [1,0,0,0,0,0|0,1,0]=2 1516 B8R0.4 CCCOCCSCC 34a_100000212035_100000210303 [1,0,0,0,0,0|0,1,0]=2 1517 B8R0.4 CCCOCCSCC 62a_100000210202_100011215938 [1,0,0,0,0,0|0,1,0]=2 1518 B8R0.4 CCCOCCSCC 62a_100011215938_100000210202 [1,0,0,0,0,0|0,1,0]=2 1519 B8R0.4 CCCOCCSCC 7a_100000212035_100000210303 [1,0,0,0,0,0|0,1,0]=2 1520 B8R0.4 CCCOCCSCF 62a_100011215938_100015361967 [1,0,0,0,0,0|1,1,0]=3 1521 B8R0.4 CCCOCCSCF 62a_100015361967_100011215938 [1,0,0,0,0,0|1,1,0]=3 1522 B8R0.4 CCCSCCCCF 62a_100000210303_100000729493 [1,0,0,0,0,0|2,1,0]=4 1523 B8R0.4 CCCSCCCCF 62a_100000729493_100000210303 [1,0,0,0,0,0|2,1,0]=4 1524 B8R0.4 CCCSCCCCO 62a_100000210303_100000210776 [1,0,0,0,0,0|2,1,0]=4 1525 B8R0.4 CCCSCCCCO 62a_100000210776_100000210303 [1,0,0,0,0,0|2,1,0]=4 1526 B8R0.4 CCCSCCCOC 62a_100000210303_100000709357 [1,0,0,0,0,0|2,0,0]=3 1527 B8R0.4 CCCSCCCOC 62a_100000709357_100000210303 [1,0,0,0,0,0|2,0,0]=3 1528 B8R0.4 CCCSCCNCC 2230a_100020603323_100000210202 [1,0,0,0,0,0|1,1,0]=3 1529 B8R0.4 CCCSCCOCC 34a_200000230433_100000210202 [1,0,0,0,0,0|0,1,0]=2 1530 B8R0.4 CCCSCCOCC 62a_100000210147_100000210303 [1,0,0,0,0,0|0,1,0]=2 1531 B8R0.4 CCCSCCOCC 62a_100000210303_100011215890 [1,0,0,0,0,0|0,1,0]=2 1532 B8R0.4 CCCSCCOCC 7a_200000230433_100000210202 [1,0,0,0,0,0|0,1,0]=2 1533 B8R0.4 CCCSCCOCF 34a_200000230433_100015361967 [1,0,0,0,0,0|1,1,0]=3 1534 B8R0.4 CCCSCCOCF 7a_200000230433_100015361967 [1,0,0,0,0,0|1,1,0]=3 1535 B8R0.4 CCCSCCSCC 62a_100000210303_100000757381 [1,0,0,0,0,0|0,2,0]=3 1536 B8R0.4 CCCSCCSCC 62a_100000757381_100000210303 [1,0,0,0,0,0|0,2,0]=3 1537 B8R0.4 CCNCCCCC#N 2230a_100015525214_100000211819 [1,0,0,0,0,0|3,0,0]=4 1538 B8R0.4 CCNCCCCC=O 2230a_100015525214_100000139335 [1,0,0,0,0,0|3,0,0]=4 1539 B8R0.4 CCNCCCCCF 2230a_100015525214_100000729378 [1,0,0,0,0,0|3,0,0]=4 1540 B8R0.4 CCNCCCCCO 2230a_100000762737_100000210202 [1,0,0,0,0,0|2,0,0]=3 1541 B8R0.4 CCNCCCCCO 2230a_100015525214_100000746330 [1,0,0,0,0,0|2,0,0]=3 1542 B8R0.4 CCNCCCCCO 34a_100000762737_100000210202 [1,0,0,0,0,0|2,0,0]=3 1543 B8R0.4 CCNCCCCOC 2230a_100015525214_100000730899 [1,0,0,0,0,0|1,0,0]=2 1544 B8R0.4 CCNCCCOCC 2230a_100000210961_100000210202 [1,0,0,0,0,0|2,0,0]=3 1545 B8R0.4 CCNCCCOCC 2230a_100015525214_100012232248 [1,0,0,0,0,0|2,0,0]=3 1546 B8R0.4 CCNCCCOCC 34a_100000210961_100000210202 [1,0,0,0,0,0|2,0,0]=3 1547 B8R0.4 CCNCCOCC#N 2230a_100015525214_200000047693 [1,0,0,0,0,0|2,0,1]=4 1548 B8R0.4 CCNCCOCCO 2230a_100000211614_100000210202 [1,0,0,0,0,0|1,0,0]=2 1549 B8R0.4 CCNCCOCCO 2230a_100015525214_100011215305 [1,0,0,0,0,0|1,0,0]=2 1550 B8R0.4 CCNCCOCCO 34a_100000211614_100000210202 [1,0,0,0,0,0|1,0,0]=2 1551 B8R0.4 CCNCCSCCO 2230a_100011219999_100000210202 [1,0,0,0,0,0|1,1,0]=3 1552 B8R0.4 CCNCOCCOC 2230a_100015525214_100000231047 [1,0,0,0,0,0|1,0,0]=2 1553 B8R0.4 CCOCCCCCBr 34a_100000746331_100000210202 [1,0,0,0,0,0|2,0,0]=3 1554 B8R0.4 CCOCCCCCBr 7a_100000746331_100000210202 [1,0,0,0,0,0|2,0,0]=3 1555 B8R0.4 CCOCCCCCCl 34a_100000746330_100000210202 [1,0,0,0,0,0|2,0,0]=3 1556 B8R0.4 CCOCCCCCCl 7a_100000746330_100000210202 [1,0,0,0,0,0|2,0,0]=3 1557 B8R0.4 CCOCCCCCF 34a_100121572206_100000729378 [1,0,0,0,0,0|2,0,0]=3 1558 B8R0.4 CCOCCCCCI 34a_200012148887_100000210202 [1,0,0,0,0,0|2,0,0]=3 1559 B8R0.4 CCOCCCCCI 7a_200012148887_100000210202 [1,0,0,0,0,0|2,0,0]=3 1560 B8R0.4 CCOCCCCCN 34a_100000762737_100000210202 [1,0,0,0,0,0|2,0,0]=3 1561 B8R0.4 CCOCCCCCO 34a_100121572206_100000746330 [1,0,0,0,0,0|1,0,0]=2 1562 B8R0.4 CCOCCCCOC 34a_100000740925_100000210202 [1,0,0,0,0,0|0,0,0]=1 1563 B8R0.4 CCOCCCCOC 34a_100121572206_100000755781 [1,0,0,0,0,0|0,0,0]=1 1564 B8R0.4 CCOCCCCSC 34a_100011217163_100000210202 [1,0,0,0,0,0|0,1,0]=2 1565 B8R0.4 CCOCCCCSC 7a_100011217163_100000210202 [1,0,0,0,0,0|0,1,0]=2 1566 B8R0.4 CCOCCCNCF 34a_100000210961_100015361967 [1,0,0,0,0,0|3,0,0]=4 1567 B8R0.4 CCOCCCOCC 34a_100000757476_100000210202 [1,0,0,0,0,0|2,0,0]=3 1568 B8R0.4 CCOCCCOCC 34a_100121572206_100012232248 [1,0,0,0,0,0|2,0,0]=3 1569 B8R0.4 CCOCCCOCC 7a_100000757476_100000210202 [1,0,0,0,0,0|2,0,0]=3 1570 B8R0.4 CCOCCCOCF 34a_100000757476_100015361967 [1,0,0,0,0,0|3,0,0]=4 1571 B8R0.4 CCOCCCOCF 7a_100000757476_100015361967 [1,0,0,0,0,0|3,0,0]=4 1572 B8R0.4 CCOCCCSCC 34a_100011216438_100000210202 [1,0,0,0,0,0|2,0,0]=3 1573 B8R0.4 CCOCCCSCC 62a_100000210202_100012232248 [1,0,0,0,0,0|2,0,0]=3 1574 B8R0.4 CCOCCCSCC 62a_100012232248_100000210202 [1,0,0,0,0,0|2,0,0]=3 1575 B8R0.4 CCOCCCSCC 7a_100011216438_100000210202 [1,0,0,0,0,0|2,0,0]=3 1576 B8R0.4 CCOCCCSCF 62a_100012232248_100015361967 [1,0,0,0,0,0|3,0,0]=4 1577 B8R0.4 CCOCCCSCF 62a_100015361967_100012232248 [1,0,0,0,0,0|3,0,0]=4 1578 B8R0.4 CCOCCNCC#N 2230a_102516460346_100011215382 [1,0,0,0,0,0|2,0,1]=4 1579 B8R0.4 CCOCCNCC=O 2230a_102516460346_200015260668 [1,0,0,0,0,0|1,0,2]=4 1580 B8R0.4 CCOCCNCC=O 34a_102516460346_200009817547 [1,0,0,0,0,0|1,0,2]=4 1581 B8R0.4 CCOCCNCCF 2230a_102516460346_100011217306 [1,0,0,0,0,0|2,0,0]=3 1582 B8R0.4 CCOCCNCCF 34a_100000724931_100000210147 [1,0,0,0,0,0|2,0,0]=3 1583 B8R0.4 CCOCCNCCF 34a_102516460346_100011217306 [1,0,0,0,0,0|2,0,0]=3 1584 B8R0.4 CCOCCNCCO 2230a_100016997473_100011215890 [1,0,0,0,0,0|1,0,0]=2 1585 B8R0.4 CCOCCNCCO 2230a_102516460346_100000211926 [1,0,0,0,0,0|1,0,0]=2 1586 B8R0.4 CCOCCNCCO 34a_100016990907_100000210147 [1,0,0,0,0,0|1,0,0]=2 1587 B8R0.4 CCOCCNCCO 34a_102516460346_100000211926 [1,0,0,0,0,0|1,0,0]=2 1588 B8R0.4 CCOCCNCOC 2230a_102516460346_100000766300 [1,0,0,0,0,0|1,0,0]=2 1589 B8R0.4 CCOCCNCSC 2230a_102516460346_100011218213 [1,0,0,0,0,0|1,1,0]=3 1590 B8R0.4 CCOCCNCSC 34a_102516460346_100011218213 [1,0,0,0,0,0|1,1,0]=3 1591 B8R0.4 CCOCCOCC#N 7a_100000210136_100011215382 [1,0,0,0,0,0|1,0,1]=3 1592 B8R0.4 CCOCCOCC=O 34a_100000210136_200009817547 [1,0,0,0,0,0|0,0,2]=3 1593 B8R0.4 CCOCCOCC=O 7a_100000210136_200015260668 [1,0,0,0,0,0|0,0,2]=3 1594 B8R0.4 CCOCCOCCBr 34a_100000211926_100000210147 [1,0,0,0,0,0|1,0,0]=2 1595 B8R0.4 CCOCCOCCBr 34a_100000692535_100000210202 [1,0,0,0,0,0|1,0,0]=2 1596 B8R0.4 CCOCCOCCBr 7a_100000692535_100000210202 [1,0,0,0,0,0|1,0,0]=2 1597 B8R0.4 CCOCCOCCCl 34a_100011215305_100000210202 [1,0,0,0,0,0|1,0,0]=2 1598 B8R0.4 CCOCCOCCCl 7a_100011215305_100000210202 [1,0,0,0,0,0|1,0,0]=2 1599 B8R0.4 CCOCCOCCF 34a_100000210136_100011217306 [1,0,0,0,0,0|1,0,0]=2 1600 B8R0.4 CCOCCOCCF 34a_200015357709_100000210202 [1,0,0,0,0,0|1,0,0]=2 1601 B8R0.4 CCOCCOCCF 7a_100000210136_100011217306 [1,0,0,0,0,0|1,0,0]=2 1602 B8R0.4 CCOCCOCCF 7a_200015357709_100000210202 [1,0,0,0,0,0|1,0,0]=2 1603 B8R0.4 CCOCCOCCI 34a_100012149058_100000210202 [1,0,0,0,0,0|1,0,0]=2 1604 B8R0.4 CCOCCOCCI 7a_100012149058_100000210202 [1,0,0,0,0,0|1,0,0]=2 1605 B8R0.4 CCOCCOCCN 34a_100000210304_100000210147 [1,0,0,0,0,0|1,0,0]=2 1606 B8R0.4 CCOCCOCCN 34a_100000211614_100000210202 [1,0,0,0,0,0|1,0,0]=2 1607 B8R0.4 CCOCCOCCO 34a_100000210136_100000211926 [1,0,0,0,0,0|0,0,0]=1 1608 B8R0.4 CCOCCOCCO 34a_100121572206_100000692535 [1,0,0,0,0,0|0,0,0]=1 1609 B8R0.4 CCOCCOCCO 7a_100000210136_100000211926 [1,0,0,0,0,0|0,0,0]=1 1610 B8R0.4 CCOCCOCSC 34a_100000210136_100011218213 [1,0,0,0,0,0|0,1,0]=2 1611 B8R0.4 CCOCCSCC#N 62a_100000210147_100011215382 [1,0,0,0,0,0|1,1,1]=4 1612 B8R0.4 CCOCCSCC#N 62a_100011215382_100011215890 [1,0,0,0,0,0|1,1,1]=4 1613 B8R0.4 CCOCCSCC=O 62a_100000210147_200015260668 [1,0,0,0,0,0|0,1,2]=4 1614 B8R0.4 CCOCCSCC=O 62a_200015260668_100011215890 [1,0,0,0,0,0|0,1,2]=4 1615 B8R0.4 CCOCCSCCF 62a_100000210147_100011217306 [1,0,0,0,0,0|1,1,0]=3 1616 B8R0.4 CCOCCSCCF 62a_100011217306_100011215890 [1,0,0,0,0,0|1,1,0]=3 1617 B8R0.4 CCOCCSCCO 62a_100000210147_100000211926 [1,0,0,0,0,0|0,1,0]=2 1618 B8R0.4 CCOCCSCCO 62a_100000211926_100011215890 [1,0,0,0,0,0|0,1,0]=2 1619 B8R0.4 CCOCCSCOC 62a_100000210147_100000766300 [1,0,0,0,0,0|0,1,0]=2 1620 B8R0.4 CCOCCSCOC 62a_100000766300_100011215890 [1,0,0,0,0,0|0,1,0]=2 1621 B8R0.4 CCOCCSCSC 62a_100000210147_100011218213 [1,0,0,0,0,0|0,2,0]=3 1622 B8R0.4 CCOCCSCSC 62a_100011218213_100011215890 [1,0,0,0,0,0|0,2,0]=3 1623 B8R0.4 CCOCSCCC#N 62a_100000739092_100011215226 [1,0,0,0,0,0|2,1,0]=4 1624 B8R0.4 CCOCSCCC#N 62a_100011215226_100000739092 [1,0,0,0,0,0|2,1,0]=4 1625 B8R0.4 CCOCSCCCF 62a_100000739092_100011934791 [1,0,0,0,0,0|2,1,0]=4 1626 B8R0.4 CCOCSCCCF 62a_100011934791_100000739092 [1,0,0,0,0,0|2,1,0]=4 1627 B8R0.4 CCOCSCCCO 62a_100000739092_100011215043 [1,0,0,0,0,0|2,0,0]=3 1628 B8R0.4 CCOCSCCCO 62a_100011215043_100000739092 [1,0,0,0,0,0|2,0,0]=3 1629 B8R0.4 CCOCSCCOC 62a_100000233755_100000739092 [1,0,0,0,0,0|0,1,0]=2 1630 B8R0.4 CCOCSCCOC 62a_100000739092_100000233755 [1,0,0,0,0,0|0,1,0]=2 1631 B8R0.4 CCOCSCCSC 62a_100000212216_100000739092 [1,0,0,0,0,0|0,2,0]=3 1632 B8R0.4 CCOCSCCSC 62a_100000739092_100000751147 [1,0,0,0,0,0|0,2,0]=3 1633 B8R0.4 CCOCSCOCC 62a_100000739092_100000739092 [1,0,0,0,0,0|2,1,0]=4 1634 B8R0.4 CCSCCCCC#N 62a_100000210202_100000211819 [1,0,0,0,0,0|2,1,0]=4 1635 B8R0.4 CCSCCCCC#N 62a_100011219923_100000210202 [1,0,0,0,0,0|2,1,0]=4 1636 B8R0.4 CCSCCCCC=O 62a_100000139335_100000210202 [1,0,0,0,0,0|2,1,0]=4 1637 B8R0.4 CCSCCCCC=O 62a_100000210202_100000139335 [1,0,0,0,0,0|2,1,0]=4 1638 B8R0.4 CCSCCCCCF 62a_100000210202_100000729378 [1,0,0,0,0,0|2,1,0]=4 1639 B8R0.4 CCSCCCCCF 62a_100000729378_100000210202 [1,0,0,0,0,0|2,1,0]=4 1640 B8R0.4 CCSCCCCCO 62a_100000210202_100000746330 [1,0,0,0,0,0|1,1,0]=3 1641 B8R0.4 CCSCCCCCO 62a_100000746330_100000210202 [1,0,0,0,0,0|1,1,0]=3 1642 B8R0.4 CCSCCCCOC 62a_100000210202_100000730899 [1,0,0,0,0,0|0,1,0]=2 1643 B8R0.4 CCSCCCCOC 62a_100000730899_100000210202 [1,0,0,0,0,0|0,1,0]=2 1644 B8R0.4 CCSCCCOCF 34a_100011216438_100015361967 [1,0,0,0,0,0|3,0,0]=4 1645 B8R0.4 CCSCCCOCF 7a_100011216438_100015361967 [1,0,0,0,0,0|3,0,0]=4 1646 B8R0.4 CCSCCNCCF 2230a_100000106463_100011217306 [1,0,0,0,0,0|2,1,0]=4 1647 B8R0.4 CCSCCNCCF 34a_100000724931_100000757381 [1,0,0,0,0,0|2,1,0]=4 1648 B8R0.4 CCSCCNCCO 2230a_100000106463_100000211926 [1,0,0,0,0,0|1,1,0]=3 1649 B8R0.4 CCSCCNCCO 2230a_100016997473_100000757381 [1,0,0,0,0,0|1,1,0]=3 1650 B8R0.4 CCSCCNCCO 34a_100016990907_100000757381 [1,0,0,0,0,0|1,1,0]=3 1651 B8R0.4 CCSCCNCOC 2230a_100000106463_100000766300 [1,0,0,0,0,0|1,1,0]=3 1652 B8R0.4 CCSCCNCSC 2230a_100000106463_100011218213 [1,0,0,0,0,0|1,2,0]=4 1653 B8R0.4 CCSCCOCC#N 62a_100000210202_200000047693 [1,0,0,0,0,0|1,1,1]=4 1654 B8R0.4 CCSCCOCC#N 62a_200000047693_100000210202 [1,0,0,0,0,0|1,1,1]=4 1655 B8R0.4 CCSCCOCC#N 7a_100000212035_100011215382 [1,0,0,0,0,0|1,1,1]=4 1656 B8R0.4 CCSCCOCC=O 34a_100000212035_200009817547 [1,0,0,0,0,0|0,1,2]=4 1657 B8R0.4 CCSCCOCC=O 7a_100000212035_200015260668 [1,0,0,0,0,0|0,1,2]=4 1658 B8R0.4 CCSCCOCCBr 34a_100000211926_100000757381 [1,0,0,0,0,0|1,1,0]=3 1659 B8R0.4 CCSCCOCCF 34a_100000212035_100011217306 [1,0,0,0,0,0|1,1,0]=3 1660 B8R0.4 CCSCCOCCF 7a_100000212035_100011217306 [1,0,0,0,0,0|1,1,0]=3 1661 B8R0.4 CCSCCOCCN 34a_100000210304_100000757381 [1,0,0,0,0,0|1,1,0]=3 1662 B8R0.4 CCSCCOCCO 34a_100000212035_100000211926 [1,0,0,0,0,0|0,1,0]=2 1663 B8R0.4 CCSCCOCCO 62a_100000210202_100011215305 [1,0,0,0,0,0|0,1,0]=2 1664 B8R0.4 CCSCCOCCO 62a_100011215305_100000210202 [1,0,0,0,0,0|0,1,0]=2 1665 B8R0.4 CCSCCOCCO 7a_100000212035_100000211926 [1,0,0,0,0,0|0,1,0]=2 1666 B8R0.4 CCSCCOCSC 34a_100000212035_100011218213 [1,0,0,0,0,0|0,2,0]=3 1667 B8R0.4 CCSCCSCCF 62a_100000757381_100011217306 [1,0,0,0,0,0|1,2,0]=4 1668 B8R0.4 CCSCCSCCF 62a_100011217306_100000757381 [1,0,0,0,0,0|1,2,0]=4 1669 B8R0.4 CCSCCSCCO 62a_100000211926_100000757381 [1,0,0,0,0,0|0,2,0]=3 1670 B8R0.4 CCSCCSCCO 62a_100000757381_100000211926 [1,0,0,0,0,0|0,2,0]=3 1671 B8R0.4 CCSCCSCOC 62a_100000757381_100000766300 [1,0,0,0,0,0|0,2,0]=3 1672 B8R0.4 CCSCCSCOC 62a_100000766300_100000757381 [1,0,0,0,0,0|0,2,0]=3 1673 B8R0.4 CCSCCSCSC 62a_100000757381_100011218213 [1,0,0,0,0,0|0,3,0]=4 1674 B8R0.4 CCSCCSCSC 62a_100011218213_100000757381 [1,0,0,0,0,0|0,3,0]=4 1675 B8R0.4 CCSCOCCOC 62a_100000210202_100000231047 [1,0,0,0,0,0|0,1,0]=2 1676 B8R0.4 CCSCOCCOC 62a_100000231047_100000210202 [1,0,0,0,0,0|0,1,0]=2 1677 B8R0.4 CNCCCCCCF 2230a_106832991635_100015922095 [1,0,0,0,0,0|3,0,0]=4 1678 B8R0.4 CNCCCCCCF 34a_100102657272_100015922095 [1,0,0,0,0,0|3,0,0]=4 1679 B8R0.4 CNCCCCCCF 7a_106832991635_100015922095 [1,0,0,0,0,0|3,0,0]=4 1680 B8R0.4 CNCCCCCCO 2230a_100000686447_200000210301 [1,0,0,0,0,0|3,0,0]=4 1681 B8R0.4 CNCCCCCCO 2230a_106832991635_100000766143 [1,0,0,0,0,0|3,0,0]=4 1682 B8R0.4 CNCCCCCCO 34a_100000686447_200000210301 [1,0,0,0,0,0|3,0,0]=4 1683 B8R0.4 CNCCCCCCO 34a_100102657272_100000766143 [1,0,0,0,0,0|3,0,0]=4 1684 B8R0.4 CNCCCCCCO 7a_106832991635_100000766143 [1,0,0,0,0,0|3,0,0]=4 1685 B8R0.4 CNCCCCCOC 2230a_100000747528_200000210301 [1,0,0,0,0,0|2,0,0]=3 1686 B8R0.4 CNCCCCCOC 34a_100000722520_200000210301 [1,0,0,0,0,0|2,0,0]=3 1687 B8R0.4 CNCCCCCOC 34a_100000747528_200000210301 [1,0,0,0,0,0|2,0,0]=3 1688 B8R0.4 CNCCCCCO[13CH3] 34a_100000722520_200025704644 [1,0,0,0,0,0|2,0,0]=3 1689 B8R0.4 CNCCCOCCF 34a_100000213112_100011217306 [1,0,0,0,0,0|3,0,0]=4 1690 B8R0.4 CNCCCOCCO 34a_100000213112_100000211926 [1,0,0,0,0,0|2,0,0]=3 1691 B8R0.4 CNCCCOCSC 34a_100000213112_100011218213 [1,0,0,0,0,0|2,1,0]=4 1692 B8R0.4 CNCCOCCOC 2230a_100000745349_200000210301 [1,0,0,0,0,0|1,0,0]=2 1693 B8R0.4 CNCCOCCOC 2230a_106832991635_100000695917 [1,0,0,0,0,0|1,0,0]=2 1694 B8R0.4 CNCCOCCOC 34a_100000228057_200000210301 [1,0,0,0,0,0|1,0,0]=2 1695 B8R0.4 CNCCOCCOC 34a_100000745349_200000210301 [1,0,0,0,0,0|1,0,0]=2 1696 B8R0.4 CNCCOCCOC 34a_100102657272_100000695917 [1,0,0,0,0,0|1,0,0]=2 1697 B8R0.4 CNCCOCCOC 7a_106832991635_100000695917 [1,0,0,0,0,0|1,0,0]=2 1698 B8R0.4 CNCCOCCO[13CH3] 34a_100000228057_200025704644 [1,0,0,0,0,0|1,0,0]=2 1699 B8R0.4 COCCCCCCBr 34a_100011215345_200000210301 [1,0,0,0,0,0|2,0,0]=3 1700 B8R0.4 COCCCCCCBr 7a_100011215345_200000210301 [1,0,0,0,0,0|2,0,0]=3 1701 B8R0.4 COCCCCCCCl 34a_100000766143_200000210301 [1,0,0,0,0,0|2,0,0]=3 1702 B8R0.4 COCCCCCCCl 7a_100000766143_200000210301 [1,0,0,0,0,0|2,0,0]=3 1703 B8R0.4 COCCCCCCF 34a_100000732779_200000210301 [1,0,0,0,0,0|2,0,0]=3 1704 B8R0.4 COCCCCCCF 34a_100138415774_100015922095 [1,0,0,0,0,0|2,0,0]=3 1705 B8R0.4 COCCCCCCF 7a_100000732779_200000210301 [1,0,0,0,0,0|2,0,0]=3 1706 B8R0.4 COCCCCCCN 34a_100000686447_200000210301 [1,0,0,0,0,0|2,0,0]=3 1707 B8R0.4 COCCCCCCO 34a_100138415774_100000766143 [1,0,0,0,0,0|2,0,0]=3 1708 B8R0.4 COCCCCCN[13CH3] 2230a_100000747528_200025704644 [1,0,0,0,0,0|2,0,0]=3 1709 B8R0.4 COCCCCCN[13CH3] 34a_100000747528_200025704644 [1,0,0,0,0,0|2,0,0]=3 1710 B8R0.4 COCCCCOCF 34a_100000740925_100015361967 [1,0,0,0,0,0|1,0,0]=2 1711 B8R0.4 COCCCCSCF 62a_100000730899_100015361967 [1,0,0,0,0,0|1,1,0]=3 1712 B8R0.4 COCCCCSCF 62a_100015361967_100000730899 [1,0,0,0,0,0|1,1,0]=3 1713 B8R0.4 COCCCNCCF 34a_100000724931_100000740836 [1,0,0,0,0,0|3,0,0]=4 1714 B8R0.4 COCCCNCCF 34a_100150723488_100011217306 [1,0,0,0,0,0|3,0,0]=4 1715 B8R0.4 COCCCNCCO 2230a_100016997473_100000740836 [1,0,0,0,0,0|3,0,0]=4 1716 B8R0.4 COCCCNCCO 34a_100016990907_100000740836 [1,0,0,0,0,0|3,0,0]=4 1717 B8R0.4 COCCCNCCO 34a_100150723488_100000211926 [1,0,0,0,0,0|3,0,0]=4 1718 B8R0.4 COCCCNCSC 34a_100150723488_100011218213 [1,0,0,0,0,0|2,1,0]=4 1719 B8R0.4 COCCCOCCBr 34a_100000211926_100000740836 [1,0,0,0,0,0|3,0,0]=4 1720 B8R0.4 COCCCOCCF 34a_100000740835_100011217306 [1,0,0,0,0,0|3,0,0]=4 1721 B8R0.4 COCCCOCCN 34a_100000210304_100000740836 [1,0,0,0,0,0|3,0,0]=4 1722 B8R0.4 COCCCOCCO 34a_100000740835_100000211926 [1,0,0,0,0,0|2,0,0]=3 1723 B8R0.4 COCCCOCSC 34a_100000740835_100011218213 [1,0,0,0,0,0|2,1,0]=4 1724 B8R0.4 COCCCSCCF 62a_100000709357_100011217306 [1,0,0,0,0,0|3,0,0]=4 1725 B8R0.4 COCCCSCCF 62a_100011217306_100000709357 [1,0,0,0,0,0|3,0,0]=4 1726 B8R0.4 COCCCSCCO 62a_100000211926_100000709357 [1,0,0,0,0,0|2,1,0]=4 1727 B8R0.4 COCCCSCCO 62a_100000709357_100000211926 [1,0,0,0,0,0|2,1,0]=4 1728 B8R0.4 COCCCSCOC 62a_100000709357_100000766300 [1,0,0,0,0,0|2,0,0]=3 1729 B8R0.4 COCCCSCOC 62a_100000766300_100000709357 [1,0,0,0,0,0|2,0,0]=3 1730 B8R0.4 COCCCSCSC 62a_100000709357_100011218213 [1,0,0,0,0,0|2,1,0]=4 1731 B8R0.4 COCCCSCSC 62a_100011218213_100000709357 [1,0,0,0,0,0|2,1,0]=4 1732 B8R0.4 COCCNCCC#N 2230a_100000209980_100011215226 [1,0,0,0,0,0|2,0,1]=4 1733 B8R0.4 COCCNCCCF 2230a_100000209980_100011934791 [1,0,0,0,0,0|2,0,0]=3 1734 B8R0.4 COCCNCCCF 2230a_100015189416_100011201679 [1,0,0,0,0,0|2,0,0]=3 1735 B8R0.4 COCCNCCCF 34a_100015189416_100011201679 [1,0,0,0,0,0|2,0,0]=3 1736 B8R0.4 COCCNCCCO 2230a_100000209980_100000230001 [1,0,0,0,0,0|2,0,0]=3 1737 B8R0.4 COCCNCCOC 2230a_100000209980_100011201679 [1,0,0,0,0,0|1,0,0]=2 1738 B8R0.4 COCCNCCSC 2230a_100000209980_100000751147 [1,0,0,0,0,0|1,1,0]=3 1739 B8R0.4 COCCNCCSC 2230a_100020590264_100011201679 [1,0,0,0,0,0|1,1,0]=3 1740 B8R0.4 COCCOCCCBr 34a_100011217188_100011201679 [1,0,0,0,0,0|1,0,0]=2 1741 B8R0.4 COCCOCCCCl 34a_100000230001_100011201679 [1,0,0,0,0,0|1,0,0]=2 1742 B8R0.4 COCCOCCCF 34a_100000210237_100011934791 [1,0,0,0,0,0|1,0,0]=2 1743 B8R0.4 COCCOCCCF 34a_100000759539_100011201679 [1,0,0,0,0,0|1,0,0]=2 1744 B8R0.4 COCCOCCCN 34a_100000182051_100011201679 [1,0,0,0,0,0|1,0,0]=2 1745 B8R0.4 COCCOCCCO 34a_100000210237_100000230001 [1,0,0,0,0,0|1,0,0]=2 1746 B8R0.4 COCCOCCN[13CH3] 2230a_100000745349_200025704644 [1,0,0,0,0,0|1,0,0]=2 1747 B8R0.4 COCCOCCN[13CH3] 34a_100000745349_200025704644 [1,0,0,0,0,0|1,0,0]=2 1748 B8R0.4 COCCOCCOC 34a_100000210237_100011201679 [1,0,0,0,0,0|0,0,0]=1 1749 B8R0.4 COCCOCCOC 34a_100011215163_200000210301 [1,0,0,0,0,0|0,0,0]=1 1750 B8R0.4 COCCOCCOC 34a_100138415774_100000695917 [1,0,0,0,0,0|0,0,0]=1 1751 B8R0.4 COCCOCCOC 7a_100011215163_200000210301 [1,0,0,0,0,0|0,0,0]=1 1752 B8R0.4 COCCOCCON 34a_100000700252_100011201679 [1,0,0,0,0,0|1,0,0]=2 1753 B8R0.4 COCCOCCO[13CH3] 34a_100011215163_200025704644 [1,0,0,0,0,0|0,0,0]=1 1754 B8R0.4 COCCOCCO[13CH3] 7a_100011215163_200025704644 [1,0,0,0,0,0|0,0,0]=1 1755 B8R0.4 COCCOCCSC 34a_100000210237_100000212216 [1,0,0,0,0,0|0,1,0]=2 1756 B8R0.4 COCCOCCSC 34a_100000230434_100011201679 [1,0,0,0,0,0|0,1,0]=2 1757 B8R0.4 COCCOCCSC 62a_100000695917_200000210301 [1,0,0,0,0,0|0,1,0]=2 1758 B8R0.4 COCCOCCSC 62a_200000210301_100000695917 [1,0,0,0,0,0|0,1,0]=2 1759 B8R0.4 COCCOCCSC 7a_100000230434_100000233755 [1,0,0,0,0,0|0,1,0]=2 1760 B8R0.4 COCCOCCS[13CH3] 62a_100000695917_200025704644 [1,0,0,0,0,0|0,1,0]=2 1761 B8R0.4 COCCOCCS[13CH3] 62a_200025704644_100000695917 [1,0,0,0,0,0|0,1,0]=2 1762 B8R0.4 COCCOCSCF 62a_100000231047_100015361967 [1,0,0,0,0,0|1,1,0]=3 1763 B8R0.4 COCCOCSCF 62a_100015361967_100000231047 [1,0,0,0,0,0|1,1,0]=3 1764 B8R0.4 COCCSCCC#N 62a_100000233755_100011215226 [1,0,0,0,0,0|1,1,1]=4 1765 B8R0.4 COCCSCCC#N 62a_100011215226_100000233755 [1,0,0,0,0,0|1,1,1]=4 1766 B8R0.4 COCCSCCCF 62a_100000233755_100011934791 [1,0,0,0,0,0|1,1,0]=3 1767 B8R0.4 COCCSCCCF 62a_100011934791_100000233755 [1,0,0,0,0,0|1,1,0]=3 1768 B8R0.4 COCCSCCCO 62a_100000233755_100011215043 [1,0,0,0,0,0|1,1,0]=3 1769 B8R0.4 COCCSCCCO 62a_100011215043_100000233755 [1,0,0,0,0,0|1,1,0]=3 1770 B8R0.4 COCCSCCOC 62a_100000233755_100000233755 [1,0,0,0,0,0|0,1,0]=2 1771 B8R0.4 COCCSCCSC 62a_100000212216_100000233755 [1,0,0,0,0,0|0,2,0]=3 1772 B8R0.4 COCCSCCSC 62a_100000233755_100000751147 [1,0,0,0,0,0|0,2,0]=3 1773 B8R0.4 COCNCCCCO 2230a_100000750430_100000766300 [1,0,0,0,0,0|3,0,0]=4 1774 B8R0.4 COCNCCCSC 2230a_100000749238_100000766300 [1,0,0,0,0,0|2,1,0]=4 1775 B8R0.4 COCSCCCCF 62a_100000729493_100000766300 [1,0,0,0,0,0|2,1,0]=4 1776 B8R0.4 COCSCCCCF 62a_100000766300_100000729493 [1,0,0,0,0,0|2,1,0]=4 1777 B8R0.4 COCSCCCCO 62a_100000210776_100000766300 [1,0,0,0,0,0|2,1,0]=4 1778 B8R0.4 COCSCCCCO 62a_100000766300_100000210776 [1,0,0,0,0,0|2,1,0]=4 1779 B8R0.4 CSCCCCCCF 62a_100015922095_200000210301 [1,0,0,0,0,0|2,1,0]=4 1780 B8R0.4 CSCCCCCCF 62a_200000210301_100015922095 [1,0,0,0,0,0|2,1,0]=4 1781 B8R0.4 CSCCCCCCO 62a_100000766143_200000210301 [1,0,0,0,0,0|2,1,0]=4 1782 B8R0.4 CSCCCCCCO 62a_200000210301_100000766143 [1,0,0,0,0,0|2,1,0]=4 1783 B8R0.4 CSCCCCOCF 34a_100011217163_100015361967 [1,0,0,0,0,0|1,1,0]=3 1784 B8R0.4 CSCCCCOCF 7a_100011217163_100015361967 [1,0,0,0,0,0|1,1,0]=3 1785 B8R0.4 CSCCCNCCO 2230a_100000749238_100000211926 [1,0,0,0,0,0|3,0,0]=4 1786 B8R0.4 CSCCCOCCF 34a_100000690336_100011217306 [1,0,0,0,0,0|3,0,0]=4 1787 B8R0.4 CSCCCOCCF 7a_100000690336_100011217306 [1,0,0,0,0,0|3,0,0]=4 1788 B8R0.4 CSCCCOCCO 34a_100000690336_100000211926 [1,0,0,0,0,0|2,0,0]=3 1789 B8R0.4 CSCCCOCCO 7a_100000690336_100000211926 [1,0,0,0,0,0|2,0,0]=3 1790 B8R0.4 CSCCCOCSC 34a_100000690336_100011218213 [1,0,0,0,0,0|2,1,0]=4 1791 B8R0.4 CSCCNCCCF 2230a_100015189416_100000751147 [1,0,0,0,0,0|2,1,0]=4 1792 B8R0.4 CSCCNCCCF 2230a_100020590264_100011934791 [1,0,0,0,0,0|2,1,0]=4 1793 B8R0.4 CSCCNCCCF 34a_100015189416_100000212216 [1,0,0,0,0,0|2,1,0]=4 1794 B8R0.4 CSCCNCCCO 2230a_100020590264_100000230001 [1,0,0,0,0,0|2,1,0]=4 1795 B8R0.4 CSCCNCCSC 2230a_100020590264_100000751147 [1,0,0,0,0,0|1,2,0]=4 1796 B8R0.4 CSCCOCCC#N 7a_100000230434_100000184422 [1,0,0,0,0,0|1,1,1]=4 1797 B8R0.4 CSCCOCCCBr 34a_100011217188_100000212216 [1,0,0,0,0,0|1,1,0]=3 1798 B8R0.4 CSCCOCCCCl 34a_100000230001_100000212216 [1,0,0,0,0,0|1,1,0]=3 1799 B8R0.4 CSCCOCCCF 34a_100000230434_100011934791 [1,0,0,0,0,0|1,1,0]=3 1800 B8R0.4 CSCCOCCCF 34a_100000759539_100000212216 [1,0,0,0,0,0|1,1,0]=3 1801 B8R0.4 CSCCOCCCF 7a_100000230434_100011934791 [1,0,0,0,0,0|1,1,0]=3 1802 B8R0.4 CSCCOCCCN 34a_100000182051_100000212216 [1,0,0,0,0,0|1,1,0]=3 1803 B8R0.4 CSCCOCCCO 34a_100000230434_100000230001 [1,0,0,0,0,0|1,1,0]=3 1804 B8R0.4 CSCCOCCCO 7a_100000230434_100011215043 [1,0,0,0,0,0|1,1,0]=3 1805 B8R0.4 CSCCOCCON 34a_100000700252_100000212216 [1,0,0,0,0,0|1,1,0]=3 1806 B8R0.4 CSCCOCCSC 34a_100000230434_100000212216 [1,0,0,0,0,0|0,2,0]=3 1807 B8R0.4 CSCCOCCSC 7a_100000230434_100000212216 [1,0,0,0,0,0|0,2,0]=3 1808 B8R0.4 CSCCSCCCF 62a_100000212216_100011934791 [1,0,0,0,0,0|1,2,0]=4 1809 B8R0.4 CSCCSCCCF 62a_100011934791_100000751147 [1,0,0,0,0,0|1,2,0]=4 1810 B8R0.4 CSCCSCCCO 62a_100000212216_100011215043 [1,0,0,0,0,0|1,2,0]=4 1811 B8R0.4 CSCCSCCCO 62a_100011215043_100000751147 [1,0,0,0,0,0|1,2,0]=4 1812 B8R0.4 CSCCSCCSC 62a_100000212216_100000751147 [1,0,0,0,0,0|0,3,0]=4 1813 B8R0.4 CSCOCCCCBr 34a_100011216708_100011218213 [1,0,0,0,0,0|2,1,0]=4 1814 B8R0.4 CSCOCCCCCl 34a_100000210776_100011218213 [1,0,0,0,0,0|2,1,0]=4 1815 B8R0.4 CSCOCCCCF 34a_100011995726_100011218213 [1,0,0,0,0,0|2,1,0]=4 1816 B8R0.4 CSCOCCCCI 34a_200012148704_100011218213 [1,0,0,0,0,0|2,1,0]=4 1817 B8R0.4 CSCOCCCCN 34a_100000750430_100011218213 [1,0,0,0,0,0|2,1,0]=4 1818 B8R0.4 FCCCCOCCBr 34a_100000211926_100000729493 [1,0,0,0,0,0|3,0,0]=4 1819 B8R0.4 FCCCCOCCF 34a_100011995726_100011217306 [1,0,0,0,0,0|3,0,0]=4 1820 B8R0.4 FCCCCOCCF 7a_100011995726_100011217306 [1,0,0,0,0,0|3,0,0]=4 1821 B8R0.4 FCCCOCCCBr 34a_100011217188_100011934791 [1,0,0,0,0,0|3,0,0]=4 1822 B8R0.4 FCCCOCCCCl 34a_100000230001_100011934791 [1,0,0,0,0,0|3,0,0]=4 1823 B8R0.4 FCCCOCCCF 34a_100000759539_100011934791 [1,0,0,0,0,0|3,0,0]=4 1824 B8R0.4 FCCOCCCCBr 34a_100011216708_100011217306 [1,0,0,0,0,0|3,0,0]=4 1825 B8R0.4 FCCOCCCCCl 34a_100000210776_100011217306 [1,0,0,0,0,0|3,0,0]=4 1826 B8R0.4 FCCOCCCCCl 7a_100000210776_100011217306 [1,0,0,0,0,0|3,0,0]=4 1827 B8R0.4 FCCOCCCCI 34a_200012148704_100011217306 [1,0,0,0,0,0|3,0,0]=4 1828 B8R0.4 FCCOCCOCF 34a_200015357709_100015361967 [1,0,0,0,0,0|2,0,0]=3 1829 B8R0.4 FCCOCCOCF 7a_200015357709_100015361967 [1,0,0,0,0,0|2,0,0]=3 1830 B8R0.4 FCOCCCCCBr 34a_100000746331_100015361967 [1,0,0,0,0,0|3,0,0]=4 1831 B8R0.4 FCOCCCCCBr 7a_100000746331_100015361967 [1,0,0,0,0,0|3,0,0]=4 1832 B8R0.4 FCOCCCCCCl 34a_100000746330_100015361967 [1,0,0,0,0,0|3,0,0]=4 1833 B8R0.4 FCOCCCCCCl 7a_100000746330_100015361967 [1,0,0,0,0,0|3,0,0]=4 1834 B8R0.4 FCOCCCCCI 34a_200012148887_100015361967 [1,0,0,0,0,0|3,0,0]=4 1835 B8R0.4 FCOCCCCCI 7a_200012148887_100015361967 [1,0,0,0,0,0|3,0,0]=4 1836 B8R0.4 FCOCCOCCBr 34a_100000692535_100015361967 [1,0,0,0,0,0|2,0,0]=3 1837 B8R0.4 FCOCCOCCBr 7a_100000692535_100015361967 [1,0,0,0,0,0|2,0,0]=3 1838 B8R0.4 FCOCCOCCCl 34a_100011215305_100015361967 [1,0,0,0,0,0|2,0,0]=3 1839 B8R0.4 FCOCCOCCCl 7a_100011215305_100015361967 [1,0,0,0,0,0|2,0,0]=3 1840 B8R0.4 FCOCCOCCI 34a_100012149058_100015361967 [1,0,0,0,0,0|2,0,0]=3 1841 B8R0.4 FCOCCOCCI 7a_100012149058_100015361967 [1,0,0,0,0,0|2,0,0]=3 1842 B8R0.4 NCCCCCOCF 34a_100000762737_100015361967 [1,0,0,0,0,0|3,0,0]=4 1843 B8R0.4 NCCCCOCCF 34a_100000750430_100011217306 [1,0,0,0,0,0|3,0,0]=4 1844 B8R0.4 NCCCCOCCO 34a_100000750430_100000211926 [1,0,0,0,0,0|2,0,0]=3 1845 B8R0.4 NCCCOCCCF 34a_100000182051_100011934791 [1,0,0,0,0,0|3,0,0]=4 1846 B8R0.4 NCCCOCCCO 34a_100000182051_100000230001 [1,0,0,0,0,0|3,0,0]=4 1847 B8R0.4 NCCOCCCCF 34a_100000210304_100000729493 [1,0,0,0,0,0|3,0,0]=4 1848 B8R0.4 NCCOCCCCO 34a_100000210304_100011216708 [1,0,0,0,0,0|3,0,0]=4 1849 B8R0.4 NCCOCCOCF 34a_100000211614_100015361967 [1,0,0,0,0,0|2,0,0]=3 1850 B8R0.4 NOCCOCCCF 34a_100000700252_100011934791 [1,0,0,0,0,0|2,0,0]=3 1851 B8R0.4 NOCCOCCCO 34a_100000700252_100000230001 [1,0,0,0,0,0|2,0,0]=3 1852 B8R0.4 OCCCCCNCF 34a_100000762737_100015361967 [1,0,0,0,0,0|3,0,0]=4 1853 B8R0.4 OCCCCCSCF 62a_100000746330_100015361967 [1,0,0,0,0,0|2,1,0]=4 1854 B8R0.4 OCCCCCSCF 62a_100015361967_100000746330 [1,0,0,0,0,0|2,1,0]=4 1855 B8R0.4 OCCCCNCCO 2230a_100000750430_100000211926 [1,0,0,0,0,0|3,0,0]=4 1856 B8R0.4 OCCCCNCCO 2230a_100016997473_100000210776 [1,0,0,0,0,0|3,0,0]=4 1857 B8R0.4 OCCCCNCCO 34a_100000750430_100000211926 [1,0,0,0,0,0|3,0,0]=4 1858 B8R0.4 OCCCCNCCO 34a_100016990907_100011216708 [1,0,0,0,0,0|3,0,0]=4 1859 B8R0.4 OCCCCOCCBr 34a_100000211926_100011216708 [1,0,0,0,0,0|3,0,0]=4 1860 B8R0.4 OCCCCSCCO 62a_100000210776_100000211926 [1,0,0,0,0,0|2,1,0]=4 1861 B8R0.4 OCCCCSCCO 62a_100000211926_100000210776 [1,0,0,0,0,0|2,1,0]=4 1862 B8R0.4 OCCCOCCCBr 34a_100011217188_100000230001 [1,0,0,0,0,0|3,0,0]=4 1863 B8R0.4 OCCCOCCCCl 34a_100000230001_100000230001 [1,0,0,0,0,0|3,0,0]=4 1864 B8R0.4 OCCCOCCCF 34a_100000759539_100000230001 [1,0,0,0,0,0|3,0,0]=4 1865 B8R0.4 OCCNCCCCF 2230a_100016997473_100000729493 [1,0,0,0,0,0|3,0,0]=4 1866 B8R0.4 OCCNCCCCF 34a_100016990907_100000729493 [1,0,0,0,0,0|3,0,0]=4 1867 B8R0.4 OCCOCC#CCCl 34a_200000047223_100000211926 [1,0,0,0,0,0|2,0,1]=4 1868 B8R0.4 OCCOCCCCBr 34a_100011216708_100000211926 [1,0,0,0,0,0|2,0,0]=3 1869 B8R0.4 OCCOCCCCCl 34a_100000210776_100000211926 [1,0,0,0,0,0|2,0,0]=3 1870 B8R0.4 OCCOCCCCCl 7a_100000210776_100000211926 [1,0,0,0,0,0|2,0,0]=3 1871 B8R0.4 OCCOCCCCF 34a_100011995726_100000211926 [1,0,0,0,0,0|2,0,0]=3 1872 B8R0.4 OCCOCCCCF 7a_100011995726_100000211926 [1,0,0,0,0,0|2,0,0]=3 1873 B8R0.4 OCCOCCCCI 34a_200012148704_100000211926 [1,0,0,0,0,0|2,0,0]=3 1874 B8R0.4 OCCOCCNCF 34a_100000211614_100015361967 [1,0,0,0,0,0|2,0,0]=3 1875 B8R0.4 OCCOCCSCF 62a_100011215305_100015361967 [1,0,0,0,0,0|1,1,0]=3 1876 B8R0.4 OCCOCCSCF 62a_100015361967_100011215305 [1,0,0,0,0,0|1,1,0]=3 1877 B8R0.4 OCCSCCCCF 62a_100000211926_100000729493 [1,0,0,0,0,0|2,1,0]=4 1878 B8R0.4 OCCSCCCCF 62a_100000729493_100000211926 [1,0,0,0,0,0|2,1,0]=4 1879 B8R0.4 [13CH3]NCCCCCCO 2230a_100000686447_200025704644 [1,0,0,0,0,0|3,0,0]=4 1880 B8R0.4 [13CH3]NCCCCCCO 34a_100000686447_200025704644 [1,0,0,0,0,0|3,0,0]=4 1881 B8R0.4 [13CH3]OCCCCCCBr 34a_100011215345_200025704644 [1,0,0,0,0,0|2,0,0]=3 1882 B8R0.4 [13CH3]OCCCCCCBr 7a_100011215345_200025704644 [1,0,0,0,0,0|2,0,0]=3 1883 B8R0.4 [13CH3]OCCCCCCCl 34a_100000766143_200025704644 [1,0,0,0,0,0|2,0,0]=3 1884 B8R0.4 [13CH3]OCCCCCCCl 7a_100000766143_200025704644 [1,0,0,0,0,0|2,0,0]=3 1885 B8R0.4 [13CH3]OCCCCCCF 34a_100000732779_200025704644 [1,0,0,0,0,0|2,0,0]=3 1886 B8R0.4 [13CH3]OCCCCCCF 7a_100000732779_200025704644 [1,0,0,0,0,0|2,0,0]=3 1887 B8R0.4 [13CH3]OCCCCCCN 34a_100000686447_200025704644 [1,0,0,0,0,0|2,0,0]=3 1888 B8R0.4 [13CH3]SCCCCCCF 62a_100015922095_200025704644 [1,0,0,0,0,0|2,1,0]=4 1889 B8R0.4 [13CH3]SCCCCCCF 62a_200025704644_100015922095 [1,0,0,0,0,0|2,1,0]=4 1890 B8R0.4 [13CH3]SCCCCCCO 62a_100000766143_200025704644 [1,0,0,0,0,0|2,1,0]=4 1891 B8R0.4 [13CH3]SCCCCCCO 62a_200025704644_100000766143 [1,0,0,0,0,0|2,1,0]=4 1892 B10R0.1 C#CCC(C)OCCCCC 34a_100000685586_100000718602 [0,1,0,0,0,0|2,0,1]=4 1893 B10R0.1 C#CCC(C)OCCCCC 7a_100000685586_100000210326 [0,1,0,0,0,0|2,0,1]=4 1894 B10R0.1 C#CCC(C)OCCOCC 34a_100000685586_100000210147 [0,1,0,0,0,0|1,0,1]=3 1895 B10R0.1 C#CCC(C)OCCOCC 7a_100000685586_100011215890 [0,1,0,0,0,0|1,0,1]=3 1896 B10R0.1 C#CCC(C)OCCSCC 34a_100000685586_100000757381 [0,1,0,0,0,0|1,1,1]=4 1897 B10R0.1 C#CCC(C)OCCSCC 7a_100000685586_100000757381 [0,1,0,0,0,0|1,1,1]=4 1898 B10R0.1 C#CCCCOC(C)COC 34a_100000215630_100000765312 [0,1,0,0,0,0|1,0,2]=4 1899 B10R0.1 C#CCCCOC(C)COC 7a_100000215630_100000765312 [0,1,0,0,0,0|1,0,2]=4 1900 B10R0.1 C#CCCCO[C@H](C)COC 34a_100011934205_100000695029 [0,1,0,0,0,0|1,0,2]=4 1901 B10R0.1 C#CCCOCC(=O)OCC 34a_100011215631_100000188475 [0,1,0,0,0,0|1,0,2]=4 1902 B10R0.1 C#CCCOCC(C)CCC 34a_100000688023_100000688953 [0,1,0,0,0,0|2,0,1]=4 1903 B10R0.1 C#CCCOCC(C)CCC 34a_100011215631_100011216630 [0,1,0,0,0,0|2,0,1]=4 1904 B10R0.1 C#CCCOCC(C)CCC 7a_100000688023_100000688953 [0,1,0,0,0,0|2,0,1]=4 1905 B10R0.1 C#CCCOC[C@@H](N)CCC 34a_100000732646_100000688953 [0,1,0,0,0,0|2,0,1]=4 1906 B10R0.1 C/C=C/C(C)OCCCCC 34a_200102604097_100000718602 [0,1,0,0,0,0|2,0,1]=4 1907 B10R0.1 C/C=C/C(C)OCCOCC 34a_200102604097_100000210147 [0,1,0,0,0,0|1,0,1]=3 1908 B10R0.1 C/C=C/C(C)OCCSCC 34a_200102604097_100000757381 [0,1,0,0,0,0|1,1,1]=4 1909 B10R0.1 C/C=C/CCOC(C)CCC 34a_100016278192_100000766640 [0,1,0,0,0,0|2,0,1]=4 1910 B10R0.1 C/C=C/CCOC(C)COC 34a_100016278192_100000765312 [0,1,0,0,0,0|1,0,1]=3 1911 B10R0.1 C/C=C/COCC(=O)OCC 34a_100016270725_100000188475 [0,1,0,0,0,0|1,0,2]=4 1912 B10R0.1 C/C=C/COCC(C)CCC 34a_100000688023_100102629194 [0,1,0,0,0,0|2,0,1]=4 1913 B10R0.1 C/C=C/COCC(C)CCC 34a_100016270725_100011216630 [0,1,0,0,0,0|2,0,1]=4 1914 B10R0.1 C/C=C/COCC(C)CCC 7a_100000688023_100102629194 [0,1,0,0,0,0|2,0,1]=4 1915 B10R0.1 C/C=C/COC[C@@H](N)CCC 34a_100000732646_100102629194 [0,1,0,0,0,0|2,0,1]=4 1916 B10R0.1 C=CCC(C)COCCOC 34a_100009832082_100011201679 [0,1,0,0,0,0|1,0,2]=4 1917 B10R0.1 C=CCC(C)COCCOC 7a_100009832082_100000233755 [0,1,0,0,0,0|1,0,2]=4 1918 B10R0.1 C=CCCCOC(C)COC 34a_100000758997_100000765312 [0,1,0,0,0,0|1,0,2]=4 1919 B10R0.1 C=CCCCOC(C)COC 7a_100000758997_100000765312 [0,1,0,0,0,0|1,0,2]=4 1920 B10R0.1 C=CCCCO[C@H](C)COC 34a_100011934205_100000757094 [0,1,0,0,0,0|1,0,2]=4 1921 B10R0.1 C=CCCOCC(=O)OCC 34a_100011205117_100000188475 [0,1,0,0,0,0|1,0,2]=4 1922 B10R0.1 C=CCCOCC(C)CCC 34a_100000688023_100000754431 [0,1,0,0,0,0|2,0,1]=4 1923 B10R0.1 C=CCCOCC(C)CCC 34a_100011205117_100011216630 [0,1,0,0,0,0|2,0,1]=4 1924 B10R0.1 C=CCCOCC(C)CCC 7a_100000688023_100000754431 [0,1,0,0,0,0|2,0,1]=4 1925 B10R0.1 C=CCCOC[C@@H](N)CCC 34a_100000732646_100000754431 [0,1,0,0,0,0|2,0,1]=4 1926 B10R0.1 C=CC[C@@H](C)OCCCCC 34a_100000731007_100000718602 [0,1,0,0,0,0|2,0,1]=4 1927 B10R0.1 C=CC[C@@H](C)OCCCCC 7a_100000731007_100000210326 [0,1,0,0,0,0|2,0,1]=4 1928 B10R0.1 C=CC[C@@H](C)OCCOCC 34a_100000731007_100000210147 [0,1,0,0,0,0|1,0,1]=3 1929 B10R0.1 C=CC[C@@H](C)OCCOCC 7a_100000731007_100011215890 [0,1,0,0,0,0|1,0,1]=3 1930 B10R0.1 C=CC[C@@H](C)OCCSCC 34a_100000731007_100000757381 [0,1,0,0,0,0|1,1,1]=4 1931 B10R0.1 C=CC[C@@H](C)OCCSCC 7a_100000731007_100000757381 [0,1,0,0,0,0|1,1,1]=4 1932 B10R0.1 C=CC[C@@H](N)COCCOC 34a_100020615467_100011201679 [0,1,0,0,0,0|1,0,2]=4 1933 B10R0.1 C=COC(=O)COCCOC 34a_100000210237_100000036128 [0,1,0,0,0,0|0,0,3]=4 1934 B10R0.1 C=COCCN[C@H](C)COC 2230a_100000764878_100000039644 [0,1,0,0,0,0|1,0,2]=4 1935 B10R0.1 C=COCCOC(C)CCC 34a_100000033082_100000766640 [0,1,0,0,0,0|1,0,2]=4 1936 B10R0.1 C=COCCOC(C)CCC 34a_100000764384_100000039644 [0,1,0,0,0,0|1,0,2]=4 1937 B10R0.1 C=COCCOC(C)CCC 7a_100000764384_100000039644 [0,1,0,0,0,0|1,0,2]=4 1938 B10R0.1 C=COCCOC(C)COC 34a_100000033082_100000765312 [0,1,0,0,0,0|0,0,2]=3 1939 B10R0.1 C=COCCO[C@H](C)COC 34a_100011934205_100000039644 [0,1,0,0,0,0|0,0,2]=3 1940 B10R0.1 C=COCCSC(C)COC 62a_100000039644_100000765312 [0,1,0,0,0,0|0,1,2]=4 1941 B10R0.1 C=COCCSC(C)COC 62a_100000765312_100000039644 [0,1,0,0,0,0|0,1,2]=4 1942 B10R0.1 CC#CC(C)OCCCCC 34a_100011216543_100000718602 [0,1,0,0,0,0|2,0,1]=4 1943 B10R0.1 CC#CC(C)OCCOCC 34a_100011216543_100000210147 [0,1,0,0,0,0|1,0,1]=3 1944 B10R0.1 CC#CC(C)OCCSCC 34a_100011216543_100000757381 [0,1,0,0,0,0|1,1,1]=4 1945 B10R0.1 CC#CCCOC(C)CCC 34a_100000750427_100000766640 [0,1,0,0,0,0|2,0,1]=4 1946 B10R0.1 CC#CCCOC(C)COC 34a_100000750427_100000765312 [0,1,0,0,0,0|1,0,1]=3 1947 B10R0.1 CC#CCOCC(=O)OCC 34a_100000761923_100000188475 [0,1,0,0,0,0|1,0,2]=4 1948 B10R0.1 CC#CCOCC(C)CCC 34a_100000688023_100000748600 [0,1,0,0,0,0|2,0,1]=4 1949 B10R0.1 CC#CCOCC(C)CCC 34a_100000761923_100011216630 [0,1,0,0,0,0|2,0,1]=4 1950 B10R0.1 CC#CCOCC(C)CCC 7a_100000688023_100000748600 [0,1,0,0,0,0|2,0,1]=4 1951 B10R0.1 CC#CCOC[C@@H](N)CCC 34a_100000732646_100000748600 [0,1,0,0,0,0|2,0,1]=4 1952 B10R0.1 CC/C=C\CN[C@H](C)COC 2230a_100000764878_100103147603 [0,1,0,0,0,0|2,0,1]=4 1953 B10R0.1 CC/C=C\COC(C)CCC 34a_100000764384_100103147603 [0,1,0,0,0,0|2,0,1]=4 1954 B10R0.1 CC/C=C\COC(C)CCC 34a_100016268518_100000766640 [0,1,0,0,0,0|2,0,1]=4 1955 B10R0.1 CC/C=C\COC(C)CCC 7a_100000764384_100103147603 [0,1,0,0,0,0|2,0,1]=4 1956 B10R0.1 CC/C=C\COC(C)COC 34a_100016268518_100000765312 [0,1,0,0,0,0|1,0,1]=3 1957 B10R0.1 CC/C=C\CO[C@H](C)COC 34a_100011934205_100103147603 [0,1,0,0,0,0|1,0,1]=3 1958 B10R0.1 CC/C=C\CSC(C)COC 62a_100000765312_100103147603 [0,1,0,0,0,0|1,1,1]=4 1959 B10R0.1 CC/C=C\CSC(C)COC 62a_100103147603_100000765312 [0,1,0,0,0,0|1,1,1]=4 1960 B10R0.1 CC=CCOCC(C)CCC 34a_100000688023_100000070051 [0,1,0,0,0,0|2,0,1]=4 1961 B10R0.1 CC=CCOCC(C)CCC 7a_100000688023_100000070051 [0,1,0,0,0,0|2,0,1]=4 1962 B10R0.1 CC=CCOC[C@@H](N)CCC 34a_100000732646_100000070051 [0,1,0,0,0,0|2,0,1]=4 1963 B10R0.1 CCC#CCN[C@H](C)COC 2230a_100000764878_100009813939 [0,1,0,0,0,0|2,0,1]=4 1964 B10R0.1 CCC#CCOC(C)CCC 34a_100000032950_100000766640 [0,1,0,0,0,0|2,0,1]=4 1965 B10R0.1 CCC#CCOC(C)CCC 34a_100000764384_100009813939 [0,1,0,0,0,0|2,0,1]=4 1966 B10R0.1 CCC#CCOC(C)CCC 7a_100000764384_100009813939 [0,1,0,0,0,0|2,0,1]=4 1967 B10R0.1 CCC#CCOC(C)COC 34a_100000032950_100000765312 [0,1,0,0,0,0|1,0,1]=3 1968 B10R0.1 CCC#CCO[C@H](C)COC 34a_100011934205_100009813939 [0,1,0,0,0,0|1,0,1]=3 1969 B10R0.1 CCC#CCSC(C)COC 62a_100000765312_100009813939 [0,1,0,0,0,0|1,1,1]=4 1970 B10R0.1 CCC#CCSC(C)COC 62a_100009813939_100000765312 [0,1,0,0,0,0|1,1,1]=4 1971 B10R0.1 CCCC(=O)CCCCOC 1458a_100000211992_100000755781 [0,1,0,0,0,0|2,0,1]=4 1972 B10R0.1 CCCC(=O)CCCOCC 1458a_100000211992_100012232248 [0,1,0,0,0,0|2,0,1]=4 1973 B10R0.1 CCCC(=O)CNCCOC 2230a_100000209980_100000747444 [0,1,0,0,0,0|2,0,1]=4 1974 B10R0.1 CCCC(=O)COCCOC 1458a_100000211095_100000210303 [0,1,0,0,0,0|1,0,1]=3 1975 B10R0.1 CCCC(=O)COCCSC 7a_100000230434_100000747444 [0,1,0,0,0,0|1,1,1]=4 1976 B10R0.1 CCCC(=O)CSCCOC 62a_100000233755_100000747444 [0,1,0,0,0,0|1,1,1]=4 1977 B10R0.1 CCCC(=O)CSCCOC 62a_100000747444_100000233755 [0,1,0,0,0,0|1,1,1]=4 1978 B10R0.1 CCCC(=O)NCCOCC 11a_100011200944_100000211992 [0,1,0,0,0,0|2,0,1]=4 1979 B10R0.1 CCCC(=O)NCCOCC 1626a_102516460346_100000211992 [0,1,0,0,0,0|2,0,1]=4 1980 B10R0.1 CCCC(=O)NCCOCC 240690a_100011200944_100000211992 [0,1,0,0,0,0|2,0,1]=4 1981 B10R0.1 CCCC(=O)NCCOCC 527a_100011200944_100000211992 [0,1,0,0,0,0|2,0,1]=4 1982 B10R0.1 CCCC(C)CCCOCC 34a_100011713154_100000210202 [0,1,0,0,0,0|2,0,0]=3 1983 B10R0.1 CCCC(C)CCCOCC 7a_100011713154_100000210202 [0,1,0,0,0,0|2,0,0]=3 1984 B10R0.1 CCCC(C)CCCOCF 34a_100011713154_100015361967 [0,1,0,0,0,0|3,0,0]=4 1985 B10R0.1 CCCC(C)CCCOCF 7a_100011713154_100015361967 [0,1,0,0,0,0|3,0,0]=4 1986 B10R0.1 CCCC(C)CNCCOC 2230a_100000209980_100011216630 [0,1,0,0,0,0|2,0,0]=3 1987 B10R0.1 CCCC(C)CNCCOC 270004a_100000209980_100000243154 [0,1,0,0,0,0|2,0,0]=3 1988 B10R0.1 CCCC(C)CNCCSC 2230a_100020590264_100011216630 [0,1,0,0,0,0|2,1,0]=4 1989 B10R0.1 CCCC(C)CNCCSC 270004a_100020590264_100000243154 [0,1,0,0,0,0|2,1,0]=4 1990 B10R0.1 CCCC(C)COCCC#N 7a_100000688023_100000184422 [0,1,0,0,0,0|3,0,0]=4 1991 B10R0.1 CCCC(C)COCCCBr 34a_100011217188_100011216630 [0,1,0,0,0,0|3,0,0]=4 1992 B10R0.1 CCCC(C)COCCCCl 34a_100000230001_100011216630 [0,1,0,0,0,0|3,0,0]=4 1993 B10R0.1 CCCC(C)COCCCF 34a_100000688023_100011934791 [0,1,0,0,0,0|3,0,0]=4 1994 B10R0.1 CCCC(C)COCCCF 34a_100000759539_100011216630 [0,1,0,0,0,0|3,0,0]=4 1995 B10R0.1 CCCC(C)COCCCF 7a_100000688023_100011934791 [0,1,0,0,0,0|3,0,0]=4 1996 B10R0.1 CCCC(C)COCCCN 34a_100000182051_100011216630 [0,1,0,0,0,0|3,0,0]=4 1997 B10R0.1 CCCC(C)COCCCO 34a_100000688023_100000230001 [0,1,0,0,0,0|3,0,0]=4 1998 B10R0.1 CCCC(C)COCCCO 7a_100000688023_100011215043 [0,1,0,0,0,0|3,0,0]=4 1999 B10R0.1 CCCC(C)COCCOC 34a_100000210237_100011216630 [0,1,0,0,0,0|1,0,0]=2 2000 B10R0.1 CCCC(C)COCCOC 34a_100000688023_100011201679 [0,1,0,0,0,0|1,0,0]=2 2001 B10R0.1 CCCC(C)COCCOC 7a_100000688023_100000233755 [0,1,0,0,0,0|1,0,0]=2 2002 B10R0.1 CCCC(C)COCCON 34a_100000700252_100011216630 [0,1,0,0,0,0|2,0,0]=3 2003 B10R0.1 CCCC(C)COCCSC 34a_100000230434_100011216630 [0,1,0,0,0,0|1,1,0]=3 2004 B10R0.1 CCCC(C)COCCSC 34a_100000688023_100000212216 [0,1,0,0,0,0|1,1,0]=3 2005 B10R0.1 CCCC(C)COCCSC 7a_100000230434_100011216630 [0,1,0,0,0,0|1,1,0]=3 2006 B10R0.1 CCCC(C)COCCSC 7a_100000688023_100000212216 [0,1,0,0,0,0|1,1,0]=3 2007 B10R0.1 CCCC(C)CSCCOC 62a_100000233755_100011216630 [0,1,0,0,0,0|1,1,0]=3 2008 B10R0.1 CCCC(C)CSCCOC 62a_100011216630_100000233755 [0,1,0,0,0,0|1,1,0]=3 2009 B10R0.1 CCCC(C)CSCCSC 62a_100000212216_100011216630 [0,1,0,0,0,0|1,2,0]=4 2010 B10R0.1 CCCC(C)CSCCSC 62a_100011216630_100000751147 [0,1,0,0,0,0|1,2,0]=4 2011 B10R0.1 CCCC(C)CSCOCC 62a_100000739092_100011216630 [0,1,0,0,0,0|3,0,0]=4 2012 B10R0.1 CCCC(C)CSCOCC 62a_100011216630_100000739092 [0,1,0,0,0,0|3,0,0]=4 2013 B10R0.1 CCCC(C)NCCCOC 2230a_100000741246_100000740836 [0,1,0,0,0,0|3,0,0]=4 2014 B10R0.1 CCCC(C)NCCCOC 270004a_100150723488_100000211909 [0,1,0,0,0,0|3,0,0]=4 2015 B10R0.1 CCCC(C)NCCCOC 34a_100150723488_100000766640 [0,1,0,0,0,0|3,0,0]=4 2016 B10R0.1 CCCC(C)NCCOCC 2230a_100000741246_100011215890 [0,1,0,0,0,0|2,0,0]=3 2017 B10R0.1 CCCC(C)NCCOCC 2230a_102516460346_100000766640 [0,1,0,0,0,0|2,0,0]=3 2018 B10R0.1 CCCC(C)NCCOCC 270004a_102516460346_100000211909 [0,1,0,0,0,0|2,0,0]=3 2019 B10R0.1 CCCC(C)NCCOCC 34a_102516460346_100000766640 [0,1,0,0,0,0|2,0,0]=3 2020 B10R0.1 CCCC(C)NCCSCC 2230a_100000106463_100000766640 [0,1,0,0,0,0|2,1,0]=4 2021 B10R0.1 CCCC(C)NCCSCC 2230a_100000741246_100000757381 [0,1,0,0,0,0|2,1,0]=4 2022 B10R0.1 CCCC(C)NCCSCC 270004a_100000106463_100000211909 [0,1,0,0,0,0|2,1,0]=4 2023 B10R0.1 CCCC(C)OCCCCBr 34a_100011216708_100000766640 [0,1,0,0,0,0|3,0,0]=4 2024 B10R0.1 CCCC(C)OCCCCCl 34a_100000210776_100000766640 [0,1,0,0,0,0|3,0,0]=4 2025 B10R0.1 CCCC(C)OCCCCCl 7a_100000210776_100000766640 [0,1,0,0,0,0|3,0,0]=4 2026 B10R0.1 CCCC(C)OCCCCF 34a_100000764384_100000729493 [0,1,0,0,0,0|3,0,0]=4 2027 B10R0.1 CCCC(C)OCCCCF 34a_100011995726_100000766640 [0,1,0,0,0,0|3,0,0]=4 2028 B10R0.1 CCCC(C)OCCCCF 7a_100000764384_100000729493 [0,1,0,0,0,0|3,0,0]=4 2029 B10R0.1 CCCC(C)OCCCCF 7a_100011995726_100000766640 [0,1,0,0,0,0|3,0,0]=4 2030 B10R0.1 CCCC(C)OCCCCI 34a_200012148704_100000766640 [0,1,0,0,0,0|3,0,0]=4 2031 B10R0.1 CCCC(C)OCCCCN 34a_100000750430_100000766640 [0,1,0,0,0,0|3,0,0]=4 2032 B10R0.1 CCCC(C)OCCCCO 34a_100000764384_100011216708 [0,1,0,0,0,0|3,0,0]=4 2033 B10R0.1 CCCC(C)OCCCCO 7a_100000764384_100000210776 [0,1,0,0,0,0|3,0,0]=4 2034 B10R0.1 CCCC(C)OCCCNC 34a_100000213112_100000766640 [0,1,0,0,0,0|3,0,0]=4 2035 B10R0.1 CCCC(C)OCCCOC 34a_100000740835_100000766640 [0,1,0,0,0,0|3,0,0]=4 2036 B10R0.1 CCCC(C)OCCCOC 34a_100000764384_100000740836 [0,1,0,0,0,0|3,0,0]=4 2037 B10R0.1 CCCC(C)OCCCOC 7a_100000764384_100000740836 [0,1,0,0,0,0|3,0,0]=4 2038 B10R0.1 CCCC(C)OCCCSC 34a_100000690336_100000766640 [0,1,0,0,0,0|3,0,0]=4 2039 B10R0.1 CCCC(C)OCCCSC 7a_100000690336_100000766640 [0,1,0,0,0,0|3,0,0]=4 2040 B10R0.1 CCCC(C)OCCOCC 34a_100000210136_100000766640 [0,1,0,0,0,0|1,0,0]=2 2041 B10R0.1 CCCC(C)OCCOCC 34a_100000764384_100000210147 [0,1,0,0,0,0|1,0,0]=2 2042 B10R0.1 CCCC(C)OCCOCC 7a_100000210136_100000766640 [0,1,0,0,0,0|1,0,0]=2 2043 B10R0.1 CCCC(C)OCCOCC 7a_100000764384_100011215890 [0,1,0,0,0,0|1,0,0]=2 2044 B10R0.1 CCCC(C)OCCSCC 34a_100000212035_100000766640 [0,1,0,0,0,0|1,1,0]=3 2045 B10R0.1 CCCC(C)OCCSCC 34a_100000764384_100000757381 [0,1,0,0,0,0|1,1,0]=3 2046 B10R0.1 CCCC(C)OCCSCC 7a_100000212035_100000766640 [0,1,0,0,0,0|1,1,0]=3 2047 B10R0.1 CCCC(C)OCCSCC 7a_100000764384_100000757381 [0,1,0,0,0,0|1,1,0]=3 2048 B10R0.1 CCCC(C)SCCCOC 62a_100000709357_100000766640 [0,1,0,0,0,0|3,0,0]=4 2049 B10R0.1 CCCC(C)SCCCOC 62a_100000766640_100000709357 [0,1,0,0,0,0|3,0,0]=4 2050 B10R0.1 CCCC(C)SCCOCC 62a_100000210147_100000766640 [0,1,0,0,0,0|1,1,0]=3 2051 B10R0.1 CCCC(C)SCCOCC 62a_100000766640_100011215890 [0,1,0,0,0,0|1,1,0]=3 2052 B10R0.1 CCCC(C)SCCSCC 62a_100000757381_100000766640 [0,1,0,0,0,0|1,2,0]=4 2053 B10R0.1 CCCC(C)SCCSCC 62a_100000766640_100000757381 [0,1,0,0,0,0|1,2,0]=4 2054 B10R0.1 CCCCCCC(=O)COC 1458a_100000210968_100000210757 [0,1,0,0,0,0|2,0,1]=4 2055 B10R0.1 CCCCCCC(C)NCC 2230a_100000210919_100000210202 [0,1,0,0,0,0|3,0,0]=4 2056 B10R0.1 CCCCCCC(C)NCC 2230a_100015525214_100011215978 [0,1,0,0,0,0|3,0,0]=4 2057 B10R0.1 CCCCCCC(C)NCC 270004a_100015525214_100000210826 [0,1,0,0,0,0|3,0,0]=4 2058 B10R0.1 CCCCCCC(C)NCC 34a_100000210919_100000210202 [0,1,0,0,0,0|3,0,0]=4 2059 B10R0.1 CCCCCCC(C)OCC 34a_100000210265_100000210202 [0,1,0,0,0,0|2,0,0]=3 2060 B10R0.1 CCCCCCC(C)OCC 34a_100121572206_100011215978 [0,1,0,0,0,0|2,0,0]=3 2061 B10R0.1 CCCCCCC(C)OCC 7a_100000210265_100000210202 [0,1,0,0,0,0|2,0,0]=3 2062 B10R0.1 CCCCCCC(C)OCF 34a_100000210265_100015361967 [0,1,0,0,0,0|3,0,0]=4 2063 B10R0.1 CCCCCCC(C)OCF 7a_100000210265_100015361967 [0,1,0,0,0,0|3,0,0]=4 2064 B10R0.1 CCCCCCC(C)SCC 62a_100000210202_100011215978 [0,1,0,0,0,0|2,1,0]=4 2065 B10R0.1 CCCCCCC(C)SCC 62a_100011215978_100000210202 [0,1,0,0,0,0|2,1,0]=4 2066 B10R0.1 CCCCCCN(C)COC 2230a_106256046315_100000766300 [0,1,0,0,0,0|3,0,0]=4 2067 B10R0.1 CCCCCCN(C)COC 269982a_106256046315_100000766300 [0,1,0,0,0,0|3,0,0]=4 2068 B10R0.1 CCCCCNC(=O)COC 11a_100000209983_100000210968 [0,1,0,0,0,0|2,0,1]=4 2069 B10R0.1 CCCCCNC(=O)COC 1626a_100000209983_100000210968 [0,1,0,0,0,0|2,0,1]=4 2070 B10R0.1 CCCCCNC(=O)COC 240690a_100000209983_100000210968 [0,1,0,0,0,0|2,0,1]=4 2071 B10R0.1 CCCCCNC(=O)COC 34a_100138415774_100000230301 [0,1,0,0,0,0|2,0,1]=4 2072 B10R0.1 CCCCCNC(=O)COC 527a_100000209983_100000210968 [0,1,0,0,0,0|2,0,1]=4 2073 B10R0.1 CCCCCNC(C)CCC 2230a_100000209983_100000766640 [0,1,0,0,0,0|3,0,0]=4 2074 B10R0.1 CCCCCNC(C)CCC 2230a_100000741246_100000210326 [0,1,0,0,0,0|3,0,0]=4 2075 B10R0.1 CCCCCNC(C)CCC 270004a_100000209983_100000211909 [0,1,0,0,0,0|3,0,0]=4 2076 B10R0.1 CCCCCNC(C)COC 2230a_100000209983_100000765312 [0,1,0,0,0,0|2,0,0]=3 2077 B10R0.1 CCCCCNC(C)COC 270004a_100000209983_100000749346 [0,1,0,0,0,0|2,0,0]=3 2078 B10R0.1 CCCCCNC(C)CSC 270004a_100000209983_100011216314 [0,1,0,0,0,0|2,1,0]=4 2079 B10R0.1 CCCCCN[C@H](C)COC 2230a_100000764878_100000210326 [0,1,0,0,0,0|2,0,0]=3 2080 B10R0.1 CCCCCOC(C)CC#N 7a_100000210253_100009813641 [0,1,0,0,0,0|3,0,0]=4 2081 B10R0.1 CCCCCOC(C)CCBr 34a_100012276601_100000718602 [0,1,0,0,0,0|3,0,0]=4 2082 B10R0.1 CCCCCOC(C)CCC 34a_100000210253_100000766640 [0,1,0,0,0,0|2,0,0]=3 2083 B10R0.1 CCCCCOC(C)CCC 34a_100000764384_100000718602 [0,1,0,0,0,0|2,0,0]=3 2084 B10R0.1 CCCCCOC(C)CCC 7a_100000210253_100000766640 [0,1,0,0,0,0|2,0,0]=3 2085 B10R0.1 CCCCCOC(C)CCC 7a_100000764384_100000210326 [0,1,0,0,0,0|2,0,0]=3 2086 B10R0.1 CCCCCOC(C)CCO 34a_100000210253_100009893172 [0,1,0,0,0,0|3,0,0]=4 2087 B10R0.1 CCCCCOC(C)CCO 7a_100000210253_100009893172 [0,1,0,0,0,0|3,0,0]=4 2088 B10R0.1 CCCCCOC(C)COC 34a_100000210253_100000765312 [0,1,0,0,0,0|1,0,0]=2 2089 B10R0.1 CCCCCOC(C)COC 7a_100000210253_100000765312 [0,1,0,0,0,0|1,0,0]=2 2090 B10R0.1 CCCCCO[C@H](C)COC 34a_100011934205_100000718602 [0,1,0,0,0,0|1,0,0]=2 2091 B10R0.1 CCCCCSC(C)CCC 62a_100000210326_100000766640 [0,1,0,0,0,0|2,1,0]=4 2092 B10R0.1 CCCCCSC(C)CCC 62a_100000766640_100000210326 [0,1,0,0,0,0|2,1,0]=4 2093 B10R0.1 CCCCCSC(C)COC 62a_100000210326_100000765312 [0,1,0,0,0,0|1,1,0]=3 2094 B10R0.1 CCCCCSC(C)COC 62a_100000765312_100000210326 [0,1,0,0,0,0|1,1,0]=3 2095 B10R0.1 CCCCNCC(=O)OCC 2230a_100000102301_100000188475 [0,1,0,0,0,0|2,0,1]=4 2096 B10R0.1 CCCCNCC(=O)OCC 7a_106832991798_100000188475 [0,1,0,0,0,0|2,0,1]=4 2097 B10R0.1 CCCCNCC(C)CCC 2230a_100000102301_100011216630 [0,1,0,0,0,0|3,0,0]=4 2098 B10R0.1 CCCCNCC(C)CCC 270004a_100000102301_100000243154 [0,1,0,0,0,0|3,0,0]=4 2099 B10R0.1 CCCCNCC(C)CCC 7a_106832991798_100011216630 [0,1,0,0,0,0|3,0,0]=4 2100 B10R0.1 CCCCNCC(O)COC 2230a_100000756049_100000210211 [0,1,0,0,0,0|3,0,0]=4 2101 B10R0.1 CCCCNCC(O)COC 34a_100000756049_100000210210 [0,1,0,0,0,0|3,0,0]=4 2102 B10R0.1 CCCCNCC(O)COC 7a_106832991798_100011215053 [0,1,0,0,0,0|3,0,0]=4 2103 B10R0.1 CCCCOCC(=O)CCC 1458a_100000211992_100011995733 [0,1,0,0,0,0|2,0,1]=4 2104 B10R0.1 CCCCOCC(=O)CCC 1458a_100000757543_100000210303 [0,1,0,0,0,0|2,0,1]=4 2105 B10R0.1 CCCCOCC(=O)CCC 7a_100000210227_100000747444 [0,1,0,0,0,0|2,0,1]=4 2106 B10R0.1 CCCCOCC(=O)NCC 11a_100015525214_100000757543 [0,1,0,0,0,0|2,0,1]=4 2107 B10R0.1 CCCCOCC(=O)NCC 240690a_100015525214_100000757543 [0,1,0,0,0,0|2,0,1]=4 2108 B10R0.1 CCCCOCC(=O)NCC 34a_100000210227_100000183381 [0,1,0,0,0,0|2,0,1]=4 2109 B10R0.1 CCCCOCC(=O)NCC 527a_100015525214_100000757543 [0,1,0,0,0,0|2,0,1]=4 2110 B10R0.1 CCCCOCC(=O)NCC 7a_100000210227_100000183381 [0,1,0,0,0,0|2,0,1]=4 2111 B10R0.1 CCCCOCC(=O)OCC 34a_100000210227_100000188475 [0,1,0,0,0,0|1,0,1]=3 2112 B10R0.1 CCCCOCC(=O)OCC 7a_100000210227_100000188475 [0,1,0,0,0,0|1,0,1]=3 2113 B10R0.1 CCCCOCC(C)CCC 34a_100000210227_100011216630 [0,1,0,0,0,0|2,0,0]=3 2114 B10R0.1 CCCCOCC(C)CCC 34a_100000688023_100000210210 [0,1,0,0,0,0|2,0,0]=3 2115 B10R0.1 CCCCOCC(C)CCC 7a_100000210227_100011216630 [0,1,0,0,0,0|2,0,0]=3 2116 B10R0.1 CCCCOCC(C)CCC 7a_100000688023_100000210211 [0,1,0,0,0,0|2,0,0]=3 2117 B10R0.1 CCCCOCC(C)CCN 34a_106354213184_100000210210 [0,1,0,0,0,0|3,0,0]=4 2118 B10R0.1 CCCCOCC(C)OCC 34a_100011217071_100000210202 [0,1,0,0,0,0|1,0,0]=2 2119 B10R0.1 CCCCOCC(C)OCC 7a_100011217071_100000210202 [0,1,0,0,0,0|1,0,0]=2 2120 B10R0.1 CCCCOCC(C)OCF 34a_100011217071_100015361967 [0,1,0,0,0,0|2,0,0]=3 2121 B10R0.1 CCCCOCC(C)OCF 7a_100011217071_100015361967 [0,1,0,0,0,0|2,0,0]=3 2122 B10R0.1 CCCCOCC(N)COC 34a_100000724102_100000210210 [0,1,0,0,0,0|3,0,0]=4 2123 B10R0.1 CCCCOCC(O)COC 34a_100000210227_100011215053 [0,1,0,0,0,0|3,0,0]=4 2124 B10R0.1 CCCCOCC(O)COC 7a_100000210227_100011215053 [0,1,0,0,0,0|3,0,0]=4 2125 B10R0.1 CCCCOCN(C)CCC 2230a_100000747261_100011995733 [0,1,0,0,0,0|3,0,0]=4 2126 B10R0.1 CCCCOCN(C)CCC 269982a_100000747261_100011995733 [0,1,0,0,0,0|3,0,0]=4 2127 B10R0.1 CCCCOC[C@@H](N)CCC 34a_100000732646_100000210210 [0,1,0,0,0,0|2,0,0]=3 2128 B10R0.1 CCCCSCC(=O)OCC 62a_100000188475_100000210210 [0,1,0,0,0,0|1,1,1]=4 2129 B10R0.1 CCCCSCC(=O)OCC 62a_100000210211_100000188475 [0,1,0,0,0,0|1,1,1]=4 2130 B10R0.1 CCCCSCC(C)CCC 62a_100000210211_100011216630 [0,1,0,0,0,0|2,1,0]=4 2131 B10R0.1 CCCCSCC(C)CCC 62a_100011216630_100000210210 [0,1,0,0,0,0|2,1,0]=4 2132 B10R0.1 CCCCSCC(O)COC 62a_100000210211_100011215053 [0,1,0,0,0,0|3,0,0]=4 2133 B10R0.1 CCCCSCC(O)COC 62a_100011215053_100000210210 [0,1,0,0,0,0|3,0,0]=4 2134 B10R0.1 CCCN(C)CCCCOC 2230a_100000747261_100000730899 [0,1,0,0,0,0|3,0,0]=4 2135 B10R0.1 CCCN(C)CCCCOC 269982a_100000747261_100000730899 [0,1,0,0,0,0|3,0,0]=4 2136 B10R0.1 CCCN(C)CCCOCC 2230a_100000747261_100012232248 [0,1,0,0,0,0|3,0,0]=4 2137 B10R0.1 CCCN(C)CCCOCC 269982a_100000747261_100012232248 [0,1,0,0,0,0|3,0,0]=4 2138 B10R0.1 CCCN(C)COCCOC 2230a_100000747261_100000231047 [0,1,0,0,0,0|2,0,0]=3 2139 B10R0.1 CCCN(C)COCCOC 269982a_100000747261_100000231047 [0,1,0,0,0,0|2,0,0]=3 2140 B10R0.1 CCC[C@H](N)COCCCF 34a_100000732646_100011934791 [0,1,0,0,0,0|3,0,0]=4 2141 B10R0.1 CCC[C@H](N)COCCCO 34a_100000732646_100000230001 [0,1,0,0,0,0|3,0,0]=4 2142 B10R0.1 CCC[C@H](N)COCCOC 34a_100000732646_100011201679 [0,1,0,0,0,0|1,0,0]=2 2143 B10R0.1 CCC[C@H](N)COCCSC 34a_100000732646_100000212216 [0,1,0,0,0,0|1,1,0]=3 2144 B10R0.1 CCNC(=O)CNCCOC 2230a_100000209980_100000183381 [0,1,0,0,0,0|2,0,1]=4 2145 B10R0.1 CCNC(=O)CNCCOC 2230a_100016988866_100011201679 [0,1,0,0,0,0|2,0,1]=4 2146 B10R0.1 CCNC(=O)COCCOC 11a_100015525214_100000211095 [0,1,0,0,0,0|1,0,1]=3 2147 B10R0.1 CCNC(=O)COCCOC 240690a_100015525214_100000211095 [0,1,0,0,0,0|1,0,1]=3 2148 B10R0.1 CCNC(=O)COCCOC 34a_100000210237_100000183381 [0,1,0,0,0,0|1,0,1]=3 2149 B10R0.1 CCNC(=O)COCCOC 527a_100015525214_100000211095 [0,1,0,0,0,0|1,0,1]=3 2150 B10R0.1 CCNC(=O)COCCON 34a_100000700252_100000183381 [0,1,0,0,0,0|2,0,1]=4 2151 B10R0.1 CCNC(=O)COCCSC 34a_100000230434_100000183381 [0,1,0,0,0,0|1,1,1]=4 2152 B10R0.1 CCNC(=O)COCCSC 7a_100000230434_100000183381 [0,1,0,0,0,0|1,1,1]=4 2153 B10R0.1 CCNC(=O)CSCCOC 62a_100000183381_100000233755 [0,1,0,0,0,0|1,1,1]=4 2154 B10R0.1 CCNC(=O)CSCCOC 62a_100000233755_100000183381 [0,1,0,0,0,0|1,1,1]=4 2155 B10R0.1 CCOC(=O)CCCCNC 2230a_106832991635_100000750268 [0,1,0,0,0,0|2,0,1]=4 2156 B10R0.1 CCOC(=O)CCCCNC 34a_100102657272_100000750268 [0,1,0,0,0,0|2,0,1]=4 2157 B10R0.1 CCOC(=O)CCCCNC 7a_106832991635_100000750268 [0,1,0,0,0,0|2,0,1]=4 2158 B10R0.1 CCOC(=O)CCCCOC 34a_100138415774_100000750268 [0,1,0,0,0,0|1,0,1]=3 2159 B10R0.1 CCOC(=O)CCCCSC 62a_100000750268_200000210301 [0,1,0,0,0,0|1,1,1]=4 2160 B10R0.1 CCOC(=O)CCCCSC 62a_200000210301_100000750268 [0,1,0,0,0,0|1,1,1]=4 2161 B10R0.1 CCOC(=O)CCCCS[13CH3] 62a_100000750268_200025704644 [0,1,0,0,0,0|1,1,1]=4 2162 B10R0.1 CCOC(=O)CCCCS[13CH3] 62a_200025704644_100000750268 [0,1,0,0,0,0|1,1,1]=4 2163 B10R0.1 CCOC(=O)CCSCOC 62a_100000765890_100000766300 [0,1,0,0,0,0|2,0,1]=4 2164 B10R0.1 CCOC(=O)CCSCOC 62a_100000766300_100000765890 [0,1,0,0,0,0|2,0,1]=4 2165 B10R0.1 CCOC(=O)CNCCOC 2230a_100000209980_100000188475 [0,1,0,0,0,0|1,0,1]=3 2166 B10R0.1 CCOC(=O)CNCCSC 2230a_100020590264_100000188475 [0,1,0,0,0,0|1,1,1]=4 2167 B10R0.1 CCOC(=O)COCCCBr 34a_100011217188_100000188475 [0,1,0,0,0,0|2,0,1]=4 2168 B10R0.1 CCOC(=O)COCCCCl 34a_100000230001_100000188475 [0,1,0,0,0,0|2,0,1]=4 2169 B10R0.1 CCOC(=O)COCCCF 34a_100000759539_100000188475 [0,1,0,0,0,0|2,0,1]=4 2170 B10R0.1 CCOC(=O)COCCCN 34a_100000182051_100000188475 [0,1,0,0,0,0|2,0,1]=4 2171 B10R0.1 CCOC(=O)COCCNC 2230a_106832991635_100000088970 [0,1,0,0,0,0|1,0,1]=3 2172 B10R0.1 CCOC(=O)COCCNC 34a_100102657272_100000088970 [0,1,0,0,0,0|1,0,1]=3 2173 B10R0.1 CCOC(=O)COCCNC 7a_106832991635_100000088970 [0,1,0,0,0,0|1,0,1]=3 2174 B10R0.1 CCOC(=O)COCCOC 34a_100000210237_100000188475 [0,1,0,0,0,0|0,0,1]=2 2175 B10R0.1 CCOC(=O)COCCOC 34a_100138415774_100000088970 [0,1,0,0,0,0|0,0,1]=2 2176 B10R0.1 CCOC(=O)COCCON 34a_100000700252_100000188475 [0,1,0,0,0,0|1,0,1]=3 2177 B10R0.1 CCOC(=O)COCCSC 34a_100000230434_100000188475 [0,1,0,0,0,0|0,1,1]=3 2178 B10R0.1 CCOC(=O)COCCSC 62a_100000088970_200000210301 [0,1,0,0,0,0|0,1,1]=3 2179 B10R0.1 CCOC(=O)COCCSC 62a_200000210301_100000088970 [0,1,0,0,0,0|0,1,1]=3 2180 B10R0.1 CCOC(=O)COCCSC 7a_100000230434_100000188475 [0,1,0,0,0,0|0,1,1]=3 2181 B10R0.1 CCOC(=O)COCCS[13CH3] 62a_100000088970_200025704644 [0,1,0,0,0,0|0,1,1]=3 2182 B10R0.1 CCOC(=O)COCCS[13CH3] 62a_200025704644_100000088970 [0,1,0,0,0,0|0,1,1]=3 2183 B10R0.1 CCOC(=O)CSCCOC 62a_100000188475_100000233755 [0,1,0,0,0,0|0,1,1]=3 2184 B10R0.1 CCOC(=O)CSCCOC 62a_100000233755_100000188475 [0,1,0,0,0,0|0,1,1]=3 2185 B10R0.1 CCOC(=O)CSCCOC 7a_200000230590_200000210301 [0,1,0,0,0,0|0,1,1]=3 2186 B10R0.1 CCOC(=O)CSCCO[13CH3] 7a_200000230590_200025704644 [0,1,0,0,0,0|0,1,1]=3 2187 B10R0.1 CCOC(=O)CSCCSC 62a_100000188475_100000751147 [0,1,0,0,0,0|0,2,1]=4 2188 B10R0.1 CCOC(=O)CSCCSC 62a_100000212216_100000188475 [0,1,0,0,0,0|0,2,1]=4 2189 B10R0.1 CCOCCCC(=O)COC 1458a_100000210968_100012232248 [0,1,0,0,0,0|1,0,1]=3 2190 B10R0.1 CCOCCCC(=O)CSC 1458a_100000184570_100012232248 [0,1,0,0,0,0|1,1,1]=4 2191 B10R0.1 CCOCCNC(=O)COC 11a_100011200944_100000210968 [0,1,0,0,0,0|1,0,1]=3 2192 B10R0.1 CCOCCNC(=O)COC 1626a_102516460346_100000210968 [0,1,0,0,0,0|1,0,1]=3 2193 B10R0.1 CCOCCNC(=O)COC 240690a_100011200944_100000210968 [0,1,0,0,0,0|1,0,1]=3 2194 B10R0.1 CCOCCNC(=O)COC 527a_100011200944_100000210968 [0,1,0,0,0,0|1,0,1]=3 2195 B10R0.1 CCOCCNC(=O)CSC 11a_100011200944_100000184570 [0,1,0,0,0,0|1,1,1]=4 2196 B10R0.1 CCOCCNC(=O)CSC 1626a_102516460346_100000184570 [0,1,0,0,0,0|1,1,1]=4 2197 B10R0.1 CCOCCNC(=O)CSC 240690a_100011200944_100000184570 [0,1,0,0,0,0|1,1,1]=4 2198 B10R0.1 CCOCCNC(=O)CSC 527a_100011200944_100000184570 [0,1,0,0,0,0|1,1,1]=4 2199 B10R0.1 CCOCCNC(C)CC#N 2230a_102516460346_100009813641 [0,1,0,0,0,0|3,0,0]=4 2200 B10R0.1 CCOCCNC(C)CCO 2230a_102516460346_100009893172 [0,1,0,0,0,0|3,0,0]=4 2201 B10R0.1 CCOCCNC(C)CCO 34a_102516460346_100009893172 [0,1,0,0,0,0|3,0,0]=4 2202 B10R0.1 CCOCCNC(C)COC 2230a_102516460346_100000765312 [0,1,0,0,0,0|1,0,0]=2 2203 B10R0.1 CCOCCNC(C)COC 270004a_102516460346_100000749346 [0,1,0,0,0,0|1,0,0]=2 2204 B10R0.1 CCOCCNC(C)COC 34a_102516460346_100000765312 [0,1,0,0,0,0|1,0,0]=2 2205 B10R0.1 CCOCCNC(C)CSC 270004a_102516460346_100011216314 [0,1,0,0,0,0|1,1,0]=3 2206 B10R0.1 CCOCCN[C@@H](C)CC#N 2230a_100016994482_100011215890 [0,1,0,0,0,0|3,0,0]=4 2207 B10R0.1 CCOCCN[C@H](C)CCO 2230a_100000706166_100011215890 [0,1,0,0,0,0|3,0,0]=4 2208 B10R0.1 CCOCCN[C@H](C)CCO 34a_100000706166_100000210147 [0,1,0,0,0,0|3,0,0]=4 2209 B10R0.1 CCOCCN[C@H](C)COC 2230a_100000764878_100011215890 [0,1,0,0,0,0|1,0,0]=2 2210 B10R0.1 CCOCCOC(=O)CNC 2230a_106832991635_200000101388 [0,1,0,0,0,0|1,0,1]=3 2211 B10R0.1 CCOCCOC(=O)CNC 34a_100102657272_200000101388 [0,1,0,0,0,0|1,0,1]=3 2212 B10R0.1 CCOCCOC(=O)CNC 7a_106832991635_200000101388 [0,1,0,0,0,0|1,0,1]=3 2213 B10R0.1 CCOCCOC(=O)COC 34a_100138415774_200000101388 [0,1,0,0,0,0|0,0,1]=2 2214 B10R0.1 CCOCCOC(=O)CSC 62a_200000101388_200000210301 [0,1,0,0,0,0|0,1,1]=3 2215 B10R0.1 CCOCCOC(=O)CSC 62a_200000210301_200000101388 [0,1,0,0,0,0|0,1,1]=3 2216 B10R0.1 CCOCCOC(=O)CS[13CH3] 62a_200000101388_200025704644 [0,1,0,0,0,0|0,1,1]=3 2217 B10R0.1 CCOCCOC(=O)CS[13CH3] 62a_200025704644_200000101388 [0,1,0,0,0,0|0,1,1]=3 2218 B10R0.1 CCOCCOC(C)CC#N 7a_100000210136_100009813641 [0,1,0,0,0,0|2,0,0]=3 2219 B10R0.1 CCOCCOC(C)CCBr 34a_100012276601_100000210147 [0,1,0,0,0,0|2,0,0]=3 2220 B10R0.1 CCOCCOC(C)CCO 34a_100000210136_100009893172 [0,1,0,0,0,0|2,0,0]=3 2221 B10R0.1 CCOCCOC(C)CCO 7a_100000210136_100009893172 [0,1,0,0,0,0|2,0,0]=3 2222 B10R0.1 CCOCCOC(C)COC 34a_100000210136_100000765312 [0,1,0,0,0,0|0,0,0]=1 2223 B10R0.1 CCOCCOC(C)COC 7a_100000210136_100000765312 [0,1,0,0,0,0|0,0,0]=1 2224 B10R0.1 CCOCCO[C@H](C)COC 34a_100011934205_100000210147 [0,1,0,0,0,0|0,0,0]=1 2225 B10R0.1 CCOCCSC(C)CC#N 62a_100000210147_100009813641 [0,1,0,0,0,0|2,1,0]=4 2226 B10R0.1 CCOCCSC(C)CC#N 62a_100009813641_100011215890 [0,1,0,0,0,0|2,1,0]=4 2227 B10R0.1 CCOCCSC(C)CCO 62a_100000210147_100009893172 [0,1,0,0,0,0|2,1,0]=4 2228 B10R0.1 CCOCCSC(C)CCO 62a_100009893172_100011215890 [0,1,0,0,0,0|2,1,0]=4 2229 B10R0.1 CCOCCSC(C)COC 62a_100000210147_100000765312 [0,1,0,0,0,0|0,1,0]=2 2230 B10R0.1 CCOCCSC(C)COC 62a_100000765312_100011215890 [0,1,0,0,0,0|0,1,0]=2 2231 B10R0.1 CCOCSCC(O)COC 62a_100000739092_100011215053 [0,1,0,0,0,0|2,0,0]=3 2232 B10R0.1 CCOCSCC(O)COC 62a_100011215053_100000739092 [0,1,0,0,0,0|2,0,0]=3 2233 B10R0.1 CCSCCNC(=O)COC 11a_100000106463_100000210968 [0,1,0,0,0,0|1,1,1]=4 2234 B10R0.1 CCSCCNC(=O)COC 1626a_100000106463_100000210968 [0,1,0,0,0,0|1,1,1]=4 2235 B10R0.1 CCSCCNC(=O)COC 240690a_100000106463_100000210968 [0,1,0,0,0,0|1,1,1]=4 2236 B10R0.1 CCSCCNC(=O)COC 527a_100000106463_100000210968 [0,1,0,0,0,0|1,1,1]=4 2237 B10R0.1 CCSCCNC(C)COC 2230a_100000106463_100000765312 [0,1,0,0,0,0|1,1,0]=3 2238 B10R0.1 CCSCCNC(C)COC 270004a_100000106463_100000749346 [0,1,0,0,0,0|1,1,0]=3 2239 B10R0.1 CCSCCNC(C)CSC 270004a_100000106463_100011216314 [0,1,0,0,0,0|1,2,0]=4 2240 B10R0.1 CCSCCN[C@H](C)COC 2230a_100000764878_100000757381 [0,1,0,0,0,0|1,1,0]=3 2241 B10R0.1 CCSCCOC(C)CC#N 7a_100000212035_100009813641 [0,1,0,0,0,0|2,1,0]=4 2242 B10R0.1 CCSCCOC(C)CCBr 34a_100012276601_100000757381 [0,1,0,0,0,0|2,1,0]=4 2243 B10R0.1 CCSCCOC(C)CCO 34a_100000212035_100009893172 [0,1,0,0,0,0|2,1,0]=4 2244 B10R0.1 CCSCCOC(C)CCO 7a_100000212035_100009893172 [0,1,0,0,0,0|2,1,0]=4 2245 B10R0.1 CCSCCOC(C)COC 34a_100000212035_100000765312 [0,1,0,0,0,0|0,1,0]=2 2246 B10R0.1 CCSCCOC(C)COC 7a_100000212035_100000765312 [0,1,0,0,0,0|0,1,0]=2 2247 B10R0.1 CCSCCO[C@H](C)COC 34a_100011934205_100000757381 [0,1,0,0,0,0|0,1,0]=2 2248 B10R0.1 CCSCCSC(C)COC 62a_100000757381_100000765312 [0,1,0,0,0,0|0,2,0]=3 2249 B10R0.1 CCSCCSC(C)COC 62a_100000765312_100000757381 [0,1,0,0,0,0|0,2,0]=3 2250 B10R0.1 CNCCCOC(C)COC 34a_100000213112_100000765312 [0,1,0,0,0,0|2,0,0]=3 2251 B10R0.1 CNNC(=O)COCCOC 22a_100016993582_100000211095 [0,1,0,0,0,0|2,0,1]=4 2252 B10R0.1 COCC(C)NCCCCO 2230a_100000750430_100000765312 [0,1,0,0,0,0|3,0,0]=4 2253 B10R0.1 COCC(C)NCCCCO 270004a_100000750430_100000749346 [0,1,0,0,0,0|3,0,0]=4 2254 B10R0.1 COCC(C)NCCCCO 34a_100000750430_100000765312 [0,1,0,0,0,0|3,0,0]=4 2255 B10R0.1 COCC(C)NCCCSC 2230a_100000749238_100000765312 [0,1,0,0,0,0|3,0,0]=4 2256 B10R0.1 COCC(C)NCCCSC 270004a_100000749238_100000749346 [0,1,0,0,0,0|3,0,0]=4 2257 B10R0.1 COCC(C)OCC#CCCl 34a_200000047223_100000765312 [0,1,0,0,0,0|2,0,1]=4 2258 B10R0.1 COCC(C)OCCCCBr 34a_100011216708_100000765312 [0,1,0,0,0,0|2,0,0]=3 2259 B10R0.1 COCC(C)OCCCCCl 34a_100000210776_100000765312 [0,1,0,0,0,0|2,0,0]=3 2260 B10R0.1 COCC(C)OCCCCCl 7a_100000210776_100000765312 [0,1,0,0,0,0|2,0,0]=3 2261 B10R0.1 COCC(C)OCCCCF 34a_100011995726_100000765312 [0,1,0,0,0,0|2,0,0]=3 2262 B10R0.1 COCC(C)OCCCCF 7a_100011995726_100000765312 [0,1,0,0,0,0|2,0,0]=3 2263 B10R0.1 COCC(C)OCCCCI 34a_200012148704_100000765312 [0,1,0,0,0,0|2,0,0]=3 2264 B10R0.1 COCC(C)OCCCCN 34a_100000750430_100000765312 [0,1,0,0,0,0|2,0,0]=3 2265 B10R0.1 COCC(C)OCCCSC 34a_100000690336_100000765312 [0,1,0,0,0,0|2,0,0]=3 2266 B10R0.1 COCC(C)OCCCSC 7a_100000690336_100000765312 [0,1,0,0,0,0|2,0,0]=3 2267 B10R0.1 COCC(C)SCCCCF 62a_100000729493_100000765312 [0,1,0,0,0,0|2,1,0]=4 2268 B10R0.1 COCC(C)SCCCCF 62a_100000765312_100000729493 [0,1,0,0,0,0|2,1,0]=4 2269 B10R0.1 COCC(C)SCCCCO 62a_100000210776_100000765312 [0,1,0,0,0,0|2,1,0]=4 2270 B10R0.1 COCC(C)SCCCCO 62a_100000765312_100000210776 [0,1,0,0,0,0|2,1,0]=4 2271 B10R0.1 COCC(N)COCCSC 34a_100000724102_100000212216 [0,1,0,0,0,0|2,1,0]=4 2272 B10R0.1 COCC(O)COCCON 34a_100000700252_100011215053 [0,1,0,0,0,0|3,0,0]=4 2273 B10R0.1 COCC(O)COCCSC 34a_100000230434_100011215053 [0,1,0,0,0,0|2,1,0]=4 2274 B10R0.1 COCC(O)COCCSC 7a_100000230434_100011215053 [0,1,0,0,0,0|2,1,0]=4 2275 B10R0.1 COCCCNC(C)COC 270004a_100150723488_100000749346 [0,1,0,0,0,0|3,0,0]=4 2276 B10R0.1 COCCCNC(C)COC 34a_100150723488_100000765312 [0,1,0,0,0,0|3,0,0]=4 2277 B10R0.1 COCCCN[C@H](C)COC 2230a_100000764878_100000740836 [0,1,0,0,0,0|3,0,0]=4 2278 B10R0.1 COCCCOC(C)COC 34a_100000740835_100000765312 [0,1,0,0,0,0|2,0,0]=3 2279 B10R0.1 COCCCO[C@H](C)COC 34a_100011934205_100000740836 [0,1,0,0,0,0|2,0,0]=3 2280 B10R0.1 COCCCSC(C)COC 62a_100000709357_100000765312 [0,1,0,0,0,0|2,1,0]=4 2281 B10R0.1 COCCCSC(C)COC 62a_100000765312_100000709357 [0,1,0,0,0,0|2,1,0]=4 2282 B10R0.1 COCCNCC(O)COC 2230a_100000756049_100011201679 [0,1,0,0,0,0|3,0,0]=4 2283 B10R0.1 COCCNCC(O)COC 34a_100000756049_100011201679 [0,1,0,0,0,0|3,0,0]=4 2284 B10R0.1 COCCOCC(=O)CCF 1458a_100000211095_100011217306 [0,1,0,0,0,0|2,0,1]=4 2285 B10R0.1 COCCOCC(=O)CCO 1458a_100000211095_100000211926 [0,1,0,0,0,0|2,0,1]=4 2286 B10R0.1 COCCOCC(=O)NCO 34a_100000210237_100000185155 [0,1,0,0,0,0|2,0,1]=4 2287 B10R0.1 COCCOCC(C)CCN 34a_106354213184_100011201679 [0,1,0,0,0,0|2,0,0]=3 2288 B10R0.1 COCCOCC(N)COC 34a_100000724102_100011201679 [0,1,0,0,0,0|2,0,0]=3 2289 B10R0.1 COCCOCC(O)COC 34a_100000210237_100011215053 [0,1,0,0,0,0|2,0,0]=3 2290 B10R0.1 COCCOCN(C)CCO 2230a_100000210263_100000231047 [0,1,0,0,0,0|3,0,0]=4 2291 B10R0.1 COCCOCN(C)CCO 269982a_100000210263_100000231047 [0,1,0,0,0,0|3,0,0]=4 2292 B10R0.1 COCCSCC(O)COC 62a_100000233755_100011215053 [0,1,0,0,0,0|2,1,0]=4 2293 B10R0.1 COCCSCC(O)COC 62a_100011215053_100000233755 [0,1,0,0,0,0|2,1,0]=4 2294 B10R0.1 COC[C@@H](C)NCCCCF 2230a_100000764878_100000729493 [0,1,0,0,0,0|3,0,0]=4 2295 B10R0.1 COC[C@@H](C)NCCCCO 2230a_100000764878_100000210776 [0,1,0,0,0,0|3,0,0]=4 2296 B10R0.1 COC[C@@H](C)OCC#CCO 34a_100011934205_200000047223 [0,1,0,0,0,0|2,0,1]=4 2297 B10R0.1 COC[C@@H](C)OCCCCF 34a_100011934205_100000729493 [0,1,0,0,0,0|2,0,0]=3 2298 B10R0.1 COC[C@@H](C)OCCCCO 34a_100011934205_100011216708 [0,1,0,0,0,0|2,0,0]=3 2299 B10R0.1 CSCCOCC(C)CCN 34a_106354213184_100000212216 [0,1,0,0,0,0|2,1,0]=4 2300 B10R0.4 C#CCCCCCOC(C)C 34a_100000212225_100012094781 [0,1,0,0,0,0|2,0,1]=4 2301 B10R0.4 C#CCCCCCOC(C)C 34a_100000766912_100000210206 [0,1,0,0,0,0|2,0,1]=4 2302 B10R0.4 C#CCCCCCOC(C)C 7a_100000766912_100000210206 [0,1,0,0,0,0|2,0,1]=4 2303 B10R0.4 C#CCCNCCOC(C)C 2230a_100000701111_100000688953 [0,1,0,0,0,0|2,0,1]=4 2304 B10R0.4 C#CCCNCCOC(C)C 34a_100000701111_100000688953 [0,1,0,0,0,0|2,0,1]=4 2305 B10R0.4 C#CCCNCCOC(C)C 34a_100000755551_100000211751 [0,1,0,0,0,0|2,0,1]=4 2306 B10R0.4 C#CCCOCCCC(C)C 34a_100000210774_100000688953 [0,1,0,0,0,0|2,0,1]=4 2307 B10R0.4 C#CCCOCCCC(C)C 34a_100011215631_100011214892 [0,1,0,0,0,0|2,0,1]=4 2308 B10R0.4 C#CCCOCCCC(C)C 7a_100000210774_100000688953 [0,1,0,0,0,0|2,0,1]=4 2309 B10R0.4 C#CCCOCCCC(C)O 34a_100011215631_200000718107 [0,1,0,0,0,0|2,0,1]=4 2310 B10R0.4 C#CCCOCCNC(C)C 34a_100000224655_100000688953 [0,1,0,0,0,0|2,0,1]=4 2311 B10R0.4 C#CCCOCCOC(=O)C 34a_100011215631_100009814007 [0,1,0,0,0,0|1,0,2]=4 2312 B10R0.4 C#CCCOCCOC(C)C 34a_100000211219_100000688953 [0,1,0,0,0,0|1,0,1]=3 2313 B10R0.4 C#CCCOCCOC(C)C 34a_100011215631_100000211751 [0,1,0,0,0,0|1,0,1]=3 2314 B10R0.4 C#CCCOCCOC(C)C 7a_100000211219_100000688953 [0,1,0,0,0,0|1,0,1]=3 2315 B10R0.4 C#CCCOCCSC(C)C 34a_100011215631_100000730970 [0,1,0,0,0,0|1,1,1]=4 2316 B10R0.4 C#CCCOCCSC(C)C 34a_200011212901_100000688953 [0,1,0,0,0,0|1,1,1]=4 2317 B10R0.4 C#CCCOCCSC(C)C 7a_200011212901_100000688953 [0,1,0,0,0,0|1,1,1]=4 2318 B10R0.4 C#CCCSCCOC(C)C 62a_100000211751_100000688953 [0,1,0,0,0,0|1,1,1]=4 2319 B10R0.4 C#CCCSCCOC(C)C 62a_100000688953_100000211751 [0,1,0,0,0,0|1,1,1]=4 2320 B10R0.4 C/C=C/CCOCCC(C)C 34a_100016278192_100000210312 [0,1,0,0,0,0|2,0,1]=4 2321 B10R0.4 C/C=C/CCOCCC(C)O 34a_100016278192_100012276601 [0,1,0,0,0,0|2,0,1]=4 2322 B10R0.4 C/C=C/CNCCOC(C)C 34a_100000701111_100102629194 [0,1,0,0,0,0|2,0,1]=4 2323 B10R0.4 C/C=C/COCCCC(C)C 34a_100000210774_100102629194 [0,1,0,0,0,0|2,0,1]=4 2324 B10R0.4 C/C=C/COCCCC(C)C 34a_100016270725_100011214892 [0,1,0,0,0,0|2,0,1]=4 2325 B10R0.4 C/C=C/COCCCC(C)C 7a_100000210774_100102629194 [0,1,0,0,0,0|2,0,1]=4 2326 B10R0.4 C/C=C/COCCCC(C)O 34a_100016270725_200000718107 [0,1,0,0,0,0|2,0,1]=4 2327 B10R0.4 C/C=C/COCCNC(C)C 34a_100000224655_100102629194 [0,1,0,0,0,0|2,0,1]=4 2328 B10R0.4 C/C=C/COCCOC(=O)C 34a_100016270725_100009814007 [0,1,0,0,0,0|1,0,2]=4 2329 B10R0.4 C/C=C/COCCOC(C)C 34a_100000211219_100102629194 [0,1,0,0,0,0|1,0,1]=3 2330 B10R0.4 C/C=C/COCCOC(C)C 34a_100016270725_100000211751 [0,1,0,0,0,0|1,0,1]=3 2331 B10R0.4 C/C=C/COCCOC(C)C 7a_100000211219_100102629194 [0,1,0,0,0,0|1,0,1]=3 2332 B10R0.4 C/C=C/COCCSC(C)C 34a_100016270725_100000730970 [0,1,0,0,0,0|1,1,1]=4 2333 B10R0.4 C/C=C/COCCSC(C)C 34a_200011212901_100102629194 [0,1,0,0,0,0|1,1,1]=4 2334 B10R0.4 C/C=C/COCCSC(C)C 7a_200011212901_100102629194 [0,1,0,0,0,0|1,1,1]=4 2335 B10R0.4 C/C=C/CSCCOC(C)C 62a_100000211751_100102629194 [0,1,0,0,0,0|1,1,1]=4 2336 B10R0.4 C/C=C/CSCCOC(C)C 62a_100102629194_100000211751 [0,1,0,0,0,0|1,1,1]=4 2337 B10R0.4 C=C(Br)CCOCCCCC 34a_100009813270_100000718602 [0,1,0,0,0,0|2,0,1]=4 2338 B10R0.4 C=C(Br)CCOCCOCC 34a_100009813270_100000210147 [0,1,0,0,0,0|1,0,1]=3 2339 B10R0.4 C=C(Br)CCOCCSCC 34a_100009813270_100000757381 [0,1,0,0,0,0|1,1,1]=4 2340 B10R0.4 C=C(C)CCNCCCCC 2230a_100000209983_100000730704 [0,1,0,0,0,0|3,0,0]=4 2341 B10R0.4 C=C(C)CCNCCOCC 2230a_102516460346_100000730704 [0,1,0,0,0,0|2,0,0]=3 2342 B10R0.4 C=C(C)CCNCCOCC 34a_102516460346_100000730704 [0,1,0,0,0,0|2,0,0]=3 2343 B10R0.4 C=C(C)CCNCCSCC 2230a_100000106463_100000730704 [0,1,0,0,0,0|2,1,0]=4 2344 B10R0.4 C=C(C)CCOC/C=C\CC 34a_100000764851_100103147603 [0,1,0,0,0,0|2,0,1]=4 2345 B10R0.4 C=C(C)CCOC/C=C\CC 34a_100016268518_100000730704 [0,1,0,0,0,0|2,0,1]=4 2346 B10R0.4 C=C(C)CCOCC#CCC 34a_100000032950_100000730704 [0,1,0,0,0,0|2,0,1]=4 2347 B10R0.4 C=C(C)CCOCC#CCC 34a_100000764851_100009813939 [0,1,0,0,0,0|2,0,1]=4 2348 B10R0.4 C=C(C)CCOCC/C=C/C 34a_100016278192_100000730704 [0,1,0,0,0,0|2,0,1]=4 2349 B10R0.4 C=C(C)CCOCCC#CC 34a_100000750427_100000730704 [0,1,0,0,0,0|2,0,1]=4 2350 B10R0.4 C=C(C)CCOCCCCBr 34a_100011216708_100000730704 [0,1,0,0,0,0|3,0,0]=4 2351 B10R0.4 C=C(C)CCOCCCCC 34a_100000210253_100000730704 [0,1,0,0,0,0|2,0,0]=3 2352 B10R0.4 C=C(C)CCOCCCCC 34a_100000764851_100000718602 [0,1,0,0,0,0|2,0,0]=3 2353 B10R0.4 C=C(C)CCOCCCCC 7a_100000210253_100000730704 [0,1,0,0,0,0|2,0,0]=3 2354 B10R0.4 C=C(C)CCOCCCCCl 34a_100000210776_100000730704 [0,1,0,0,0,0|3,0,0]=4 2355 B10R0.4 C=C(C)CCOCCCCCl 7a_100000210776_100000730704 [0,1,0,0,0,0|3,0,0]=4 2356 B10R0.4 C=C(C)CCOCCCCF 34a_100000764851_100000729493 [0,1,0,0,0,0|3,0,0]=4 2357 B10R0.4 C=C(C)CCOCCCCF 34a_100011995726_100000730704 [0,1,0,0,0,0|3,0,0]=4 2358 B10R0.4 C=C(C)CCOCCCCF 7a_100011995726_100000730704 [0,1,0,0,0,0|3,0,0]=4 2359 B10R0.4 C=C(C)CCOCCCCI 34a_200012148704_100000730704 [0,1,0,0,0,0|3,0,0]=4 2360 B10R0.4 C=C(C)CCOCCCCN 34a_100000750430_100000730704 [0,1,0,0,0,0|3,0,0]=4 2361 B10R0.4 C=C(C)CCOCCCCO 34a_100000764851_100011216708 [0,1,0,0,0,0|3,0,0]=4 2362 B10R0.4 C=C(C)CCOCCCNC 34a_100000213112_100000730704 [0,1,0,0,0,0|3,0,0]=4 2363 B10R0.4 C=C(C)CCOCCCOC 34a_100000740835_100000730704 [0,1,0,0,0,0|3,0,0]=4 2364 B10R0.4 C=C(C)CCOCCCOC 34a_100000764851_100000740836 [0,1,0,0,0,0|3,0,0]=4 2365 B10R0.4 C=C(C)CCOCCCSC 34a_100000690336_100000730704 [0,1,0,0,0,0|3,0,0]=4 2366 B10R0.4 C=C(C)CCOCCCSC 7a_100000690336_100000730704 [0,1,0,0,0,0|3,0,0]=4 2367 B10R0.4 C=C(C)CCOCCOCC 34a_100000210136_100000730704 [0,1,0,0,0,0|1,0,0]=2 2368 B10R0.4 C=C(C)CCOCCOCC 34a_100000764851_100000210147 [0,1,0,0,0,0|1,0,0]=2 2369 B10R0.4 C=C(C)CCOCCOCC 7a_100000210136_100000730704 [0,1,0,0,0,0|1,0,0]=2 2370 B10R0.4 C=C(C)CCOCCSCC 34a_100000212035_100000730704 [0,1,0,0,0,0|1,1,0]=3 2371 B10R0.4 C=C(C)CCOCCSCC 34a_100000764851_100000757381 [0,1,0,0,0,0|1,1,0]=3 2372 B10R0.4 C=C(C)CCOCCSCC 7a_100000212035_100000730704 [0,1,0,0,0,0|1,1,0]=3 2373 B10R0.4 C=C(C)CCSCCCCC 62a_100000210326_100000730704 [0,1,0,0,0,0|2,1,0]=4 2374 B10R0.4 C=C(C)CCSCCCCC 62a_100000730704_100000210326 [0,1,0,0,0,0|2,1,0]=4 2375 B10R0.4 C=C(C)CCSCCOCC 62a_100000210147_100000730704 [0,1,0,0,0,0|1,1,0]=3 2376 B10R0.4 C=C(C)CCSCCOCC 62a_100000730704_100011215890 [0,1,0,0,0,0|1,1,0]=3 2377 B10R0.4 C=C(C)CCSCCSCC 62a_100000730704_100000757381 [0,1,0,0,0,0|1,2,0]=4 2378 B10R0.4 C=C(C)CCSCCSCC 62a_100000757381_100000730704 [0,1,0,0,0,0|1,2,0]=4 2379 B10R0.4 C=C(C)CNCCCOCC 2230a_100000210961_100000748629 [0,1,0,0,0,0|3,0,0]=4 2380 B10R0.4 C=C(C)CNCCCOCC 34a_100000210961_100000748629 [0,1,0,0,0,0|3,0,0]=4 2381 B10R0.4 C=C(C)COCCCOCC 34a_100000210245_100012232248 [0,1,0,0,0,0|3,0,0]=4 2382 B10R0.4 C=C(C)COCCCOCC 34a_100000757476_100000748629 [0,1,0,0,0,0|3,0,0]=4 2383 B10R0.4 C=C(C)COCCCOCC 7a_100000757476_100000748629 [0,1,0,0,0,0|3,0,0]=4 2384 B10R0.4 C=C(C)CSCCCOCC 62a_100000748629_100012232248 [0,1,0,0,0,0|3,0,0]=4 2385 B10R0.4 C=C(C)CSCCCOCC 62a_100012232248_100000211660 [0,1,0,0,0,0|3,0,0]=4 2386 B10R0.4 C=C(C)CSCOCCOC 62a_100000231047_100000211660 [0,1,0,0,0,0|2,0,1]=4 2387 B10R0.4 C=C(C)CSCOCCOC 62a_100000748629_100000231047 [0,1,0,0,0,0|2,0,1]=4 2388 B10R0.4 C=CCCCCCOC(C)C 34a_100000212225_100000700193 [0,1,0,0,0,0|2,0,1]=4 2389 B10R0.4 C=CCCCCCOC(C)C 34a_100011216702_100000210206 [0,1,0,0,0,0|2,0,1]=4 2390 B10R0.4 C=CCCCCCOC(C)C 7a_100011216702_100000210206 [0,1,0,0,0,0|2,0,1]=4 2391 B10R0.4 C=CCCNCCOC(C)C 2230a_100000701111_100000754431 [0,1,0,0,0,0|2,0,1]=4 2392 B10R0.4 C=CCCNCCOC(C)C 2230a_100015191253_100000211751 [0,1,0,0,0,0|2,0,1]=4 2393 B10R0.4 C=CCCNCCOC(C)C 34a_100000701111_100000754431 [0,1,0,0,0,0|2,0,1]=4 2394 B10R0.4 C=CCCOCCCC(C)C 34a_100000210774_100000754431 [0,1,0,0,0,0|2,0,1]=4 2395 B10R0.4 C=CCCOCCCC(C)C 34a_100011205117_100011214892 [0,1,0,0,0,0|2,0,1]=4 2396 B10R0.4 C=CCCOCCCC(C)C 7a_100000210774_100000754431 [0,1,0,0,0,0|2,0,1]=4 2397 B10R0.4 C=CCCOCCCC(C)O 34a_100011205117_200000718107 [0,1,0,0,0,0|2,0,1]=4 2398 B10R0.4 C=CCCOCCNC(C)C 34a_100000224655_100000754431 [0,1,0,0,0,0|2,0,1]=4 2399 B10R0.4 C=CCCOCCOC(=O)C 34a_100011205117_100009814007 [0,1,0,0,0,0|1,0,2]=4 2400 B10R0.4 C=CCCOCCOC(C)C 34a_100000211219_100000754431 [0,1,0,0,0,0|1,0,1]=3 2401 B10R0.4 C=CCCOCCOC(C)C 34a_100011205117_100000211751 [0,1,0,0,0,0|1,0,1]=3 2402 B10R0.4 C=CCCOCCOC(C)C 7a_100000211219_100000754431 [0,1,0,0,0,0|1,0,1]=3 2403 B10R0.4 C=CCCOCCSC(C)C 34a_100011205117_100000730970 [0,1,0,0,0,0|1,1,1]=4 2404 B10R0.4 C=CCCOCCSC(C)C 34a_200011212901_100000754431 [0,1,0,0,0,0|1,1,1]=4 2405 B10R0.4 C=CCCOCCSC(C)C 7a_200011212901_100000754431 [0,1,0,0,0,0|1,1,1]=4 2406 B10R0.4 C=CCCSCCOC(C)C 62a_100000211751_100000754431 [0,1,0,0,0,0|1,1,1]=4 2407 B10R0.4 C=CCCSCCOC(C)C 62a_100000754431_100000211751 [0,1,0,0,0,0|1,1,1]=4 2408 B10R0.4 C=COCCOCCC(=C)C 34a_100000033082_100000730704 [0,1,0,0,0,0|1,0,2]=4 2409 B10R0.4 C=COCCOCCC(=C)C 34a_100000764851_100000039644 [0,1,0,0,0,0|1,0,2]=4 2410 B10R0.4 C=COCCOCCC(=O)C 34a_100000759926_100000039644 [0,1,0,0,0,0|1,0,2]=4 2411 B10R0.4 C=COCCOCCC(=O)C 7a_100000759926_100000039644 [0,1,0,0,0,0|1,0,2]=4 2412 B10R0.4 C=COCCOCCC(C)Br 34a_100009893172_100000039644 [0,1,0,0,0,0|1,0,2]=4 2413 B10R0.4 C=COCCOCCC(C)C 34a_100000033082_100000210312 [0,1,0,0,0,0|1,0,2]=4 2414 B10R0.4 C=COCCOCCC(C)C 34a_100000210254_100000039644 [0,1,0,0,0,0|1,0,2]=4 2415 B10R0.4 C=COCCOCCC(C)C 7a_100000210254_100000039644 [0,1,0,0,0,0|1,0,2]=4 2416 B10R0.4 C=COCCOCCC(C)O 34a_100000033082_100012276601 [0,1,0,0,0,0|1,0,2]=4 2417 B10R0.4 C=COCCOCC[C@@H](C)N 34a_100000706166_100000039644 [0,1,0,0,0,0|1,0,2]=4 2418 B10R0.4 CC#CCCOCCC(C)C 34a_100000750427_100000210312 [0,1,0,0,0,0|2,0,1]=4 2419 B10R0.4 CC#CCCOCCC(C)O 34a_100000750427_100012276601 [0,1,0,0,0,0|2,0,1]=4 2420 B10R0.4 CC#CCNCCOC(C)C 2230a_100000685387_100000211751 [0,1,0,0,0,0|2,0,1]=4 2421 B10R0.4 CC#CCNCCOC(C)C 2230a_100000701111_100000748600 [0,1,0,0,0,0|2,0,1]=4 2422 B10R0.4 CC#CCNCCOC(C)C 34a_100000685387_100000211751 [0,1,0,0,0,0|2,0,1]=4 2423 B10R0.4 CC#CCNCCOC(C)C 34a_100000701111_100000748600 [0,1,0,0,0,0|2,0,1]=4 2424 B10R0.4 CC#CCOCCCC(C)C 34a_100000210774_100000748600 [0,1,0,0,0,0|2,0,1]=4 2425 B10R0.4 CC#CCOCCCC(C)C 34a_100000761923_100011214892 [0,1,0,0,0,0|2,0,1]=4 2426 B10R0.4 CC#CCOCCCC(C)C 7a_100000210774_100000748600 [0,1,0,0,0,0|2,0,1]=4 2427 B10R0.4 CC#CCOCCCC(C)O 34a_100000761923_200000718107 [0,1,0,0,0,0|2,0,1]=4 2428 B10R0.4 CC#CCOCCNC(C)C 34a_100000224655_100000748600 [0,1,0,0,0,0|2,0,1]=4 2429 B10R0.4 CC#CCOCCOC(=O)C 34a_100000761923_100009814007 [0,1,0,0,0,0|1,0,2]=4 2430 B10R0.4 CC#CCOCCOC(C)C 34a_100000211219_100000748600 [0,1,0,0,0,0|1,0,1]=3 2431 B10R0.4 CC#CCOCCOC(C)C 34a_100000761923_100000211751 [0,1,0,0,0,0|1,0,1]=3 2432 B10R0.4 CC#CCOCCOC(C)C 7a_100000211219_100000748600 [0,1,0,0,0,0|1,0,1]=3 2433 B10R0.4 CC#CCOCCSC(C)C 34a_100000761923_100000730970 [0,1,0,0,0,0|1,1,1]=4 2434 B10R0.4 CC#CCOCCSC(C)C 34a_200011212901_100000748600 [0,1,0,0,0,0|1,1,1]=4 2435 B10R0.4 CC#CCOCCSC(C)C 7a_200011212901_100000748600 [0,1,0,0,0,0|1,1,1]=4 2436 B10R0.4 CC#CCSCCOC(C)C 62a_100000211751_100000748600 [0,1,0,0,0,0|1,1,1]=4 2437 B10R0.4 CC#CCSCCOC(C)C 62a_100000748600_100000211751 [0,1,0,0,0,0|1,1,1]=4 2438 B10R0.4 CC(=CCCOCCON)C 34a_100000700252_100011217483 [0,1,0,0,0,0|2,0,1]=4 2439 B10R0.4 CC(=O)CCCOCCON 34a_100000700252_100000685027 [0,1,0,0,0,0|2,0,1]=4 2440 B10R0.4 CC(=O)CCOCCCCCl 7a_100000210776_100000053229 [0,1,0,0,0,0|3,0,0]=4 2441 B10R0.4 CC(=O)CCOCCCCF 34a_100000759926_100000729493 [0,1,0,0,0,0|3,0,0]=4 2442 B10R0.4 CC(=O)CCOCCCCF 7a_100000759926_100000729493 [0,1,0,0,0,0|3,0,0]=4 2443 B10R0.4 CC(=O)CCOCCCCF 7a_100011995726_100000053229 [0,1,0,0,0,0|3,0,0]=4 2444 B10R0.4 CC(=O)CCOCCCCO 34a_100000759926_100011216708 [0,1,0,0,0,0|3,0,0]=4 2445 B10R0.4 CC(=O)CCOCCCCO 7a_100000759926_100000210776 [0,1,0,0,0,0|3,0,0]=4 2446 B10R0.4 CC(=O)OCCCCCS[13CH3] 62a_100000033007_200025704644 [0,1,0,0,0,0|1,1,1]=4 2447 B10R0.4 CC(=O)OCCCCCS[13CH3] 62a_200025704644_100000033007 [0,1,0,0,0,0|1,1,1]=4 2448 B10R0.4 CC(=O)OCCOCCCBr 34a_100011217188_100009814007 [0,1,0,0,0,0|2,0,1]=4 2449 B10R0.4 CC(=O)OCCOCCCCl 34a_100000230001_100009814007 [0,1,0,0,0,0|2,0,1]=4 2450 B10R0.4 CC(=O)OCCOCCCF 34a_100000759539_100009814007 [0,1,0,0,0,0|2,0,1]=4 2451 B10R0.4 CC(=O)OCCOCCCN 34a_100000182051_100009814007 [0,1,0,0,0,0|2,0,1]=4 2452 B10R0.4 CC(=O)OCCOCCON 34a_100000700252_100009814007 [0,1,0,0,0,0|1,0,1]=3 2453 B10R0.4 CC(=O)OCCOCCS[13CH3] 62a_200000083610_200025704644 [0,1,0,0,0,0|0,1,1]=3 2454 B10R0.4 CC(=O)OCCOCCS[13CH3] 62a_200025704644_200000083610 [0,1,0,0,0,0|0,1,1]=3 2455 B10R0.4 CC(Br)CCOCCCCF 34a_100009893172_100000729493 [0,1,0,0,0,0|3,0,0]=4 2456 B10R0.4 CC(Br)CCOCCCCO 34a_100009893172_100011216708 [0,1,0,0,0,0|3,0,0]=4 2457 B10R0.4 CC(C)CCCCCCN[13CH3] 2230a_100000211014_200025704644 [0,1,0,0,0,0|3,0,0]=4 2458 B10R0.4 CC(C)CCCCCCN[13CH3] 34a_100000211014_200025704644 [0,1,0,0,0,0|3,0,0]=4 2459 B10R0.4 CC(C)CCCCCOCF 34a_100011995859_100015361967 [0,1,0,0,0,0|3,0,0]=4 2460 B10R0.4 CC(C)CCCCCOCF 7a_100011995859_100015361967 [0,1,0,0,0,0|3,0,0]=4 2461 B10R0.4 CC(C)CCCOCCC#N 7a_100000210774_100000184422 [0,1,0,0,0,0|3,0,0]=4 2462 B10R0.4 CC(C)CCCOCCCBr 34a_100011217188_100011214892 [0,1,0,0,0,0|3,0,0]=4 2463 B10R0.4 CC(C)CCCOCCCCl 34a_100000230001_100011214892 [0,1,0,0,0,0|3,0,0]=4 2464 B10R0.4 CC(C)CCCOCCCF 34a_100000210774_100011934791 [0,1,0,0,0,0|3,0,0]=4 2465 B10R0.4 CC(C)CCCOCCCF 34a_100000759539_100011214892 [0,1,0,0,0,0|3,0,0]=4 2466 B10R0.4 CC(C)CCCOCCCF 7a_100000210774_100011934791 [0,1,0,0,0,0|3,0,0]=4 2467 B10R0.4 CC(C)CCCOCCCN 34a_100000182051_100011214892 [0,1,0,0,0,0|3,0,0]=4 2468 B10R0.4 CC(C)CCCOCCCO 34a_100000210774_100000230001 [0,1,0,0,0,0|3,0,0]=4 2469 B10R0.4 CC(C)CCCOCCCO 7a_100000210774_100011215043 [0,1,0,0,0,0|3,0,0]=4 2470 B10R0.4 CC(C)CCCOCCON 34a_100000700252_100011214892 [0,1,0,0,0,0|2,0,0]=3 2471 B10R0.4 CC(C)CCOCCCCBr 34a_100011216708_100000210312 [0,1,0,0,0,0|3,0,0]=4 2472 B10R0.4 CC(C)CCOCCCCCl 34a_100000210776_100000210312 [0,1,0,0,0,0|3,0,0]=4 2473 B10R0.4 CC(C)CCOCCCCCl 7a_100000210776_100000210626 [0,1,0,0,0,0|3,0,0]=4 2474 B10R0.4 CC(C)CCOCCCCF 34a_100000210254_100000729493 [0,1,0,0,0,0|3,0,0]=4 2475 B10R0.4 CC(C)CCOCCCCF 34a_100011995726_100000210312 [0,1,0,0,0,0|3,0,0]=4 2476 B10R0.4 CC(C)CCOCCCCF 7a_100000210254_100000729493 [0,1,0,0,0,0|3,0,0]=4 2477 B10R0.4 CC(C)CCOCCCCF 7a_100011995726_100000210626 [0,1,0,0,0,0|3,0,0]=4 2478 B10R0.4 CC(C)CCOCCCCI 34a_200012148704_100000210312 [0,1,0,0,0,0|3,0,0]=4 2479 B10R0.4 CC(C)CCOCCCCN 34a_100000750430_100000210312 [0,1,0,0,0,0|3,0,0]=4 2480 B10R0.4 CC(C)CCOCCCCO 34a_100000210254_100011216708 [0,1,0,0,0,0|3,0,0]=4 2481 B10R0.4 CC(C)CCOCCCCO 7a_100000210254_100000210776 [0,1,0,0,0,0|3,0,0]=4 2482 B10R0.4 CC(C)NCCCCCO[13CH3] 34a_100011629493_200025704644 [0,1,0,0,0,0|2,0,0]=3 2483 B10R0.4 CC(C)NCCOCCCF 34a_100000224655_100011934791 [0,1,0,0,0,0|3,0,0]=4 2484 B10R0.4 CC(C)NCCOCCCO 34a_100000224655_100000230001 [0,1,0,0,0,0|3,0,0]=4 2485 B10R0.4 CC(C)OCCCCCCBr 34a_100011215345_100000210206 [0,1,0,0,0,0|3,0,0]=4 2486 B10R0.4 CC(C)OCCCCCCBr 7a_100011215345_100000210206 [0,1,0,0,0,0|3,0,0]=4 2487 B10R0.4 CC(C)OCCCCCCCl 34a_100000766143_100000210206 [0,1,0,0,0,0|3,0,0]=4 2488 B10R0.4 CC(C)OCCCCCCCl 7a_100000766143_100000210206 [0,1,0,0,0,0|3,0,0]=4 2489 B10R0.4 CC(C)OCCCCCCF 34a_100000212225_100015922095 [0,1,0,0,0,0|3,0,0]=4 2490 B10R0.4 CC(C)OCCCCCCF 34a_100000732779_100000210206 [0,1,0,0,0,0|3,0,0]=4 2491 B10R0.4 CC(C)OCCCCCCF 7a_100000732779_100000210206 [0,1,0,0,0,0|3,0,0]=4 2492 B10R0.4 CC(C)OCCCCCCN 34a_100000686447_100000210206 [0,1,0,0,0,0|3,0,0]=4 2493 B10R0.4 CC(C)OCCCCCCO 34a_100000212225_100000766143 [0,1,0,0,0,0|3,0,0]=4 2494 B10R0.4 CC(C)OCCNCCC#N 2230a_100000701111_100011215226 [0,1,0,0,0,0|3,0,0]=4 2495 B10R0.4 CC(C)OCCNCCCF 2230a_100000701111_100011934791 [0,1,0,0,0,0|3,0,0]=4 2496 B10R0.4 CC(C)OCCNCCCF 2230a_100015189416_100000211751 [0,1,0,0,0,0|3,0,0]=4 2497 B10R0.4 CC(C)OCCNCCCF 34a_100000701111_100011934791 [0,1,0,0,0,0|3,0,0]=4 2498 B10R0.4 CC(C)OCCNCCCF 34a_100015189416_100000211751 [0,1,0,0,0,0|3,0,0]=4 2499 B10R0.4 CC(C)OCCNCCCO 2230a_100000701111_100000230001 [0,1,0,0,0,0|3,0,0]=4 2500 B10R0.4 CC(C)OCCNCCCO 34a_100000701111_100000230001 [0,1,0,0,0,0|3,0,0]=4 2501 B10R0.4 CC(C)OCCOCCC#N 7a_100000211219_100000184422 [0,1,0,0,0,0|2,0,0]=3 2502 B10R0.4 CC(C)OCCOCCCBr 34a_100011217188_100000211751 [0,1,0,0,0,0|2,0,0]=3 2503 B10R0.4 CC(C)OCCOCCCCl 34a_100000230001_100000211751 [0,1,0,0,0,0|2,0,0]=3 2504 B10R0.4 CC(C)OCCOCCCF 34a_100000211219_100011934791 [0,1,0,0,0,0|2,0,0]=3 2505 B10R0.4 CC(C)OCCOCCCF 34a_100000759539_100000211751 [0,1,0,0,0,0|2,0,0]=3 2506 B10R0.4 CC(C)OCCOCCCF 7a_100000211219_100011934791 [0,1,0,0,0,0|2,0,0]=3 2507 B10R0.4 CC(C)OCCOCCCN 34a_100000182051_100000211751 [0,1,0,0,0,0|2,0,0]=3 2508 B10R0.4 CC(C)OCCOCCCO 34a_100000211219_100000230001 [0,1,0,0,0,0|2,0,0]=3 2509 B10R0.4 CC(C)OCCOCCCO 7a_100000211219_100011215043 [0,1,0,0,0,0|2,0,0]=3 2510 B10R0.4 CC(C)OCCOCCON 34a_100000700252_100000211751 [0,1,0,0,0,0|1,0,0]=2 2511 B10R0.4 CC(C)OCCSCCC#N 62a_100000211751_100011215226 [0,1,0,0,0,0|2,1,0]=4 2512 B10R0.4 CC(C)OCCSCCC#N 62a_100011215226_100000211751 [0,1,0,0,0,0|2,1,0]=4 2513 B10R0.4 CC(C)OCCSCCCF 62a_100000211751_100011934791 [0,1,0,0,0,0|2,1,0]=4 2514 B10R0.4 CC(C)OCCSCCCF 62a_100011934791_100000211751 [0,1,0,0,0,0|2,1,0]=4 2515 B10R0.4 CC(C)OCCSCCCO 62a_100000211751_100011215043 [0,1,0,0,0,0|2,1,0]=4 2516 B10R0.4 CC(C)OCCSCCCO 62a_100011215043_100000211751 [0,1,0,0,0,0|2,1,0]=4 2517 B10R0.4 CC(C)SCCOCCC#N 7a_200011212901_100000184422 [0,1,0,0,0,0|2,1,0]=4 2518 B10R0.4 CC(C)SCCOCCCBr 34a_100011217188_100000730970 [0,1,0,0,0,0|2,1,0]=4 2519 B10R0.4 CC(C)SCCOCCCCl 34a_100000230001_100000730970 [0,1,0,0,0,0|2,1,0]=4 2520 B10R0.4 CC(C)SCCOCCCF 34a_100000759539_100000730970 [0,1,0,0,0,0|2,1,0]=4 2521 B10R0.4 CC(C)SCCOCCCF 34a_200011212901_100011934791 [0,1,0,0,0,0|2,1,0]=4 2522 B10R0.4 CC(C)SCCOCCCF 7a_200011212901_100011934791 [0,1,0,0,0,0|2,1,0]=4 2523 B10R0.4 CC(C)SCCOCCCN 34a_100000182051_100000730970 [0,1,0,0,0,0|2,1,0]=4 2524 B10R0.4 CC(C)SCCOCCCO 34a_200011212901_100000230001 [0,1,0,0,0,0|2,1,0]=4 2525 B10R0.4 CC(C)SCCOCCCO 7a_200011212901_100011215043 [0,1,0,0,0,0|2,1,0]=4 2526 B10R0.4 CC(C)SCCOCCON 34a_100000700252_100000730970 [0,1,0,0,0,0|1,1,0]=3 2527 B10R0.4 CC(O)CCCOCCCBr 34a_100011217188_200000718107 [0,1,0,0,0,0|3,0,0]=4 2528 B10R0.4 CC(O)CCCOCCCCl 34a_100000230001_200000718107 [0,1,0,0,0,0|3,0,0]=4 2529 B10R0.4 CC(O)CCCOCCCF 34a_100000759539_200000718107 [0,1,0,0,0,0|3,0,0]=4 2530 B10R0.4 CC(O)CCCOCCCN 34a_100000182051_200000718107 [0,1,0,0,0,0|3,0,0]=4 2531 B10R0.4 CC(O)CCCOCCON 34a_100000700252_200000718107 [0,1,0,0,0,0|2,0,0]=3 2532 B10R0.4 CC(O)CCOCCCCBr 34a_100011216708_100012276601 [0,1,0,0,0,0|3,0,0]=4 2533 B10R0.4 CC(O)CCOCCCCCl 34a_100000210776_100012276601 [0,1,0,0,0,0|3,0,0]=4 2534 B10R0.4 CC(O)CCOCCCCCl 7a_100000210776_100012276601 [0,1,0,0,0,0|3,0,0]=4 2535 B10R0.4 CC(O)CCOCCCCF 34a_100011995726_100012276601 [0,1,0,0,0,0|3,0,0]=4 2536 B10R0.4 CC(O)CCOCCCCF 7a_100011995726_100012276601 [0,1,0,0,0,0|3,0,0]=4 2537 B10R0.4 CC(O)CCOCCCCI 34a_200012148704_100012276601 [0,1,0,0,0,0|3,0,0]=4 2538 B10R0.4 CC(O)CCOCCCCN 34a_100000750430_100012276601 [0,1,0,0,0,0|3,0,0]=4 2539 B10R0.4 CC/C=C\COCCC(=O)C 34a_100000759926_100103147603 [0,1,0,0,0,0|2,0,1]=4 2540 B10R0.4 CC/C=C\COCCC(=O)C 7a_100000759926_100103147603 [0,1,0,0,0,0|2,0,1]=4 2541 B10R0.4 CC/C=C\COCCC(C)Br 34a_100009893172_100103147603 [0,1,0,0,0,0|2,0,1]=4 2542 B10R0.4 CC/C=C\COCCC(C)C 34a_100000210254_100103147603 [0,1,0,0,0,0|2,0,1]=4 2543 B10R0.4 CC/C=C\COCCC(C)C 34a_100016268518_100000210312 [0,1,0,0,0,0|2,0,1]=4 2544 B10R0.4 CC/C=C\COCCC(C)C 7a_100000210254_100103147603 [0,1,0,0,0,0|2,0,1]=4 2545 B10R0.4 CC/C=C\COCCC(C)O 34a_100016268518_100012276601 [0,1,0,0,0,0|2,0,1]=4 2546 B10R0.4 CC/C=C\COCC[C@@H](C)N 34a_100000706166_100103147603 [0,1,0,0,0,0|2,0,1]=4 2547 B10R0.4 CC=CCNCCOC(C)C 2230a_100000701111_100000070051 [0,1,0,0,0,0|2,0,1]=4 2548 B10R0.4 CC=CCNCCOC(C)C 34a_100000701111_100000070051 [0,1,0,0,0,0|2,0,1]=4 2549 B10R0.4 CC=CCOCCCC(C)C 34a_100000210774_100000070051 [0,1,0,0,0,0|2,0,1]=4 2550 B10R0.4 CC=CCOCCCC(C)C 7a_100000210774_100000070051 [0,1,0,0,0,0|2,0,1]=4 2551 B10R0.4 CC=CCOCCNC(C)C 34a_100000224655_100000070051 [0,1,0,0,0,0|2,0,1]=4 2552 B10R0.4 CC=CCOCCOC(C)C 34a_100000211219_100000070051 [0,1,0,0,0,0|1,0,1]=3 2553 B10R0.4 CC=CCOCCOC(C)C 7a_100000211219_100000070051 [0,1,0,0,0,0|1,0,1]=3 2554 B10R0.4 CC=CCOCCSC(C)C 34a_200011212901_100000070051 [0,1,0,0,0,0|1,1,1]=4 2555 B10R0.4 CC=CCOCCSC(C)C 7a_200011212901_100000070051 [0,1,0,0,0,0|1,1,1]=4 2556 B10R0.4 CC=CCSCCOC(C)C 62a_100000070051_100000211751 [0,1,0,0,0,0|1,1,1]=4 2557 B10R0.4 CC=CCSCCOC(C)C 62a_100000211751_100000070051 [0,1,0,0,0,0|1,1,1]=4 2558 B10R0.4 CCC#CCOCCC(=O)C 34a_100000759926_100009813939 [0,1,0,0,0,0|2,0,1]=4 2559 B10R0.4 CCC#CCOCCC(=O)C 7a_100000759926_100009813939 [0,1,0,0,0,0|2,0,1]=4 2560 B10R0.4 CCC#CCOCCC(C)Br 34a_100009893172_100009813939 [0,1,0,0,0,0|2,0,1]=4 2561 B10R0.4 CCC#CCOCCC(C)C 34a_100000032950_100000210312 [0,1,0,0,0,0|2,0,1]=4 2562 B10R0.4 CCC#CCOCCC(C)C 34a_100000210254_100009813939 [0,1,0,0,0,0|2,0,1]=4 2563 B10R0.4 CCC#CCOCCC(C)C 7a_100000210254_100009813939 [0,1,0,0,0,0|2,0,1]=4 2564 B10R0.4 CCC#CCOCCC(C)O 34a_100000032950_100012276601 [0,1,0,0,0,0|2,0,1]=4 2565 B10R0.4 CCC#CCOCC[C@@H](C)N 34a_100000706166_100009813939 [0,1,0,0,0,0|2,0,1]=4 2566 B10R0.4 CCCC#CCCOC(C)C 34a_100000042726_100000210206 [0,1,0,0,0,0|2,0,1]=4 2567 B10R0.4 CCCC#CCCOC(C)C 7a_100000042726_100000210206 [0,1,0,0,0,0|2,0,1]=4 2568 B10R0.4 CCCC/C=C/COC(C)C 34a_200016272032_100000210206 [0,1,0,0,0,0|2,0,1]=4 2569 B10R0.4 CCCC/C=C/COC(C)C 7a_200016272032_100000210206 [0,1,0,0,0,0|2,0,1]=4 2570 B10R0.4 CCCCC#CCOC(C)C 34a_200000034558_100000210206 [0,1,0,0,0,0|2,0,1]=4 2571 B10R0.4 CCCCC#CCOC(C)C 7a_200000034558_100000210206 [0,1,0,0,0,0|2,0,1]=4 2572 B10R0.4 CCCCCCCCC(=O)C 1458a_100000070787_100000210759 [0,1,0,0,0,0|3,0,0]=4 2573 B10R0.4 CCCCCCCCC(=O)C 1458a_100000210188_200000210301 [0,1,0,0,0,0|3,0,0]=4 2574 B10R0.4 CCCCCCCCC(=O)[13CH3] 1458a_100000210188_200025704644 [0,1,0,0,0,0|3,0,0]=4 2575 B10R0.4 CCCCCCCCN(C)C 2230a_100000207567_200000210301 [0,1,0,0,0,0|3,0,0]=4 2576 B10R0.4 CCCCCCCCN(C)C 2230a_100102631434_100000210759 [0,1,0,0,0,0|3,0,0]=4 2577 B10R0.4 CCCCCCCCN(C)C 269982a_100000207567_200000210301 [0,1,0,0,0,0|3,0,0]=4 2578 B10R0.4 CCCCCCCCN(C)C 269982a_100102631434_100000210759 [0,1,0,0,0,0|3,0,0]=4 2579 B10R0.4 CCCCCCCCN(C)[13CH3] 2230a_100000207567_200025704644 [0,1,0,0,0,0|3,0,0]=4 2580 B10R0.4 CCCCCCCCN(C)[13CH3] 269982a_100000207567_200025704644 [0,1,0,0,0,0|3,0,0]=4 2581 B10R0.4 CCCCCCCNC(C)C 2230a_100000229938_100000210206 [0,1,0,0,0,0|3,0,0]=4 2582 B10R0.4 CCCCCCCNC(C)C 2230a_100138425928_100000210681 [0,1,0,0,0,0|3,0,0]=4 2583 B10R0.4 CCCCCCCNC(C)C 34a_100138425928_100000210614 [0,1,0,0,0,0|3,0,0]=4 2584 B10R0.4 CCCCCCCOC(C)C 34a_100000210272_100000210206 [0,1,0,0,0,0|2,0,0]=3 2585 B10R0.4 CCCCCCCOC(C)C 34a_100000212225_100000210614 [0,1,0,0,0,0|2,0,0]=3 2586 B10R0.4 CCCCCCCOC(C)C 7a_100000210272_100000210206 [0,1,0,0,0,0|2,0,0]=3 2587 B10R0.4 CCCCCCCSC(C)C 62a_100000210206_100000210316 [0,1,0,0,0,0|2,1,0]=4 2588 B10R0.4 CCCCCCCSC(C)C 62a_100000210614_100000210206 [0,1,0,0,0,0|2,1,0]=4 2589 B10R0.4 CCCCCNCCC(C)C 2230a_100000209983_100000210312 [0,1,0,0,0,0|3,0,0]=4 2590 B10R0.4 CCCCCNCCC(C)C 269862a_100000209983_100000185833 [0,1,0,0,0,0|3,0,0]=4 2591 B10R0.4 CCCCCNCCC(C)O 2230a_100000209983_100012276601 [0,1,0,0,0,0|3,0,0]=4 2592 B10R0.4 CCCCCNCCC(C)O 2230a_200000755665_100000210326 [0,1,0,0,0,0|3,0,0]=4 2593 B10R0.4 CCCCCNCOC(C)C 2230a_100000209983_100000709892 [0,1,0,0,0,0|3,0,0]=4 2594 B10R0.4 CCCCCOCC=C(C)C 34a_100000210253_100000761012 [0,1,0,0,0,0|2,0,1]=4 2595 B10R0.4 CCCCCOCC=C(C)C 34a_100000753907_100000718602 [0,1,0,0,0,0|2,0,1]=4 2596 B10R0.4 CCCCCOCC=C(C)C 7a_100000210253_100000761012 [0,1,0,0,0,0|2,0,1]=4 2597 B10R0.4 CCCCCOCCC(=O)C 34a_100000759926_100000718602 [0,1,0,0,0,0|2,0,0]=3 2598 B10R0.4 CCCCCOCCC(=O)C 7a_100000210253_100000053229 [0,1,0,0,0,0|2,0,0]=3 2599 B10R0.4 CCCCCOCCC(=O)C 7a_100000759926_100000210326 [0,1,0,0,0,0|2,0,0]=3 2600 B10R0.4 CCCCCOCCC(=O)N 34a_100000210253_100000731001 [0,1,0,0,0,0|3,0,0]=4 2601 B10R0.4 CCCCCOCCC(=O)N 34a_100000757172_100000718602 [0,1,0,0,0,0|3,0,0]=4 2602 B10R0.4 CCCCCOCCC(=O)N 7a_100000210253_100000744528 [0,1,0,0,0,0|3,0,0]=4 2603 B10R0.4 CCCCCOCCC(=O)N 7a_100000757172_100000210326 [0,1,0,0,0,0|3,0,0]=4 2604 B10R0.4 CCCCCOCCC(C)Br 34a_100009893172_100000718602 [0,1,0,0,0,0|2,0,0]=3 2605 B10R0.4 CCCCCOCCC(C)C 34a_100000210253_100000210312 [0,1,0,0,0,0|2,0,0]=3 2606 B10R0.4 CCCCCOCCC(C)C 34a_100000210254_100000718602 [0,1,0,0,0,0|2,0,0]=3 2607 B10R0.4 CCCCCOCCC(C)C 7a_100000210253_100000210626 [0,1,0,0,0,0|2,0,0]=3 2608 B10R0.4 CCCCCOCCC(C)C 7a_100000210254_100000210326 [0,1,0,0,0,0|2,0,0]=3 2609 B10R0.4 CCCCCOCCC(C)O 34a_100000210253_100012276601 [0,1,0,0,0,0|2,0,0]=3 2610 B10R0.4 CCCCCOCCC(C)O 7a_100000210253_100012276601 [0,1,0,0,0,0|2,0,0]=3 2611 B10R0.4 CCCCCOCCC(F)F 34a_100103093639_100000718602 [0,1,0,0,0,0|3,0,0]=4 2612 B10R0.4 CCCCCOCCN(C)C 7a_100000210253_100000755713 [0,1,0,0,0,0|2,0,0]=3 2613 B10R0.4 CCCCCOCC[C@@H](C)N 34a_100000706166_100000718602 [0,1,0,0,0,0|2,0,0]=3 2614 B10R0.4 CCCCCOCOC(=O)C 34a_100000210253_100009813279 [0,1,0,0,0,0|3,0,0]=4 2615 B10R0.4 CCCCCOCOC(C)C 34a_100000210253_100000709892 [0,1,0,0,0,0|3,0,0]=4 2616 B10R0.4 CCCCCSCCC(=O)C 62a_100000053229_100000210326 [0,1,0,0,0,0|2,1,0]=4 2617 B10R0.4 CCCCCSCCC(=O)C 62a_100000210326_100000053229 [0,1,0,0,0,0|2,1,0]=4 2618 B10R0.4 CCCCCSCCC(C)C 62a_100000210312_100000210326 [0,1,0,0,0,0|2,1,0]=4 2619 B10R0.4 CCCCCSCCC(C)C 62a_100000210326_100000210312 [0,1,0,0,0,0|2,1,0]=4 2620 B10R0.4 CCCCCSCCC(C)O 62a_100000210326_100012276601 [0,1,0,0,0,0|2,1,0]=4 2621 B10R0.4 CCCCCSCCC(C)O 62a_100012276601_100000210326 [0,1,0,0,0,0|2,1,0]=4 2622 B10R0.4 CCCCCSCCN(C)C 62a_100000210326_100000755713 [0,1,0,0,0,0|2,1,0]=4 2623 B10R0.4 CCCCCSCOC(C)C 62a_100000210326_100000709892 [0,1,0,0,0,0|3,0,0]=4 2624 B10R0.4 CCCCCSCOC(C)C 62a_100000709892_100000210326 [0,1,0,0,0,0|3,0,0]=4 2625 B10R0.4 CCCCNCCCC(C)C 2230a_100000102301_100011214892 [0,1,0,0,0,0|3,0,0]=4 2626 B10R0.4 CCCCNCCCC(C)C 2230a_200000737386_100000210211 [0,1,0,0,0,0|3,0,0]=4 2627 B10R0.4 CCCCNCCCC(C)C 34a_200000737386_100000210210 [0,1,0,0,0,0|3,0,0]=4 2628 B10R0.4 CCCCNCCCC(C)C 7a_106832991798_100011214892 [0,1,0,0,0,0|3,0,0]=4 2629 B10R0.4 CCCCNCCCC(C)O 2230a_100000102301_200000718107 [0,1,0,0,0,0|3,0,0]=4 2630 B10R0.4 CCCCNCCCC(C)O 7a_106832991798_200000718107 [0,1,0,0,0,0|3,0,0]=4 2631 B10R0.4 CCCCNCCOC(=O)C 7a_106832991798_100009814007 [0,1,0,0,0,0|2,0,1]=4 2632 B10R0.4 CCCCNCCOC(C)C 2230a_100000102301_100000211751 [0,1,0,0,0,0|2,0,0]=3 2633 B10R0.4 CCCCNCCOC(C)C 2230a_100000701111_100000210211 [0,1,0,0,0,0|2,0,0]=3 2634 B10R0.4 CCCCNCCOC(C)C 34a_100000701111_100000210210 [0,1,0,0,0,0|2,0,0]=3 2635 B10R0.4 CCCCNCCOC(C)C 7a_106832991798_100000211751 [0,1,0,0,0,0|2,0,0]=3 2636 B10R0.4 CCCCNCCSC(C)C 2230a_100000102301_100000730970 [0,1,0,0,0,0|2,1,0]=4 2637 B10R0.4 CCCCNCCSC(C)C 2230a_100000731138_100000210211 [0,1,0,0,0,0|2,1,0]=4 2638 B10R0.4 CCCCNCCSC(C)C 34a_100000731138_100000210210 [0,1,0,0,0,0|2,1,0]=4 2639 B10R0.4 CCCCNCCSC(C)C 7a_106832991798_100000730970 [0,1,0,0,0,0|2,1,0]=4 2640 B10R0.4 CCCCOCCC=C(C)C 34a_100000210227_100011217483 [0,1,0,0,0,0|2,0,1]=4 2641 B10R0.4 CCCCOCCC=C(C)C 7a_100000210227_100011217483 [0,1,0,0,0,0|2,0,1]=4 2642 B10R0.4 CCCCOCCCC(=O)C 34a_100000210227_100000685027 [0,1,0,0,0,0|2,0,1]=4 2643 B10R0.4 CCCCOCCCC(=O)C 34a_100000759063_100000210210 [0,1,0,0,0,0|2,0,1]=4 2644 B10R0.4 CCCCOCCCC(=O)C 7a_100000210227_100011215641 [0,1,0,0,0,0|2,0,1]=4 2645 B10R0.4 CCCCOCCCC(=O)C 7a_100000759063_100000210211 [0,1,0,0,0,0|2,0,1]=4 2646 B10R0.4 CCCCOCCCC(C)C 34a_100000210227_100011214892 [0,1,0,0,0,0|2,0,0]=3 2647 B10R0.4 CCCCOCCCC(C)C 34a_100000210774_100000210210 [0,1,0,0,0,0|2,0,0]=3 2648 B10R0.4 CCCCOCCCC(C)C 7a_100000210227_100011214892 [0,1,0,0,0,0|2,0,0]=3 2649 B10R0.4 CCCCOCCCC(C)C 7a_100000210774_100000210211 [0,1,0,0,0,0|2,0,0]=3 2650 B10R0.4 CCCCOCCCC(C)O 34a_100000210227_200000718107 [0,1,0,0,0,0|2,0,0]=3 2651 B10R0.4 CCCCOCCCC(C)O 7a_100000210227_200000718107 [0,1,0,0,0,0|2,0,0]=3 2652 B10R0.4 CCCCOCCCN(C)C 7a_100000210227_100000757444 [0,1,0,0,0,0|3,0,0]=4 2653 B10R0.4 CCCCOCCNC(=O)C 34a_100000158858_100000210210 [0,1,0,0,0,0|2,0,1]=4 2654 B10R0.4 CCCCOCCNC(=O)C 7a_100000210227_100000189650 [0,1,0,0,0,0|2,0,1]=4 2655 B10R0.4 CCCCOCCNC(C)C 2230a_100138425928_100000743108 [0,1,0,0,0,0|2,0,0]=3 2656 B10R0.4 CCCCOCCNC(C)C 34a_100000224655_100000210210 [0,1,0,0,0,0|2,0,0]=3 2657 B10R0.4 CCCCOCCNC(C)C 34a_100138425928_100000743108 [0,1,0,0,0,0|2,0,0]=3 2658 B10R0.4 CCCCOCCOC(=O)C 34a_100000210227_100009814007 [0,1,0,0,0,0|1,0,1]=3 2659 B10R0.4 CCCCOCCOC(=O)C 7a_100000210227_100009814007 [0,1,0,0,0,0|1,0,1]=3 2660 B10R0.4 CCCCOCCOC(=O)N 34a_100000210227_200011214921 [0,1,0,0,0,0|2,0,1]=4 2661 B10R0.4 CCCCOCCOC(=O)N 7a_100000210227_200011214921 [0,1,0,0,0,0|2,0,1]=4 2662 B10R0.4 CCCCOCCOC(=O)N 7a_100000766696_100000210211 [0,1,0,0,0,0|2,0,1]=4 2663 B10R0.4 CCCCOCCOC(C)C 34a_100000210227_100000211751 [0,1,0,0,0,0|1,0,0]=2 2664 B10R0.4 CCCCOCCOC(C)C 34a_100000210238_100000210206 [0,1,0,0,0,0|1,0,0]=2 2665 B10R0.4 CCCCOCCOC(C)C 34a_100000211219_100000210210 [0,1,0,0,0,0|1,0,0]=2 2666 B10R0.4 CCCCOCCOC(C)C 34a_100000212225_100000743108 [0,1,0,0,0,0|1,0,0]=2 2667 B10R0.4 CCCCOCCOC(C)C 7a_100000210227_100000211751 [0,1,0,0,0,0|1,0,0]=2 2668 B10R0.4 CCCCOCCOC(C)C 7a_100000210238_100000210206 [0,1,0,0,0,0|1,0,0]=2 2669 B10R0.4 CCCCOCCOC(C)C 7a_100000211219_100000210211 [0,1,0,0,0,0|1,0,0]=2 2670 B10R0.4 CCCCOCCSC(C)C 34a_100000210227_100000730970 [0,1,0,0,0,0|1,1,0]=3 2671 B10R0.4 CCCCOCCSC(C)C 34a_200011212901_100000210210 [0,1,0,0,0,0|1,1,0]=3 2672 B10R0.4 CCCCOCCSC(C)C 62a_100000210206_100000743108 [0,1,0,0,0,0|1,1,0]=3 2673 B10R0.4 CCCCOCCSC(C)C 62a_100000743108_100000210206 [0,1,0,0,0,0|1,1,0]=3 2674 B10R0.4 CCCCOCCSC(C)C 7a_100000210227_100000730970 [0,1,0,0,0,0|1,1,0]=3 2675 B10R0.4 CCCCOCCSC(C)C 7a_200011212901_100000210211 [0,1,0,0,0,0|1,1,0]=3 2676 B10R0.4 CCCCOCNCC(C)C 2230a_100000210953_100011995733 [0,1,0,0,0,0|3,0,0]=4 2677 B10R0.4 CCCCOCNCC(C)C 34a_100000210953_100011995733 [0,1,0,0,0,0|3,0,0]=4 2678 B10R0.4 CCCCOCNCC(C)O 2230a_100000210904_100011995733 [0,1,0,0,0,0|3,0,0]=4 2679 B10R0.4 CCCCOCNCC(C)O 34a_100000210904_100011995733 [0,1,0,0,0,0|3,0,0]=4 2680 B10R0.4 CCCCOCOCC(C)Br 34a_100012180447_100011995733 [0,1,0,0,0,0|3,0,0]=4 2681 B10R0.4 CCCCOCOCC(C)C 34a_100000210257_100011995733 [0,1,0,0,0,0|3,0,0]=4 2682 B10R0.4 CCCCOCOCC(C)F 34a_100015925927_100011995733 [0,1,0,0,0,0|3,0,0]=4 2683 B10R0.4 CCCCOCOC[C@@H](C)Cl 34a_100016084084_100011995733 [0,1,0,0,0,0|3,0,0]=4 2684 B10R0.4 CCCCOCOC[C@@H](C)N 34a_100000737577_100011995733 [0,1,0,0,0,0|3,0,0]=4 2685 B10R0.4 CCCCOCSCC(C)C 62a_100000210624_100011995733 [0,1,0,0,0,0|3,0,0]=4 2686 B10R0.4 CCCCOCSCC(C)C 62a_100011995733_100000210760 [0,1,0,0,0,0|3,0,0]=4 2687 B10R0.4 CCCCOCSCC(C)O 62a_100011218427_100011995733 [0,1,0,0,0,0|3,0,0]=4 2688 B10R0.4 CCCCOCSCC(C)O 62a_100011995733_100011218427 [0,1,0,0,0,0|3,0,0]=4 2689 B10R0.4 CCCCOCSC[C@@H](C)O 62a_100009817552_100011995733 [0,1,0,0,0,0|3,0,0]=4 2690 B10R0.4 CCCCOCSC[C@@H](C)O 62a_100011995733_100009817552 [0,1,0,0,0,0|3,0,0]=4 2691 B10R0.4 CCCCSCCCC(C)C 62a_100000210211_100011214892 [0,1,0,0,0,0|2,1,0]=4 2692 B10R0.4 CCCCSCCCC(C)C 62a_100011214892_100000210210 [0,1,0,0,0,0|2,1,0]=4 2693 B10R0.4 CCCCSCCCC(C)O 62a_100000210211_200000718107 [0,1,0,0,0,0|2,1,0]=4 2694 B10R0.4 CCCCSCCCC(C)O 62a_200000718107_100000210210 [0,1,0,0,0,0|2,1,0]=4 2695 B10R0.4 CCCCSCCNC(C)C 2230a_100025743550_100000210206 [0,1,0,0,0,0|2,1,0]=4 2696 B10R0.4 CCCCSCCOC(=O)C 62a_100000210211_100009814007 [0,1,0,0,0,0|1,1,1]=4 2697 B10R0.4 CCCCSCCOC(=O)C 62a_100009814007_100000210210 [0,1,0,0,0,0|1,1,1]=4 2698 B10R0.4 CCCCSCCOC(C)C 34a_200000230436_100000210206 [0,1,0,0,0,0|1,1,0]=3 2699 B10R0.4 CCCCSCCOC(C)C 62a_100000210211_100000211751 [0,1,0,0,0,0|1,1,0]=3 2700 B10R0.4 CCCCSCCOC(C)C 62a_100000211751_100000210210 [0,1,0,0,0,0|1,1,0]=3 2701 B10R0.4 CCCCSCCOC(C)C 7a_200000230436_100000210206 [0,1,0,0,0,0|1,1,0]=3 2702 B10R0.4 CCCCSCCSC(C)C 62a_100000210211_100000730970 [0,1,0,0,0,0|1,2,0]=4 2703 B10R0.4 CCCCSCCSC(C)C 62a_100000730970_100000210210 [0,1,0,0,0,0|1,2,0]=4 2704 B10R0.4 CCCNCCCOC(C)C 2230a_100000737246_100000210303 [0,1,0,0,0,0|3,0,0]=4 2705 B10R0.4 CCCNCCCOC(C)C 34a_100000737246_100000210303 [0,1,0,0,0,0|3,0,0]=4 2706 B10R0.4 CCNCCCCCC(C)C 2230a_100011290863_100000210202 [0,1,0,0,0,0|3,0,0]=4 2707 B10R0.4 CCNCCCCCC(C)C 2230a_100015525214_100000210682 [0,1,0,0,0,0|3,0,0]=4 2708 B10R0.4 CCNCCCCCC(C)C 34a_100011290863_100000210202 [0,1,0,0,0,0|3,0,0]=4 2709 B10R0.4 CCOCCCCCB(O)O 34a_100121572206_200009817188 [0,1,0,0,0,0|3,0,0]=4 2710 B10R0.4 CCOCCCCCC(=O)N 34a_100000123541_100000210202 [0,1,0,0,0,0|3,0,0]=4 2711 B10R0.4 CCOCCCCCC(=O)N 34a_100121572206_100009817443 [0,1,0,0,0,0|3,0,0]=4 2712 B10R0.4 CCOCCCCCC(=O)N 7a_100000123541_100000210202 [0,1,0,0,0,0|3,0,0]=4 2713 B10R0.4 CCOCCCCCC(=O)[O-] 7a_100102619762_100000210202 [0,1,0,0,0,0|3,0,0]=4 2714 B10R0.4 CCOCCCCCC(C)C 34a_100011995859_100000210202 [0,1,0,0,0,0|2,0,0]=3 2715 B10R0.4 CCOCCCCCC(C)C 34a_100121572206_100000210682 [0,1,0,0,0,0|2,0,0]=3 2716 B10R0.4 CCOCCCCCC(C)C 7a_100011995859_100000210202 [0,1,0,0,0,0|2,0,0]=3 2717 B10R0.4 CCOCCCCNC(C)C 34a_100011521146_100000210202 [0,1,0,0,0,0|3,0,0]=4 2718 B10R0.4 CCOCCCCOC(=O)C 34a_100000073216_100000210202 [0,1,0,0,0,0|3,0,0]=4 2719 B10R0.4 CCOCCCCOC(=O)C 34a_100121572206_100000033659 [0,1,0,0,0,0|3,0,0]=4 2720 B10R0.4 CCOCCCCOC(=O)C 7a_100000073216_100000210202 [0,1,0,0,0,0|3,0,0]=4 2721 B10R0.4 CCOCCCCSC(=O)C 34a_100121572206_200010402107 [0,1,0,0,0,0|3,0,0]=4 2722 B10R0.4 CCOCCCNCC(C)C 2230a_100000210953_100012232248 [0,1,0,0,0,0|3,0,0]=4 2723 B10R0.4 CCOCCCNCC(C)C 2230a_100000210961_100000210760 [0,1,0,0,0,0|3,0,0]=4 2724 B10R0.4 CCOCCCNCC(C)C 270004a_100000210961_100000210432 [0,1,0,0,0,0|3,0,0]=4 2725 B10R0.4 CCOCCCNCC(C)C 34a_100000210953_100012232248 [0,1,0,0,0,0|3,0,0]=4 2726 B10R0.4 CCOCCCNCC(C)C 34a_100000210961_100000210624 [0,1,0,0,0,0|3,0,0]=4 2727 B10R0.4 CCOCCCNCC(C)O 2230a_100000210904_100012232248 [0,1,0,0,0,0|3,0,0]=4 2728 B10R0.4 CCOCCCNCC(C)O 2230a_100000210961_100011218427 [0,1,0,0,0,0|3,0,0]=4 2729 B10R0.4 CCOCCCNCC(C)O 34a_100000210904_100012232248 [0,1,0,0,0,0|3,0,0]=4 2730 B10R0.4 CCOCCCNCC(C)O 34a_100000210961_100011218427 [0,1,0,0,0,0|3,0,0]=4 2731 B10R0.4 CCOCCCNC[C@@H](C)O 2230a_100000210961_100009817552 [0,1,0,0,0,0|3,0,0]=4 2732 B10R0.4 CCOCCCNC[C@@H](C)O 34a_100000210961_100009817552 [0,1,0,0,0,0|3,0,0]=4 2733 B10R0.4 CCOCCCOCC(=O)C 34a_100000211253_100012232248 [0,1,0,0,0,0|3,0,0]=4 2734 B10R0.4 CCOCCCOCC(C)Br 34a_100012180447_100012232248 [0,1,0,0,0,0|3,0,0]=4 2735 B10R0.4 CCOCCCOCC(C)C 34a_100000210257_100012232248 [0,1,0,0,0,0|3,0,0]=4 2736 B10R0.4 CCOCCCOCC(C)C 34a_100000757476_100000210624 [0,1,0,0,0,0|3,0,0]=4 2737 B10R0.4 CCOCCCOCC(C)C 7a_100000757476_100000210760 [0,1,0,0,0,0|3,0,0]=4 2738 B10R0.4 CCOCCCOCC(C)F 34a_100015925927_100012232248 [0,1,0,0,0,0|3,0,0]=4 2739 B10R0.4 CCOCCCOCC(C)O 34a_100000757476_100011218427 [0,1,0,0,0,0|3,0,0]=4 2740 B10R0.4 CCOCCCOCC(C)O 7a_100000757476_100011218427 [0,1,0,0,0,0|3,0,0]=4 2741 B10R0.4 CCOCCCOC[C@@H](C)Cl 34a_100016084084_100012232248 [0,1,0,0,0,0|3,0,0]=4 2742 B10R0.4 CCOCCCOC[C@@H](C)N 34a_100000737577_100012232248 [0,1,0,0,0,0|3,0,0]=4 2743 B10R0.4 CCOCCCOC[C@@H](C)O 34a_100000757476_100009817552 [0,1,0,0,0,0|3,0,0]=4 2744 B10R0.4 CCOCCCOC[C@@H](C)O 7a_100000757476_100009817552 [0,1,0,0,0,0|3,0,0]=4 2745 B10R0.4 CCOCCCSCC(C)C 62a_100000210624_100012232248 [0,1,0,0,0,0|3,0,0]=4 2746 B10R0.4 CCOCCCSCC(C)C 62a_100012232248_100000210760 [0,1,0,0,0,0|3,0,0]=4 2747 B10R0.4 CCOCCCSCC(C)O 62a_100011218427_100012232248 [0,1,0,0,0,0|3,0,0]=4 2748 B10R0.4 CCOCCCSCC(C)O 62a_100012232248_100011218427 [0,1,0,0,0,0|3,0,0]=4 2749 B10R0.4 CCOCCCSC[C@@H](C)O 62a_100009817552_100012232248 [0,1,0,0,0,0|3,0,0]=4 2750 B10R0.4 CCOCCCSC[C@@H](C)O 62a_100012232248_100009817552 [0,1,0,0,0,0|3,0,0]=4 2751 B10R0.4 CCOCCNCC=C(C)C 2230a_102516460346_100000761012 [0,1,0,0,0,0|2,0,1]=4 2752 B10R0.4 CCOCCNCC=C(C)C 34a_100000718196_100000210147 [0,1,0,0,0,0|2,0,1]=4 2753 B10R0.4 CCOCCNCC=C(C)C 34a_102516460346_100000761012 [0,1,0,0,0,0|2,0,1]=4 2754 B10R0.4 CCOCCNCCC(=O)N 2230a_102516460346_100000744528 [0,1,0,0,0,0|3,0,0]=4 2755 B10R0.4 CCOCCNCCC(=O)N 34a_102516460346_100000731001 [0,1,0,0,0,0|3,0,0]=4 2756 B10R0.4 CCOCCNCCC(C)C 2230a_102516460346_100000210312 [0,1,0,0,0,0|2,0,0]=3 2757 B10R0.4 CCOCCNCCC(C)C 269862a_100011200944_100000185833 [0,1,0,0,0,0|2,0,0]=3 2758 B10R0.4 CCOCCNCCC(C)C 34a_102516460346_100000210312 [0,1,0,0,0,0|2,0,0]=3 2759 B10R0.4 CCOCCNCCC(C)O 2230a_102516460346_100012276601 [0,1,0,0,0,0|2,0,0]=3 2760 B10R0.4 CCOCCNCCC(C)O 2230a_200000755665_100011215890 [0,1,0,0,0,0|2,0,0]=3 2761 B10R0.4 CCOCCNCCC(C)O 34a_102516460346_100012276601 [0,1,0,0,0,0|2,0,0]=3 2762 B10R0.4 CCOCCNCOC(=O)C 34a_102516460346_100009813279 [0,1,0,0,0,0|3,0,0]=4 2763 B10R0.4 CCOCCNCOC(C)C 2230a_102516460346_100000709892 [0,1,0,0,0,0|3,0,0]=4 2764 B10R0.4 CCOCCNCOC(C)C 34a_102516460346_100000709892 [0,1,0,0,0,0|3,0,0]=4 2765 B10R0.4 CCOCCOCC=C(C)C 34a_100000210136_100000761012 [0,1,0,0,0,0|1,0,1]=3 2766 B10R0.4 CCOCCOCC=C(C)C 34a_100000753907_100000210147 [0,1,0,0,0,0|1,0,1]=3 2767 B10R0.4 CCOCCOCC=C(C)C 7a_100000210136_100000761012 [0,1,0,0,0,0|1,0,1]=3 2768 B10R0.4 CCOCCOCCC(=O)C 1458a_100000070787_100011211534 [0,1,0,0,0,0|1,0,0]=2 2769 B10R0.4 CCOCCOCCC(=O)C 34a_100000759926_100000210147 [0,1,0,0,0,0|1,0,0]=2 2770 B10R0.4 CCOCCOCCC(=O)C 7a_100000210136_100000053229 [0,1,0,0,0,0|1,0,0]=2 2771 B10R0.4 CCOCCOCCC(=O)C 7a_100000759926_100011215890 [0,1,0,0,0,0|1,0,0]=2 2772 B10R0.4 CCOCCOCCC(=O)N 34a_100000210136_100000731001 [0,1,0,0,0,0|2,0,0]=3 2773 B10R0.4 CCOCCOCCC(=O)N 34a_100000757172_100000210147 [0,1,0,0,0,0|2,0,0]=3 2774 B10R0.4 CCOCCOCCC(=O)N 7a_100000210136_100000744528 [0,1,0,0,0,0|2,0,0]=3 2775 B10R0.4 CCOCCOCCC(=O)N 7a_100000757172_100011215890 [0,1,0,0,0,0|2,0,0]=3 2776 B10R0.4 CCOCCOCCC(C)Br 34a_100009893172_100000210147 [0,1,0,0,0,0|1,0,0]=2 2777 B10R0.4 CCOCCOCCC(C)C 34a_100000210136_100000210312 [0,1,0,0,0,0|1,0,0]=2 2778 B10R0.4 CCOCCOCCC(C)C 34a_100000210254_100000210147 [0,1,0,0,0,0|1,0,0]=2 2779 B10R0.4 CCOCCOCCC(C)C 7a_100000210136_100000210626 [0,1,0,0,0,0|1,0,0]=2 2780 B10R0.4 CCOCCOCCC(C)C 7a_100000210254_100011215890 [0,1,0,0,0,0|1,0,0]=2 2781 B10R0.4 CCOCCOCCC(C)O 34a_100000210136_100012276601 [0,1,0,0,0,0|1,0,0]=2 2782 B10R0.4 CCOCCOCCC(C)O 7a_100000210136_100012276601 [0,1,0,0,0,0|1,0,0]=2 2783 B10R0.4 CCOCCOCCC(F)F 34a_100103093639_100000210147 [0,1,0,0,0,0|2,0,0]=3 2784 B10R0.4 CCOCCOCCN(C)C 2230a_100102631434_100011211534 [0,1,0,0,0,0|1,0,0]=2 2785 B10R0.4 CCOCCOCCN(C)C 269982a_100102631434_100011211534 [0,1,0,0,0,0|1,0,0]=2 2786 B10R0.4 CCOCCOCCN(C)C 7a_100000210136_100000755713 [0,1,0,0,0,0|1,0,0]=2 2787 B10R0.4 CCOCCOCC[C@@H](C)N 34a_100000706166_100000210147 [0,1,0,0,0,0|1,0,0]=2 2788 B10R0.4 CCOCCOCOC(=O)C 34a_100000210136_100009813279 [0,1,0,0,0,0|2,0,0]=3 2789 B10R0.4 CCOCCOCOC(C)C 34a_100000210136_100000709892 [0,1,0,0,0,0|2,0,0]=3 2790 B10R0.4 CCOCCSCC=C(C)C 62a_100000210147_100000761012 [0,1,0,0,0,0|1,1,1]=4 2791 B10R0.4 CCOCCSCC=C(C)C 62a_100000761012_100011215890 [0,1,0,0,0,0|1,1,1]=4 2792 B10R0.4 CCOCCSCCC(=O)C 62a_100000053229_100011215890 [0,1,0,0,0,0|1,1,0]=3 2793 B10R0.4 CCOCCSCCC(=O)C 62a_100000210147_100000053229 [0,1,0,0,0,0|1,1,0]=3 2794 B10R0.4 CCOCCSCCC(=O)N 62a_100000210147_100000744528 [0,1,0,0,0,0|2,1,0]=4 2795 B10R0.4 CCOCCSCCC(=O)N 62a_100000744528_100011215890 [0,1,0,0,0,0|2,1,0]=4 2796 B10R0.4 CCOCCSCCC(C)C 62a_100000210147_100000210312 [0,1,0,0,0,0|1,1,0]=3 2797 B10R0.4 CCOCCSCCC(C)C 62a_100000210312_100011215890 [0,1,0,0,0,0|1,1,0]=3 2798 B10R0.4 CCOCCSCCC(C)O 62a_100000210147_100012276601 [0,1,0,0,0,0|1,1,0]=3 2799 B10R0.4 CCOCCSCCC(C)O 62a_100012276601_100011215890 [0,1,0,0,0,0|1,1,0]=3 2800 B10R0.4 CCOCCSCCN(C)C 62a_100000210147_100000755713 [0,1,0,0,0,0|1,1,0]=3 2801 B10R0.4 CCOCCSCOC(=O)C 62a_100000076356_100011215890 [0,1,0,0,0,0|2,1,0]=4 2802 B10R0.4 CCOCCSCOC(=O)C 62a_100000210147_100000076356 [0,1,0,0,0,0|2,1,0]=4 2803 B10R0.4 CCOCCSCOC(C)C 62a_100000210147_100000709892 [0,1,0,0,0,0|2,1,0]=4 2804 B10R0.4 CCOCCSCOC(C)C 62a_100000709892_100011215890 [0,1,0,0,0,0|2,1,0]=4 2805 B10R0.4 CCOCOCCOC(=O)C 34a_100121572206_100000076355 [0,1,0,0,0,0|2,0,1]=4 2806 B10R0.4 CCOCSCCCC(=O)C 62a_100000739092_100011215641 [0,1,0,0,0,0|3,0,0]=4 2807 B10R0.4 CCOCSCCCC(=O)C 62a_100011215641_100000739092 [0,1,0,0,0,0|3,0,0]=4 2808 B10R0.4 CCOCSCCCC(C)C 62a_100000739092_100011214892 [0,1,0,0,0,0|3,0,0]=4 2809 B10R0.4 CCOCSCCCC(C)C 62a_100011214892_100000739092 [0,1,0,0,0,0|3,0,0]=4 2810 B10R0.4 CCOCSCCCC(C)O 62a_100000739092_200000718107 [0,1,0,0,0,0|3,0,0]=4 2811 B10R0.4 CCOCSCCCC(C)O 62a_200000718107_100000739092 [0,1,0,0,0,0|3,0,0]=4 2812 B10R0.4 CCOCSCCCN(C)C 62a_100000739092_100000757444 [0,1,0,0,0,0|3,0,0]=4 2813 B10R0.4 CCOCSCCOC(C)C 62a_100000211751_100000739092 [0,1,0,0,0,0|2,1,0]=4 2814 B10R0.4 CCOCSCCOC(C)C 62a_100000739092_100000211751 [0,1,0,0,0,0|2,1,0]=4 2815 B10R0.4 CCSCCCCCC(C)C 62a_100000210202_100000210682 [0,1,0,0,0,0|2,1,0]=4 2816 B10R0.4 CCSCCCCCC(C)C 62a_100000210682_100000210202 [0,1,0,0,0,0|2,1,0]=4 2817 B10R0.4 CCSCCNCCC(C)C 2230a_100000106463_100000210312 [0,1,0,0,0,0|2,1,0]=4 2818 B10R0.4 CCSCCNCCC(C)C 269862a_100000106463_100000185833 [0,1,0,0,0,0|2,1,0]=4 2819 B10R0.4 CCSCCNCCC(C)O 2230a_100000106463_100012276601 [0,1,0,0,0,0|2,1,0]=4 2820 B10R0.4 CCSCCNCCC(C)O 2230a_200000755665_100000757381 [0,1,0,0,0,0|2,1,0]=4 2821 B10R0.4 CCSCCOCC=C(C)C 34a_100000212035_100000761012 [0,1,0,0,0,0|1,1,1]=4 2822 B10R0.4 CCSCCOCC=C(C)C 34a_100000753907_100000757381 [0,1,0,0,0,0|1,1,1]=4 2823 B10R0.4 CCSCCOCC=C(C)C 7a_100000212035_100000761012 [0,1,0,0,0,0|1,1,1]=4 2824 B10R0.4 CCSCCOCCC(=O)C 34a_100000759926_100000757381 [0,1,0,0,0,0|1,1,0]=3 2825 B10R0.4 CCSCCOCCC(=O)C 7a_100000212035_100000053229 [0,1,0,0,0,0|1,1,0]=3 2826 B10R0.4 CCSCCOCCC(=O)C 7a_100000759926_100000757381 [0,1,0,0,0,0|1,1,0]=3 2827 B10R0.4 CCSCCOCCC(=O)N 34a_100000212035_100000731001 [0,1,0,0,0,0|2,1,0]=4 2828 B10R0.4 CCSCCOCCC(=O)N 34a_100000757172_100000757381 [0,1,0,0,0,0|2,1,0]=4 2829 B10R0.4 CCSCCOCCC(=O)N 7a_100000212035_100000744528 [0,1,0,0,0,0|2,1,0]=4 2830 B10R0.4 CCSCCOCCC(=O)N 7a_100000757172_100000757381 [0,1,0,0,0,0|2,1,0]=4 2831 B10R0.4 CCSCCOCCC(C)Br 34a_100009893172_100000757381 [0,1,0,0,0,0|1,1,0]=3 2832 B10R0.4 CCSCCOCCC(C)C 34a_100000210254_100000757381 [0,1,0,0,0,0|1,1,0]=3 2833 B10R0.4 CCSCCOCCC(C)C 34a_100000212035_100000210312 [0,1,0,0,0,0|1,1,0]=3 2834 B10R0.4 CCSCCOCCC(C)C 7a_100000210254_100000757381 [0,1,0,0,0,0|1,1,0]=3 2835 B10R0.4 CCSCCOCCC(C)C 7a_100000212035_100000210626 [0,1,0,0,0,0|1,1,0]=3 2836 B10R0.4 CCSCCOCCC(C)O 34a_100000212035_100012276601 [0,1,0,0,0,0|1,1,0]=3 2837 B10R0.4 CCSCCOCCC(C)O 7a_100000212035_100012276601 [0,1,0,0,0,0|1,1,0]=3 2838 B10R0.4 CCSCCOCCC(F)F 34a_100103093639_100000757381 [0,1,0,0,0,0|2,1,0]=4 2839 B10R0.4 CCSCCOCCN(C)C 7a_100000212035_100000755713 [0,1,0,0,0,0|1,1,0]=3 2840 B10R0.4 CCSCCOCC[C@@H](C)N 34a_100000706166_100000757381 [0,1,0,0,0,0|1,1,0]=3 2841 B10R0.4 CCSCCOCOC(=O)C 34a_100000212035_100009813279 [0,1,0,0,0,0|2,1,0]=4 2842 B10R0.4 CCSCCOCOC(C)C 34a_100000212035_100000709892 [0,1,0,0,0,0|2,1,0]=4 2843 B10R0.4 CCSCCSCCC(=O)C 62a_100000053229_100000757381 [0,1,0,0,0,0|1,2,0]=4 2844 B10R0.4 CCSCCSCCC(=O)C 62a_100000757381_100000053229 [0,1,0,0,0,0|1,2,0]=4 2845 B10R0.4 CCSCCSCCC(C)C 62a_100000210312_100000757381 [0,1,0,0,0,0|1,2,0]=4 2846 B10R0.4 CCSCCSCCC(C)C 62a_100000757381_100000210312 [0,1,0,0,0,0|1,2,0]=4 2847 B10R0.4 CCSCCSCCC(C)O 62a_100000757381_100012276601 [0,1,0,0,0,0|1,2,0]=4 2848 B10R0.4 CCSCCSCCC(C)O 62a_100012276601_100000757381 [0,1,0,0,0,0|1,2,0]=4 2849 B10R0.4 CCSCCSCCN(C)C 62a_100000757381_100000755713 [0,1,0,0,0,0|1,2,0]=4 2850 B10R0.4 CCSCOCCOC(=O)C 62a_100000076355_100000210202 [0,1,0,0,0,0|2,0,1]=4 2851 B10R0.4 CCSCOCCOC(=O)C 62a_100000210202_100000076355 [0,1,0,0,0,0|2,0,1]=4 2852 B10R0.4 CN(C)CCOCCCCCl 7a_100000210776_100000755713 [0,1,0,0,0,0|3,0,0]=4 2853 B10R0.4 CN(C)CCOCCCCF 7a_100011995726_100000755713 [0,1,0,0,0,0|3,0,0]=4 2854 B10R0.4 CNCCCCCCC(C)C 2230a_100000211014_200000210301 [0,1,0,0,0,0|3,0,0]=4 2855 B10R0.4 CNCCCCCCC(C)C 34a_100000211014_200000210301 [0,1,0,0,0,0|3,0,0]=4 2856 B10R0.4 CNCCCCCOC(=O)C 2230a_106832991635_100009813381 [0,1,0,0,0,0|2,0,1]=4 2857 B10R0.4 CNCCCCCOC(=O)C 34a_100102657272_100000033007 [0,1,0,0,0,0|2,0,1]=4 2858 B10R0.4 CNCCCCCOC(=O)C 7a_106832991635_100000033007 [0,1,0,0,0,0|2,0,1]=4 2859 B10R0.4 CNCCCCCOC(C)C 34a_100000722520_100000210206 [0,1,0,0,0,0|2,0,0]=3 2860 B10R0.4 CNCCCOCCC(C)C 34a_100000213112_100000210312 [0,1,0,0,0,0|3,0,0]=4 2861 B10R0.4 CNCCCOCCC(C)O 34a_100000213112_100012276601 [0,1,0,0,0,0|3,0,0]=4 2862 B10R0.4 CNCCCOCOC(C)C 34a_100000213112_100000709892 [0,1,0,0,0,0|3,0,0]=4 2863 B10R0.4 CNCCOCCOC(=O)C 2230a_106832991635_200000083610 [0,1,0,0,0,0|1,0,1]=3 2864 B10R0.4 CNCCOCCOC(=O)C 34a_100102657272_200000083610 [0,1,0,0,0,0|1,0,1]=3 2865 B10R0.4 CNCCOCCOC(=O)C 7a_106832991635_200000083610 [0,1,0,0,0,0|1,0,1]=3 2866 B10R0.4 CNCCOCCOC(C)C 34a_100000228057_100000210206 [0,1,0,0,0,0|1,0,0]=2 2867 B10R0.4 COCCCCCCC(=O)C 1458a_100000070787_100011998445 [0,1,0,0,0,0|2,0,1]=4 2868 B10R0.4 COCCCCCCN(C)C 2230a_100102631434_100011998445 [0,1,0,0,0,0|3,0,0]=4 2869 B10R0.4 COCCCCCCN(C)C 269982a_100102631434_100011998445 [0,1,0,0,0,0|3,0,0]=4 2870 B10R0.4 COCCCCCNC(=O)C 11a_100000747528_100015343762 [0,1,0,0,0,0|2,0,1]=4 2871 B10R0.4 COCCCCCNC(=O)C 1626a_100000747528_100015343762 [0,1,0,0,0,0|2,0,1]=4 2872 B10R0.4 COCCCCCNC(=O)C 240690a_100000747528_100015343762 [0,1,0,0,0,0|2,0,1]=4 2873 B10R0.4 COCCCCCNC(=O)C 527a_100000747528_100103153847 [0,1,0,0,0,0|2,0,1]=4 2874 B10R0.4 COCCCCCNC(C)C 2230a_100000747528_100000210206 [0,1,0,0,0,0|2,0,0]=3 2875 B10R0.4 COCCCCCNC(C)C 34a_100000747528_100000210206 [0,1,0,0,0,0|2,0,0]=3 2876 B10R0.4 COCCCCCNC(C)C 34a_100011629493_200000210301 [0,1,0,0,0,0|2,0,0]=3 2877 B10R0.4 COCCCCCOC(=O)C 34a_100138415774_100000033007 [0,1,0,0,0,0|1,0,1]=3 2878 B10R0.4 COCCCCNCC(C)C 2230a_100000210953_100000730899 [0,1,0,0,0,0|3,0,0]=4 2879 B10R0.4 COCCCCNCC(C)C 34a_100000210953_100000755781 [0,1,0,0,0,0|3,0,0]=4 2880 B10R0.4 COCCCCNCC(C)O 2230a_100000210904_100000730899 [0,1,0,0,0,0|3,0,0]=4 2881 B10R0.4 COCCCCNCC(C)O 34a_100000210904_100000755781 [0,1,0,0,0,0|3,0,0]=4 2882 B10R0.4 COCCCCOCC(C)Br 34a_100012180447_100000755781 [0,1,0,0,0,0|3,0,0]=4 2883 B10R0.4 COCCCCOCC(C)C 34a_100000210257_100000755781 [0,1,0,0,0,0|3,0,0]=4 2884 B10R0.4 COCCCCOCC(C)C 34a_100000740925_100000210624 [0,1,0,0,0,0|3,0,0]=4 2885 B10R0.4 COCCCCOCC(C)F 34a_100015925927_100000755781 [0,1,0,0,0,0|3,0,0]=4 2886 B10R0.4 COCCCCOCC(C)O 34a_100000740925_100011218427 [0,1,0,0,0,0|3,0,0]=4 2887 B10R0.4 COCCCCOC[C@@H](C)Cl 34a_100016084084_100000755781 [0,1,0,0,0,0|3,0,0]=4 2888 B10R0.4 COCCCCOC[C@@H](C)N 34a_100000737577_100000755781 [0,1,0,0,0,0|3,0,0]=4 2889 B10R0.4 COCCCCOC[C@@H](C)O 34a_100000740925_100009817552 [0,1,0,0,0,0|3,0,0]=4 2890 B10R0.4 COCCCCSCC(C)C 62a_100000210624_100000730899 [0,1,0,0,0,0|3,0,0]=4 2891 B10R0.4 COCCCCSCC(C)C 62a_100000730899_100000210760 [0,1,0,0,0,0|3,0,0]=4 2892 B10R0.4 COCCCCSCC(C)O 62a_100000730899_100011218427 [0,1,0,0,0,0|3,0,0]=4 2893 B10R0.4 COCCCCSCC(C)O 62a_100011218427_100000730899 [0,1,0,0,0,0|3,0,0]=4 2894 B10R0.4 COCCCCSC[C@@H](C)O 62a_100000730899_100009817552 [0,1,0,0,0,0|3,0,0]=4 2895 B10R0.4 COCCCCSC[C@@H](C)O 62a_100009817552_100000730899 [0,1,0,0,0,0|3,0,0]=4 2896 B10R0.4 COCCCNCCC(C)C 269862a_100150723488_100000185833 [0,1,0,0,0,0|3,0,0]=4 2897 B10R0.4 COCCCNCCC(C)C 34a_100150723488_100000210312 [0,1,0,0,0,0|3,0,0]=4 2898 B10R0.4 COCCCNCCC(C)O 2230a_200000755665_100000740836 [0,1,0,0,0,0|3,0,0]=4 2899 B10R0.4 COCCCNCCC(C)O 34a_100150723488_100012276601 [0,1,0,0,0,0|3,0,0]=4 2900 B10R0.4 COCCCNCOC(=O)C 34a_100150723488_100009813279 [0,1,0,0,0,0|2,0,1]=4 2901 B10R0.4 COCCCNCOC(C)C 34a_100150723488_100000709892 [0,1,0,0,0,0|2,0,0]=3 2902 B10R0.4 COCCCOCCC(=O)C 34a_100000759926_100000740836 [0,1,0,0,0,0|3,0,0]=4 2903 B10R0.4 COCCCOCCC(=O)C 7a_100000759926_100000740836 [0,1,0,0,0,0|3,0,0]=4 2904 B10R0.4 COCCCOCCC(C)Br 34a_100009893172_100000740836 [0,1,0,0,0,0|3,0,0]=4 2905 B10R0.4 COCCCOCCC(C)C 34a_100000210254_100000740836 [0,1,0,0,0,0|3,0,0]=4 2906 B10R0.4 COCCCOCCC(C)C 34a_100000740835_100000210312 [0,1,0,0,0,0|3,0,0]=4 2907 B10R0.4 COCCCOCCC(C)C 7a_100000210254_100000740836 [0,1,0,0,0,0|3,0,0]=4 2908 B10R0.4 COCCCOCCC(C)O 34a_100000740835_100012276601 [0,1,0,0,0,0|3,0,0]=4 2909 B10R0.4 COCCCOCC[C@@H](C)N 34a_100000706166_100000740836 [0,1,0,0,0,0|3,0,0]=4 2910 B10R0.4 COCCCOCOC(=O)C 34a_100000740835_100009813279 [0,1,0,0,0,0|2,0,1]=4 2911 B10R0.4 COCCCOCOC(C)C 34a_100000740835_100000709892 [0,1,0,0,0,0|2,0,0]=3 2912 B10R0.4 COCCCSCCC(C)C 62a_100000210312_100000709357 [0,1,0,0,0,0|3,0,0]=4 2913 B10R0.4 COCCCSCCC(C)C 62a_100000709357_100000210312 [0,1,0,0,0,0|3,0,0]=4 2914 B10R0.4 COCCCSCCC(C)O 62a_100000709357_100012276601 [0,1,0,0,0,0|3,0,0]=4 2915 B10R0.4 COCCCSCCC(C)O 62a_100012276601_100000709357 [0,1,0,0,0,0|3,0,0]=4 2916 B10R0.4 COCCCSCOC(=O)C 62a_100000076356_100000709357 [0,1,0,0,0,0|2,0,1]=4 2917 B10R0.4 COCCCSCOC(=O)C 62a_100000709357_100000076356 [0,1,0,0,0,0|2,0,1]=4 2918 B10R0.4 COCCCSCOC(C)C 62a_100000709357_100000709892 [0,1,0,0,0,0|2,0,0]=3 2919 B10R0.4 COCCCSCOC(C)C 62a_100000709892_100000709357 [0,1,0,0,0,0|2,0,0]=3 2920 B10R0.4 COCCNCCC=C(C)C 2230a_100000209980_100011217483 [0,1,0,0,0,0|2,0,1]=4 2921 B10R0.4 COCCNCCCC(C)C 2230a_100000209980_100011214892 [0,1,0,0,0,0|2,0,0]=3 2922 B10R0.4 COCCNCCCC(C)C 2230a_200000737386_100011201679 [0,1,0,0,0,0|2,0,0]=3 2923 B10R0.4 COCCNCCCC(C)C 34a_200000737386_100011201679 [0,1,0,0,0,0|2,0,0]=3 2924 B10R0.4 COCCNCCCC(C)O 2230a_100000209980_200000718107 [0,1,0,0,0,0|2,0,0]=3 2925 B10R0.4 COCCNCCCS(=O)C 2230a_200000753449_100011201679 [0,1,0,0,0,0|3,0,0]=4 2926 B10R0.4 COCCNCCNC(=O)C 2230a_100000209853_100011201679 [0,1,0,0,0,0|2,0,1]=4 2927 B10R0.4 COCCNCCNC(=O)C 2230a_100000209980_100000189650 [0,1,0,0,0,0|2,0,1]=4 2928 B10R0.4 COCCNCCOC(C)C 2230a_100000209980_100000211751 [0,1,0,0,0,0|1,0,0]=2 2929 B10R0.4 COCCNCCOC(C)C 2230a_100000701111_100011201679 [0,1,0,0,0,0|1,0,0]=2 2930 B10R0.4 COCCNCCOC(C)C 34a_100000701111_100011201679 [0,1,0,0,0,0|1,0,0]=2 2931 B10R0.4 COCCNCCSC(C)C 2230a_100000209980_100000730970 [0,1,0,0,0,0|1,1,0]=3 2932 B10R0.4 COCCNCCSC(C)C 2230a_100000731138_100011201679 [0,1,0,0,0,0|1,1,0]=3 2933 B10R0.4 COCCNCCSC(C)C 34a_100000731138_100011201679 [0,1,0,0,0,0|1,1,0]=3 2934 B10R0.4 COCCOCCC=C(C)C 34a_100000210237_100011217483 [0,1,0,0,0,0|1,0,1]=3 2935 B10R0.4 COCCOCCC=C(F)F 34a_100000210237_200009816681 [0,1,0,0,0,0|2,0,1]=4 2936 B10R0.4 COCCOCCCC(=O)C 1458a_100000070787_100011216529 [0,1,0,0,0,0|1,0,1]=3 2937 B10R0.4 COCCOCCCC(=O)C 34a_100000210237_100000685027 [0,1,0,0,0,0|1,0,1]=3 2938 B10R0.4 COCCOCCCC(=O)C 34a_100000759063_100011201679 [0,1,0,0,0,0|1,0,1]=3 2939 B10R0.4 COCCOCCCC(=O)C 7a_100000759063_100000233755 [0,1,0,0,0,0|1,0,1]=3 2940 B10R0.4 COCCOCCCC(=O)N 34a_100000210237_100102525003 [0,1,0,0,0,0|2,0,1]=4 2941 B10R0.4 COCCOCCCC(C)C 34a_100000210237_100011214892 [0,1,0,0,0,0|1,0,0]=2 2942 B10R0.4 COCCOCCCC(C)C 34a_100000210774_100011201679 [0,1,0,0,0,0|1,0,0]=2 2943 B10R0.4 COCCOCCCC(C)C 7a_100000210774_100000233755 [0,1,0,0,0,0|1,0,0]=2 2944 B10R0.4 COCCOCCCC(C)O 34a_100000210237_200000718107 [0,1,0,0,0,0|1,0,0]=2 2945 B10R0.4 COCCOCCCN(C)C 2230a_100102631434_100011216529 [0,1,0,0,0,0|2,0,0]=3 2946 B10R0.4 COCCOCCCN(C)C 269982a_100102631434_100011216529 [0,1,0,0,0,0|2,0,0]=3 2947 B10R0.4 COCCOCCC[N+](=O)[O-] 34a_200000037920_100011201679 [0,1,0,0,0,0|3,0,0]=4 2948 B10R0.4 COCCOCCNC(=O)C 11a_100000745349_100015343762 [0,1,0,0,0,0|1,0,1]=3 2949 B10R0.4 COCCOCCNC(=O)C 1626a_100000745349_100015343762 [0,1,0,0,0,0|1,0,1]=3 2950 B10R0.4 COCCOCCNC(=O)C 240690a_100000745349_100015343762 [0,1,0,0,0,0|1,0,1]=3 2951 B10R0.4 COCCOCCNC(=O)C 34a_100000158858_100011201679 [0,1,0,0,0,0|1,0,1]=3 2952 B10R0.4 COCCOCCNC(=O)C 527a_100000745349_100103153847 [0,1,0,0,0,0|1,0,1]=3 2953 B10R0.4 COCCOCCNC(=O)N 34a_100000181757_100011201679 [0,1,0,0,0,0|2,0,1]=4 2954 B10R0.4 COCCOCCNC(C)C 2230a_100000745349_100000210206 [0,1,0,0,0,0|1,0,0]=2 2955 B10R0.4 COCCOCCNC(C)C 2230a_100138425928_100000695917 [0,1,0,0,0,0|1,0,0]=2 2956 B10R0.4 COCCOCCNC(C)C 34a_100000224655_100011201679 [0,1,0,0,0,0|1,0,0]=2 2957 B10R0.4 COCCOCCNC(C)C 34a_100000745349_100000210206 [0,1,0,0,0,0|1,0,0]=2 2958 B10R0.4 COCCOCCNC(C)C 34a_100138425928_100000695917 [0,1,0,0,0,0|1,0,0]=2 2959 B10R0.4 COCCOCCOC(=O)C 34a_100000210237_100009814007 [0,1,0,0,0,0|0,0,1]=2 2960 B10R0.4 COCCOCCOC(=O)C 34a_100138415774_200000083610 [0,1,0,0,0,0|0,0,1]=2 2961 B10R0.4 COCCOCCOC(=O)N 34a_100000210237_200011214921 [0,1,0,0,0,0|1,0,1]=3 2962 B10R0.4 COCCOCCOC(=O)N 7a_100000766696_100000233755 [0,1,0,0,0,0|1,0,1]=3 2963 B10R0.4 COCCOCCOC(C)C 34a_100000210237_100000211751 [0,1,0,0,0,0|0,0,0]=1 2964 B10R0.4 COCCOCCOC(C)C 34a_100000211219_100011201679 [0,1,0,0,0,0|0,0,0]=1 2965 B10R0.4 COCCOCCOC(C)C 34a_100000212225_100000695917 [0,1,0,0,0,0|0,0,0]=1 2966 B10R0.4 COCCOCCOC(C)C 34a_100011215163_100000210206 [0,1,0,0,0,0|0,0,0]=1 2967 B10R0.4 COCCOCCOC(C)C 7a_100000211219_100000233755 [0,1,0,0,0,0|0,0,0]=1 2968 B10R0.4 COCCOCCOC(C)C 7a_100011215163_100000210206 [0,1,0,0,0,0|0,0,0]=1 2969 B10R0.4 COCCOCCSC(C)C 34a_100000210237_100000730970 [0,1,0,0,0,0|0,1,0]=2 2970 B10R0.4 COCCOCCSC(C)C 34a_200011212901_100011201679 [0,1,0,0,0,0|0,1,0]=2 2971 B10R0.4 COCCOCCSC(C)C 62a_100000210206_100000695917 [0,1,0,0,0,0|0,1,0]=2 2972 B10R0.4 COCCOCCSC(C)C 62a_100000695917_100000210206 [0,1,0,0,0,0|0,1,0]=2 2973 B10R0.4 COCCOCCSC(C)C 7a_200011212901_100000233755 [0,1,0,0,0,0|0,1,0]=2 2974 B10R0.4 COCCOCNCC(C)C 2230a_100000210953_100000231047 [0,1,0,0,0,0|2,0,0]=3 2975 B10R0.4 COCCOCNCC(C)O 2230a_100000210904_100000231047 [0,1,0,0,0,0|2,0,0]=3 2976 B10R0.4 COCCOCSCC(C)C 62a_100000210624_100000231047 [0,1,0,0,0,0|2,0,0]=3 2977 B10R0.4 COCCOCSCC(C)C 62a_100000231047_100000210760 [0,1,0,0,0,0|2,0,0]=3 2978 B10R0.4 COCCOCSCC(C)O 62a_100000231047_100011218427 [0,1,0,0,0,0|2,0,0]=3 2979 B10R0.4 COCCOCSCC(C)O 62a_100011218427_100000231047 [0,1,0,0,0,0|2,0,0]=3 2980 B10R0.4 COCCOCSCC(F)F 62a_100000231047_100011934356 [0,1,0,0,0,0|3,0,0]=4 2981 B10R0.4 COCCOCSCC(F)F 62a_100011934356_100000231047 [0,1,0,0,0,0|3,0,0]=4 2982 B10R0.4 COCCOCSC[C@@H](C)O 62a_100000231047_100009817552 [0,1,0,0,0,0|2,0,0]=3 2983 B10R0.4 COCCOCSC[C@@H](C)O 62a_100009817552_100000231047 [0,1,0,0,0,0|2,0,0]=3 2984 B10R0.4 COCCSCCC=C(C)C 62a_100000233755_100011217483 [0,1,0,0,0,0|1,1,1]=4 2985 B10R0.4 COCCSCCC=C(C)C 62a_100011217483_100000233755 [0,1,0,0,0,0|1,1,1]=4 2986 B10R0.4 COCCSCCCC(=O)C 62a_100000233755_100011215641 [0,1,0,0,0,0|1,1,1]=4 2987 B10R0.4 COCCSCCCC(=O)C 62a_100011215641_100000233755 [0,1,0,0,0,0|1,1,1]=4 2988 B10R0.4 COCCSCCCC(C)C 62a_100000233755_100011214892 [0,1,0,0,0,0|1,1,0]=3 2989 B10R0.4 COCCSCCCC(C)C 62a_100011214892_100000233755 [0,1,0,0,0,0|1,1,0]=3 2990 B10R0.4 COCCSCCCC(C)O 62a_100000233755_200000718107 [0,1,0,0,0,0|1,1,0]=3 2991 B10R0.4 COCCSCCCC(C)O 62a_200000718107_100000233755 [0,1,0,0,0,0|1,1,0]=3 2992 B10R0.4 COCCSCCCN(C)C 62a_100000233755_100000757444 [0,1,0,0,0,0|2,1,0]=4 2993 B10R0.4 COCCSCCNC(=O)C 62a_100000189650_100000233755 [0,1,0,0,0,0|1,1,1]=4 2994 B10R0.4 COCCSCCNC(=O)C 62a_100000233755_100000189650 [0,1,0,0,0,0|1,1,1]=4 2995 B10R0.4 COCCSCCOC(=O)C 62a_100000233755_100009814007 [0,1,0,0,0,0|0,1,1]=3 2996 B10R0.4 COCCSCCOC(=O)C 62a_100009814007_100000233755 [0,1,0,0,0,0|0,1,1]=3 2997 B10R0.4 COCCSCCOC(=O)N 62a_100000233755_200011214921 [0,1,0,0,0,0|1,1,1]=4 2998 B10R0.4 COCCSCCOC(=O)N 62a_200011214921_100000233755 [0,1,0,0,0,0|1,1,1]=4 2999 B10R0.4 COCCSCCOC(C)C 62a_100000211751_100000233755 [0,1,0,0,0,0|0,1,0]=2 3000 B10R0.4 COCCSCCOC(C)C 62a_100000233755_100000211751 [0,1,0,0,0,0|0,1,0]=2 3001 B10R0.4 COCCSCCSC(C)C 62a_100000233755_100000730970 [0,1,0,0,0,0|0,2,0]=3 3002 B10R0.4 COCCSCCSC(C)C 62a_100000730970_100000233755 [0,1,0,0,0,0|0,2,0]=3 3003 B10R0.4 COCNCCCOC(C)C 2230a_100000737246_100000766300 [0,1,0,0,0,0|2,0,0]=3 3004 B10R0.4 COCSCCCCC(C)C 62a_100000766300_100011216152 [0,1,0,0,0,0|3,0,0]=4 3005 B10R0.4 COCSCCCCC(C)C 62a_100011216152_100000766300 [0,1,0,0,0,0|3,0,0]=4 3006 B10R0.4 COCSCCCOC(=O)C 62a_100000042594_100000766300 [0,1,0,0,0,0|2,0,1]=4 3007 B10R0.4 COCSCCCOC(=O)C 62a_100000766300_100000042594 [0,1,0,0,0,0|2,0,1]=4 3008 B10R0.4 COCSCCCOC(=S)C 62a_100000766300_200135323944 [0,1,0,0,0,0|2,0,1]=4 3009 B10R0.4 COCSCCCOC(=S)C 62a_200135323944_100000766300 [0,1,0,0,0,0|2,0,1]=4 3010 B10R0.4 CSCCCCCOC(=O)C 62a_100000033007_200000210301 [0,1,0,0,0,0|1,1,1]=4 3011 B10R0.4 CSCCCCCOC(=O)C 62a_200000210301_100000033007 [0,1,0,0,0,0|1,1,1]=4 3012 B10R0.4 CSCCCNCOC(C)C 2230a_100000749238_100000709892 [0,1,0,0,0,0|2,1,0]=4 3013 B10R0.4 CSCCCOCCC(=O)C 7a_100000690336_100000053229 [0,1,0,0,0,0|3,0,0]=4 3014 B10R0.4 CSCCCOCCC(C)C 34a_100000690336_100000210312 [0,1,0,0,0,0|3,0,0]=4 3015 B10R0.4 CSCCCOCCC(C)C 7a_100000690336_100000210626 [0,1,0,0,0,0|3,0,0]=4 3016 B10R0.4 CSCCCOCCC(C)O 34a_100000690336_100012276601 [0,1,0,0,0,0|3,0,0]=4 3017 B10R0.4 CSCCCOCCC(C)O 7a_100000690336_100012276601 [0,1,0,0,0,0|3,0,0]=4 3018 B10R0.4 CSCCCOCCN(C)C 7a_100000690336_100000755713 [0,1,0,0,0,0|3,0,0]=4 3019 B10R0.4 CSCCCOCOC(C)C 34a_100000690336_100000709892 [0,1,0,0,0,0|2,1,0]=4 3020 B10R0.4 CSCCNCCCC(C)C 2230a_100020590264_100011214892 [0,1,0,0,0,0|2,1,0]=4 3021 B10R0.4 CSCCNCCCC(C)C 2230a_200000737386_100000751147 [0,1,0,0,0,0|2,1,0]=4 3022 B10R0.4 CSCCNCCCC(C)C 34a_200000737386_100000212216 [0,1,0,0,0,0|2,1,0]=4 3023 B10R0.4 CSCCNCCCC(C)O 2230a_100020590264_200000718107 [0,1,0,0,0,0|2,1,0]=4 3024 B10R0.4 CSCCNCCOC(C)C 2230a_100000701111_100000751147 [0,1,0,0,0,0|1,1,0]=3 3025 B10R0.4 CSCCNCCOC(C)C 2230a_100020590264_100000211751 [0,1,0,0,0,0|1,1,0]=3 3026 B10R0.4 CSCCNCCOC(C)C 34a_100000701111_100000212216 [0,1,0,0,0,0|1,1,0]=3 3027 B10R0.4 CSCCNCCSC(C)C 2230a_100000731138_100000751147 [0,1,0,0,0,0|1,2,0]=4 3028 B10R0.4 CSCCNCCSC(C)C 2230a_100020590264_100000730970 [0,1,0,0,0,0|1,2,0]=4 3029 B10R0.4 CSCCNCCSC(C)C 34a_100000731138_100000212216 [0,1,0,0,0,0|1,2,0]=4 3030 B10R0.4 CSCCOCCC=C(C)C 34a_100000230434_100011217483 [0,1,0,0,0,0|1,1,1]=4 3031 B10R0.4 CSCCOCCC=C(C)C 7a_100000230434_100011217483 [0,1,0,0,0,0|1,1,1]=4 3032 B10R0.4 CSCCOCCCC(=O)C 34a_100000230434_100000685027 [0,1,0,0,0,0|1,1,1]=4 3033 B10R0.4 CSCCOCCCC(=O)C 34a_100000759063_100000212216 [0,1,0,0,0,0|1,1,1]=4 3034 B10R0.4 CSCCOCCCC(=O)C 7a_100000230434_100011215641 [0,1,0,0,0,0|1,1,1]=4 3035 B10R0.4 CSCCOCCCC(=O)C 7a_100000759063_100000212216 [0,1,0,0,0,0|1,1,1]=4 3036 B10R0.4 CSCCOCCCC(C)C 34a_100000210774_100000212216 [0,1,0,0,0,0|1,1,0]=3 3037 B10R0.4 CSCCOCCCC(C)C 34a_100000230434_100011214892 [0,1,0,0,0,0|1,1,0]=3 3038 B10R0.4 CSCCOCCCC(C)C 7a_100000210774_100000212216 [0,1,0,0,0,0|1,1,0]=3 3039 B10R0.4 CSCCOCCCC(C)C 7a_100000230434_100011214892 [0,1,0,0,0,0|1,1,0]=3 3040 B10R0.4 CSCCOCCCC(C)O 34a_100000230434_200000718107 [0,1,0,0,0,0|1,1,0]=3 3041 B10R0.4 CSCCOCCCC(C)O 7a_100000230434_200000718107 [0,1,0,0,0,0|1,1,0]=3 3042 B10R0.4 CSCCOCCCN(C)C 7a_100000230434_100000757444 [0,1,0,0,0,0|2,1,0]=4 3043 B10R0.4 CSCCOCCNC(=O)C 34a_100000158858_100000212216 [0,1,0,0,0,0|1,1,1]=4 3044 B10R0.4 CSCCOCCNC(=O)C 7a_100000230434_100000189650 [0,1,0,0,0,0|1,1,1]=4 3045 B10R0.4 CSCCOCCNC(C)C 34a_100000224655_100000212216 [0,1,0,0,0,0|1,1,0]=3 3046 B10R0.4 CSCCOCCOC(=O)C 34a_100000230434_100009814007 [0,1,0,0,0,0|0,1,1]=3 3047 B10R0.4 CSCCOCCOC(=O)C 62a_200000083610_200000210301 [0,1,0,0,0,0|0,1,1]=3 3048 B10R0.4 CSCCOCCOC(=O)C 62a_200000210301_200000083610 [0,1,0,0,0,0|0,1,1]=3 3049 B10R0.4 CSCCOCCOC(=O)C 7a_100000230434_100009814007 [0,1,0,0,0,0|0,1,1]=3 3050 B10R0.4 CSCCOCCOC(=O)N 34a_100000230434_200011214921 [0,1,0,0,0,0|1,1,1]=4 3051 B10R0.4 CSCCOCCOC(=O)N 7a_100000230434_200011214921 [0,1,0,0,0,0|1,1,1]=4 3052 B10R0.4 CSCCOCCOC(=O)N 7a_100000766696_100000212216 [0,1,0,0,0,0|1,1,1]=4 3053 B10R0.4 CSCCOCCOC(C)C 34a_100000211219_100000212216 [0,1,0,0,0,0|0,1,0]=2 3054 B10R0.4 CSCCOCCOC(C)C 34a_100000230434_100000211751 [0,1,0,0,0,0|0,1,0]=2 3055 B10R0.4 CSCCOCCOC(C)C 7a_100000211219_100000212216 [0,1,0,0,0,0|0,1,0]=2 3056 B10R0.4 CSCCOCCOC(C)C 7a_100000230434_100000211751 [0,1,0,0,0,0|0,1,0]=2 3057 B10R0.4 CSCCOCCSC(C)C 34a_100000230434_100000730970 [0,1,0,0,0,0|0,2,0]=3 3058 B10R0.4 CSCCOCCSC(C)C 34a_200011212901_100000212216 [0,1,0,0,0,0|0,2,0]=3 3059 B10R0.4 CSCCOCCSC(C)C 7a_100000230434_100000730970 [0,1,0,0,0,0|0,2,0]=3 3060 B10R0.4 CSCCOCCSC(C)C 7a_200011212901_100000212216 [0,1,0,0,0,0|0,2,0]=3 3061 B10R0.4 CSCCSCCCC(C)C 62a_100000212216_100011214892 [0,1,0,0,0,0|1,2,0]=4 3062 B10R0.4 CSCCSCCCC(C)C 62a_100011214892_100000751147 [0,1,0,0,0,0|1,2,0]=4 3063 B10R0.4 CSCCSCCCC(C)O 62a_100000212216_200000718107 [0,1,0,0,0,0|1,2,0]=4 3064 B10R0.4 CSCCSCCCC(C)O 62a_200000718107_100000751147 [0,1,0,0,0,0|1,2,0]=4 3065 B10R0.4 CSCCSCCOC(=O)C 62a_100000212216_100009814007 [0,1,0,0,0,0|0,2,1]=4 3066 B10R0.4 CSCCSCCOC(=O)C 62a_100009814007_100000751147 [0,1,0,0,0,0|0,2,1]=4 3067 B10R0.4 CSCCSCCOC(C)C 62a_100000211751_100000751147 [0,1,0,0,0,0|0,2,0]=3 3068 B10R0.4 CSCCSCCOC(C)C 62a_100000212216_100000211751 [0,1,0,0,0,0|0,2,0]=3 3069 B10R0.4 CSCCSCCSC(C)C 62a_100000212216_100000730970 [0,1,0,0,0,0|0,3,0]=4 3070 B10R0.4 CSCCSCCSC(C)C 62a_100000730970_100000751147 [0,1,0,0,0,0|0,3,0]=4 3071 B10R0.4 CSCNCCCOC(C)C 2230a_100000737246_100011218213 [0,1,0,0,0,0|2,1,0]=4 3072 B10R0.4 CSCNCCCOC(C)C 34a_100000737246_100011218213 [0,1,0,0,0,0|2,1,0]=4 3073 B10R0.4 C[C@@H](N)CCOCCCCF 34a_100000706166_100000729493 [0,1,0,0,0,0|3,0,0]=4 3074 B10R0.4 C[C@@H](N)CCOCCCCO 34a_100000706166_100011216708 [0,1,0,0,0,0|3,0,0]=4 3075 B10R0.4 NOCCOCCOC(=O)N 34a_100000700252_200011214921 [0,1,0,0,0,0|2,0,1]=4 3076 B10R0.71 C#CCCCCCCCOC 34a_100000054614_200000210301 [0,1,0,0,0,0|2,0,1]=4 3077 B10R0.71 C#CCCCCCCCOC 34a_100138415774_100153394163 [0,1,0,0,0,0|2,0,1]=4 3078 B10R0.71 C#CCCCCCCCOC 7a_100000054614_200000210301 [0,1,0,0,0,0|2,0,1]=4 3079 B10R0.71 C#CCCCCCCCO[13CH3] 34a_100000054614_200025704644 [0,1,0,0,0,0|2,0,1]=4 3080 B10R0.71 C#CCCCCCCCO[13CH3] 7a_100000054614_200025704644 [0,1,0,0,0,0|2,0,1]=4 3081 B10R0.71 C#CCCCCCCOCC 34a_100011217361_100000210202 [0,1,0,0,0,0|2,0,1]=4 3082 B10R0.71 C#CCCCCCCOCC 34a_100121572206_100012276617 [0,1,0,0,0,0|2,0,1]=4 3083 B10R0.71 C#CCCCCCCOCC 7a_100011217361_100000210202 [0,1,0,0,0,0|2,0,1]=4 3084 B10R0.71 C#CCCCCCOCCBr 34a_100000211926_100012094781 [0,1,0,0,0,0|2,0,1]=4 3085 B10R0.71 C#CCCCCCOCCC 34a_100000210258_100012094781 [0,1,0,0,0,0|2,0,1]=4 3086 B10R0.71 C#CCCCCCOCCC 34a_100000766912_100000210303 [0,1,0,0,0,0|2,0,1]=4 3087 B10R0.71 C#CCCCCCOCCC 7a_100000766912_100000210303 [0,1,0,0,0,0|2,0,1]=4 3088 B10R0.71 C#CCCCCCOCCF 34a_100000766912_100011217306 [0,1,0,0,0,0|2,0,1]=4 3089 B10R0.71 C#CCCCCCOCCF 7a_100000766912_100011217306 [0,1,0,0,0,0|2,0,1]=4 3090 B10R0.71 C#CCCCCCOCCN 34a_100000210304_100012094781 [0,1,0,0,0,0|2,0,1]=4 3091 B10R0.71 C#CCCCCCOCCO 34a_100000766912_100000211926 [0,1,0,0,0,0|2,0,1]=4 3092 B10R0.71 C#CCCCCCOCCO 7a_100000766912_100000211926 [0,1,0,0,0,0|2,0,1]=4 3093 B10R0.71 C#CCCCCCOCSC 34a_100000766912_100011218213 [0,1,0,0,0,0|2,0,1]=4 3094 B10R0.71 C#CCCCCNCCOC 2230a_100000209980_100010269958 [0,1,0,0,0,0|2,0,1]=4 3095 B10R0.71 C#CCCCCNCCOC 2230a_100000706060_100011201679 [0,1,0,0,0,0|2,0,1]=4 3096 B10R0.71 C#CCCCCNCCOC 34a_100000706060_100011201679 [0,1,0,0,0,0|2,0,1]=4 3097 B10R0.71 C#CCCCCOCCCC 34a_100000210227_100010269958 [0,1,0,0,0,0|2,0,1]=4 3098 B10R0.71 C#CCCCCOCCCC 34a_100000766709_100000210210 [0,1,0,0,0,0|2,0,1]=4 3099 B10R0.71 C#CCCCCOCCCC 7a_100000210227_100010269958 [0,1,0,0,0,0|2,0,1]=4 3100 B10R0.71 C#CCCCCOCCCC 7a_100000766709_100000210211 [0,1,0,0,0,0|2,0,1]=4 3101 B10R0.71 C#CCCCCOCCOC 34a_100000210237_100010269958 [0,1,0,0,0,0|1,0,1]=3 3102 B10R0.71 C#CCCCCOCCOC 34a_100000766709_100011201679 [0,1,0,0,0,0|1,0,1]=3 3103 B10R0.71 C#CCCCCOCCOC 7a_100000766709_100000233755 [0,1,0,0,0,0|1,0,1]=3 3104 B10R0.71 C#CCCCCOCCON 34a_100000700252_100010269958 [0,1,0,0,0,0|2,0,1]=4 3105 B10R0.71 C#CCCCCOCCSC 34a_100000230434_100010269958 [0,1,0,0,0,0|1,1,1]=4 3106 B10R0.71 C#CCCCCOCCSC 34a_100000766709_100000212216 [0,1,0,0,0,0|1,1,1]=4 3107 B10R0.71 C#CCCCCOCCSC 7a_100000230434_100010269958 [0,1,0,0,0,0|1,1,1]=4 3108 B10R0.71 C#CCCCCOCCSC 7a_100000766709_100000212216 [0,1,0,0,0,0|1,1,1]=4 3109 B10R0.71 C#CCCCCSCCOC 62a_100000233755_100010269958 [0,1,0,0,0,0|1,1,1]=4 3110 B10R0.71 C#CCCCCSCCOC 62a_100010269958_100000233755 [0,1,0,0,0,0|1,1,1]=4 3111 B10R0.71 C#CCCCCSCOCC 62a_100000739092_100010269958 [0,1,0,0,0,0|2,0,1]=4 3112 B10R0.71 C#CCCCCSCOCC 62a_100010269958_100000739092 [0,1,0,0,0,0|2,0,1]=4 3113 B10R0.71 C#CCCCNCCOCC 2230a_102516460346_100000731252 [0,1,0,0,0,0|2,0,1]=4 3114 B10R0.71 C#CCCCNCCOCC 34a_100000718082_100000210147 [0,1,0,0,0,0|2,0,1]=4 3115 B10R0.71 C#CCCCNCCOCC 34a_102516460346_100000695029 [0,1,0,0,0,0|2,0,1]=4 3116 B10R0.71 C#CCCCOCCCCC 34a_100000210253_100000695029 [0,1,0,0,0,0|2,0,1]=4 3117 B10R0.71 C#CCCCOCCCCC 34a_100000215630_100000718602 [0,1,0,0,0,0|2,0,1]=4 3118 B10R0.71 C#CCCCOCCCCC 7a_100000210253_100011215417 [0,1,0,0,0,0|2,0,1]=4 3119 B10R0.71 C#CCCCOCCCCC 7a_100000215630_100000210326 [0,1,0,0,0,0|2,0,1]=4 3120 B10R0.71 C#CCCCOCCCOC 34a_100000215630_100000740836 [0,1,0,0,0,0|1,0,2]=4 3121 B10R0.71 C#CCCCOCCCOC 34a_100000740835_100000695029 [0,1,0,0,0,0|1,0,2]=4 3122 B10R0.71 C#CCCCOCCCOC 7a_100000215630_100000740836 [0,1,0,0,0,0|1,0,2]=4 3123 B10R0.71 C#CCCCOCCOCC 34a_100000210136_100000695029 [0,1,0,0,0,0|1,0,1]=3 3124 B10R0.71 C#CCCCOCCOCC 34a_100000215630_100000210147 [0,1,0,0,0,0|1,0,1]=3 3125 B10R0.71 C#CCCCOCCOCC 7a_100000210136_100011215417 [0,1,0,0,0,0|1,0,1]=3 3126 B10R0.71 C#CCCCOCCOCC 7a_100000215630_100011215890 [0,1,0,0,0,0|1,0,1]=3 3127 B10R0.71 C#CCCCOCCSCC 34a_100000212035_100000695029 [0,1,0,0,0,0|1,1,1]=4 3128 B10R0.71 C#CCCCOCCSCC 34a_100000215630_100000757381 [0,1,0,0,0,0|1,1,1]=4 3129 B10R0.71 C#CCCCOCCSCC 7a_100000212035_100011215417 [0,1,0,0,0,0|1,1,1]=4 3130 B10R0.71 C#CCCCOCCSCC 7a_100000215630_100000757381 [0,1,0,0,0,0|1,1,1]=4 3131 B10R0.71 C#CCCCSCCOCC 62a_100000210147_100011215417 [0,1,0,0,0,0|1,1,1]=4 3132 B10R0.71 C#CCCCSCCOCC 62a_100011215417_100011215890 [0,1,0,0,0,0|1,1,1]=4 3133 B10R0.71 C#CCCNCCCOCC 2230a_100000210961_100000688953 [0,1,0,0,0,0|2,0,1]=4 3134 B10R0.71 C#CCCNCCCOCC 34a_100000210961_100000688953 [0,1,0,0,0,0|2,0,1]=4 3135 B10R0.71 C#CCCNCCCOCC 34a_100000755551_100012232248 [0,1,0,0,0,0|2,0,1]=4 3136 B10R0.71 C#CCCNCCOCCC 2230a_100161115042_100000688953 [0,1,0,0,0,0|2,0,1]=4 3137 B10R0.71 C#CCCNCCOCCC 34a_100000755551_100011215938 [0,1,0,0,0,0|2,0,1]=4 3138 B10R0.71 C#CCCNCCOCCC 34a_100161115042_100000688953 [0,1,0,0,0,0|2,0,1]=4 3139 B10R0.71 C#CCCNCCOCCO 2230a_100000211614_100000688953 [0,1,0,0,0,0|2,0,1]=4 3140 B10R0.71 C#CCCNCCOCCO 34a_100000211614_100000688953 [0,1,0,0,0,0|2,0,1]=4 3141 B10R0.71 C#CCCNCCOCCO 34a_100000755551_100000692535 [0,1,0,0,0,0|2,0,1]=4 3142 B10R0.71 C#CCCOCC/C=C\CC 34a_100011215631_100015370543 [0,1,0,0,0,0|2,0,1]=4 3143 B10R0.71 C#CCCOCC/C=C\CC 34a_100016288707_100000688953 [0,1,0,0,0,0|2,0,1]=4 3144 B10R0.71 C#CCCOCC/C=C\CC 7a_100016288707_100000688953 [0,1,0,0,0,0|2,0,1]=4 3145 B10R0.71 C#CCCOCCC#CCC 34a_100000036655_100000688953 [0,1,0,0,0,0|2,0,1]=4 3146 B10R0.71 C#CCCOCCC#CCC 7a_100000036655_100000688953 [0,1,0,0,0,0|2,0,1]=4 3147 B10R0.71 C#CCCOCCCCCBr 34a_100000746331_100000688953 [0,1,0,0,0,0|2,0,1]=4 3148 B10R0.71 C#CCCOCCCCCBr 7a_100000746331_100000688953 [0,1,0,0,0,0|2,0,1]=4 3149 B10R0.71 C#CCCOCCCCCC 34a_100000210259_100000688953 [0,1,0,0,0,0|2,0,1]=4 3150 B10R0.71 C#CCCOCCCCCC 34a_100011215631_100000210314 [0,1,0,0,0,0|2,0,1]=4 3151 B10R0.71 C#CCCOCCCCCC 7a_100000210259_100000688953 [0,1,0,0,0,0|2,0,1]=4 3152 B10R0.71 C#CCCOCCCCCCl 34a_100000746330_100000688953 [0,1,0,0,0,0|2,0,1]=4 3153 B10R0.71 C#CCCOCCCCCCl 7a_100000746330_100000688953 [0,1,0,0,0,0|2,0,1]=4 3154 B10R0.71 C#CCCOCCCCCF 34a_100011215631_100000729378 [0,1,0,0,0,0|2,0,1]=4 3155 B10R0.71 C#CCCOCCCCCI 34a_200012148887_100000688953 [0,1,0,0,0,0|2,0,1]=4 3156 B10R0.71 C#CCCOCCCCCI 7a_200012148887_100000688953 [0,1,0,0,0,0|2,0,1]=4 3157 B10R0.71 C#CCCOCCCCCN 34a_100000762737_100000688953 [0,1,0,0,0,0|2,0,1]=4 3158 B10R0.71 C#CCCOCCCCCO 34a_100011215631_100000746330 [0,1,0,0,0,0|2,0,1]=4 3159 B10R0.71 C#CCCOCCCCOC 34a_100000740925_100000688953 [0,1,0,0,0,0|2,0,1]=4 3160 B10R0.71 C#CCCOCCCCOC 34a_100011215631_100000755781 [0,1,0,0,0,0|2,0,1]=4 3161 B10R0.71 C#CCCOCCCCSC 34a_100011217163_100000688953 [0,1,0,0,0,0|2,0,1]=4 3162 B10R0.71 C#CCCOCCCCSC 7a_100011217163_100000688953 [0,1,0,0,0,0|2,0,1]=4 3163 B10R0.71 C#CCCOCCCOCC 34a_100000757476_100000688953 [0,1,0,0,0,0|1,0,1]=3 3164 B10R0.71 C#CCCOCCCOCC 34a_100011215631_100012232248 [0,1,0,0,0,0|1,0,1]=3 3165 B10R0.71 C#CCCOCCCOCC 7a_100000757476_100000688953 [0,1,0,0,0,0|1,0,1]=3 3166 B10R0.71 C#CCCOCCCSCC 34a_100011216438_100000688953 [0,1,0,0,0,0|1,1,1]=4 3167 B10R0.71 C#CCCOCCCSCC 7a_100011216438_100000688953 [0,1,0,0,0,0|1,1,1]=4 3168 B10R0.71 C#CCCOCCOCC#C 34a_100000054580_100000688953 [0,1,0,0,0,0|1,0,2]=4 3169 B10R0.71 C#CCCOCCOCC#C 34a_100011215631_100010402529 [0,1,0,0,0,0|1,0,2]=4 3170 B10R0.71 C#CCCOCCOCC#C 7a_100000054580_100000688953 [0,1,0,0,0,0|1,0,2]=4 3171 B10R0.71 C#CCCOCCOCC=C 34a_100000037705_100000688953 [0,1,0,0,0,0|1,0,2]=4 3172 B10R0.71 C#CCCOCCOCC=C 7a_100000037705_100000688953 [0,1,0,0,0,0|1,0,2]=4 3173 B10R0.71 C#CCCOCCOCCBr 34a_100000692535_100000688953 [0,1,0,0,0,0|1,0,1]=3 3174 B10R0.71 C#CCCOCCOCCBr 7a_100000692535_100000688953 [0,1,0,0,0,0|1,0,1]=3 3175 B10R0.71 C#CCCOCCOCCC 34a_100000752267_100000688953 [0,1,0,0,0,0|1,0,1]=3 3176 B10R0.71 C#CCCOCCOCCC 34a_100011215631_100011215938 [0,1,0,0,0,0|1,0,1]=3 3177 B10R0.71 C#CCCOCCOCCC 7a_100000752267_100000688953 [0,1,0,0,0,0|1,0,1]=3 3178 B10R0.71 C#CCCOCCOCCCl 34a_100011215305_100000688953 [0,1,0,0,0,0|1,0,1]=3 3179 B10R0.71 C#CCCOCCOCCCl 7a_100011215305_100000688953 [0,1,0,0,0,0|1,0,1]=3 3180 B10R0.71 C#CCCOCCOCCF 34a_200015357709_100000688953 [0,1,0,0,0,0|1,0,1]=3 3181 B10R0.71 C#CCCOCCOCCF 7a_200015357709_100000688953 [0,1,0,0,0,0|1,0,1]=3 3182 B10R0.71 C#CCCOCCOCCI 34a_100012149058_100000688953 [0,1,0,0,0,0|1,0,1]=3 3183 B10R0.71 C#CCCOCCOCCI 7a_100012149058_100000688953 [0,1,0,0,0,0|1,0,1]=3 3184 B10R0.71 C#CCCOCCOCCN 34a_100000211614_100000688953 [0,1,0,0,0,0|1,0,1]=3 3185 B10R0.71 C#CCCOCCOCCO 34a_100011215631_100000692535 [0,1,0,0,0,0|1,0,1]=3 3186 B10R0.71 C#CCCOCCSCCC 34a_200000230433_100000688953 [0,1,0,0,0,0|1,1,1]=4 3187 B10R0.71 C#CCCOCCSCCC 7a_200000230433_100000688953 [0,1,0,0,0,0|1,1,1]=4 3188 B10R0.71 C#CCCOCOCCCC 34a_100011215631_100011995733 [0,1,0,0,0,0|2,0,1]=4 3189 B10R0.71 C#CCCSCCCOCC 62a_100000688953_100012232248 [0,1,0,0,0,0|1,1,1]=4 3190 B10R0.71 C#CCCSCCCOCC 62a_100012232248_100000688953 [0,1,0,0,0,0|1,1,1]=4 3191 B10R0.71 C#CCCSCCOCCC 62a_100000688953_100011215938 [0,1,0,0,0,0|1,1,1]=4 3192 B10R0.71 C#CCCSCCOCCC 62a_100011215938_100000688953 [0,1,0,0,0,0|1,1,1]=4 3193 B10R0.71 C#CCCSCCOCCO 62a_100000688953_100011215305 [0,1,0,0,0,0|1,1,1]=4 3194 B10R0.71 C#CCCSCCOCCO 62a_100011215305_100000688953 [0,1,0,0,0,0|1,1,1]=4 3195 B10R0.71 C#CCCSCOCCOC 62a_100000231047_100000688953 [0,1,0,0,0,0|1,0,2]=4 3196 B10R0.71 C#CCCSCOCCOC 62a_100000688953_100000231047 [0,1,0,0,0,0|1,0,2]=4 3197 B10R0.71 C#CCNCCCCCOC 2230a_100000747528_100000038162 [0,1,0,0,0,0|2,0,1]=4 3198 B10R0.71 C#CCNCCCCCOC 34a_100000747528_100000184674 [0,1,0,0,0,0|2,0,1]=4 3199 B10R0.71 C#CCNCCOCCCC 34a_100000212058_100000743108 [0,1,0,0,0,0|2,0,1]=4 3200 B10R0.71 C#CCNCCOCCOC 2230a_100000745349_100000038162 [0,1,0,0,0,0|1,0,1]=3 3201 B10R0.71 C#CCNCCOCCOC 34a_100000212058_100000695917 [0,1,0,0,0,0|1,0,1]=3 3202 B10R0.71 C#CCNCCOCCOC 34a_100000745349_100000184674 [0,1,0,0,0,0|1,0,1]=3 3203 B10R0.71 C#CCOCCCCCCC 34a_100000210247_100000210614 [0,1,0,0,0,0|2,0,1]=4 3204 B10R0.71 C#CCOCCCCCCC 34a_100000210272_100000184674 [0,1,0,0,0,0|2,0,1]=4 3205 B10R0.71 C#CCOCCCCCCC 7a_100000210272_100000038162 [0,1,0,0,0,0|2,0,1]=4 3206 B10R0.71 C#CCOCCCCCNC 34a_100000722520_100000184674 [0,1,0,0,0,0|2,0,1]=4 3207 B10R0.71 C#CCOCCNCCCC 2230a_100000102301_100010402529 [0,1,0,0,0,0|2,0,1]=4 3208 B10R0.71 C#CCOCCNCCCC 2230a_100000700922_100000210211 [0,1,0,0,0,0|2,0,1]=4 3209 B10R0.71 C#CCOCCNCCCC 34a_100000700922_100000210210 [0,1,0,0,0,0|2,0,1]=4 3210 B10R0.71 C#CCOCCNCCCC 7a_106832991798_100010402529 [0,1,0,0,0,0|2,0,1]=4 3211 B10R0.71 C#CCOCCNCCOC 2230a_100000209980_100010402529 [0,1,0,0,0,0|1,0,1]=3 3212 B10R0.71 C#CCOCCNCCOC 2230a_100000700922_100011201679 [0,1,0,0,0,0|1,0,1]=3 3213 B10R0.71 C#CCOCCNCCOC 34a_100000700922_100011201679 [0,1,0,0,0,0|1,0,1]=3 3214 B10R0.71 C#CCOCCNCCSC 2230a_100000700922_100000751147 [0,1,0,0,0,0|1,1,1]=4 3215 B10R0.71 C#CCOCCNCCSC 2230a_100020590264_100010402529 [0,1,0,0,0,0|1,1,1]=4 3216 B10R0.71 C#CCOCCNCCSC 34a_100000700922_100000212216 [0,1,0,0,0,0|1,1,1]=4 3217 B10R0.71 C#CCOCCOC/C=C/C 34a_100000054580_100102629194 [0,1,0,0,0,0|1,0,2]=4 3218 B10R0.71 C#CCOCCOC/C=C/C 34a_100016270725_100010402529 [0,1,0,0,0,0|1,0,2]=4 3219 B10R0.71 C#CCOCCOC/C=C/C 7a_100000054580_100102629194 [0,1,0,0,0,0|1,0,2]=4 3220 B10R0.71 C#CCOCCOCC#CC 34a_100000054580_100000748600 [0,1,0,0,0,0|1,0,2]=4 3221 B10R0.71 C#CCOCCOCC#CC 34a_100000761923_100010402529 [0,1,0,0,0,0|1,0,2]=4 3222 B10R0.71 C#CCOCCOCC#CC 7a_100000054580_100000748600 [0,1,0,0,0,0|1,0,2]=4 3223 B10R0.71 C#CCOCCOCC=CC 34a_100000054580_100000070051 [0,1,0,0,0,0|1,0,2]=4 3224 B10R0.71 C#CCOCCOCC=CC 7a_100000054580_100000070051 [0,1,0,0,0,0|1,0,2]=4 3225 B10R0.71 C#CCOCCOCCC#N 7a_100000054580_100000184422 [0,1,0,0,0,0|2,0,1]=4 3226 B10R0.71 C#CCOCCOCCC=C 34a_100000054580_100000754431 [0,1,0,0,0,0|1,0,2]=4 3227 B10R0.71 C#CCOCCOCCC=C 34a_100011205117_100010402529 [0,1,0,0,0,0|1,0,2]=4 3228 B10R0.71 C#CCOCCOCCC=C 7a_100000054580_100000754431 [0,1,0,0,0,0|1,0,2]=4 3229 B10R0.71 C#CCOCCOCCCBr 34a_100011217188_100010402529 [0,1,0,0,0,0|2,0,1]=4 3230 B10R0.71 C#CCOCCOCCCC 34a_100000054580_100000210210 [0,1,0,0,0,0|1,0,1]=3 3231 B10R0.71 C#CCOCCOCCCC 34a_100000210227_100010402529 [0,1,0,0,0,0|1,0,1]=3 3232 B10R0.71 C#CCOCCOCCCC 34a_100000210238_100000184674 [0,1,0,0,0,0|1,0,1]=3 3233 B10R0.71 C#CCOCCOCCCC 34a_100000210247_100000743108 [0,1,0,0,0,0|1,0,1]=3 3234 B10R0.71 C#CCOCCOCCCC 7a_100000054580_100000210211 [0,1,0,0,0,0|1,0,1]=3 3235 B10R0.71 C#CCOCCOCCCC 7a_100000210227_100010402529 [0,1,0,0,0,0|1,0,1]=3 3236 B10R0.71 C#CCOCCOCCCC 7a_100000210238_100000038162 [0,1,0,0,0,0|1,0,1]=3 3237 B10R0.71 C#CCOCCOCCCCl 34a_100000230001_100010402529 [0,1,0,0,0,0|2,0,1]=4 3238 B10R0.71 C#CCOCCOCCCF 34a_100000054580_100011934791 [0,1,0,0,0,0|2,0,1]=4 3239 B10R0.71 C#CCOCCOCCCF 34a_100000759539_100010402529 [0,1,0,0,0,0|2,0,1]=4 3240 B10R0.71 C#CCOCCOCCCF 7a_100000054580_100011934791 [0,1,0,0,0,0|2,0,1]=4 3241 B10R0.71 C#CCOCCOCCCN 34a_100000182051_100010402529 [0,1,0,0,0,0|2,0,1]=4 3242 B10R0.71 C#CCOCCOCCCO 34a_100000054580_100000230001 [0,1,0,0,0,0|2,0,1]=4 3243 B10R0.71 C#CCOCCOCCCO 7a_100000054580_100011215043 [0,1,0,0,0,0|2,0,1]=4 3244 B10R0.71 C#CCOCCOCCNC 2230a_100000056377_200000210301 [0,1,0,0,0,0|1,0,1]=3 3245 B10R0.71 C#CCOCCOCCNC 2230a_106832991635_100010408581 [0,1,0,0,0,0|1,0,1]=3 3246 B10R0.71 C#CCOCCOCCNC 34a_100000056377_200000210301 [0,1,0,0,0,0|1,0,1]=3 3247 B10R0.71 C#CCOCCOCCNC 34a_100000228057_100000184674 [0,1,0,0,0,0|1,0,1]=3 3248 B10R0.71 C#CCOCCOCCNC 34a_100102657272_100010408581 [0,1,0,0,0,0|1,0,1]=3 3249 B10R0.71 C#CCOCCOCCNC 7a_106832991635_100010408581 [0,1,0,0,0,0|1,0,1]=3 3250 B10R0.71 C#CCOCCOCCN[13CH3] 2230a_100000056377_200025704644 [0,1,0,0,0,0|1,0,1]=3 3251 B10R0.71 C#CCOCCOCCN[13CH3] 34a_100000056377_200025704644 [0,1,0,0,0,0|1,0,1]=3 3252 B10R0.71 C#CCOCCOCCOC 34a_100000041007_200000210301 [0,1,0,0,0,0|0,0,1]=2 3253 B10R0.71 C#CCOCCOCCOC 34a_100000054580_100011201679 [0,1,0,0,0,0|0,0,1]=2 3254 B10R0.71 C#CCOCCOCCOC 34a_100000210237_100010402529 [0,1,0,0,0,0|0,0,1]=2 3255 B10R0.71 C#CCOCCOCCOC 34a_100000210247_100000695917 [0,1,0,0,0,0|0,0,1]=2 3256 B10R0.71 C#CCOCCOCCOC 34a_100011215163_100000184674 [0,1,0,0,0,0|0,0,1]=2 3257 B10R0.71 C#CCOCCOCCOC 34a_100138415774_100010408581 [0,1,0,0,0,0|0,0,1]=2 3258 B10R0.71 C#CCOCCOCCOC 7a_100000041007_200000210301 [0,1,0,0,0,0|0,0,1]=2 3259 B10R0.71 C#CCOCCOCCOC 7a_100000054580_100000233755 [0,1,0,0,0,0|0,0,1]=2 3260 B10R0.71 C#CCOCCOCCOC 7a_100011215163_100000038162 [0,1,0,0,0,0|0,0,1]=2 3261 B10R0.71 C#CCOCCOCCON 34a_100000700252_100010402529 [0,1,0,0,0,0|1,0,1]=3 3262 B10R0.71 C#CCOCCOCCO[13CH3] 34a_100000041007_200025704644 [0,1,0,0,0,0|0,0,1]=2 3263 B10R0.71 C#CCOCCOCCO[13CH3] 7a_100000041007_200025704644 [0,1,0,0,0,0|0,0,1]=2 3264 B10R0.71 C#CCOCCOCCSC 34a_100000054580_100000212216 [0,1,0,0,0,0|0,1,1]=3 3265 B10R0.71 C#CCOCCOCCSC 34a_100000230434_100010402529 [0,1,0,0,0,0|0,1,1]=3 3266 B10R0.71 C#CCOCCOCCSC 62a_100010408581_200000210301 [0,1,0,0,0,0|0,1,1]=3 3267 B10R0.71 C#CCOCCOCCSC 62a_200000210301_100010408581 [0,1,0,0,0,0|0,1,1]=3 3268 B10R0.71 C#CCOCCOCCSC 7a_100000054580_100000212216 [0,1,0,0,0,0|0,1,1]=3 3269 B10R0.71 C#CCOCCOCCSC 7a_100000230434_100010402529 [0,1,0,0,0,0|0,1,1]=3 3270 B10R0.71 C#CCOCCOCCS[13CH3] 62a_100010408581_200025704644 [0,1,0,0,0,0|0,1,1]=3 3271 B10R0.71 C#CCOCCOCCS[13CH3] 62a_200025704644_100010408581 [0,1,0,0,0,0|0,1,1]=3 3272 B10R0.71 C#CCOCCSCCCC 34a_200000230436_100000184674 [0,1,0,0,0,0|1,1,1]=4 3273 B10R0.71 C#CCOCCSCCCC 62a_100000210211_100010402529 [0,1,0,0,0,0|1,1,1]=4 3274 B10R0.71 C#CCOCCSCCCC 62a_100010402529_100000210210 [0,1,0,0,0,0|1,1,1]=4 3275 B10R0.71 C#CCOCCSCCCC 7a_200000230436_100000038162 [0,1,0,0,0,0|1,1,1]=4 3276 B10R0.71 C#CCOCCSCCOC 62a_100000233755_100010402529 [0,1,0,0,0,0|0,1,1]=3 3277 B10R0.71 C#CCOCCSCCOC 62a_100010402529_100000233755 [0,1,0,0,0,0|0,1,1]=3 3278 B10R0.71 C#CCOCCSCCSC 62a_100000212216_100010402529 [0,1,0,0,0,0|0,2,1]=4 3279 B10R0.71 C#CCOCCSCCSC 62a_100010402529_100000751147 [0,1,0,0,0,0|0,2,1]=4 3280 B10R0.71 C#CCSCCOCCCC 62a_100000038162_100000743108 [0,1,0,0,0,0|1,1,1]=4 3281 B10R0.71 C#CCSCCOCCOC 62a_100000038162_100000695917 [0,1,0,0,0,0|0,1,1]=3 3282 B10R0.71 C/C=C/C=C/COCCOC 34a_100016283227_100011201679 [0,1,0,0,0,0|1,0,2]=4 3283 B10R0.71 C/C=C/CCOC/C=C\CC 34a_100016278192_100103147603 [0,1,0,0,0,0|2,0,1]=4 3284 B10R0.71 C/C=C/CCOCC#CCC 34a_100016278192_100009813939 [0,1,0,0,0,0|2,0,1]=4 3285 B10R0.71 C/C=C/CCOCCCCC 34a_100016278192_100000718602 [0,1,0,0,0,0|2,0,0]=3 3286 B10R0.71 C/C=C/CCOCCCCF 34a_100016278192_100000729493 [0,1,0,0,0,0|2,0,1]=4 3287 B10R0.71 C/C=C/CCOCCCCO 34a_100016278192_100011216708 [0,1,0,0,0,0|2,0,1]=4 3288 B10R0.71 C/C=C/CCOCCCOC 34a_100016278192_100000740836 [0,1,0,0,0,0|1,0,1]=3 3289 B10R0.71 C/C=C/CCOCCOCC 34a_100016278192_100000210147 [0,1,0,0,0,0|1,0,0]=2 3290 B10R0.71 C/C=C/CCOCCSCC 34a_100016278192_100000757381 [0,1,0,0,0,0|1,1,0]=3 3291 B10R0.71 C/C=C/CNCCCOCC 34a_100000210961_100102629194 [0,1,0,0,0,0|2,0,1]=4 3292 B10R0.71 C/C=C/CNCCOCCC 34a_100161115042_100102629194 [0,1,0,0,0,0|2,0,1]=4 3293 B10R0.71 C/C=C/CNCCOCCO 34a_100000211614_100102629194 [0,1,0,0,0,0|2,0,1]=4 3294 B10R0.71 C/C=C/COCC/C=C\CC 34a_100016270725_100015370543 [0,1,0,0,0,0|2,0,1]=4 3295 B10R0.71 C/C=C/COCC/C=C\CC 34a_100016288707_100102629194 [0,1,0,0,0,0|2,0,1]=4 3296 B10R0.71 C/C=C/COCC/C=C\CC 7a_100016288707_100102629194 [0,1,0,0,0,0|2,0,1]=4 3297 B10R0.71 C/C=C/COCCC#CCC 34a_100000036655_100102629194 [0,1,0,0,0,0|2,0,1]=4 3298 B10R0.71 C/C=C/COCCC#CCC 7a_100000036655_100102629194 [0,1,0,0,0,0|2,0,1]=4 3299 B10R0.71 C/C=C/COCCCCCBr 34a_100000746331_100102629194 [0,1,0,0,0,0|2,0,1]=4 3300 B10R0.71 C/C=C/COCCCCCBr 7a_100000746331_100102629194 [0,1,0,0,0,0|2,0,1]=4 3301 B10R0.71 C/C=C/COCCCCCC 34a_100000210259_100102629194 [0,1,0,0,0,0|2,0,1]=4 3302 B10R0.71 C/C=C/COCCCCCC 34a_100016270725_100000210314 [0,1,0,0,0,0|2,0,1]=4 3303 B10R0.71 C/C=C/COCCCCCC 7a_100000210259_100102629194 [0,1,0,0,0,0|2,0,1]=4 3304 B10R0.71 C/C=C/COCCCCCCl 34a_100000746330_100102629194 [0,1,0,0,0,0|2,0,1]=4 3305 B10R0.71 C/C=C/COCCCCCCl 7a_100000746330_100102629194 [0,1,0,0,0,0|2,0,1]=4 3306 B10R0.71 C/C=C/COCCCCCF 34a_100016270725_100000729378 [0,1,0,0,0,0|2,0,1]=4 3307 B10R0.71 C/C=C/COCCCCCI 34a_200012148887_100102629194 [0,1,0,0,0,0|2,0,1]=4 3308 B10R0.71 C/C=C/COCCCCCI 7a_200012148887_100102629194 [0,1,0,0,0,0|2,0,1]=4 3309 B10R0.71 C/C=C/COCCCCCN 34a_100000762737_100102629194 [0,1,0,0,0,0|2,0,1]=4 3310 B10R0.71 C/C=C/COCCCCCO 34a_100016270725_100000746330 [0,1,0,0,0,0|2,0,1]=4 3311 B10R0.71 C/C=C/COCCCCOC 34a_100000740925_100102629194 [0,1,0,0,0,0|2,0,1]=4 3312 B10R0.71 C/C=C/COCCCCOC 34a_100016270725_100000755781 [0,1,0,0,0,0|2,0,1]=4 3313 B10R0.71 C/C=C/COCCCCSC 34a_100011217163_100102629194 [0,1,0,0,0,0|2,0,1]=4 3314 B10R0.71 C/C=C/COCCCCSC 7a_100011217163_100102629194 [0,1,0,0,0,0|2,0,1]=4 3315 B10R0.71 C/C=C/COCCCOCC 34a_100000757476_100102629194 [0,1,0,0,0,0|1,0,1]=3 3316 B10R0.71 C/C=C/COCCCOCC 34a_100016270725_100012232248 [0,1,0,0,0,0|1,0,1]=3 3317 B10R0.71 C/C=C/COCCCOCC 7a_100000757476_100102629194 [0,1,0,0,0,0|1,0,1]=3 3318 B10R0.71 C/C=C/COCCCSCC 34a_100011216438_100102629194 [0,1,0,0,0,0|1,1,1]=4 3319 B10R0.71 C/C=C/COCCCSCC 7a_100011216438_100102629194 [0,1,0,0,0,0|1,1,1]=4 3320 B10R0.71 C/C=C/COCCOCCBr 34a_100000692535_100102629194 [0,1,0,0,0,0|1,0,1]=3 3321 B10R0.71 C/C=C/COCCOCCBr 7a_100000692535_100102629194 [0,1,0,0,0,0|1,0,1]=3 3322 B10R0.71 C/C=C/COCCOCCC 34a_100000752267_100102629194 [0,1,0,0,0,0|1,0,1]=3 3323 B10R0.71 C/C=C/COCCOCCC 34a_100016270725_100011215938 [0,1,0,0,0,0|1,0,1]=3 3324 B10R0.71 C/C=C/COCCOCCC 7a_100000752267_100102629194 [0,1,0,0,0,0|1,0,1]=3 3325 B10R0.71 C/C=C/COCCOCCCl 34a_100011215305_100102629194 [0,1,0,0,0,0|1,0,1]=3 3326 B10R0.71 C/C=C/COCCOCCCl 7a_100011215305_100102629194 [0,1,0,0,0,0|1,0,1]=3 3327 B10R0.71 C/C=C/COCCOCCF 34a_200015357709_100102629194 [0,1,0,0,0,0|1,0,1]=3 3328 B10R0.71 C/C=C/COCCOCCF 7a_200015357709_100102629194 [0,1,0,0,0,0|1,0,1]=3 3329 B10R0.71 C/C=C/COCCOCCI 34a_100012149058_100102629194 [0,1,0,0,0,0|1,0,1]=3 3330 B10R0.71 C/C=C/COCCOCCI 7a_100012149058_100102629194 [0,1,0,0,0,0|1,0,1]=3 3331 B10R0.71 C/C=C/COCCOCCN 34a_100000211614_100102629194 [0,1,0,0,0,0|1,0,1]=3 3332 B10R0.71 C/C=C/COCCOCCO 34a_100016270725_100000692535 [0,1,0,0,0,0|1,0,1]=3 3333 B10R0.71 C/C=C/COCCSCCC 34a_200000230433_100102629194 [0,1,0,0,0,0|1,1,1]=4 3334 B10R0.71 C/C=C/COCCSCCC 7a_200000230433_100102629194 [0,1,0,0,0,0|1,1,1]=4 3335 B10R0.71 C/C=C/COCOCCCC 34a_100016270725_100011995733 [0,1,0,0,0,0|2,0,1]=4 3336 B10R0.71 C/C=C/CSCCCCOC 62a_100000730899_100102629194 [0,1,0,0,0,0|2,0,1]=4 3337 B10R0.71 C/C=C/CSCCCCOC 62a_100102629194_100000730899 [0,1,0,0,0,0|2,0,1]=4 3338 B10R0.71 C/C=C/CSCCCOCC 62a_100012232248_100102629194 [0,1,0,0,0,0|1,1,1]=4 3339 B10R0.71 C/C=C/CSCCCOCC 62a_100102629194_100012232248 [0,1,0,0,0,0|1,1,1]=4 3340 B10R0.71 C/C=C/CSCCOCCC 62a_100011215938_100102629194 [0,1,0,0,0,0|1,1,1]=4 3341 B10R0.71 C/C=C/CSCCOCCC 62a_100102629194_100011215938 [0,1,0,0,0,0|1,1,1]=4 3342 B10R0.71 C/C=C/CSCCOCCO 62a_100011215305_100102629194 [0,1,0,0,0,0|1,1,1]=4 3343 B10R0.71 C/C=C/CSCCOCCO 62a_100102629194_100011215305 [0,1,0,0,0,0|1,1,1]=4 3344 B10R0.71 C/C=C/CSCOCCCC 62a_100011995733_100102629194 [0,1,0,0,0,0|2,0,1]=4 3345 B10R0.71 C/C=C/CSCOCCCC 62a_100102629194_100011995733 [0,1,0,0,0,0|2,0,1]=4 3346 B10R0.71 C/C=C/CSCOCCOC 62a_100000231047_100102629194 [0,1,0,0,0,0|1,0,1]=3 3347 B10R0.71 C/C=C/CSCOCCOC 62a_100102629194_100000231047 [0,1,0,0,0,0|1,0,1]=3 3348 B10R0.71 C=CCCCCCCCOC 34a_100000730831_200000210301 [0,1,0,0,0,0|2,0,1]=4 3349 B10R0.71 C=CCCCCCCCOC 34a_100138415774_100012355270 [0,1,0,0,0,0|2,0,1]=4 3350 B10R0.71 C=CCCCCCCCOC 7a_100000730831_200000210301 [0,1,0,0,0,0|2,0,1]=4 3351 B10R0.71 C=CCCCCCCCO[13CH3] 34a_100000730831_200025704644 [0,1,0,0,0,0|2,0,1]=4 3352 B10R0.71 C=CCCCCCCCO[13CH3] 7a_100000730831_200025704644 [0,1,0,0,0,0|2,0,1]=4 3353 B10R0.71 C=CCCCCCCOCC 34a_100121572206_100011215473 [0,1,0,0,0,0|2,0,1]=4 3354 B10R0.71 C=CCCCCCCOCC 34a_200011216477_100000210202 [0,1,0,0,0,0|2,0,1]=4 3355 B10R0.71 C=CCCCCCCOCC 7a_200011216477_100000210202 [0,1,0,0,0,0|2,0,1]=4 3356 B10R0.71 C=CCCCCCOCCBr 34a_100000211926_100000700193 [0,1,0,0,0,0|2,0,1]=4 3357 B10R0.71 C=CCCCCCOCCC 34a_100000210258_100000700193 [0,1,0,0,0,0|2,0,1]=4 3358 B10R0.71 C=CCCCCCOCCC 34a_100011216702_100000210303 [0,1,0,0,0,0|2,0,1]=4 3359 B10R0.71 C=CCCCCCOCCC 7a_100011216702_100000210303 [0,1,0,0,0,0|2,0,1]=4 3360 B10R0.71 C=CCCCCCOCCF 34a_100011216702_100011217306 [0,1,0,0,0,0|2,0,1]=4 3361 B10R0.71 C=CCCCCCOCCF 7a_100011216702_100011217306 [0,1,0,0,0,0|2,0,1]=4 3362 B10R0.71 C=CCCCCCOCCN 34a_100000210304_100000700193 [0,1,0,0,0,0|2,0,1]=4 3363 B10R0.71 C=CCCCCCOCCO 34a_100011216702_100000211926 [0,1,0,0,0,0|2,0,1]=4 3364 B10R0.71 C=CCCCCCOCCO 7a_100011216702_100000211926 [0,1,0,0,0,0|2,0,1]=4 3365 B10R0.71 C=CCCCCCOCSC 34a_100011216702_100011218213 [0,1,0,0,0,0|2,0,1]=4 3366 B10R0.71 C=CCCCCNCCOC 2230a_100000209980_100011215482 [0,1,0,0,0,0|2,0,1]=4 3367 B10R0.71 C=CCCCCNCCOC 2230a_100000703577_100011201679 [0,1,0,0,0,0|2,0,1]=4 3368 B10R0.71 C=CCCCCNCCOC 34a_100000703577_100011201679 [0,1,0,0,0,0|2,0,1]=4 3369 B10R0.71 C=CCCCCOCCCC 34a_100000210227_100011215482 [0,1,0,0,0,0|2,0,1]=4 3370 B10R0.71 C=CCCCCOCCCC 34a_100000766645_100000210210 [0,1,0,0,0,0|2,0,1]=4 3371 B10R0.71 C=CCCCCOCCCC 7a_100000210227_100011215482 [0,1,0,0,0,0|2,0,1]=4 3372 B10R0.71 C=CCCCCOCCCC 7a_100000766645_100000210211 [0,1,0,0,0,0|2,0,1]=4 3373 B10R0.71 C=CCCCCOCCOC 34a_100000210237_100011215482 [0,1,0,0,0,0|1,0,1]=3 3374 B10R0.71 C=CCCCCOCCOC 34a_100000766645_100011201679 [0,1,0,0,0,0|1,0,1]=3 3375 B10R0.71 C=CCCCCOCCOC 7a_100000766645_100000233755 [0,1,0,0,0,0|1,0,1]=3 3376 B10R0.71 C=CCCCCOCCON 34a_100000700252_100011215482 [0,1,0,0,0,0|2,0,1]=4 3377 B10R0.71 C=CCCCCOCCSC 34a_100000230434_100011215482 [0,1,0,0,0,0|1,1,1]=4 3378 B10R0.71 C=CCCCCOCCSC 34a_100000766645_100000212216 [0,1,0,0,0,0|1,1,1]=4 3379 B10R0.71 C=CCCCCOCCSC 7a_100000230434_100011215482 [0,1,0,0,0,0|1,1,1]=4 3380 B10R0.71 C=CCCCCOCCSC 7a_100000766645_100000212216 [0,1,0,0,0,0|1,1,1]=4 3381 B10R0.71 C=CCCCCSCCOC 62a_100000233755_100011215482 [0,1,0,0,0,0|1,1,1]=4 3382 B10R0.71 C=CCCCCSCCOC 62a_100011215482_100000233755 [0,1,0,0,0,0|1,1,1]=4 3383 B10R0.71 C=CCCCCSCOCC 62a_100000739092_100011215482 [0,1,0,0,0,0|2,0,1]=4 3384 B10R0.71 C=CCCCCSCOCC 62a_100011215482_100000739092 [0,1,0,0,0,0|2,0,1]=4 3385 B10R0.71 C=CCCCNCCOCC 2230a_100000700776_100011215890 [0,1,0,0,0,0|2,0,1]=4 3386 B10R0.71 C=CCCCNCCOCC 2230a_102516460346_100011713584 [0,1,0,0,0,0|2,0,1]=4 3387 B10R0.71 C=CCCCNCCOCC 34a_100000700776_100000210147 [0,1,0,0,0,0|2,0,1]=4 3388 B10R0.71 C=CCCCNCCOCC 34a_102516460346_100000757094 [0,1,0,0,0,0|2,0,1]=4 3389 B10R0.71 C=CCCCOCCCCC 34a_100000210253_100000757094 [0,1,0,0,0,0|2,0,1]=4 3390 B10R0.71 C=CCCCOCCCCC 34a_100000758997_100000718602 [0,1,0,0,0,0|2,0,1]=4 3391 B10R0.71 C=CCCCOCCCCC 7a_100000210253_100000757094 [0,1,0,0,0,0|2,0,1]=4 3392 B10R0.71 C=CCCCOCCCCC 7a_100000758997_100000210326 [0,1,0,0,0,0|2,0,1]=4 3393 B10R0.71 C=CCCCOCCCOC 34a_100000740835_100000757094 [0,1,0,0,0,0|1,0,2]=4 3394 B10R0.71 C=CCCCOCCCOC 34a_100000758997_100000740836 [0,1,0,0,0,0|1,0,2]=4 3395 B10R0.71 C=CCCCOCCCOC 7a_100000758997_100000740836 [0,1,0,0,0,0|1,0,2]=4 3396 B10R0.71 C=CCCCOCCOCC 34a_100000210136_100000757094 [0,1,0,0,0,0|1,0,1]=3 3397 B10R0.71 C=CCCCOCCOCC 34a_100000758997_100000210147 [0,1,0,0,0,0|1,0,1]=3 3398 B10R0.71 C=CCCCOCCOCC 7a_100000210136_100000757094 [0,1,0,0,0,0|1,0,1]=3 3399 B10R0.71 C=CCCCOCCOCC 7a_100000758997_100011215890 [0,1,0,0,0,0|1,0,1]=3 3400 B10R0.71 C=CCCCOCCSCC 34a_100000212035_100000757094 [0,1,0,0,0,0|1,1,1]=4 3401 B10R0.71 C=CCCCOCCSCC 34a_100000758997_100000757381 [0,1,0,0,0,0|1,1,1]=4 3402 B10R0.71 C=CCCCOCCSCC 7a_100000212035_100000757094 [0,1,0,0,0,0|1,1,1]=4 3403 B10R0.71 C=CCCCOCCSCC 7a_100000758997_100000757381 [0,1,0,0,0,0|1,1,1]=4 3404 B10R0.71 C=CCCCSCCOCC 62a_100000210147_100000757094 [0,1,0,0,0,0|1,1,1]=4 3405 B10R0.71 C=CCCCSCCOCC 62a_100011713584_100011215890 [0,1,0,0,0,0|1,1,1]=4 3406 B10R0.71 C=CCCNCCCOCC 2230a_100000210961_100000754431 [0,1,0,0,0,0|2,0,1]=4 3407 B10R0.71 C=CCCNCCCOCC 2230a_100015191253_100012232248 [0,1,0,0,0,0|2,0,1]=4 3408 B10R0.71 C=CCCNCCCOCC 34a_100000210961_100000754431 [0,1,0,0,0,0|2,0,1]=4 3409 B10R0.71 C=CCCNCCOCCC 2230a_100015191253_100011215938 [0,1,0,0,0,0|2,0,1]=4 3410 B10R0.71 C=CCCNCCOCCC 2230a_100161115042_100000754431 [0,1,0,0,0,0|2,0,1]=4 3411 B10R0.71 C=CCCNCCOCCC 34a_100161115042_100000754431 [0,1,0,0,0,0|2,0,1]=4 3412 B10R0.71 C=CCCNCCOCCO 2230a_100000211614_100000754431 [0,1,0,0,0,0|2,0,1]=4 3413 B10R0.71 C=CCCNCCOCCO 2230a_100015191253_100011215305 [0,1,0,0,0,0|2,0,1]=4 3414 B10R0.71 C=CCCNCCOCCO 34a_100000211614_100000754431 [0,1,0,0,0,0|2,0,1]=4 3415 B10R0.71 C=CCCNCOCCOC 2230a_100015191253_100000231047 [0,1,0,0,0,0|1,0,2]=4 3416 B10R0.71 C=CCCOCC/C=C\CC 34a_100011205117_100015370543 [0,1,0,0,0,0|2,0,1]=4 3417 B10R0.71 C=CCCOCC/C=C\CC 34a_100016288707_100000754431 [0,1,0,0,0,0|2,0,1]=4 3418 B10R0.71 C=CCCOCC/C=C\CC 7a_100016288707_100000754431 [0,1,0,0,0,0|2,0,1]=4 3419 B10R0.71 C=CCCOCCC#CCC 34a_100000036655_100000754431 [0,1,0,0,0,0|2,0,1]=4 3420 B10R0.71 C=CCCOCCC#CCC 7a_100000036655_100000754431 [0,1,0,0,0,0|2,0,1]=4 3421 B10R0.71 C=CCCOCCCCCBr 34a_100000746331_100000754431 [0,1,0,0,0,0|2,0,1]=4 3422 B10R0.71 C=CCCOCCCCCBr 7a_100000746331_100000754431 [0,1,0,0,0,0|2,0,1]=4 3423 B10R0.71 C=CCCOCCCCCC 34a_100000210259_100000754431 [0,1,0,0,0,0|2,0,1]=4 3424 B10R0.71 C=CCCOCCCCCC 34a_100011205117_100000210314 [0,1,0,0,0,0|2,0,1]=4 3425 B10R0.71 C=CCCOCCCCCC 7a_100000210259_100000754431 [0,1,0,0,0,0|2,0,1]=4 3426 B10R0.71 C=CCCOCCCCCCl 34a_100000746330_100000754431 [0,1,0,0,0,0|2,0,1]=4 3427 B10R0.71 C=CCCOCCCCCCl 7a_100000746330_100000754431 [0,1,0,0,0,0|2,0,1]=4 3428 B10R0.71 C=CCCOCCCCCF 34a_100011205117_100000729378 [0,1,0,0,0,0|2,0,1]=4 3429 B10R0.71 C=CCCOCCCCCI 34a_200012148887_100000754431 [0,1,0,0,0,0|2,0,1]=4 3430 B10R0.71 C=CCCOCCCCCI 7a_200012148887_100000754431 [0,1,0,0,0,0|2,0,1]=4 3431 B10R0.71 C=CCCOCCCCCN 34a_100000762737_100000754431 [0,1,0,0,0,0|2,0,1]=4 3432 B10R0.71 C=CCCOCCCCCO 34a_100011205117_100000746330 [0,1,0,0,0,0|2,0,1]=4 3433 B10R0.71 C=CCCOCCCCOC 34a_100000740925_100000754431 [0,1,0,0,0,0|2,0,1]=4 3434 B10R0.71 C=CCCOCCCCOC 34a_100011205117_100000755781 [0,1,0,0,0,0|2,0,1]=4 3435 B10R0.71 C=CCCOCCCCSC 34a_100011217163_100000754431 [0,1,0,0,0,0|2,0,1]=4 3436 B10R0.71 C=CCCOCCCCSC 7a_100011217163_100000754431 [0,1,0,0,0,0|2,0,1]=4 3437 B10R0.71 C=CCCOCCCOCC 34a_100000757476_100000754431 [0,1,0,0,0,0|1,0,1]=3 3438 B10R0.71 C=CCCOCCCOCC 34a_100011205117_100012232248 [0,1,0,0,0,0|1,0,1]=3 3439 B10R0.71 C=CCCOCCCOCC 7a_100000757476_100000754431 [0,1,0,0,0,0|1,0,1]=3 3440 B10R0.71 C=CCCOCCCSCC 34a_100011216438_100000754431 [0,1,0,0,0,0|1,1,1]=4 3441 B10R0.71 C=CCCOCCCSCC 7a_100011216438_100000754431 [0,1,0,0,0,0|1,1,1]=4 3442 B10R0.71 C=CCCOCCOCC=C 34a_100000037705_100000754431 [0,1,0,0,0,0|1,0,2]=4 3443 B10R0.71 C=CCCOCCOCC=C 7a_100000037705_100000754431 [0,1,0,0,0,0|1,0,2]=4 3444 B10R0.71 C=CCCOCCOCCBr 34a_100000692535_100000754431 [0,1,0,0,0,0|1,0,1]=3 3445 B10R0.71 C=CCCOCCOCCBr 7a_100000692535_100000754431 [0,1,0,0,0,0|1,0,1]=3 3446 B10R0.71 C=CCCOCCOCCC 34a_100000752267_100000754431 [0,1,0,0,0,0|1,0,1]=3 3447 B10R0.71 C=CCCOCCOCCC 34a_100011205117_100011215938 [0,1,0,0,0,0|1,0,1]=3 3448 B10R0.71 C=CCCOCCOCCC 7a_100000752267_100000754431 [0,1,0,0,0,0|1,0,1]=3 3449 B10R0.71 C=CCCOCCOCCCl 34a_100011215305_100000754431 [0,1,0,0,0,0|1,0,1]=3 3450 B10R0.71 C=CCCOCCOCCCl 7a_100011215305_100000754431 [0,1,0,0,0,0|1,0,1]=3 3451 B10R0.71 C=CCCOCCOCCF 34a_200015357709_100000754431 [0,1,0,0,0,0|1,0,1]=3 3452 B10R0.71 C=CCCOCCOCCF 7a_200015357709_100000754431 [0,1,0,0,0,0|1,0,1]=3 3453 B10R0.71 C=CCCOCCOCCI 34a_100012149058_100000754431 [0,1,0,0,0,0|1,0,1]=3 3454 B10R0.71 C=CCCOCCOCCI 7a_100012149058_100000754431 [0,1,0,0,0,0|1,0,1]=3 3455 B10R0.71 C=CCCOCCOCCN 34a_100000211614_100000754431 [0,1,0,0,0,0|1,0,1]=3 3456 B10R0.71 C=CCCOCCOCCO 34a_100011205117_100000692535 [0,1,0,0,0,0|1,0,1]=3 3457 B10R0.71 C=CCCOCCSCCC 34a_200000230433_100000754431 [0,1,0,0,0,0|1,1,1]=4 3458 B10R0.71 C=CCCOCCSCCC 7a_200000230433_100000754431 [0,1,0,0,0,0|1,1,1]=4 3459 B10R0.71 C=CCCOCOCCCC 34a_100011205117_100011995733 [0,1,0,0,0,0|2,0,1]=4 3460 B10R0.71 C=CCCSCCCOCC 62a_100000754431_100012232248 [0,1,0,0,0,0|1,1,1]=4 3461 B10R0.71 C=CCCSCCCOCC 62a_100012232248_100000754431 [0,1,0,0,0,0|1,1,1]=4 3462 B10R0.71 C=CCCSCCOCCC 62a_100000754431_100011215938 [0,1,0,0,0,0|1,1,1]=4 3463 B10R0.71 C=CCCSCCOCCC 62a_100011215938_100000754431 [0,1,0,0,0,0|1,1,1]=4 3464 B10R0.71 C=CCCSCCOCCO 62a_100000754431_100011215305 [0,1,0,0,0,0|1,1,1]=4 3465 B10R0.71 C=CCCSCCOCCO 62a_100011215305_100000754431 [0,1,0,0,0,0|1,1,1]=4 3466 B10R0.71 C=CCCSCOCCOC 62a_100000231047_100000754431 [0,1,0,0,0,0|1,0,2]=4 3467 B10R0.71 C=CCCSCOCCOC 62a_100000754431_100000231047 [0,1,0,0,0,0|1,0,2]=4 3468 B10R0.71 C=CCNCCCCCOC 2230a_100000747528_100000210623 [0,1,0,0,0,0|2,0,1]=4 3469 B10R0.71 C=CCNCCCCCOC 34a_100000747528_100015514636 [0,1,0,0,0,0|2,0,1]=4 3470 B10R0.71 C=CCNCCOCCCC 2230a_100020586998_100000743108 [0,1,0,0,0,0|2,0,1]=4 3471 B10R0.71 C=CCNCCOCCOC 2230a_100000745349_100000210623 [0,1,0,0,0,0|1,0,1]=3 3472 B10R0.71 C=CCNCCOCCOC 2230a_100020586998_100000695917 [0,1,0,0,0,0|1,0,1]=3 3473 B10R0.71 C=CCNCCOCCOC 34a_100000745349_100015514636 [0,1,0,0,0,0|1,0,1]=3 3474 B10R0.71 C=CCOCCCCCCC 34a_100000210272_100015514636 [0,1,0,0,0,0|2,0,1]=4 3475 B10R0.71 C=CCOCCCCCCC 34a_200000210373_100000210614 [0,1,0,0,0,0|2,0,1]=4 3476 B10R0.71 C=CCOCCCCCCC 7a_100000210272_100015514636 [0,1,0,0,0,0|2,0,1]=4 3477 B10R0.71 C=CCOCCCCCNC 34a_100000722520_100015514636 [0,1,0,0,0,0|2,0,1]=4 3478 B10R0.71 C=CCOCCOC/C=C/C 34a_100000037705_100102629194 [0,1,0,0,0,0|1,0,2]=4 3479 B10R0.71 C=CCOCCOC/C=C/C 7a_100000037705_100102629194 [0,1,0,0,0,0|1,0,2]=4 3480 B10R0.71 C=CCOCCOCC#CC 34a_100000037705_100000748600 [0,1,0,0,0,0|1,0,2]=4 3481 B10R0.71 C=CCOCCOCC#CC 7a_100000037705_100000748600 [0,1,0,0,0,0|1,0,2]=4 3482 B10R0.71 C=CCOCCOCC=CC 34a_100000037705_100000070051 [0,1,0,0,0,0|1,0,2]=4 3483 B10R0.71 C=CCOCCOCC=CC 7a_100000037705_100000070051 [0,1,0,0,0,0|1,0,2]=4 3484 B10R0.71 C=CCOCCOCCC#N 7a_100000037705_100000184422 [0,1,0,0,0,0|2,0,1]=4 3485 B10R0.71 C=CCOCCOCCCC 34a_100000037705_100000210210 [0,1,0,0,0,0|1,0,1]=3 3486 B10R0.71 C=CCOCCOCCCC 34a_100000210238_100015514636 [0,1,0,0,0,0|1,0,1]=3 3487 B10R0.71 C=CCOCCOCCCC 34a_200000210373_100000743108 [0,1,0,0,0,0|1,0,1]=3 3488 B10R0.71 C=CCOCCOCCCC 7a_100000037705_100000210211 [0,1,0,0,0,0|1,0,1]=3 3489 B10R0.71 C=CCOCCOCCCC 7a_100000210238_100015514636 [0,1,0,0,0,0|1,0,1]=3 3490 B10R0.71 C=CCOCCOCCCF 34a_100000037705_100011934791 [0,1,0,0,0,0|2,0,1]=4 3491 B10R0.71 C=CCOCCOCCCF 7a_100000037705_100011934791 [0,1,0,0,0,0|2,0,1]=4 3492 B10R0.71 C=CCOCCOCCCO 34a_100000037705_100000230001 [0,1,0,0,0,0|2,0,1]=4 3493 B10R0.71 C=CCOCCOCCCO 7a_100000037705_100011215043 [0,1,0,0,0,0|2,0,1]=4 3494 B10R0.71 C=CCOCCOCCNC 34a_100000228057_100015514636 [0,1,0,0,0,0|1,0,1]=3 3495 B10R0.71 C=CCOCCOCCOC 34a_100000037705_100011201679 [0,1,0,0,0,0|0,0,1]=2 3496 B10R0.71 C=CCOCCOCCOC 34a_100000065479_200000210301 [0,1,0,0,0,0|0,0,1]=2 3497 B10R0.71 C=CCOCCOCCOC 34a_100011215163_100015514636 [0,1,0,0,0,0|0,0,1]=2 3498 B10R0.71 C=CCOCCOCCOC 34a_200000210373_100000695917 [0,1,0,0,0,0|0,0,1]=2 3499 B10R0.71 C=CCOCCOCCOC 7a_100000037705_100000233755 [0,1,0,0,0,0|0,0,1]=2 3500 B10R0.71 C=CCOCCOCCOC 7a_100000065479_200000210301 [0,1,0,0,0,0|0,0,1]=2 3501 B10R0.71 C=CCOCCOCCOC 7a_100011215163_100015514636 [0,1,0,0,0,0|0,0,1]=2 3502 B10R0.71 C=CCOCCOCCO[13CH3] 34a_100000065479_200025704644 [0,1,0,0,0,0|0,0,1]=2 3503 B10R0.71 C=CCOCCOCCO[13CH3] 7a_100000065479_200025704644 [0,1,0,0,0,0|0,0,1]=2 3504 B10R0.71 C=CCOCCOCCSC 34a_100000037705_100000212216 [0,1,0,0,0,0|0,1,1]=3 3505 B10R0.71 C=CCOCCOCCSC 7a_100000037705_100000212216 [0,1,0,0,0,0|0,1,1]=3 3506 B10R0.71 C=CCOCCSCCCC 34a_200000230436_100015514636 [0,1,0,0,0,0|1,1,1]=4 3507 B10R0.71 C=CCOCCSCCCC 7a_200000230436_100015514636 [0,1,0,0,0,0|1,1,1]=4 3508 B10R0.71 C=CCSCCOCCCC 62a_100000210623_100000743108 [0,1,0,0,0,0|1,1,1]=4 3509 B10R0.71 C=CCSCCOCCCC 62a_100000743108_100000210623 [0,1,0,0,0,0|1,1,1]=4 3510 B10R0.71 C=CCSCCOCCOC 62a_100000210623_100000695917 [0,1,0,0,0,0|0,1,1]=3 3511 B10R0.71 C=CCSCCOCCOC 62a_100000695917_100000210623 [0,1,0,0,0,0|0,1,1]=3 3512 B10R0.71 C=COCCCNCCOC 2230a_100000210767_100011201679 [0,1,0,0,0,0|1,0,2]=4 3513 B10R0.71 C=COCCCNCCOC 34a_100000210767_100011201679 [0,1,0,0,0,0|1,0,2]=4 3514 B10R0.71 C=COCCNCCCCC 2230a_100000209983_100000039644 [0,1,0,0,0,0|2,0,1]=4 3515 B10R0.71 C=COCCNCCCOC 34a_100150723488_100000039644 [0,1,0,0,0,0|1,0,2]=4 3516 B10R0.71 C=COCCNCCOCC 2230a_102516460346_100000039644 [0,1,0,0,0,0|1,0,1]=3 3517 B10R0.71 C=COCCNCCOCC 34a_102516460346_100000039644 [0,1,0,0,0,0|1,0,1]=3 3518 B10R0.71 C=COCCNCCSCC 2230a_100000106463_100000039644 [0,1,0,0,0,0|1,1,1]=4 3519 B10R0.71 C=COCCOC/C=C\CC 34a_100000033082_100103147603 [0,1,0,0,0,0|1,0,2]=4 3520 B10R0.71 C=COCCOC/C=C\CC 34a_100016268518_100000039644 [0,1,0,0,0,0|1,0,2]=4 3521 B10R0.71 C=COCCOCC#CCC 34a_100000032950_100000039644 [0,1,0,0,0,0|1,0,2]=4 3522 B10R0.71 C=COCCOCC#CCC 34a_100000033082_100009813939 [0,1,0,0,0,0|1,0,2]=4 3523 B10R0.71 C=COCCOCC/C=C/C 34a_100016278192_100000039644 [0,1,0,0,0,0|1,0,2]=4 3524 B10R0.71 C=COCCOCCC#CC 34a_100000750427_100000039644 [0,1,0,0,0,0|1,0,2]=4 3525 B10R0.71 C=COCCOCCCCBr 34a_100011216708_100000039644 [0,1,0,0,0,0|1,0,2]=4 3526 B10R0.71 C=COCCOCCCCC 34a_100000033082_100000718602 [0,1,0,0,0,0|1,0,1]=3 3527 B10R0.71 C=COCCOCCCCC 34a_100000210253_100000039644 [0,1,0,0,0,0|1,0,1]=3 3528 B10R0.71 C=COCCOCCCCC 7a_100000210253_100000039644 [0,1,0,0,0,0|1,0,1]=3 3529 B10R0.71 C=COCCOCCCCCl 34a_100000210776_100000039644 [0,1,0,0,0,0|1,0,2]=4 3530 B10R0.71 C=COCCOCCCCCl 7a_100000210776_100000039644 [0,1,0,0,0,0|1,0,2]=4 3531 B10R0.71 C=COCCOCCCCF 34a_100000033082_100000729493 [0,1,0,0,0,0|1,0,2]=4 3532 B10R0.71 C=COCCOCCCCF 34a_100011995726_100000039644 [0,1,0,0,0,0|1,0,2]=4 3533 B10R0.71 C=COCCOCCCCF 7a_100011995726_100000039644 [0,1,0,0,0,0|1,0,2]=4 3534 B10R0.71 C=COCCOCCCCI 34a_200012148704_100000039644 [0,1,0,0,0,0|1,0,2]=4 3535 B10R0.71 C=COCCOCCCCN 34a_100000750430_100000039644 [0,1,0,0,0,0|1,0,2]=4 3536 B10R0.71 C=COCCOCCCCO 34a_100000033082_100011216708 [0,1,0,0,0,0|1,0,2]=4 3537 B10R0.71 C=COCCOCCCNC 34a_100000213112_100000039644 [0,1,0,0,0,0|1,0,2]=4 3538 B10R0.71 C=COCCOCCCOC 34a_100000033082_100000740836 [0,1,0,0,0,0|0,0,2]=3 3539 B10R0.71 C=COCCOCCCOC 34a_100000740835_100000039644 [0,1,0,0,0,0|0,0,2]=3 3540 B10R0.71 C=COCCOCCCSC 34a_100000690336_100000039644 [0,1,0,0,0,0|0,1,2]=4 3541 B10R0.71 C=COCCOCCCSC 7a_100000690336_100000039644 [0,1,0,0,0,0|0,1,2]=4 3542 B10R0.71 C=COCCOCCOC=C 34a_100000033082_100000039644 [0,1,0,0,0,0|0,0,3]=4 3543 B10R0.71 C=COCCOCCOCC 34a_100000033082_100000210147 [0,1,0,0,0,0|0,0,1]=2 3544 B10R0.71 C=COCCOCCOCC 34a_100000039918_100000210202 [0,1,0,0,0,0|0,0,1]=2 3545 B10R0.71 C=COCCOCCOCC 34a_100000210136_100000039644 [0,1,0,0,0,0|0,0,1]=2 3546 B10R0.71 C=COCCOCCOCC 7a_100000039918_100000210202 [0,1,0,0,0,0|0,0,1]=2 3547 B10R0.71 C=COCCOCCOCC 7a_100000210136_100000039644 [0,1,0,0,0,0|0,0,1]=2 3548 B10R0.71 C=COCCOCCOCF 34a_100000039918_100015361967 [0,1,0,0,0,0|0,0,2]=3 3549 B10R0.71 C=COCCOCCOCF 7a_100000039918_100015361967 [0,1,0,0,0,0|0,0,2]=3 3550 B10R0.71 C=COCCOCCSCC 34a_100000033082_100000757381 [0,1,0,0,0,0|0,1,1]=3 3551 B10R0.71 C=COCCOCCSCC 34a_100000212035_100000039644 [0,1,0,0,0,0|0,1,1]=3 3552 B10R0.71 C=COCCOCCSCC 7a_100000212035_100000039644 [0,1,0,0,0,0|0,1,1]=3 3553 B10R0.71 C=COCCSCCCCC 62a_100000039644_100000210326 [0,1,0,0,0,0|1,1,1]=4 3554 B10R0.71 C=COCCSCCCCC 62a_100000210326_100000039644 [0,1,0,0,0,0|1,1,1]=4 3555 B10R0.71 C=COCCSCCCOC 62a_100000039644_100000709357 [0,1,0,0,0,0|0,1,2]=4 3556 B10R0.71 C=COCCSCCCOC 62a_100000709357_100000039644 [0,1,0,0,0,0|0,1,2]=4 3557 B10R0.71 C=COCCSCCOCC 62a_100000039644_100011215890 [0,1,0,0,0,0|0,1,1]=3 3558 B10R0.71 C=COCCSCCOCC 62a_100000210147_100000039644 [0,1,0,0,0,0|0,1,1]=3 3559 B10R0.71 C=COCCSCCSCC 62a_100000039644_100000757381 [0,1,0,0,0,0|0,2,1]=4 3560 B10R0.71 C=COCCSCCSCC 62a_100000757381_100000039644 [0,1,0,0,0,0|0,2,1]=4 3561 B10R0.71 CC#CCCOC/C=C\CC 34a_100000750427_100103147603 [0,1,0,0,0,0|2,0,1]=4 3562 B10R0.71 CC#CCCOCC#CCC 34a_100000750427_100009813939 [0,1,0,0,0,0|2,0,1]=4 3563 B10R0.71 CC#CCCOCCCCC 34a_100000750427_100000718602 [0,1,0,0,0,0|2,0,0]=3 3564 B10R0.71 CC#CCCOCCCCF 34a_100000750427_100000729493 [0,1,0,0,0,0|2,0,1]=4 3565 B10R0.71 CC#CCCOCCCCO 34a_100000750427_100011216708 [0,1,0,0,0,0|2,0,1]=4 3566 B10R0.71 CC#CCCOCCCOC 34a_100000750427_100000740836 [0,1,0,0,0,0|1,0,1]=3 3567 B10R0.71 CC#CCCOCCOCC 34a_100000750427_100000210147 [0,1,0,0,0,0|1,0,0]=2 3568 B10R0.71 CC#CCCOCCSCC 34a_100000750427_100000757381 [0,1,0,0,0,0|1,1,0]=3 3569 B10R0.71 CC#CCNCCCCOC 2230a_100000685387_100000730899 [0,1,0,0,0,0|2,0,1]=4 3570 B10R0.71 CC#CCNCCCCOC 34a_100000685387_100000755781 [0,1,0,0,0,0|2,0,1]=4 3571 B10R0.71 CC#CCNCCCOCC 2230a_100000210961_100000748600 [0,1,0,0,0,0|2,0,1]=4 3572 B10R0.71 CC#CCNCCCOCC 2230a_100000685387_100012232248 [0,1,0,0,0,0|2,0,1]=4 3573 B10R0.71 CC#CCNCCCOCC 34a_100000210961_100000748600 [0,1,0,0,0,0|2,0,1]=4 3574 B10R0.71 CC#CCNCCCOCC 34a_100000685387_100012232248 [0,1,0,0,0,0|2,0,1]=4 3575 B10R0.71 CC#CCNCCOCCC 2230a_100000685387_100011215938 [0,1,0,0,0,0|2,0,1]=4 3576 B10R0.71 CC#CCNCCOCCC 2230a_100161115042_100000748600 [0,1,0,0,0,0|2,0,1]=4 3577 B10R0.71 CC#CCNCCOCCC 34a_100000685387_100011215938 [0,1,0,0,0,0|2,0,1]=4 3578 B10R0.71 CC#CCNCCOCCC 34a_100161115042_100000748600 [0,1,0,0,0,0|2,0,1]=4 3579 B10R0.71 CC#CCNCCOCCO 2230a_100000211614_100000748600 [0,1,0,0,0,0|2,0,1]=4 3580 B10R0.71 CC#CCNCCOCCO 2230a_100000685387_100011215305 [0,1,0,0,0,0|2,0,1]=4 3581 B10R0.71 CC#CCNCCOCCO 34a_100000211614_100000748600 [0,1,0,0,0,0|2,0,1]=4 3582 B10R0.71 CC#CCNCCOCCO 34a_100000685387_100000692535 [0,1,0,0,0,0|2,0,1]=4 3583 B10R0.71 CC#CCNCOCCCC 2230a_100000685387_100011995733 [0,1,0,0,0,0|2,0,1]=4 3584 B10R0.71 CC#CCNCOCCCC 34a_100000685387_100011995733 [0,1,0,0,0,0|2,0,1]=4 3585 B10R0.71 CC#CCNCOCCOC 2230a_100000685387_100000231047 [0,1,0,0,0,0|1,0,1]=3 3586 B10R0.71 CC#CCOCC/C=C\CC 34a_100000761923_100015370543 [0,1,0,0,0,0|2,0,1]=4 3587 B10R0.71 CC#CCOCC/C=C\CC 34a_100016288707_100000748600 [0,1,0,0,0,0|2,0,1]=4 3588 B10R0.71 CC#CCOCC/C=C\CC 7a_100016288707_100000748600 [0,1,0,0,0,0|2,0,1]=4 3589 B10R0.71 CC#CCOCCC#CCC 34a_100000036655_100000748600 [0,1,0,0,0,0|2,0,1]=4 3590 B10R0.71 CC#CCOCCC#CCC 7a_100000036655_100000748600 [0,1,0,0,0,0|2,0,1]=4 3591 B10R0.71 CC#CCOCCCCCBr 34a_100000746331_100000748600 [0,1,0,0,0,0|2,0,1]=4 3592 B10R0.71 CC#CCOCCCCCBr 7a_100000746331_100000748600 [0,1,0,0,0,0|2,0,1]=4 3593 B10R0.71 CC#CCOCCCCCC 34a_100000210259_100000748600 [0,1,0,0,0,0|2,0,1]=4 3594 B10R0.71 CC#CCOCCCCCC 34a_100000761923_100000210314 [0,1,0,0,0,0|2,0,1]=4 3595 B10R0.71 CC#CCOCCCCCC 7a_100000210259_100000748600 [0,1,0,0,0,0|2,0,1]=4 3596 B10R0.71 CC#CCOCCCCCCl 34a_100000746330_100000748600 [0,1,0,0,0,0|2,0,1]=4 3597 B10R0.71 CC#CCOCCCCCCl 7a_100000746330_100000748600 [0,1,0,0,0,0|2,0,1]=4 3598 B10R0.71 CC#CCOCCCCCF 34a_100000761923_100000729378 [0,1,0,0,0,0|2,0,1]=4 3599 B10R0.71 CC#CCOCCCCCI 34a_200012148887_100000748600 [0,1,0,0,0,0|2,0,1]=4 3600 B10R0.71 CC#CCOCCCCCI 7a_200012148887_100000748600 [0,1,0,0,0,0|2,0,1]=4 3601 B10R0.71 CC#CCOCCCCCN 34a_100000762737_100000748600 [0,1,0,0,0,0|2,0,1]=4 3602 B10R0.71 CC#CCOCCCCCO 34a_100000761923_100000746330 [0,1,0,0,0,0|2,0,1]=4 3603 B10R0.71 CC#CCOCCCCOC 34a_100000740925_100000748600 [0,1,0,0,0,0|2,0,1]=4 3604 B10R0.71 CC#CCOCCCCOC 34a_100000761923_100000755781 [0,1,0,0,0,0|2,0,1]=4 3605 B10R0.71 CC#CCOCCCCSC 34a_100011217163_100000748600 [0,1,0,0,0,0|2,0,1]=4 3606 B10R0.71 CC#CCOCCCCSC 7a_100011217163_100000748600 [0,1,0,0,0,0|2,0,1]=4 3607 B10R0.71 CC#CCOCCCOCC 34a_100000757476_100000748600 [0,1,0,0,0,0|1,0,1]=3 3608 B10R0.71 CC#CCOCCCOCC 34a_100000761923_100012232248 [0,1,0,0,0,0|1,0,1]=3 3609 B10R0.71 CC#CCOCCCOCC 7a_100000757476_100000748600 [0,1,0,0,0,0|1,0,1]=3 3610 B10R0.71 CC#CCOCCCSCC 34a_100011216438_100000748600 [0,1,0,0,0,0|1,1,1]=4 3611 B10R0.71 CC#CCOCCCSCC 7a_100011216438_100000748600 [0,1,0,0,0,0|1,1,1]=4 3612 B10R0.71 CC#CCOCCOCCBr 34a_100000692535_100000748600 [0,1,0,0,0,0|1,0,1]=3 3613 B10R0.71 CC#CCOCCOCCBr 7a_100000692535_100000748600 [0,1,0,0,0,0|1,0,1]=3 3614 B10R0.71 CC#CCOCCOCCC 34a_100000752267_100000748600 [0,1,0,0,0,0|1,0,1]=3 3615 B10R0.71 CC#CCOCCOCCC 34a_100000761923_100011215938 [0,1,0,0,0,0|1,0,1]=3 3616 B10R0.71 CC#CCOCCOCCC 7a_100000752267_100000748600 [0,1,0,0,0,0|1,0,1]=3 3617 B10R0.71 CC#CCOCCOCCCl 34a_100011215305_100000748600 [0,1,0,0,0,0|1,0,1]=3 3618 B10R0.71 CC#CCOCCOCCCl 7a_100011215305_100000748600 [0,1,0,0,0,0|1,0,1]=3 3619 B10R0.71 CC#CCOCCOCCF 34a_200015357709_100000748600 [0,1,0,0,0,0|1,0,1]=3 3620 B10R0.71 CC#CCOCCOCCF 7a_200015357709_100000748600 [0,1,0,0,0,0|1,0,1]=3 3621 B10R0.71 CC#CCOCCOCCI 34a_100012149058_100000748600 [0,1,0,0,0,0|1,0,1]=3 3622 B10R0.71 CC#CCOCCOCCI 7a_100012149058_100000748600 [0,1,0,0,0,0|1,0,1]=3 3623 B10R0.71 CC#CCOCCOCCN 34a_100000211614_100000748600 [0,1,0,0,0,0|1,0,1]=3 3624 B10R0.71 CC#CCOCCOCCO 34a_100000761923_100000692535 [0,1,0,0,0,0|1,0,1]=3 3625 B10R0.71 CC#CCOCCSCCC 34a_200000230433_100000748600 [0,1,0,0,0,0|1,1,1]=4 3626 B10R0.71 CC#CCOCCSCCC 7a_200000230433_100000748600 [0,1,0,0,0,0|1,1,1]=4 3627 B10R0.71 CC#CCOCOCCCC 34a_100000761923_100011995733 [0,1,0,0,0,0|2,0,1]=4 3628 B10R0.71 CC#CCSCCCCOC 62a_100000730899_100000748600 [0,1,0,0,0,0|2,0,1]=4 3629 B10R0.71 CC#CCSCCCCOC 62a_100000748600_100000730899 [0,1,0,0,0,0|2,0,1]=4 3630 B10R0.71 CC#CCSCCCOCC 62a_100000748600_100012232248 [0,1,0,0,0,0|1,1,1]=4 3631 B10R0.71 CC#CCSCCCOCC 62a_100012232248_100000748600 [0,1,0,0,0,0|1,1,1]=4 3632 B10R0.71 CC#CCSCCOCCC 62a_100000748600_100011215938 [0,1,0,0,0,0|1,1,1]=4 3633 B10R0.71 CC#CCSCCOCCC 62a_100011215938_100000748600 [0,1,0,0,0,0|1,1,1]=4 3634 B10R0.71 CC#CCSCCOCCO 62a_100000748600_100011215305 [0,1,0,0,0,0|1,1,1]=4 3635 B10R0.71 CC#CCSCCOCCO 62a_100011215305_100000748600 [0,1,0,0,0,0|1,1,1]=4 3636 B10R0.71 CC#CCSCOCCCC 62a_100000748600_100011995733 [0,1,0,0,0,0|2,0,1]=4 3637 B10R0.71 CC#CCSCOCCCC 62a_100011995733_100000748600 [0,1,0,0,0,0|2,0,1]=4 3638 B10R0.71 CC#CCSCOCCOC 62a_100000231047_100000748600 [0,1,0,0,0,0|1,0,1]=3 3639 B10R0.71 CC#CCSCOCCOC 62a_100000748600_100000231047 [0,1,0,0,0,0|1,0,1]=3 3640 B10R0.71 CC/C=C/C/C=C/CCOC 34a_200016273837_200000210301 [0,1,0,0,0,0|2,0,1]=4 3641 B10R0.71 CC/C=C/C/C=C/CCOC 7a_200016273837_200000210301 [0,1,0,0,0,0|2,0,1]=4 3642 B10R0.71 CC/C=C/C/C=C/CCO[13CH3] 34a_200016273837_200025704644 [0,1,0,0,0,0|2,0,1]=4 3643 B10R0.71 CC/C=C/C/C=C/CCO[13CH3] 7a_200016273837_200025704644 [0,1,0,0,0,0|2,0,1]=4 3644 B10R0.71 CC/C=C/CC/C=C/COC 34a_100016264143_200000210301 [0,1,0,0,0,0|2,0,1]=4 3645 B10R0.71 CC/C=C/CC/C=C/COC 7a_100016264143_200000210301 [0,1,0,0,0,0|2,0,1]=4 3646 B10R0.71 CC/C=C/CC/C=C/CO[13CH3] 34a_100016264143_200025704644 [0,1,0,0,0,0|2,0,1]=4 3647 B10R0.71 CC/C=C/CC/C=C/CO[13CH3] 7a_100016264143_200025704644 [0,1,0,0,0,0|2,0,1]=4 3648 B10R0.71 CC/C=C\CCCCCNC 269862a_106832991636_100016288537 [0,1,0,0,0,0|3,0,0]=4 3649 B10R0.71 CC/C=C\CCCCCOC 34a_100016268722_200000210301 [0,1,0,0,0,0|2,0,0]=3 3650 B10R0.71 CC/C=C\CCCCCOC 7a_100016268722_200000210301 [0,1,0,0,0,0|2,0,0]=3 3651 B10R0.71 CC/C=C\CCCCCO[13CH3] 34a_100016268722_200025704644 [0,1,0,0,0,0|2,0,0]=3 3652 B10R0.71 CC/C=C\CCCCCO[13CH3] 7a_100016268722_200025704644 [0,1,0,0,0,0|2,0,0]=3 3653 B10R0.71 CC/C=C\CCCCOCC 34a_100016287862_100000210202 [0,1,0,0,0,0|2,0,1]=4 3654 B10R0.71 CC/C=C\CCCCOCC 7a_100016287862_100000210202 [0,1,0,0,0,0|2,0,1]=4 3655 B10R0.71 CC/C=C\CCCCOCF 34a_100016287862_100015361967 [0,1,0,0,0,0|2,0,1]=4 3656 B10R0.71 CC/C=C\CCCCOCF 7a_100016287862_100015361967 [0,1,0,0,0,0|2,0,1]=4 3657 B10R0.71 CC/C=C\CCNCCCC 2230a_100000102301_100015370543 [0,1,0,0,0,0|3,0,0]=4 3658 B10R0.71 CC/C=C\CCNCCCC 7a_106832991798_100015370543 [0,1,0,0,0,0|3,0,0]=4 3659 B10R0.71 CC/C=C\CCNCCOC 2230a_100000209980_100015370543 [0,1,0,0,0,0|2,0,0]=3 3660 B10R0.71 CC/C=C\CCNCCSC 2230a_100020590264_100015370543 [0,1,0,0,0,0|2,1,0]=4 3661 B10R0.71 CC/C=C\CCOCCC#N 7a_100016288707_100000184422 [0,1,0,0,0,0|3,0,0]=4 3662 B10R0.71 CC/C=C\CCOCCCBr 34a_100011217188_100015370543 [0,1,0,0,0,0|3,0,0]=4 3663 B10R0.71 CC/C=C\CCOCCCC 34a_100000210227_100015370543 [0,1,0,0,0,0|2,0,0]=3 3664 B10R0.71 CC/C=C\CCOCCCC 34a_100016288707_100000210210 [0,1,0,0,0,0|2,0,0]=3 3665 B10R0.71 CC/C=C\CCOCCCC 7a_100000210227_100015370543 [0,1,0,0,0,0|2,0,0]=3 3666 B10R0.71 CC/C=C\CCOCCCC 7a_100016288707_100000210211 [0,1,0,0,0,0|2,0,0]=3 3667 B10R0.71 CC/C=C\CCOCCCCl 34a_100000230001_100015370543 [0,1,0,0,0,0|3,0,0]=4 3668 B10R0.71 CC/C=C\CCOCCCF 34a_100000759539_100015370543 [0,1,0,0,0,0|3,0,0]=4 3669 B10R0.71 CC/C=C\CCOCCCF 34a_100016288707_100011934791 [0,1,0,0,0,0|3,0,0]=4 3670 B10R0.71 CC/C=C\CCOCCCF 7a_100016288707_100011934791 [0,1,0,0,0,0|3,0,0]=4 3671 B10R0.71 CC/C=C\CCOCCCN 34a_100000182051_100015370543 [0,1,0,0,0,0|3,0,0]=4 3672 B10R0.71 CC/C=C\CCOCCCO 34a_100016288707_100000230001 [0,1,0,0,0,0|3,0,0]=4 3673 B10R0.71 CC/C=C\CCOCCCO 7a_100016288707_100011215043 [0,1,0,0,0,0|3,0,0]=4 3674 B10R0.71 CC/C=C\CCOCCOC 34a_100000210237_100015370543 [0,1,0,0,0,0|1,0,0]=2 3675 B10R0.71 CC/C=C\CCOCCOC 34a_100016288707_100011201679 [0,1,0,0,0,0|1,0,0]=2 3676 B10R0.71 CC/C=C\CCOCCOC 7a_100016288707_100000233755 [0,1,0,0,0,0|1,0,0]=2 3677 B10R0.71 CC/C=C\CCOCCON 34a_100000700252_100015370543 [0,1,0,0,0,0|2,0,0]=3 3678 B10R0.71 CC/C=C\CCOCCSC 34a_100000230434_100015370543 [0,1,0,0,0,0|1,1,0]=3 3679 B10R0.71 CC/C=C\CCOCCSC 34a_100016288707_100000212216 [0,1,0,0,0,0|1,1,0]=3 3680 B10R0.71 CC/C=C\CCOCCSC 7a_100000230434_100015370543 [0,1,0,0,0,0|1,1,0]=3 3681 B10R0.71 CC/C=C\CCOCCSC 7a_100016288707_100000212216 [0,1,0,0,0,0|1,1,0]=3 3682 B10R0.71 CC/C=C\CCSCCCC 62a_100000210211_100015370543 [0,1,0,0,0,0|2,1,0]=4 3683 B10R0.71 CC/C=C\CCSCCCC 62a_100015370543_100000210210 [0,1,0,0,0,0|2,1,0]=4 3684 B10R0.71 CC/C=C\CCSCCOC 62a_100000233755_100015370543 [0,1,0,0,0,0|1,1,0]=3 3685 B10R0.71 CC/C=C\CCSCCOC 62a_100015370543_100000233755 [0,1,0,0,0,0|1,1,0]=3 3686 B10R0.71 CC/C=C\CCSCCSC 62a_100000212216_100015370543 [0,1,0,0,0,0|1,2,0]=4 3687 B10R0.71 CC/C=C\CCSCCSC 62a_100015370543_100000751147 [0,1,0,0,0,0|1,2,0]=4 3688 B10R0.71 CC/C=C\CNCCCOC 34a_100150723488_100103147603 [0,1,0,0,0,0|2,0,1]=4 3689 B10R0.71 CC/C=C\CNCCOCC 2230a_102516460346_100103147603 [0,1,0,0,0,0|2,0,1]=4 3690 B10R0.71 CC/C=C\CNCCOCC 34a_102516460346_100103147603 [0,1,0,0,0,0|2,0,1]=4 3691 B10R0.71 CC/C=C\COCCCCBr 34a_100011216708_100103147603 [0,1,0,0,0,0|2,0,1]=4 3692 B10R0.71 CC/C=C\COCCCCC 34a_100000210253_100103147603 [0,1,0,0,0,0|2,0,1]=4 3693 B10R0.71 CC/C=C\COCCCCC 34a_100016268518_100000718602 [0,1,0,0,0,0|2,0,1]=4 3694 B10R0.71 CC/C=C\COCCCCC 7a_100000210253_100103147603 [0,1,0,0,0,0|2,0,1]=4 3695 B10R0.71 CC/C=C\COCCCCCl 34a_100000210776_100103147603 [0,1,0,0,0,0|2,0,1]=4 3696 B10R0.71 CC/C=C\COCCCCCl 7a_100000210776_100103147603 [0,1,0,0,0,0|2,0,1]=4 3697 B10R0.71 CC/C=C\COCCCCF 34a_100011995726_100103147603 [0,1,0,0,0,0|2,0,1]=4 3698 B10R0.71 CC/C=C\COCCCCF 34a_100016268518_100000729493 [0,1,0,0,0,0|2,0,1]=4 3699 B10R0.71 CC/C=C\COCCCCF 7a_100011995726_100103147603 [0,1,0,0,0,0|2,0,1]=4 3700 B10R0.71 CC/C=C\COCCCCI 34a_200012148704_100103147603 [0,1,0,0,0,0|2,0,1]=4 3701 B10R0.71 CC/C=C\COCCCCN 34a_100000750430_100103147603 [0,1,0,0,0,0|2,0,1]=4 3702 B10R0.71 CC/C=C\COCCCCO 34a_100016268518_100011216708 [0,1,0,0,0,0|2,0,1]=4 3703 B10R0.71 CC/C=C\COCCCNC 34a_100000213112_100103147603 [0,1,0,0,0,0|2,0,1]=4 3704 B10R0.71 CC/C=C\COCCCOC 34a_100000740835_100103147603 [0,1,0,0,0,0|1,0,1]=3 3705 B10R0.71 CC/C=C\COCCCOC 34a_100016268518_100000740836 [0,1,0,0,0,0|1,0,1]=3 3706 B10R0.71 CC/C=C\COCCCSC 34a_100000690336_100103147603 [0,1,0,0,0,0|1,1,1]=4 3707 B10R0.71 CC/C=C\COCCCSC 7a_100000690336_100103147603 [0,1,0,0,0,0|1,1,1]=4 3708 B10R0.71 CC/C=C\COCCOCC 34a_100000210136_100103147603 [0,1,0,0,0,0|1,0,1]=3 3709 B10R0.71 CC/C=C\COCCOCC 34a_100016268518_100000210147 [0,1,0,0,0,0|1,0,1]=3 3710 B10R0.71 CC/C=C\COCCOCC 7a_100000210136_100103147603 [0,1,0,0,0,0|1,0,1]=3 3711 B10R0.71 CC/C=C\COCCSCC 34a_100000212035_100103147603 [0,1,0,0,0,0|1,1,1]=4 3712 B10R0.71 CC/C=C\COCCSCC 34a_100016268518_100000757381 [0,1,0,0,0,0|1,1,1]=4 3713 B10R0.71 CC/C=C\COCCSCC 7a_100000212035_100103147603 [0,1,0,0,0,0|1,1,1]=4 3714 B10R0.71 CC/C=C\CSCCCOC 62a_100000709357_100103147603 [0,1,0,0,0,0|1,1,1]=4 3715 B10R0.71 CC/C=C\CSCCCOC 62a_100103147603_100000709357 [0,1,0,0,0,0|1,1,1]=4 3716 B10R0.71 CC/C=C\CSCCOCC 62a_100000210147_100103147603 [0,1,0,0,0,0|1,1,1]=4 3717 B10R0.71 CC/C=C\CSCCOCC 62a_100103147603_100011215890 [0,1,0,0,0,0|1,1,1]=4 3718 B10R0.71 CC=C=CCCOCCCC 34a_100011020354_100000210210 [0,1,0,0,0,0|2,0,1]=4 3719 B10R0.71 CC=C=CCCOCCOC 34a_100011020354_100011201679 [0,1,0,0,0,0|1,0,1]=3 3720 B10R0.71 CC=C=CCCOCCSC 34a_100011020354_100000212216 [0,1,0,0,0,0|1,1,1]=4 3721 B10R0.71 CC=CCCCOCCCC 34a_100020645299_100000210210 [0,1,0,0,0,0|2,0,1]=4 3722 B10R0.71 CC=CCCCOCCOC 34a_100020645299_100011201679 [0,1,0,0,0,0|1,0,1]=3 3723 B10R0.71 CC=CCCCOCCSC 34a_100020645299_100000212216 [0,1,0,0,0,0|1,1,1]=4 3724 B10R0.71 CC=CCNCCCOCC 2230a_100000210961_100000070051 [0,1,0,0,0,0|2,0,1]=4 3725 B10R0.71 CC=CCNCCCOCC 34a_100000210961_100000070051 [0,1,0,0,0,0|2,0,1]=4 3726 B10R0.71 CC=CCNCCOCCC 2230a_100161115042_100000070051 [0,1,0,0,0,0|2,0,1]=4 3727 B10R0.71 CC=CCNCCOCCC 34a_100161115042_100000070051 [0,1,0,0,0,0|2,0,1]=4 3728 B10R0.71 CC=CCNCCOCCO 2230a_100000211614_100000070051 [0,1,0,0,0,0|2,0,1]=4 3729 B10R0.71 CC=CCNCCOCCO 34a_100000211614_100000070051 [0,1,0,0,0,0|2,0,1]=4 3730 B10R0.71 CC=CCOCC/C=C\CC 34a_100016288707_100000070051 [0,1,0,0,0,0|2,0,1]=4 3731 B10R0.71 CC=CCOCC/C=C\CC 7a_100016288707_100000070051 [0,1,0,0,0,0|2,0,1]=4 3732 B10R0.71 CC=CCOCCC#CCC 34a_100000036655_100000070051 [0,1,0,0,0,0|2,0,1]=4 3733 B10R0.71 CC=CCOCCC#CCC 7a_100000036655_100000070051 [0,1,0,0,0,0|2,0,1]=4 3734 B10R0.71 CC=CCOCCCCCBr 34a_100000746331_100000070051 [0,1,0,0,0,0|2,0,1]=4 3735 B10R0.71 CC=CCOCCCCCBr 7a_100000746331_100000070051 [0,1,0,0,0,0|2,0,1]=4 3736 B10R0.71 CC=CCOCCCCCC 34a_100000210259_100000070051 [0,1,0,0,0,0|2,0,1]=4 3737 B10R0.71 CC=CCOCCCCCC 7a_100000210259_100000070051 [0,1,0,0,0,0|2,0,1]=4 3738 B10R0.71 CC=CCOCCCCCCl 34a_100000746330_100000070051 [0,1,0,0,0,0|2,0,1]=4 3739 B10R0.71 CC=CCOCCCCCCl 7a_100000746330_100000070051 [0,1,0,0,0,0|2,0,1]=4 3740 B10R0.71 CC=CCOCCCCCI 34a_200012148887_100000070051 [0,1,0,0,0,0|2,0,1]=4 3741 B10R0.71 CC=CCOCCCCCI 7a_200012148887_100000070051 [0,1,0,0,0,0|2,0,1]=4 3742 B10R0.71 CC=CCOCCCCCN 34a_100000762737_100000070051 [0,1,0,0,0,0|2,0,1]=4 3743 B10R0.71 CC=CCOCCCCOC 34a_100000740925_100000070051 [0,1,0,0,0,0|2,0,1]=4 3744 B10R0.71 CC=CCOCCCCSC 34a_100011217163_100000070051 [0,1,0,0,0,0|2,0,1]=4 3745 B10R0.71 CC=CCOCCCCSC 7a_100011217163_100000070051 [0,1,0,0,0,0|2,0,1]=4 3746 B10R0.71 CC=CCOCCCOCC 34a_100000757476_100000070051 [0,1,0,0,0,0|1,0,1]=3 3747 B10R0.71 CC=CCOCCCOCC 7a_100000757476_100000070051 [0,1,0,0,0,0|1,0,1]=3 3748 B10R0.71 CC=CCOCCCSCC 34a_100011216438_100000070051 [0,1,0,0,0,0|1,1,1]=4 3749 B10R0.71 CC=CCOCCCSCC 7a_100011216438_100000070051 [0,1,0,0,0,0|1,1,1]=4 3750 B10R0.71 CC=CCOCCOCCBr 34a_100000692535_100000070051 [0,1,0,0,0,0|1,0,1]=3 3751 B10R0.71 CC=CCOCCOCCBr 7a_100000692535_100000070051 [0,1,0,0,0,0|1,0,1]=3 3752 B10R0.71 CC=CCOCCOCCC 34a_100000752267_100000070051 [0,1,0,0,0,0|1,0,1]=3 3753 B10R0.71 CC=CCOCCOCCC 7a_100000752267_100000070051 [0,1,0,0,0,0|1,0,1]=3 3754 B10R0.71 CC=CCOCCOCCCl 34a_100011215305_100000070051 [0,1,0,0,0,0|1,0,1]=3 3755 B10R0.71 CC=CCOCCOCCCl 7a_100011215305_100000070051 [0,1,0,0,0,0|1,0,1]=3 3756 B10R0.71 CC=CCOCCOCCF 34a_200015357709_100000070051 [0,1,0,0,0,0|1,0,1]=3 3757 B10R0.71 CC=CCOCCOCCF 7a_200015357709_100000070051 [0,1,0,0,0,0|1,0,1]=3 3758 B10R0.71 CC=CCOCCOCCI 34a_100012149058_100000070051 [0,1,0,0,0,0|1,0,1]=3 3759 B10R0.71 CC=CCOCCOCCI 7a_100012149058_100000070051 [0,1,0,0,0,0|1,0,1]=3 3760 B10R0.71 CC=CCOCCOCCN 34a_100000211614_100000070051 [0,1,0,0,0,0|1,0,1]=3 3761 B10R0.71 CC=CCOCCSCCC 34a_200000230433_100000070051 [0,1,0,0,0,0|1,1,1]=4 3762 B10R0.71 CC=CCOCCSCCC 7a_200000230433_100000070051 [0,1,0,0,0,0|1,1,1]=4 3763 B10R0.71 CC=CCSCCCCOC 62a_100000070051_100000730899 [0,1,0,0,0,0|2,0,1]=4 3764 B10R0.71 CC=CCSCCCCOC 62a_100000730899_100000070051 [0,1,0,0,0,0|2,0,1]=4 3765 B10R0.71 CC=CCSCCCOCC 62a_100000070051_100012232248 [0,1,0,0,0,0|1,1,1]=4 3766 B10R0.71 CC=CCSCCCOCC 62a_100012232248_100000070051 [0,1,0,0,0,0|1,1,1]=4 3767 B10R0.71 CC=CCSCCOCCC 62a_100000070051_100011215938 [0,1,0,0,0,0|1,1,1]=4 3768 B10R0.71 CC=CCSCCOCCC 62a_100011215938_100000070051 [0,1,0,0,0,0|1,1,1]=4 3769 B10R0.71 CC=CCSCCOCCO 62a_100000070051_100011215305 [0,1,0,0,0,0|1,1,1]=4 3770 B10R0.71 CC=CCSCCOCCO 62a_100011215305_100000070051 [0,1,0,0,0,0|1,1,1]=4 3771 B10R0.71 CC=CCSCOCCCC 62a_100000070051_100011995733 [0,1,0,0,0,0|2,0,1]=4 3772 B10R0.71 CC=CCSCOCCCC 62a_100011995733_100000070051 [0,1,0,0,0,0|2,0,1]=4 3773 B10R0.71 CC=CCSCOCCOC 62a_100000070051_100000231047 [0,1,0,0,0,0|1,0,1]=3 3774 B10R0.71 CC=CCSCOCCOC 62a_100000231047_100000070051 [0,1,0,0,0,0|1,0,1]=3 3775 B10R0.71 CCC#CCCOCCC#N 7a_100000036655_100000184422 [0,1,0,0,0,0|3,0,0]=4 3776 B10R0.71 CCC#CCCOCCCC 34a_100000036655_100000210210 [0,1,0,0,0,0|2,0,0]=3 3777 B10R0.71 CCC#CCCOCCCC 7a_100000036655_100000210211 [0,1,0,0,0,0|2,0,0]=3 3778 B10R0.71 CCC#CCCOCCCF 34a_100000036655_100011934791 [0,1,0,0,0,0|3,0,0]=4 3779 B10R0.71 CCC#CCCOCCCF 7a_100000036655_100011934791 [0,1,0,0,0,0|3,0,0]=4 3780 B10R0.71 CCC#CCCOCCCO 34a_100000036655_100000230001 [0,1,0,0,0,0|3,0,0]=4 3781 B10R0.71 CCC#CCCOCCCO 7a_100000036655_100011215043 [0,1,0,0,0,0|3,0,0]=4 3782 B10R0.71 CCC#CCCOCCOC 34a_100000036655_100011201679 [0,1,0,0,0,0|1,0,0]=2 3783 B10R0.71 CCC#CCCOCCOC 7a_100000036655_100000233755 [0,1,0,0,0,0|1,0,0]=2 3784 B10R0.71 CCC#CCCOCCSC 34a_100000036655_100000212216 [0,1,0,0,0,0|1,1,0]=3 3785 B10R0.71 CCC#CCCOCCSC 7a_100000036655_100000212216 [0,1,0,0,0,0|1,1,0]=3 3786 B10R0.71 CCC#CCNCCCOC 34a_100150723488_100009813939 [0,1,0,0,0,0|2,0,1]=4 3787 B10R0.71 CCC#CCNCCOCC 2230a_102516460346_100009813939 [0,1,0,0,0,0|2,0,1]=4 3788 B10R0.71 CCC#CCNCCOCC 34a_102516460346_100009813939 [0,1,0,0,0,0|2,0,1]=4 3789 B10R0.71 CCC#CCOCCCCBr 34a_100011216708_100009813939 [0,1,0,0,0,0|2,0,1]=4 3790 B10R0.71 CCC#CCOCCCCC 34a_100000032950_100000718602 [0,1,0,0,0,0|2,0,1]=4 3791 B10R0.71 CCC#CCOCCCCC 34a_100000210253_100009813939 [0,1,0,0,0,0|2,0,1]=4 3792 B10R0.71 CCC#CCOCCCCC 7a_100000210253_100009813939 [0,1,0,0,0,0|2,0,1]=4 3793 B10R0.71 CCC#CCOCCCCCl 34a_100000210776_100009813939 [0,1,0,0,0,0|2,0,1]=4 3794 B10R0.71 CCC#CCOCCCCCl 7a_100000210776_100009813939 [0,1,0,0,0,0|2,0,1]=4 3795 B10R0.71 CCC#CCOCCCCF 34a_100000032950_100000729493 [0,1,0,0,0,0|2,0,1]=4 3796 B10R0.71 CCC#CCOCCCCF 34a_100011995726_100009813939 [0,1,0,0,0,0|2,0,1]=4 3797 B10R0.71 CCC#CCOCCCCF 7a_100011995726_100009813939 [0,1,0,0,0,0|2,0,1]=4 3798 B10R0.71 CCC#CCOCCCCI 34a_200012148704_100009813939 [0,1,0,0,0,0|2,0,1]=4 3799 B10R0.71 CCC#CCOCCCCN 34a_100000750430_100009813939 [0,1,0,0,0,0|2,0,1]=4 3800 B10R0.71 CCC#CCOCCCCO 34a_100000032950_100011216708 [0,1,0,0,0,0|2,0,1]=4 3801 B10R0.71 CCC#CCOCCCNC 34a_100000213112_100009813939 [0,1,0,0,0,0|2,0,1]=4 3802 B10R0.71 CCC#CCOCCCOC 34a_100000032950_100000740836 [0,1,0,0,0,0|1,0,1]=3 3803 B10R0.71 CCC#CCOCCCOC 34a_100000740835_100009813939 [0,1,0,0,0,0|1,0,1]=3 3804 B10R0.71 CCC#CCOCCCSC 34a_100000690336_100009813939 [0,1,0,0,0,0|1,1,1]=4 3805 B10R0.71 CCC#CCOCCCSC 7a_100000690336_100009813939 [0,1,0,0,0,0|1,1,1]=4 3806 B10R0.71 CCC#CCOCCOCC 34a_100000032950_100000210147 [0,1,0,0,0,0|1,0,1]=3 3807 B10R0.71 CCC#CCOCCOCC 34a_100000210136_100009813939 [0,1,0,0,0,0|1,0,1]=3 3808 B10R0.71 CCC#CCOCCOCC 7a_100000210136_100009813939 [0,1,0,0,0,0|1,0,1]=3 3809 B10R0.71 CCC#CCOCCSCC 34a_100000032950_100000757381 [0,1,0,0,0,0|1,1,1]=4 3810 B10R0.71 CCC#CCOCCSCC 34a_100000212035_100009813939 [0,1,0,0,0,0|1,1,1]=4 3811 B10R0.71 CCC#CCOCCSCC 7a_100000212035_100009813939 [0,1,0,0,0,0|1,1,1]=4 3812 B10R0.71 CCC#CCSCCCOC 62a_100000709357_100009813939 [0,1,0,0,0,0|1,1,1]=4 3813 B10R0.71 CCC#CCSCCCOC 62a_100009813939_100000709357 [0,1,0,0,0,0|1,1,1]=4 3814 B10R0.71 CCC#CCSCCOCC 62a_100000210147_100009813939 [0,1,0,0,0,0|1,1,1]=4 3815 B10R0.71 CCC#CCSCCOCC 62a_100009813939_100011215890 [0,1,0,0,0,0|1,1,1]=4 3816 B10R0.71 CCC/C=C/COCCCC 34a_100016278788_100000210210 [0,1,0,0,0,0|2,0,1]=4 3817 B10R0.71 CCC/C=C/COCCCC 7a_100016278788_100000210211 [0,1,0,0,0,0|2,0,1]=4 3818 B10R0.71 CCC/C=C/COCCOC 34a_100016278788_100011201679 [0,1,0,0,0,0|1,0,1]=3 3819 B10R0.71 CCC/C=C/COCCOC 7a_100016278788_100000233755 [0,1,0,0,0,0|1,0,1]=3 3820 B10R0.71 CCC/C=C/COCCSC 34a_100016278788_100000212216 [0,1,0,0,0,0|1,1,1]=4 3821 B10R0.71 CCC/C=C/COCCSC 7a_100016278788_100000212216 [0,1,0,0,0,0|1,1,1]=4 3822 B10R0.71 CCCC#CCCOCCC 34a_100000042726_100000210303 [0,1,0,0,0,0|2,0,1]=4 3823 B10R0.71 CCCC#CCCOCCC 7a_100000042726_100000210303 [0,1,0,0,0,0|2,0,1]=4 3824 B10R0.71 CCCC#CCCOCCF 34a_100000042726_100011217306 [0,1,0,0,0,0|2,0,1]=4 3825 B10R0.71 CCCC#CCCOCCF 7a_100000042726_100011217306 [0,1,0,0,0,0|2,0,1]=4 3826 B10R0.71 CCCC#CCCOCCO 34a_100000042726_100000211926 [0,1,0,0,0,0|2,0,1]=4 3827 B10R0.71 CCCC#CCCOCCO 7a_100000042726_100000211926 [0,1,0,0,0,0|2,0,1]=4 3828 B10R0.71 CCCC#CCCOCSC 34a_100000042726_100011218213 [0,1,0,0,0,0|2,0,1]=4 3829 B10R0.71 CCCC#CCOCCCC 34a_100000034806_100000210210 [0,1,0,0,0,0|2,0,1]=4 3830 B10R0.71 CCCC#CCOCCCC 7a_100000034806_100000210211 [0,1,0,0,0,0|2,0,1]=4 3831 B10R0.71 CCCC#CCOCCOC 34a_100000034806_100011201679 [0,1,0,0,0,0|1,0,1]=3 3832 B10R0.71 CCCC#CCOCCOC 7a_100000034806_100000233755 [0,1,0,0,0,0|1,0,1]=3 3833 B10R0.71 CCCC#CCOCCSC 34a_100000034806_100000212216 [0,1,0,0,0,0|1,1,1]=4 3834 B10R0.71 CCCC#CCOCCSC 7a_100000034806_100000212216 [0,1,0,0,0,0|1,1,1]=4 3835 B10R0.71 CCCC/C=C/COCCC 34a_200016272032_100000210303 [0,1,0,0,0,0|2,0,1]=4 3836 B10R0.71 CCCC/C=C/COCCC 7a_200016272032_100000210303 [0,1,0,0,0,0|2,0,1]=4 3837 B10R0.71 CCCC/C=C/COCCF 34a_200016272032_100011217306 [0,1,0,0,0,0|2,0,1]=4 3838 B10R0.71 CCCC/C=C/COCCF 7a_200016272032_100011217306 [0,1,0,0,0,0|2,0,1]=4 3839 B10R0.71 CCCC/C=C/COCCO 34a_200016272032_100000211926 [0,1,0,0,0,0|2,0,1]=4 3840 B10R0.71 CCCC/C=C/COCCO 7a_200016272032_100000211926 [0,1,0,0,0,0|2,0,1]=4 3841 B10R0.71 CCCC/C=C/COCSC 34a_200016272032_100011218213 [0,1,0,0,0,0|2,0,1]=4 3842 B10R0.71 CCCC/C=C\CCOCC 34a_200016286491_100000210202 [0,1,0,0,0,0|2,0,0]=3 3843 B10R0.71 CCCC/C=C\CCOCC 7a_200016286491_100000210202 [0,1,0,0,0,0|2,0,0]=3 3844 B10R0.71 CCCC/C=C\CCOCF 34a_200016286491_100015361967 [0,1,0,0,0,0|2,0,1]=4 3845 B10R0.71 CCCC/C=C\CCOCF 7a_200016286491_100015361967 [0,1,0,0,0,0|2,0,1]=4 3846 B10R0.71 CCCC=NNCCOCC 4a_100000732670_100000185831 [0,1,0,0,0,0|2,0,1]=4 3847 B10R0.71 CCCCC#CCCCOC 34a_100138415774_200000047210 [0,1,0,0,0,0|2,0,1]=4 3848 B10R0.71 CCCCC#CCCOCC 34a_100000037610_100000210202 [0,1,0,0,0,0|2,0,0]=3 3849 B10R0.71 CCCCC#CCCOCC 7a_100000037610_100000210202 [0,1,0,0,0,0|2,0,0]=3 3850 B10R0.71 CCCCC#CCCOCF 34a_100000037610_100015361967 [0,1,0,0,0,0|2,0,1]=4 3851 B10R0.71 CCCCC#CCCOCF 7a_100000037610_100015361967 [0,1,0,0,0,0|2,0,1]=4 3852 B10R0.71 CCCCC#CCOCCC 34a_200000034558_100000210303 [0,1,0,0,0,0|2,0,1]=4 3853 B10R0.71 CCCCC#CCOCCC 7a_200000034558_100000210303 [0,1,0,0,0,0|2,0,1]=4 3854 B10R0.71 CCCCC#CCOCCF 34a_200000034558_100011217306 [0,1,0,0,0,0|2,0,1]=4 3855 B10R0.71 CCCCC#CCOCCF 7a_200000034558_100011217306 [0,1,0,0,0,0|2,0,1]=4 3856 B10R0.71 CCCCC#CCOCCO 34a_200000034558_100000211926 [0,1,0,0,0,0|2,0,1]=4 3857 B10R0.71 CCCCC#CCOCCO 7a_200000034558_100000211926 [0,1,0,0,0,0|2,0,1]=4 3858 B10R0.71 CCCCC#CCOCSC 34a_200000034558_100011218213 [0,1,0,0,0,0|2,0,1]=4 3859 B10R0.71 CCCCC/C=C/COCC 34a_100016258190_100000210202 [0,1,0,0,0,0|2,0,1]=4 3860 B10R0.71 CCCCC/C=C/COCC 7a_100016258190_100000210202 [0,1,0,0,0,0|2,0,1]=4 3861 B10R0.71 CCCCC/C=C/COCF 34a_100016258190_100015361967 [0,1,0,0,0,0|2,0,1]=4 3862 B10R0.71 CCCCC/C=C/COCF 7a_100016258190_100015361967 [0,1,0,0,0,0|2,0,1]=4 3863 B10R0.71 CCCCC/C=C\CCOC 34a_100016277358_200000210301 [0,1,0,0,0,0|2,0,0]=3 3864 B10R0.71 CCCCC/C=C\CCOC 7a_100016277358_200000210301 [0,1,0,0,0,0|2,0,0]=3 3865 B10R0.71 CCCCC/C=C\CCO[13CH3] 34a_100016277358_200025704644 [0,1,0,0,0,0|2,0,0]=3 3866 B10R0.71 CCCCC/C=C\CCO[13CH3] 7a_100016277358_200025704644 [0,1,0,0,0,0|2,0,0]=3 3867 B10R0.71 CCCCCC#CCCOC 34a_200000042877_200000210301 [0,1,0,0,0,0|2,0,0]=3 3868 B10R0.71 CCCCCC#CCCOC 7a_200000042877_200000210301 [0,1,0,0,0,0|2,0,0]=3 3869 B10R0.71 CCCCCC#CCCO[13CH3] 34a_200000042877_200025704644 [0,1,0,0,0,0|2,0,0]=3 3870 B10R0.71 CCCCCC#CCCO[13CH3] 7a_200000042877_200025704644 [0,1,0,0,0,0|2,0,0]=3 3871 B10R0.71 CCCCCC#CCOCC 34a_100121572206_100009816472 [0,1,0,0,0,0|2,0,1]=4 3872 B10R0.71 CCCCCC#CCOCC 34a_200000033628_100000210202 [0,1,0,0,0,0|2,0,1]=4 3873 B10R0.71 CCCCCC#CCOCC 7a_200000033628_100000210202 [0,1,0,0,0,0|2,0,1]=4 3874 B10R0.71 CCCCCC#CCOCF 34a_200000033628_100015361967 [0,1,0,0,0,0|2,0,1]=4 3875 B10R0.71 CCCCCC#CCOCF 7a_200000033628_100015361967 [0,1,0,0,0,0|2,0,1]=4 3876 B10R0.71 CCCCCC/C=C/COC 34a_200016276170_200000210301 [0,1,0,0,0,0|2,0,1]=4 3877 B10R0.71 CCCCCC/C=C/COC 7a_200016276170_200000210301 [0,1,0,0,0,0|2,0,1]=4 3878 B10R0.71 CCCCCC/C=C/CO[13CH3] 34a_200016276170_200025704644 [0,1,0,0,0,0|2,0,1]=4 3879 B10R0.71 CCCCCC/C=C/CO[13CH3] 7a_200016276170_200025704644 [0,1,0,0,0,0|2,0,1]=4 3880 B10R0.71 CCCCCCC#CCOC 34a_200000037284_200000210301 [0,1,0,0,0,0|2,0,1]=4 3881 B10R0.71 CCCCCCC#CCOC 7a_200000037284_200000210301 [0,1,0,0,0,0|2,0,1]=4 3882 B10R0.71 CCCCCCC#CCO[13CH3] 34a_200000037284_200025704644 [0,1,0,0,0,0|2,0,1]=4 3883 B10R0.71 CCCCCCC#CCO[13CH3] 7a_200000037284_200025704644 [0,1,0,0,0,0|2,0,1]=4 3884 B10R0.71 CCCCCCCCCNC 2230a_100000212291_200000210301 [0,1,0,0,0,0|3,0,0]=4 3885 B10R0.71 CCCCCCCCCNC 2230a_106832991635_100011214924 [0,1,0,0,0,0|3,0,0]=4 3886 B10R0.71 CCCCCCCCCNC 34a_100000212291_200000210301 [0,1,0,0,0,0|3,0,0]=4 3887 B10R0.71 CCCCCCCCCNC 34a_100102657272_100011214924 [0,1,0,0,0,0|3,0,0]=4 3888 B10R0.71 CCCCCCCCCNC 7a_106832991635_100000210328 [0,1,0,0,0,0|3,0,0]=4 3889 B10R0.71 CCCCCCCCCN[13CH3] 2230a_100000212291_200025704644 [0,1,0,0,0,0|3,0,0]=4 3890 B10R0.71 CCCCCCCCCN[13CH3] 34a_100000212291_200025704644 [0,1,0,0,0,0|3,0,0]=4 3891 B10R0.71 CCCCCCCCCOC 34a_100000210712_200000210301 [0,1,0,0,0,0|2,0,0]=3 3892 B10R0.71 CCCCCCCCCOC 34a_100138415774_100011214924 [0,1,0,0,0,0|2,0,0]=3 3893 B10R0.71 CCCCCCCCCOC 7a_100000210712_200000210301 [0,1,0,0,0,0|2,0,0]=3 3894 B10R0.71 CCCCCCCCCO[13CH3] 34a_100000210712_200025704644 [0,1,0,0,0,0|2,0,0]=3 3895 B10R0.71 CCCCCCCCCO[13CH3] 7a_100000210712_200025704644 [0,1,0,0,0,0|2,0,0]=3 3896 B10R0.71 CCCCCCCCCSC 62a_200000210301_100000210670 [0,1,0,0,0,0|2,1,0]=4 3897 B10R0.71 CCCCCCCCCS[13CH3] 62a_200025704644_100000210670 [0,1,0,0,0,0|2,1,0]=4 3898 B10R0.71 CCCCCCCCNCC 2230a_100000229939_100000210202 [0,1,0,0,0,0|3,0,0]=4 3899 B10R0.71 CCCCCCCCNCC 2230a_100015525214_100000210759 [0,1,0,0,0,0|3,0,0]=4 3900 B10R0.71 CCCCCCCCNCC 34a_100000229939_100000210202 [0,1,0,0,0,0|3,0,0]=4 3901 B10R0.71 CCCCCCCCNCF 34a_100000229939_100015361967 [0,1,0,0,0,0|3,0,0]=4 3902 B10R0.71 CCCCCCCCOCC 34a_100000210232_100000210202 [0,1,0,0,0,0|2,0,0]=3 3903 B10R0.71 CCCCCCCCOCC 34a_100121572206_100000210759 [0,1,0,0,0,0|2,0,0]=3 3904 B10R0.71 CCCCCCCCOCC 7a_100000210232_100000210202 [0,1,0,0,0,0|2,0,0]=3 3905 B10R0.71 CCCCCCCCOCF 34a_100000210232_100015361967 [0,1,0,0,0,0|2,0,0]=3 3906 B10R0.71 CCCCCCCCOCF 7a_100000210232_100015361967 [0,1,0,0,0,0|2,0,0]=3 3907 B10R0.71 CCCCCCCCSCC 62a_100000210202_100000210317 [0,1,0,0,0,0|2,1,0]=4 3908 B10R0.71 CCCCCCCCSCC 62a_100000210759_100000210202 [0,1,0,0,0,0|2,1,0]=4 3909 B10R0.71 CCCCCCCCSCF 62a_100000210759_100015361967 [0,1,0,0,0,0|2,1,0]=4 3910 B10R0.71 CCCCCCCCSCF 62a_100015361967_100000210317 [0,1,0,0,0,0|2,1,0]=4 3911 B10R0.71 CCCCCCCNCCC 2230a_100000229938_100000210303 [0,1,0,0,0,0|3,0,0]=4 3912 B10R0.71 CCCCCCCNCCF 2230a_100000229938_100011217306 [0,1,0,0,0,0|3,0,0]=4 3913 B10R0.71 CCCCCCCNCCF 34a_100000724931_100000210614 [0,1,0,0,0,0|3,0,0]=4 3914 B10R0.71 CCCCCCCNCCO 2230a_100000229938_100000211926 [0,1,0,0,0,0|3,0,0]=4 3915 B10R0.71 CCCCCCCNCCO 2230a_100016997473_100000210681 [0,1,0,0,0,0|3,0,0]=4 3916 B10R0.71 CCCCCCCNCCO 34a_100016990907_100000210614 [0,1,0,0,0,0|3,0,0]=4 3917 B10R0.71 CCCCCCCNCOC 2230a_100000229938_100000766300 [0,1,0,0,0,0|2,0,0]=3 3918 B10R0.71 CCCCCCCNCSC 2230a_100000229938_100011218213 [0,1,0,0,0,0|2,1,0]=4 3919 B10R0.71 CCCCCCCOCC#N 7a_100000210272_100011215382 [0,1,0,0,0,0|2,0,1]=4 3920 B10R0.71 CCCCCCCOCC=O 34a_100000210272_200009817547 [0,1,0,0,0,0|2,0,1]=4 3921 B10R0.71 CCCCCCCOCC=O 7a_100000210272_200015260668 [0,1,0,0,0,0|2,0,1]=4 3922 B10R0.71 CCCCCCCOCCBr 34a_100000211926_100000210614 [0,1,0,0,0,0|2,0,0]=3 3923 B10R0.71 CCCCCCCOCCC 34a_100000210258_100000210614 [0,1,0,0,0,0|2,0,0]=3 3924 B10R0.71 CCCCCCCOCCC 34a_100000210272_100000210303 [0,1,0,0,0,0|2,0,0]=3 3925 B10R0.71 CCCCCCCOCCC 7a_100000210272_100000210303 [0,1,0,0,0,0|2,0,0]=3 3926 B10R0.71 CCCCCCCOCCF 34a_100000210272_100011217306 [0,1,0,0,0,0|2,0,0]=3 3927 B10R0.71 CCCCCCCOCCF 7a_100000210272_100011217306 [0,1,0,0,0,0|2,0,0]=3 3928 B10R0.71 CCCCCCCOCCN 34a_100000210304_100000210614 [0,1,0,0,0,0|2,0,0]=3 3929 B10R0.71 CCCCCCCOCCO 34a_100000210272_100000211926 [0,1,0,0,0,0|2,0,0]=3 3930 B10R0.71 CCCCCCCOCCO 7a_100000210272_100000211926 [0,1,0,0,0,0|2,0,0]=3 3931 B10R0.71 CCCCCCCOCSC 34a_100000210272_100011218213 [0,1,0,0,0,0|2,0,0]=3 3932 B10R0.71 CCCCCCCSCCC 62a_100000210303_100000210316 [0,1,0,0,0,0|2,1,0]=4 3933 B10R0.71 CCCCCCCSCCC 62a_100000210614_100000210303 [0,1,0,0,0,0|2,1,0]=4 3934 B10R0.71 CCCCCCCSCCF 62a_100000210614_100011217306 [0,1,0,0,0,0|2,1,0]=4 3935 B10R0.71 CCCCCCCSCCF 62a_100011217306_100000210316 [0,1,0,0,0,0|2,1,0]=4 3936 B10R0.71 CCCCCCCSCCO 62a_100000210614_100000211926 [0,1,0,0,0,0|2,1,0]=4 3937 B10R0.71 CCCCCCCSCCO 62a_100000211926_100000210316 [0,1,0,0,0,0|2,1,0]=4 3938 B10R0.71 CCCCCCCSCOC 62a_100000210614_100000766300 [0,1,0,0,0,0|2,0,0]=3 3939 B10R0.71 CCCCCCCSCOC 62a_100000766300_100000210316 [0,1,0,0,0,0|2,0,0]=3 3940 B10R0.71 CCCCCCCSCSC 62a_100000210614_100011218213 [0,1,0,0,0,0|2,1,0]=4 3941 B10R0.71 CCCCCCCSCSC 62a_100011218213_100000210316 [0,1,0,0,0,0|2,1,0]=4 3942 B10R0.71 CCCCCCNCCCC 2230a_100000102301_100000210314 [0,1,0,0,0,0|3,0,0]=4 3943 B10R0.71 CCCCCCNCCCC 2230a_100000210581_100000210211 [0,1,0,0,0,0|3,0,0]=4 3944 B10R0.71 CCCCCCNCCCC 7a_106832991798_100000210314 [0,1,0,0,0,0|3,0,0]=4 3945 B10R0.71 CCCCCCNCCOC 2230a_100000209980_100000210314 [0,1,0,0,0,0|2,0,0]=3 3946 B10R0.71 CCCCCCNCCOC 2230a_100000210581_100011201679 [0,1,0,0,0,0|2,0,0]=3 3947 B10R0.71 CCCCCCNCCSC 2230a_100000210581_100000751147 [0,1,0,0,0,0|2,1,0]=4 3948 B10R0.71 CCCCCCNCCSC 2230a_100020590264_100000210314 [0,1,0,0,0,0|2,1,0]=4 3949 B10R0.71 CCCCCCOCCC#N 7a_100000210259_100000184422 [0,1,0,0,0,0|3,0,0]=4 3950 B10R0.71 CCCCCCOCCCBr 34a_100011217188_100000210314 [0,1,0,0,0,0|3,0,0]=4 3951 B10R0.71 CCCCCCOCCCC 34a_100000210227_100000210314 [0,1,0,0,0,0|2,0,0]=3 3952 B10R0.71 CCCCCCOCCCC 34a_100000210259_100000210210 [0,1,0,0,0,0|2,0,0]=3 3953 B10R0.71 CCCCCCOCCCC 7a_100000210227_100000210314 [0,1,0,0,0,0|2,0,0]=3 3954 B10R0.71 CCCCCCOCCCC 7a_100000210259_100000210211 [0,1,0,0,0,0|2,0,0]=3 3955 B10R0.71 CCCCCCOCCCCl 34a_100000230001_100000210314 [0,1,0,0,0,0|3,0,0]=4 3956 B10R0.71 CCCCCCOCCCF 34a_100000210259_100011934791 [0,1,0,0,0,0|3,0,0]=4 3957 B10R0.71 CCCCCCOCCCF 34a_100000759539_100000210314 [0,1,0,0,0,0|3,0,0]=4 3958 B10R0.71 CCCCCCOCCCF 7a_100000210259_100011934791 [0,1,0,0,0,0|3,0,0]=4 3959 B10R0.71 CCCCCCOCCCN 34a_100000182051_100000210314 [0,1,0,0,0,0|3,0,0]=4 3960 B10R0.71 CCCCCCOCCCO 34a_100000210259_100000230001 [0,1,0,0,0,0|3,0,0]=4 3961 B10R0.71 CCCCCCOCCCO 7a_100000210259_100011215043 [0,1,0,0,0,0|3,0,0]=4 3962 B10R0.71 CCCCCCOCCOC 34a_100000210237_100000210314 [0,1,0,0,0,0|1,0,0]=2 3963 B10R0.71 CCCCCCOCCOC 34a_100000210259_100011201679 [0,1,0,0,0,0|1,0,0]=2 3964 B10R0.71 CCCCCCOCCOC 34a_100000691444_200000210301 [0,1,0,0,0,0|1,0,0]=2 3965 B10R0.71 CCCCCCOCCOC 7a_100000210259_100000233755 [0,1,0,0,0,0|1,0,0]=2 3966 B10R0.71 CCCCCCOCCOC 7a_100000691444_200000210301 [0,1,0,0,0,0|1,0,0]=2 3967 B10R0.71 CCCCCCOCCON 34a_100000700252_100000210314 [0,1,0,0,0,0|2,0,0]=3 3968 B10R0.71 CCCCCCOCCO[13CH3] 34a_100000691444_200025704644 [0,1,0,0,0,0|1,0,0]=2 3969 B10R0.71 CCCCCCOCCO[13CH3] 7a_100000691444_200025704644 [0,1,0,0,0,0|1,0,0]=2 3970 B10R0.71 CCCCCCOCCSC 34a_100000210259_100000212216 [0,1,0,0,0,0|1,1,0]=3 3971 B10R0.71 CCCCCCOCCSC 34a_100000230434_100000210314 [0,1,0,0,0,0|1,1,0]=3 3972 B10R0.71 CCCCCCOCCSC 7a_100000210259_100000212216 [0,1,0,0,0,0|1,1,0]=3 3973 B10R0.71 CCCCCCOCCSC 7a_100000230434_100000210314 [0,1,0,0,0,0|1,1,0]=3 3974 B10R0.71 CCCCCCSCCCC 62a_100000210211_100000210757 [0,1,0,0,0,0|2,1,0]=4 3975 B10R0.71 CCCCCCSCCCC 62a_100000210314_100000210210 [0,1,0,0,0,0|2,1,0]=4 3976 B10R0.71 CCCCCCSCCOC 62a_100000210314_100000233755 [0,1,0,0,0,0|1,1,0]=3 3977 B10R0.71 CCCCCCSCCOC 62a_100000233755_100000210757 [0,1,0,0,0,0|1,1,0]=3 3978 B10R0.71 CCCCCCSCCSC 62a_100000210314_100000751147 [0,1,0,0,0,0|1,2,0]=4 3979 B10R0.71 CCCCCCSCCSC 62a_100000212216_100000210757 [0,1,0,0,0,0|1,2,0]=4 3980 B10R0.71 CCCCCCSCOCC 62a_100000210314_100000739092 [0,1,0,0,0,0|2,0,0]=3 3981 B10R0.71 CCCCCCSCOCC 62a_100000739092_100000210757 [0,1,0,0,0,0|2,0,0]=3 3982 B10R0.71 CCCCCNCCCCC 2230a_100000209983_100000210326 [0,1,0,0,0,0|3,0,0]=4 3983 B10R0.71 CCCCCNCCCCF 2230a_100000209983_100000729493 [0,1,0,0,0,0|3,0,0]=4 3984 B10R0.71 CCCCCNCCCCO 2230a_100000209983_100000210776 [0,1,0,0,0,0|3,0,0]=4 3985 B10R0.71 CCCCCNCCCCO 2230a_100000750430_100000210326 [0,1,0,0,0,0|3,0,0]=4 3986 B10R0.71 CCCCCNCCCCO 34a_100000750430_100000718602 [0,1,0,0,0,0|3,0,0]=4 3987 B10R0.71 CCCCCNCCCOC 2230a_100000209983_100000740836 [0,1,0,0,0,0|2,0,0]=3 3988 B10R0.71 CCCCCNCCCOC 34a_100150723488_100000718602 [0,1,0,0,0,0|2,0,0]=3 3989 B10R0.71 CCCCCNCCCSC 2230a_100000749238_100000210326 [0,1,0,0,0,0|2,1,0]=4 3990 B10R0.71 CCCCCNCCOCC 2230a_100000209983_100011215890 [0,1,0,0,0,0|2,0,0]=3 3991 B10R0.71 CCCCCNCCOCC 2230a_102516460346_100000210326 [0,1,0,0,0,0|2,0,0]=3 3992 B10R0.71 CCCCCNCCOCC 34a_100000224656_100000210202 [0,1,0,0,0,0|2,0,0]=3 3993 B10R0.71 CCCCCNCCOCC 34a_102516460346_100000718602 [0,1,0,0,0,0|2,0,0]=3 3994 B10R0.71 CCCCCNCCOCF 34a_100000224656_100015361967 [0,1,0,0,0,0|2,0,0]=3 3995 B10R0.71 CCCCCNCCSCC 2230a_100000106463_100000210326 [0,1,0,0,0,0|2,1,0]=4 3996 B10R0.71 CCCCCNCCSCC 2230a_100000209983_100000757381 [0,1,0,0,0,0|2,1,0]=4 3997 B10R0.71 CCCCCOCC#CCCl 34a_200000047223_100000718602 [0,1,0,0,0,0|2,0,1]=4 3998 B10R0.71 CCCCCOCC#CCO 34a_100000210253_200000047223 [0,1,0,0,0,0|2,0,1]=4 3999 B10R0.71 CCCCCOCC#CCO 7a_100000210253_200000047223 [0,1,0,0,0,0|2,0,1]=4 4000 B10R0.71 CCCCCOCCCC#N 7a_100000210253_100000687738 [0,1,0,0,0,0|2,0,1]=4 4001 B10R0.71 CCCCCOCCCC=O 7a_100000210253_200011292268 [0,1,0,0,0,0|2,0,1]=4 4002 B10R0.71 CCCCCOCCCCBr 34a_100011216708_100000718602 [0,1,0,0,0,0|2,0,0]=3 4003 B10R0.71 CCCCCOCCCCC 34a_100000210253_100000718602 [0,1,0,0,0,0|2,0,0]=3 4004 B10R0.71 CCCCCOCCCCC 7a_100000210253_100000210326 [0,1,0,0,0,0|2,0,0]=3 4005 B10R0.71 CCCCCOCCCCCl 34a_100000210776_100000718602 [0,1,0,0,0,0|2,0,0]=3 4006 B10R0.71 CCCCCOCCCCCl 7a_100000210776_100000210326 [0,1,0,0,0,0|2,0,0]=3 4007 B10R0.71 CCCCCOCCCCF 34a_100000210253_100000729493 [0,1,0,0,0,0|2,0,0]=3 4008 B10R0.71 CCCCCOCCCCF 34a_100011995726_100000718602 [0,1,0,0,0,0|2,0,0]=3 4009 B10R0.71 CCCCCOCCCCF 7a_100000210253_100000729493 [0,1,0,0,0,0|2,0,0]=3 4010 B10R0.71 CCCCCOCCCCF 7a_100011995726_100000210326 [0,1,0,0,0,0|2,0,0]=3 4011 B10R0.71 CCCCCOCCCCI 34a_200012148704_100000718602 [0,1,0,0,0,0|2,0,0]=3 4012 B10R0.71 CCCCCOCCCCN 34a_100000750430_100000718602 [0,1,0,0,0,0|2,0,0]=3 4013 B10R0.71 CCCCCOCCCCO 34a_100000210253_100011216708 [0,1,0,0,0,0|2,0,0]=3 4014 B10R0.71 CCCCCOCCCCO 7a_100000210253_100000210776 [0,1,0,0,0,0|2,0,0]=3 4015 B10R0.71 CCCCCOCCCNC 34a_100000213112_100000718602 [0,1,0,0,0,0|2,0,0]=3 4016 B10R0.71 CCCCCOCCCOC 34a_100000210253_100000740836 [0,1,0,0,0,0|1,0,0]=2 4017 B10R0.71 CCCCCOCCCOC 34a_100000740835_100000718602 [0,1,0,0,0,0|1,0,0]=2 4018 B10R0.71 CCCCCOCCCOC 7a_100000210253_100000740836 [0,1,0,0,0,0|1,0,0]=2 4019 B10R0.71 CCCCCOCCCSC 34a_100000690336_100000718602 [0,1,0,0,0,0|1,1,0]=3 4020 B10R0.71 CCCCCOCCCSC 7a_100000690336_100000210326 [0,1,0,0,0,0|1,1,0]=3 4021 B10R0.71 CCCCCOCCOCC 34a_100000210136_100000718602 [0,1,0,0,0,0|1,0,0]=2 4022 B10R0.71 CCCCCOCCOCC 34a_100000210253_100000210147 [0,1,0,0,0,0|1,0,0]=2 4023 B10R0.71 CCCCCOCCOCC 34a_100011215259_100000210202 [0,1,0,0,0,0|1,0,0]=2 4024 B10R0.71 CCCCCOCCOCC 7a_100000210136_100000210326 [0,1,0,0,0,0|1,0,0]=2 4025 B10R0.71 CCCCCOCCOCC 7a_100000210253_100011215890 [0,1,0,0,0,0|1,0,0]=2 4026 B10R0.71 CCCCCOCCOCC 7a_100011215259_100000210202 [0,1,0,0,0,0|1,0,0]=2 4027 B10R0.71 CCCCCOCCOCF 34a_100011215259_100015361967 [0,1,0,0,0,0|1,0,0]=2 4028 B10R0.71 CCCCCOCCOCF 7a_100011215259_100015361967 [0,1,0,0,0,0|1,0,0]=2 4029 B10R0.71 CCCCCOCCSCC 34a_100000210253_100000757381 [0,1,0,0,0,0|1,1,0]=3 4030 B10R0.71 CCCCCOCCSCC 34a_100000212035_100000718602 [0,1,0,0,0,0|1,1,0]=3 4031 B10R0.71 CCCCCOCCSCC 7a_100000210253_100000757381 [0,1,0,0,0,0|1,1,0]=3 4032 B10R0.71 CCCCCOCCSCC 7a_100000212035_100000210326 [0,1,0,0,0,0|1,1,0]=3 4033 B10R0.71 CCCCCSCCCCC 62a_100000210326_100000210326 [0,1,0,0,0,0|2,1,0]=4 4034 B10R0.71 CCCCCSCCCCF 62a_100000210326_100000729493 [0,1,0,0,0,0|2,1,0]=4 4035 B10R0.71 CCCCCSCCCCF 62a_100000729493_100000210326 [0,1,0,0,0,0|2,1,0]=4 4036 B10R0.71 CCCCCSCCCCO 62a_100000210326_100000210776 [0,1,0,0,0,0|2,1,0]=4 4037 B10R0.71 CCCCCSCCCCO 62a_100000210776_100000210326 [0,1,0,0,0,0|2,1,0]=4 4038 B10R0.71 CCCCCSCCCOC 62a_100000210326_100000709357 [0,1,0,0,0,0|1,1,0]=3 4039 B10R0.71 CCCCCSCCCOC 62a_100000709357_100000210326 [0,1,0,0,0,0|1,1,0]=3 4040 B10R0.71 CCCCCSCCOCC 62a_100000210147_100000210326 [0,1,0,0,0,0|1,1,0]=3 4041 B10R0.71 CCCCCSCCOCC 62a_100000210326_100011215890 [0,1,0,0,0,0|1,1,0]=3 4042 B10R0.71 CCCCCSCCSCC 62a_100000210326_100000757381 [0,1,0,0,0,0|1,2,0]=4 4043 B10R0.71 CCCCCSCCSCC 62a_100000757381_100000210326 [0,1,0,0,0,0|1,2,0]=4 4044 B10R0.71 CCCCNCCCCCF 2230a_100000102301_100000729378 [0,1,0,0,0,0|3,0,0]=4 4045 B10R0.71 CCCCNCCCCCF 7a_106832991798_100000729378 [0,1,0,0,0,0|3,0,0]=4 4046 B10R0.71 CCCCNCCCCCO 2230a_100000102301_100000746330 [0,1,0,0,0,0|3,0,0]=4 4047 B10R0.71 CCCCNCCCCCO 2230a_100000762737_100000210211 [0,1,0,0,0,0|3,0,0]=4 4048 B10R0.71 CCCCNCCCCCO 34a_100000762737_100000210210 [0,1,0,0,0,0|3,0,0]=4 4049 B10R0.71 CCCCNCCCCCO 7a_106832991798_100000746330 [0,1,0,0,0,0|3,0,0]=4 4050 B10R0.71 CCCCNCCCCOC 2230a_100000102301_100000730899 [0,1,0,0,0,0|2,0,0]=3 4051 B10R0.71 CCCCNCCCCOC 34a_200011216965_200000210301 [0,1,0,0,0,0|2,0,0]=3 4052 B10R0.71 CCCCNCCCCOC 7a_106832991798_100000730899 [0,1,0,0,0,0|2,0,0]=3 4053 B10R0.71 CCCCNCCCCO[13CH3] 34a_200011216965_200025704644 [0,1,0,0,0,0|2,0,0]=3 4054 B10R0.71 CCCCNCCCOCC 2230a_100000102301_100012232248 [0,1,0,0,0,0|2,0,0]=3 4055 B10R0.71 CCCCNCCCOCC 2230a_100000210961_100000210211 [0,1,0,0,0,0|2,0,0]=3 4056 B10R0.71 CCCCNCCCOCC 34a_100000210961_100000210210 [0,1,0,0,0,0|2,0,0]=3 4057 B10R0.71 CCCCNCCCOCC 7a_106832991798_100012232248 [0,1,0,0,0,0|2,0,0]=3 4058 B10R0.71 CCCCNCCOCC#N 2230a_100000102301_200000047693 [0,1,0,0,0,0|2,0,1]=4 4059 B10R0.71 CCCCNCCOCC#N 7a_106832991798_200000047693 [0,1,0,0,0,0|2,0,1]=4 4060 B10R0.71 CCCCNCCOCCC 2230a_100000102301_100011215938 [0,1,0,0,0,0|2,0,0]=3 4061 B10R0.71 CCCCNCCOCCC 2230a_100161115042_100000210211 [0,1,0,0,0,0|2,0,0]=3 4062 B10R0.71 CCCCNCCOCCC 34a_100161115042_100000210210 [0,1,0,0,0,0|2,0,0]=3 4063 B10R0.71 CCCCNCCOCCC 7a_106832991798_100011215938 [0,1,0,0,0,0|2,0,0]=3 4064 B10R0.71 CCCCNCCOCCO 2230a_100000102301_100011215305 [0,1,0,0,0,0|2,0,0]=3 4065 B10R0.71 CCCCNCCOCCO 2230a_100000211614_100000210211 [0,1,0,0,0,0|2,0,0]=3 4066 B10R0.71 CCCCNCCOCCO 34a_100000211614_100000210210 [0,1,0,0,0,0|2,0,0]=3 4067 B10R0.71 CCCCNCCOCCO 7a_106832991798_100011215305 [0,1,0,0,0,0|2,0,0]=3 4068 B10R0.71 CCCCNCCSCCC 2230a_100020603323_100000210211 [0,1,0,0,0,0|2,1,0]=4 4069 B10R0.71 CCCCNCCSCCO 2230a_100011219999_100000210211 [0,1,0,0,0,0|2,1,0]=4 4070 B10R0.71 CCCCNCOCCCC 2230a_100000102301_100011995733 [0,1,0,0,0,0|2,0,0]=3 4071 B10R0.71 CCCCNCOCCOC 2230a_100000102301_100000231047 [0,1,0,0,0,0|1,0,0]=2 4072 B10R0.71 CCCCOCCCCC#N 7a_100000210227_100000211819 [0,1,0,0,0,0|2,0,1]=4 4073 B10R0.71 CCCCOCCCCC=O 7a_100000210227_100000139335 [0,1,0,0,0,0|2,0,1]=4 4074 B10R0.71 CCCCOCCCCCBr 34a_100000746331_100000210210 [0,1,0,0,0,0|2,0,0]=3 4075 B10R0.71 CCCCOCCCCCBr 7a_100000746331_100000210211 [0,1,0,0,0,0|2,0,0]=3 4076 B10R0.71 CCCCOCCCCCCl 34a_100000746330_100000210210 [0,1,0,0,0,0|2,0,0]=3 4077 B10R0.71 CCCCOCCCCCCl 7a_100000746330_100000210211 [0,1,0,0,0,0|2,0,0]=3 4078 B10R0.71 CCCCOCCCCCF 34a_100000210227_100000729378 [0,1,0,0,0,0|2,0,0]=3 4079 B10R0.71 CCCCOCCCCCF 7a_100000210227_100000729378 [0,1,0,0,0,0|2,0,0]=3 4080 B10R0.71 CCCCOCCCCCI 34a_200012148887_100000210210 [0,1,0,0,0,0|2,0,0]=3 4081 B10R0.71 CCCCOCCCCCI 7a_200012148887_100000210211 [0,1,0,0,0,0|2,0,0]=3 4082 B10R0.71 CCCCOCCCCCN 34a_100000762737_100000210210 [0,1,0,0,0,0|2,0,0]=3 4083 B10R0.71 CCCCOCCCCCO 34a_100000210227_100000746330 [0,1,0,0,0,0|2,0,0]=3 4084 B10R0.71 CCCCOCCCCCO 7a_100000210227_100000746330 [0,1,0,0,0,0|2,0,0]=3 4085 B10R0.71 CCCCOCCCCOC 34a_100000210227_100000755781 [0,1,0,0,0,0|2,0,0]=3 4086 B10R0.71 CCCCOCCCCOC 34a_100000740925_100000210210 [0,1,0,0,0,0|2,0,0]=3 4087 B10R0.71 CCCCOCCCCOC 34a_200000760531_200000210301 [0,1,0,0,0,0|2,0,0]=3 4088 B10R0.71 CCCCOCCCCOC 7a_100000210227_100000730899 [0,1,0,0,0,0|2,0,0]=3 4089 B10R0.71 CCCCOCCCCOC 7a_200000760531_200000210301 [0,1,0,0,0,0|2,0,0]=3 4090 B10R0.71 CCCCOCCCCO[13CH3] 34a_200000760531_200025704644 [0,1,0,0,0,0|2,0,0]=3 4091 B10R0.71 CCCCOCCCCO[13CH3] 7a_200000760531_200025704644 [0,1,0,0,0,0|2,0,0]=3 4092 B10R0.71 CCCCOCCCCSC 34a_100011217163_100000210210 [0,1,0,0,0,0|2,0,0]=3 4093 B10R0.71 CCCCOCCCCSC 7a_100011217163_100000210211 [0,1,0,0,0,0|2,0,0]=3 4094 B10R0.71 CCCCOCCCNCC 2230a_200000211371_100000210202 [0,1,0,0,0,0|2,0,0]=3 4095 B10R0.71 CCCCOCCCNCC 34a_200000211371_100000210202 [0,1,0,0,0,0|2,0,0]=3 4096 B10R0.71 CCCCOCCCNCF 34a_200000211371_100015361967 [0,1,0,0,0,0|3,0,0]=4 4097 B10R0.71 CCCCOCCCOCC 34a_100000210227_100012232248 [0,1,0,0,0,0|1,0,0]=2 4098 B10R0.71 CCCCOCCCOCC 34a_100000757476_100000210210 [0,1,0,0,0,0|1,0,0]=2 4099 B10R0.71 CCCCOCCCOCC 34a_200011215613_100000210202 [0,1,0,0,0,0|1,0,0]=2 4100 B10R0.71 CCCCOCCCOCC 7a_100000210227_100012232248 [0,1,0,0,0,0|1,0,0]=2 4101 B10R0.71 CCCCOCCCOCC 7a_100000757476_100000210211 [0,1,0,0,0,0|1,0,0]=2 4102 B10R0.71 CCCCOCCCOCC 7a_200011215613_100000210202 [0,1,0,0,0,0|1,0,0]=2 4103 B10R0.71 CCCCOCCCOCF 34a_200011215613_100015361967 [0,1,0,0,0,0|2,0,0]=3 4104 B10R0.71 CCCCOCCCOCF 7a_200011215613_100015361967 [0,1,0,0,0,0|2,0,0]=3 4105 B10R0.71 CCCCOCCCSCC 34a_100011216438_100000210210 [0,1,0,0,0,0|1,1,0]=3 4106 B10R0.71 CCCCOCCCSCC 7a_100011216438_100000210211 [0,1,0,0,0,0|1,1,0]=3 4107 B10R0.71 CCCCOCCNCCF 34a_100000724931_100000743108 [0,1,0,0,0,0|2,0,0]=3 4108 B10R0.71 CCCCOCCNCCO 2230a_100016997473_100000743108 [0,1,0,0,0,0|2,0,0]=3 4109 B10R0.71 CCCCOCCNCCO 34a_100016990907_100000743108 [0,1,0,0,0,0|2,0,0]=3 4110 B10R0.71 CCCCOCCOCC#N 7a_100000210227_200000047693 [0,1,0,0,0,0|1,0,1]=3 4111 B10R0.71 CCCCOCCOCC#N 7a_100000210238_100011215382 [0,1,0,0,0,0|1,0,1]=3 4112 B10R0.71 CCCCOCCOCC=O 34a_100000210238_200009817547 [0,1,0,0,0,0|1,0,1]=3 4113 B10R0.71 CCCCOCCOCC=O 7a_100000210238_200015260668 [0,1,0,0,0,0|1,0,1]=3 4114 B10R0.71 CCCCOCCOCCBr 34a_100000211926_100000743108 [0,1,0,0,0,0|1,0,0]=2 4115 B10R0.71 CCCCOCCOCCBr 34a_100000692535_100000210210 [0,1,0,0,0,0|1,0,0]=2 4116 B10R0.71 CCCCOCCOCCBr 7a_100000692535_100000210211 [0,1,0,0,0,0|1,0,0]=2 4117 B10R0.71 CCCCOCCOCCC 34a_100000210227_100011215938 [0,1,0,0,0,0|1,0,0]=2 4118 B10R0.71 CCCCOCCOCCC 34a_100000210238_100000210303 [0,1,0,0,0,0|1,0,0]=2 4119 B10R0.71 CCCCOCCOCCC 34a_100000210258_100000743108 [0,1,0,0,0,0|1,0,0]=2 4120 B10R0.71 CCCCOCCOCCC 34a_100000752267_100000210210 [0,1,0,0,0,0|1,0,0]=2 4121 B10R0.71 CCCCOCCOCCC 7a_100000210227_100011215938 [0,1,0,0,0,0|1,0,0]=2 4122 B10R0.71 CCCCOCCOCCC 7a_100000210238_100000210303 [0,1,0,0,0,0|1,0,0]=2 4123 B10R0.71 CCCCOCCOCCC 7a_100000752267_100000210211 [0,1,0,0,0,0|1,0,0]=2 4124 B10R0.71 CCCCOCCOCCCl 34a_100011215305_100000210210 [0,1,0,0,0,0|1,0,0]=2 4125 B10R0.71 CCCCOCCOCCCl 7a_100011215305_100000210211 [0,1,0,0,0,0|1,0,0]=2 4126 B10R0.71 CCCCOCCOCCF 34a_100000210238_100011217306 [0,1,0,0,0,0|1,0,0]=2 4127 B10R0.71 CCCCOCCOCCF 34a_200015357709_100000210210 [0,1,0,0,0,0|1,0,0]=2 4128 B10R0.71 CCCCOCCOCCF 7a_100000210238_100011217306 [0,1,0,0,0,0|1,0,0]=2 4129 B10R0.71 CCCCOCCOCCF 7a_200015357709_100000210211 [0,1,0,0,0,0|1,0,0]=2 4130 B10R0.71 CCCCOCCOCCI 34a_100012149058_100000210210 [0,1,0,0,0,0|1,0,0]=2 4131 B10R0.71 CCCCOCCOCCI 7a_100012149058_100000210211 [0,1,0,0,0,0|1,0,0]=2 4132 B10R0.71 CCCCOCCOCCN 34a_100000210304_100000743108 [0,1,0,0,0,0|1,0,0]=2 4133 B10R0.71 CCCCOCCOCCN 34a_100000211614_100000210210 [0,1,0,0,0,0|1,0,0]=2 4134 B10R0.71 CCCCOCCOCCO 34a_100000210227_100000692535 [0,1,0,0,0,0|1,0,0]=2 4135 B10R0.71 CCCCOCCOCCO 34a_100000210238_100000211926 [0,1,0,0,0,0|1,0,0]=2 4136 B10R0.71 CCCCOCCOCCO 7a_100000210227_100011215305 [0,1,0,0,0,0|1,0,0]=2 4137 B10R0.71 CCCCOCCOCCO 7a_100000210238_100000211926 [0,1,0,0,0,0|1,0,0]=2 4138 B10R0.71 CCCCOCCOCSC 34a_100000210238_100011218213 [0,1,0,0,0,0|1,0,0]=2 4139 B10R0.71 CCCCOCCSCC#N 62a_100000743108_100011215382 [0,1,0,0,0,0|1,1,1]=4 4140 B10R0.71 CCCCOCCSCC#N 62a_100011215382_100000743108 [0,1,0,0,0,0|1,1,1]=4 4141 B10R0.71 CCCCOCCSCC=O 62a_100000743108_200015260668 [0,1,0,0,0,0|1,1,1]=4 4142 B10R0.71 CCCCOCCSCC=O 62a_200015260668_100000743108 [0,1,0,0,0,0|1,1,1]=4 4143 B10R0.71 CCCCOCCSCCC 34a_200000230433_100000210210 [0,1,0,0,0,0|1,1,0]=3 4144 B10R0.71 CCCCOCCSCCC 62a_100000210303_100000743108 [0,1,0,0,0,0|1,1,0]=3 4145 B10R0.71 CCCCOCCSCCC 62a_100000743108_100000210303 [0,1,0,0,0,0|1,1,0]=3 4146 B10R0.71 CCCCOCCSCCC 7a_200000230433_100000210211 [0,1,0,0,0,0|1,1,0]=3 4147 B10R0.71 CCCCOCCSCCF 62a_100000743108_100011217306 [0,1,0,0,0,0|1,1,0]=3 4148 B10R0.71 CCCCOCCSCCF 62a_100011217306_100000743108 [0,1,0,0,0,0|1,1,0]=3 4149 B10R0.71 CCCCOCCSCCO 62a_100000211926_100000743108 [0,1,0,0,0,0|1,1,0]=3 4150 B10R0.71 CCCCOCCSCCO 62a_100000743108_100000211926 [0,1,0,0,0,0|1,1,0]=3 4151 B10R0.71 CCCCOCCSCOC 62a_100000743108_100000766300 [0,1,0,0,0,0|1,1,0]=3 4152 B10R0.71 CCCCOCCSCOC 62a_100000766300_100000743108 [0,1,0,0,0,0|1,1,0]=3 4153 B10R0.71 CCCCOCCSCSC 62a_100000743108_100011218213 [0,1,0,0,0,0|1,1,0]=3 4154 B10R0.71 CCCCOCCSCSC 62a_100011218213_100000743108 [0,1,0,0,0,0|1,1,0]=3 4155 B10R0.71 CCCCOCNCCCF 2230a_100015189416_100011995733 [0,1,0,0,0,0|3,0,0]=4 4156 B10R0.71 CCCCOCNCCCF 34a_100015189416_100011995733 [0,1,0,0,0,0|3,0,0]=4 4157 B10R0.71 CCCCOCNCCOC 2230a_100000209980_100011995733 [0,1,0,0,0,0|2,0,0]=3 4158 B10R0.71 CCCCOCNCCSC 2230a_100020590264_100011995733 [0,1,0,0,0,0|2,1,0]=4 4159 B10R0.71 CCCCOCOCCCBr 34a_100011217188_100011995733 [0,1,0,0,0,0|3,0,0]=4 4160 B10R0.71 CCCCOCOCCCC 34a_100000210227_100011995733 [0,1,0,0,0,0|2,0,0]=3 4161 B10R0.71 CCCCOCOCCCCl 34a_100000230001_100011995733 [0,1,0,0,0,0|3,0,0]=4 4162 B10R0.71 CCCCOCOCCCF 34a_100000759539_100011995733 [0,1,0,0,0,0|3,0,0]=4 4163 B10R0.71 CCCCOCOCCCN 34a_100000182051_100011995733 [0,1,0,0,0,0|3,0,0]=4 4164 B10R0.71 CCCCOCOCCOC 34a_100000210237_100011995733 [0,1,0,0,0,0|1,0,0]=2 4165 B10R0.71 CCCCOCOCCON 34a_100000700252_100011995733 [0,1,0,0,0,0|2,0,0]=3 4166 B10R0.71 CCCCOCOCCSC 34a_100000230434_100011995733 [0,1,0,0,0,0|1,1,0]=3 4167 B10R0.71 CCCCOCSCCCC 62a_100000210211_100011995733 [0,1,0,0,0,0|2,0,0]=3 4168 B10R0.71 CCCCOCSCCCC 62a_100011995733_100000210210 [0,1,0,0,0,0|2,0,0]=3 4169 B10R0.71 CCCCOCSCCCF 62a_100011934791_100011995733 [0,1,0,0,0,0|3,0,0]=4 4170 B10R0.71 CCCCOCSCCCF 62a_100011995733_100011934791 [0,1,0,0,0,0|3,0,0]=4 4171 B10R0.71 CCCCOCSCCCO 62a_100011215043_100011995733 [0,1,0,0,0,0|3,0,0]=4 4172 B10R0.71 CCCCOCSCCCO 62a_100011995733_100011215043 [0,1,0,0,0,0|3,0,0]=4 4173 B10R0.71 CCCCOCSCCOC 62a_100000233755_100011995733 [0,1,0,0,0,0|1,1,0]=3 4174 B10R0.71 CCCCOCSCCOC 62a_100011995733_100000233755 [0,1,0,0,0,0|1,1,0]=3 4175 B10R0.71 CCCCOCSCCSC 62a_100000212216_100011995733 [0,1,0,0,0,0|1,2,0]=4 4176 B10R0.71 CCCCOCSCCSC 62a_100011995733_100000751147 [0,1,0,0,0,0|1,2,0]=4 4177 B10R0.71 CCCCOCSCOCC 62a_100000739092_100011995733 [0,1,0,0,0,0|1,0,0]=2 4178 B10R0.71 CCCCOCSCOCC 62a_100011995733_100000739092 [0,1,0,0,0,0|1,0,0]=2 4179 B10R0.71 CCCCSCCCCCF 62a_100000210211_100000729378 [0,1,0,0,0,0|2,1,0]=4 4180 B10R0.71 CCCCSCCCCCF 62a_100000729378_100000210210 [0,1,0,0,0,0|2,1,0]=4 4181 B10R0.71 CCCCSCCCCCO 62a_100000210211_100000746330 [0,1,0,0,0,0|2,1,0]=4 4182 B10R0.71 CCCCSCCCCCO 62a_100000746330_100000210210 [0,1,0,0,0,0|2,1,0]=4 4183 B10R0.71 CCCCSCCCCOC 62a_100000210211_100000730899 [0,1,0,0,0,0|2,0,0]=3 4184 B10R0.71 CCCCSCCCCOC 62a_100000730899_100000210210 [0,1,0,0,0,0|2,0,0]=3 4185 B10R0.71 CCCCSCCCOCC 62a_100000210211_100012232248 [0,1,0,0,0,0|1,1,0]=3 4186 B10R0.71 CCCCSCCCOCC 62a_100012232248_100000210210 [0,1,0,0,0,0|1,1,0]=3 4187 B10R0.71 CCCCSCCNCCC 2230a_100025743550_100000210303 [0,1,0,0,0,0|2,1,0]=4 4188 B10R0.71 CCCCSCCNCCF 2230a_100025743550_100011217306 [0,1,0,0,0,0|2,1,0]=4 4189 B10R0.71 CCCCSCCNCCO 2230a_100025743550_100000211926 [0,1,0,0,0,0|2,1,0]=4 4190 B10R0.71 CCCCSCCNCOC 2230a_100025743550_100000766300 [0,1,0,0,0,0|2,1,0]=4 4191 B10R0.71 CCCCSCCNCSC 2230a_100025743550_100011218213 [0,1,0,0,0,0|2,1,0]=4 4192 B10R0.71 CCCCSCCOCC#N 62a_100000210211_200000047693 [0,1,0,0,0,0|1,1,1]=4 4193 B10R0.71 CCCCSCCOCC#N 62a_200000047693_100000210210 [0,1,0,0,0,0|1,1,1]=4 4194 B10R0.71 CCCCSCCOCC#N 7a_200000230436_100011215382 [0,1,0,0,0,0|1,1,1]=4 4195 B10R0.71 CCCCSCCOCC=O 34a_200000230436_200009817547 [0,1,0,0,0,0|1,1,1]=4 4196 B10R0.71 CCCCSCCOCC=O 7a_200000230436_200015260668 [0,1,0,0,0,0|1,1,1]=4 4197 B10R0.71 CCCCSCCOCCC 34a_200000230436_100000210303 [0,1,0,0,0,0|1,1,0]=3 4198 B10R0.71 CCCCSCCOCCC 62a_100000210211_100011215938 [0,1,0,0,0,0|1,1,0]=3 4199 B10R0.71 CCCCSCCOCCC 62a_100011215938_100000210210 [0,1,0,0,0,0|1,1,0]=3 4200 B10R0.71 CCCCSCCOCCC 7a_200000230436_100000210303 [0,1,0,0,0,0|1,1,0]=3 4201 B10R0.71 CCCCSCCOCCF 34a_200000230436_100011217306 [0,1,0,0,0,0|1,1,0]=3 4202 B10R0.71 CCCCSCCOCCF 7a_200000230436_100011217306 [0,1,0,0,0,0|1,1,0]=3 4203 B10R0.71 CCCCSCCOCCO 34a_200000230436_100000211926 [0,1,0,0,0,0|1,1,0]=3 4204 B10R0.71 CCCCSCCOCCO 62a_100000210211_100011215305 [0,1,0,0,0,0|1,1,0]=3 4205 B10R0.71 CCCCSCCOCCO 62a_100011215305_100000210210 [0,1,0,0,0,0|1,1,0]=3 4206 B10R0.71 CCCCSCCOCCO 7a_200000230436_100000211926 [0,1,0,0,0,0|1,1,0]=3 4207 B10R0.71 CCCCSCCOCSC 34a_200000230436_100011218213 [0,1,0,0,0,0|1,1,0]=3 4208 B10R0.71 CCCCSCOCCOC 62a_100000210211_100000231047 [0,1,0,0,0,0|1,0,0]=2 4209 B10R0.71 CCCCSCOCCOC 62a_100000231047_100000210210 [0,1,0,0,0,0|1,0,0]=2 4210 B10R0.71 CCCNCCCCCOC 2230a_100000747528_100000210303 [0,1,0,0,0,0|2,0,0]=3 4211 B10R0.71 CCCNCCCCCOC 34a_100000747528_100000210303 [0,1,0,0,0,0|2,0,0]=3 4212 B10R0.71 CCCNCCCOCCC 2230a_100011217757_100000210303 [0,1,0,0,0,0|3,0,0]=4 4213 B10R0.71 CCCNCCCOCCC 34a_100011217757_100000210303 [0,1,0,0,0,0|3,0,0]=4 4214 B10R0.71 CCCNCCOCCOC 2230a_100000745349_100000210303 [0,1,0,0,0,0|1,0,0]=2 4215 B10R0.71 CCCNCCOCCOC 34a_100000745349_100000210303 [0,1,0,0,0,0|1,0,0]=2 4216 B10R0.71 CCCOCCCCCCBr 34a_100011215345_100000210303 [0,1,0,0,0,0|3,0,0]=4 4217 B10R0.71 CCCOCCCCCCBr 7a_100011215345_100000210303 [0,1,0,0,0,0|3,0,0]=4 4218 B10R0.71 CCCOCCCCCCCl 34a_100000766143_100000210303 [0,1,0,0,0,0|3,0,0]=4 4219 B10R0.71 CCCOCCCCCCCl 7a_100000766143_100000210303 [0,1,0,0,0,0|3,0,0]=4 4220 B10R0.71 CCCOCCCCCCF 34a_100000210258_100015922095 [0,1,0,0,0,0|3,0,0]=4 4221 B10R0.71 CCCOCCCCCCF 34a_100000732779_100000210303 [0,1,0,0,0,0|3,0,0]=4 4222 B10R0.71 CCCOCCCCCCF 7a_100000732779_100000210303 [0,1,0,0,0,0|3,0,0]=4 4223 B10R0.71 CCCOCCCCCCN 34a_100000686447_100000210303 [0,1,0,0,0,0|3,0,0]=4 4224 B10R0.71 CCCOCCCCCCO 34a_100000210258_100000766143 [0,1,0,0,0,0|3,0,0]=4 4225 B10R0.71 CCCOCCCCCNC 34a_100000722520_100000210303 [0,1,0,0,0,0|2,0,0]=3 4226 B10R0.71 CCCOCCCNCOC 2230a_100011217757_100000766300 [0,1,0,0,0,0|2,0,0]=3 4227 B10R0.71 CCCOCCCNCSC 2230a_100011217757_100011218213 [0,1,0,0,0,0|2,1,0]=4 4228 B10R0.71 CCCOCCCNCSC 34a_100011217757_100011218213 [0,1,0,0,0,0|2,1,0]=4 4229 B10R0.71 CCCOCCNCCC#N 2230a_100161115042_100011215226 [0,1,0,0,0,0|3,0,0]=4 4230 B10R0.71 CCCOCCNCCCF 2230a_100015189416_100011215938 [0,1,0,0,0,0|3,0,0]=4 4231 B10R0.71 CCCOCCNCCCF 2230a_100161115042_100011934791 [0,1,0,0,0,0|3,0,0]=4 4232 B10R0.71 CCCOCCNCCCF 34a_100015189416_100011215938 [0,1,0,0,0,0|3,0,0]=4 4233 B10R0.71 CCCOCCNCCCF 34a_100161115042_100011934791 [0,1,0,0,0,0|3,0,0]=4 4234 B10R0.71 CCCOCCNCCCO 2230a_100161115042_100000230001 [0,1,0,0,0,0|3,0,0]=4 4235 B10R0.71 CCCOCCNCCCO 34a_100161115042_100000230001 [0,1,0,0,0,0|3,0,0]=4 4236 B10R0.71 CCCOCCNCCOC 2230a_100000209980_100011215938 [0,1,0,0,0,0|1,0,0]=2 4237 B10R0.71 CCCOCCNCCOC 2230a_100161115042_100011201679 [0,1,0,0,0,0|1,0,0]=2 4238 B10R0.71 CCCOCCNCCOC 34a_100161115042_100011201679 [0,1,0,0,0,0|1,0,0]=2 4239 B10R0.71 CCCOCCNCCSC 2230a_100020590264_100011215938 [0,1,0,0,0,0|1,1,0]=3 4240 B10R0.71 CCCOCCNCCSC 2230a_100161115042_100000751147 [0,1,0,0,0,0|1,1,0]=3 4241 B10R0.71 CCCOCCNCCSC 34a_100161115042_100000212216 [0,1,0,0,0,0|1,1,0]=3 4242 B10R0.71 CCCOCCOCCC#N 7a_100000752267_100000184422 [0,1,0,0,0,0|2,0,0]=3 4243 B10R0.71 CCCOCCOCCCBr 34a_100011217188_100011215938 [0,1,0,0,0,0|2,0,0]=3 4244 B10R0.71 CCCOCCOCCCCl 34a_100000230001_100011215938 [0,1,0,0,0,0|2,0,0]=3 4245 B10R0.71 CCCOCCOCCCF 34a_100000752267_100011934791 [0,1,0,0,0,0|2,0,0]=3 4246 B10R0.71 CCCOCCOCCCF 34a_100000759539_100011215938 [0,1,0,0,0,0|2,0,0]=3 4247 B10R0.71 CCCOCCOCCCF 7a_100000752267_100011934791 [0,1,0,0,0,0|2,0,0]=3 4248 B10R0.71 CCCOCCOCCCN 34a_100000182051_100011215938 [0,1,0,0,0,0|2,0,0]=3 4249 B10R0.71 CCCOCCOCCCO 34a_100000752267_100000230001 [0,1,0,0,0,0|2,0,0]=3 4250 B10R0.71 CCCOCCOCCCO 7a_100000752267_100011215043 [0,1,0,0,0,0|2,0,0]=3 4251 B10R0.71 CCCOCCOCCNC 2230a_200011904461_200000210301 [0,1,0,0,0,0|1,0,0]=2 4252 B10R0.71 CCCOCCOCCNC 34a_100000228057_100000210303 [0,1,0,0,0,0|1,0,0]=2 4253 B10R0.71 CCCOCCOCCNC 34a_200011904461_200000210301 [0,1,0,0,0,0|1,0,0]=2 4254 B10R0.71 CCCOCCOCCN[13CH3] 2230a_200011904461_200025704644 [0,1,0,0,0,0|1,0,0]=2 4255 B10R0.71 CCCOCCOCCN[13CH3] 34a_200011904461_200025704644 [0,1,0,0,0,0|1,0,0]=2 4256 B10R0.71 CCCOCCOCCOC 34a_100000210237_100011215938 [0,1,0,0,0,0|0,0,0]=1 4257 B10R0.71 CCCOCCOCCOC 34a_100000210258_100000695917 [0,1,0,0,0,0|0,0,0]=1 4258 B10R0.71 CCCOCCOCCOC 34a_100000752267_100011201679 [0,1,0,0,0,0|0,0,0]=1 4259 B10R0.71 CCCOCCOCCOC 34a_100011215163_100000210303 [0,1,0,0,0,0|0,0,0]=1 4260 B10R0.71 CCCOCCOCCOC 7a_100000752267_100000233755 [0,1,0,0,0,0|0,0,0]=1 4261 B10R0.71 CCCOCCOCCOC 7a_100011215163_100000210303 [0,1,0,0,0,0|0,0,0]=1 4262 B10R0.71 CCCOCCOCCON 34a_100000700252_100011215938 [0,1,0,0,0,0|1,0,0]=2 4263 B10R0.71 CCCOCCOCCSC 34a_100000230434_100011215938 [0,1,0,0,0,0|0,1,0]=2 4264 B10R0.71 CCCOCCOCCSC 34a_100000752267_100000212216 [0,1,0,0,0,0|0,1,0]=2 4265 B10R0.71 CCCOCCOCCSC 7a_100000230434_100011215938 [0,1,0,0,0,0|0,1,0]=2 4266 B10R0.71 CCCOCCOCCSC 7a_100000752267_100000212216 [0,1,0,0,0,0|0,1,0]=2 4267 B10R0.71 CCCOCCSCCC#N 62a_100011215226_100011215938 [0,1,0,0,0,0|2,1,0]=4 4268 B10R0.71 CCCOCCSCCC#N 62a_100011215938_100011215226 [0,1,0,0,0,0|2,1,0]=4 4269 B10R0.71 CCCOCCSCCCF 62a_100011215938_100011934791 [0,1,0,0,0,0|2,1,0]=4 4270 B10R0.71 CCCOCCSCCCF 62a_100011934791_100011215938 [0,1,0,0,0,0|2,1,0]=4 4271 B10R0.71 CCCOCCSCCCO 62a_100011215043_100011215938 [0,1,0,0,0,0|2,1,0]=4 4272 B10R0.71 CCCOCCSCCCO 62a_100011215938_100011215043 [0,1,0,0,0,0|2,1,0]=4 4273 B10R0.71 CCCOCCSCCOC 62a_100000233755_100011215938 [0,1,0,0,0,0|0,1,0]=2 4274 B10R0.71 CCCOCCSCCOC 62a_100011215938_100000233755 [0,1,0,0,0,0|0,1,0]=2 4275 B10R0.71 CCCOCCSCCSC 62a_100000212216_100011215938 [0,1,0,0,0,0|0,2,0]=3 4276 B10R0.71 CCCOCCSCCSC 62a_100011215938_100000751147 [0,1,0,0,0,0|0,2,0]=3 4277 B10R0.71 CCCOCCSCOCC 62a_100000739092_100011215938 [0,1,0,0,0,0|2,1,0]=4 4278 B10R0.71 CCCOCCSCOCC 62a_100011215938_100000739092 [0,1,0,0,0,0|2,1,0]=4 4279 B10R0.71 CCCSCCNCCOC 2230a_100020603323_100011201679 [0,1,0,0,0,0|1,1,0]=3 4280 B10R0.71 CCCSCCNCCSC 2230a_100020603323_100000751147 [0,1,0,0,0,0|1,2,0]=4 4281 B10R0.71 CCCSCCOCCC#N 7a_200000230433_100000184422 [0,1,0,0,0,0|2,1,0]=4 4282 B10R0.71 CCCSCCOCCCF 34a_200000230433_100011934791 [0,1,0,0,0,0|2,1,0]=4 4283 B10R0.71 CCCSCCOCCCF 7a_200000230433_100011934791 [0,1,0,0,0,0|2,1,0]=4 4284 B10R0.71 CCCSCCOCCCO 34a_200000230433_100000230001 [0,1,0,0,0,0|2,1,0]=4 4285 B10R0.71 CCCSCCOCCCO 7a_200000230433_100011215043 [0,1,0,0,0,0|2,1,0]=4 4286 B10R0.71 CCCSCCOCCOC 34a_200000230433_100011201679 [0,1,0,0,0,0|0,1,0]=2 4287 B10R0.71 CCCSCCOCCOC 62a_100000210303_100000695917 [0,1,0,0,0,0|0,1,0]=2 4288 B10R0.71 CCCSCCOCCOC 62a_100000695917_100000210303 [0,1,0,0,0,0|0,1,0]=2 4289 B10R0.71 CCCSCCOCCOC 7a_200000230433_100000233755 [0,1,0,0,0,0|0,1,0]=2 4290 B10R0.71 CCCSCCOCCSC 34a_200000230433_100000212216 [0,1,0,0,0,0|0,2,0]=3 4291 B10R0.71 CCCSCCOCCSC 7a_200000230433_100000212216 [0,1,0,0,0,0|0,2,0]=3 4292 B10R0.71 CCNCCCCCCCO 2230a_100011996573_100000210202 [0,1,0,0,0,0|3,0,0]=4 4293 B10R0.71 CCNCCCCCCCO 2230a_100015525214_100000760002 [0,1,0,0,0,0|3,0,0]=4 4294 B10R0.71 CCNCCCCCCCO 34a_100011996573_100000210202 [0,1,0,0,0,0|3,0,0]=4 4295 B10R0.71 CCNCCCCCCOC 2230a_100015525214_100011998445 [0,1,0,0,0,0|2,0,0]=3 4296 B10R0.71 CCNCCCOCCCO 2230a_100011310245_100000210202 [0,1,0,0,0,0|3,0,0]=4 4297 B10R0.71 CCNCCCOCCCO 34a_100011310245_100000210202 [0,1,0,0,0,0|3,0,0]=4 4298 B10R0.71 CCNCCCOCCOC 2230a_100000206027_100000210202 [0,1,0,0,0,0|1,0,0]=2 4299 B10R0.71 CCNCCCOCCOC 2230a_100015525214_100011216529 [0,1,0,0,0,0|1,0,0]=2 4300 B10R0.71 CCNCCCOCCOC 34a_100000206027_100000210202 [0,1,0,0,0,0|1,0,0]=2 4301 B10R0.71 CCNCCOCCN=[N+]=[N-] 2230a_100102953956_100000210202 [0,1,0,0,0,0|3,0,0]=4 4302 B10R0.71 CCNCCOCCOCC 2230a_100015525214_100011211534 [0,1,0,0,0,0|1,0,0]=2 4303 B10R0.71 CCNCCOCCOCC 2230a_100102712874_100000210202 [0,1,0,0,0,0|1,0,0]=2 4304 B10R0.71 CCNCCOCCOCC 34a_100102712874_100000210202 [0,1,0,0,0,0|1,0,0]=2 4305 B10R0.71 CCOCCCCCCCBr 34a_100000760002_100000210202 [0,1,0,0,0,0|2,0,0]=3 4306 B10R0.71 CCOCCCCCCCBr 7a_100000760002_100000210202 [0,1,0,0,0,0|2,0,0]=3 4307 B10R0.71 CCOCCCCCCCN 34a_100011996573_100000210202 [0,1,0,0,0,0|2,0,0]=3 4308 B10R0.71 CCOCCCCCCCO 34a_100121572206_100000760002 [0,1,0,0,0,0|2,0,0]=3 4309 B10R0.71 CCOCCCCCCOC 34a_100121572206_100011998445 [0,1,0,0,0,0|1,0,0]=2 4310 B10R0.71 CCOCCCCCCOC 34a_200012092642_100000210202 [0,1,0,0,0,0|1,0,0]=2 4311 B10R0.71 CCOCCCCCCOC 7a_200012092642_100000210202 [0,1,0,0,0,0|1,0,0]=2 4312 B10R0.71 CCOCCCNCCC#N 2230a_100000210961_100011215226 [0,1,0,0,0,0|3,0,0]=4 4313 B10R0.71 CCOCCCNCCCF 2230a_100000210961_100011934791 [0,1,0,0,0,0|3,0,0]=4 4314 B10R0.71 CCOCCCNCCCF 2230a_100015189416_100012232248 [0,1,0,0,0,0|3,0,0]=4 4315 B10R0.71 CCOCCCNCCCF 34a_100000210961_100011934791 [0,1,0,0,0,0|3,0,0]=4 4316 B10R0.71 CCOCCCNCCCF 34a_100015189416_100012232248 [0,1,0,0,0,0|3,0,0]=4 4317 B10R0.71 CCOCCCNCCCO 2230a_100000210961_100000230001 [0,1,0,0,0,0|3,0,0]=4 4318 B10R0.71 CCOCCCNCCCO 34a_100000210961_100000230001 [0,1,0,0,0,0|3,0,0]=4 4319 B10R0.71 CCOCCCNCCOC 2230a_100000209980_100012232248 [0,1,0,0,0,0|1,0,0]=2 4320 B10R0.71 CCOCCCNCCOC 2230a_100000210961_100011201679 [0,1,0,0,0,0|1,0,0]=2 4321 B10R0.71 CCOCCCNCCOC 34a_100000210961_100011201679 [0,1,0,0,0,0|1,0,0]=2 4322 B10R0.71 CCOCCCNCCSC 2230a_100000210961_100000751147 [0,1,0,0,0,0|1,1,0]=3 4323 B10R0.71 CCOCCCNCCSC 2230a_100020590264_100012232248 [0,1,0,0,0,0|1,1,0]=3 4324 B10R0.71 CCOCCCNCCSC 34a_100000210961_100000212216 [0,1,0,0,0,0|1,1,0]=3 4325 B10R0.71 CCOCCCOCCC#N 7a_100000757476_100000184422 [0,1,0,0,0,0|2,0,0]=3 4326 B10R0.71 CCOCCCOCCCBr 34a_100011217188_100012232248 [0,1,0,0,0,0|2,0,0]=3 4327 B10R0.71 CCOCCCOCCCCl 34a_100000230001_100012232248 [0,1,0,0,0,0|2,0,0]=3 4328 B10R0.71 CCOCCCOCCCF 34a_100000757476_100011934791 [0,1,0,0,0,0|2,0,0]=3 4329 B10R0.71 CCOCCCOCCCF 34a_100000759539_100012232248 [0,1,0,0,0,0|2,0,0]=3 4330 B10R0.71 CCOCCCOCCCF 7a_100000757476_100011934791 [0,1,0,0,0,0|2,0,0]=3 4331 B10R0.71 CCOCCCOCCCN 34a_100000182051_100012232248 [0,1,0,0,0,0|2,0,0]=3 4332 B10R0.71 CCOCCCOCCCN 34a_100011310245_100000210202 [0,1,0,0,0,0|2,0,0]=3 4333 B10R0.71 CCOCCCOCCCO 34a_100000757476_100000230001 [0,1,0,0,0,0|2,0,0]=3 4334 B10R0.71 CCOCCCOCCCO 7a_100000757476_100011215043 [0,1,0,0,0,0|2,0,0]=3 4335 B10R0.71 CCOCCCOCCOC 34a_100000210237_100012232248 [0,1,0,0,0,0|0,0,0]=1 4336 B10R0.71 CCOCCCOCCOC 34a_100000757476_100011201679 [0,1,0,0,0,0|0,0,0]=1 4337 B10R0.71 CCOCCCOCCOC 34a_100121572206_100011216529 [0,1,0,0,0,0|0,0,0]=1 4338 B10R0.71 CCOCCCOCCOC 7a_100000757476_100000233755 [0,1,0,0,0,0|0,0,0]=1 4339 B10R0.71 CCOCCCOCCON 34a_100000700252_100012232248 [0,1,0,0,0,0|1,0,0]=2 4340 B10R0.71 CCOCCCOCCSC 34a_100000230434_100012232248 [0,1,0,0,0,0|0,1,0]=2 4341 B10R0.71 CCOCCCOCCSC 34a_100000757476_100000212216 [0,1,0,0,0,0|0,1,0]=2 4342 B10R0.71 CCOCCCOCCSC 7a_100000230434_100012232248 [0,1,0,0,0,0|0,1,0]=2 4343 B10R0.71 CCOCCCOCCSC 7a_100000757476_100000212216 [0,1,0,0,0,0|0,1,0]=2 4344 B10R0.71 CCOCCCSCCC#N 62a_100011215226_100012232248 [0,1,0,0,0,0|2,1,0]=4 4345 B10R0.71 CCOCCCSCCC#N 62a_100012232248_100011215226 [0,1,0,0,0,0|2,1,0]=4 4346 B10R0.71 CCOCCCSCCCF 62a_100011934791_100012232248 [0,1,0,0,0,0|2,1,0]=4 4347 B10R0.71 CCOCCCSCCCF 62a_100012232248_100011934791 [0,1,0,0,0,0|2,1,0]=4 4348 B10R0.71 CCOCCCSCCCO 62a_100011215043_100012232248 [0,1,0,0,0,0|2,1,0]=4 4349 B10R0.71 CCOCCCSCCCO 62a_100012232248_100011215043 [0,1,0,0,0,0|2,1,0]=4 4350 B10R0.71 CCOCCCSCCOC 62a_100000233755_100012232248 [0,1,0,0,0,0|0,1,0]=2 4351 B10R0.71 CCOCCCSCCOC 62a_100012232248_100000233755 [0,1,0,0,0,0|0,1,0]=2 4352 B10R0.71 CCOCCCSCCSC 62a_100000212216_100012232248 [0,1,0,0,0,0|0,2,0]=3 4353 B10R0.71 CCOCCCSCCSC 62a_100012232248_100000751147 [0,1,0,0,0,0|0,2,0]=3 4354 B10R0.71 CCOCCCSCOCC 62a_100000739092_100012232248 [0,1,0,0,0,0|2,0,0]=3 4355 B10R0.71 CCOCCCSCOCC 62a_100012232248_100000739092 [0,1,0,0,0,0|2,0,0]=3 4356 B10R0.71 CCOCCNCC#CCO 2230a_102516460346_200000047223 [0,1,0,0,0,0|2,0,1]=4 4357 B10R0.71 CCOCCNCC#CCO 34a_102516460346_200000047223 [0,1,0,0,0,0|2,0,1]=4 4358 B10R0.71 CCOCCNCCCC#N 2230a_102516460346_100000687738 [0,1,0,0,0,0|2,0,1]=4 4359 B10R0.71 CCOCCNCCCC=O 2230a_102516460346_200011292268 [0,1,0,0,0,0|2,0,1]=4 4360 B10R0.71 CCOCCNCCCCF 2230a_102516460346_100000729493 [0,1,0,0,0,0|2,0,0]=3 4361 B10R0.71 CCOCCNCCCCF 34a_102516460346_100000729493 [0,1,0,0,0,0|2,0,0]=3 4362 B10R0.71 CCOCCNCCCCO 2230a_100000750430_100011215890 [0,1,0,0,0,0|2,0,0]=3 4363 B10R0.71 CCOCCNCCCCO 2230a_102516460346_100000210776 [0,1,0,0,0,0|2,0,0]=3 4364 B10R0.71 CCOCCNCCCCO 34a_100000750430_100000210147 [0,1,0,0,0,0|2,0,0]=3 4365 B10R0.71 CCOCCNCCCCO 34a_102516460346_100011216708 [0,1,0,0,0,0|2,0,0]=3 4366 B10R0.71 CCOCCNCCCOC 2230a_102516460346_100000740836 [0,1,0,0,0,0|1,0,0]=2 4367 B10R0.71 CCOCCNCCCOC 34a_100150723488_100000210147 [0,1,0,0,0,0|1,0,0]=2 4368 B10R0.71 CCOCCNCCCOC 34a_102516460346_100000740836 [0,1,0,0,0,0|1,0,0]=2 4369 B10R0.71 CCOCCNCCCSC 2230a_100000749238_100011215890 [0,1,0,0,0,0|1,1,0]=3 4370 B10R0.71 CCOCCNCCOCC 2230a_102516460346_100011215890 [0,1,0,0,0,0|1,0,0]=2 4371 B10R0.71 CCOCCNCCOCC 34a_102516460346_100000210147 [0,1,0,0,0,0|1,0,0]=2 4372 B10R0.71 CCOCCNCCSCC 2230a_100000106463_100011215890 [0,1,0,0,0,0|1,1,0]=3 4373 B10R0.71 CCOCCNCCSCC 2230a_102516460346_100000757381 [0,1,0,0,0,0|1,1,0]=3 4374 B10R0.71 CCOCCNCCSCC 34a_102516460346_100000757381 [0,1,0,0,0,0|1,1,0]=3 4375 B10R0.71 CCOCCOCC#CCCl 34a_200000047223_100000210147 [0,1,0,0,0,0|1,0,1]=3 4376 B10R0.71 CCOCCOCC#CCO 34a_100000210136_200000047223 [0,1,0,0,0,0|1,0,1]=3 4377 B10R0.71 CCOCCOCC#CCO 7a_100000210136_200000047223 [0,1,0,0,0,0|1,0,1]=3 4378 B10R0.71 CCOCCOCCCC#N 7a_100000210136_100000687738 [0,1,0,0,0,0|1,0,1]=3 4379 B10R0.71 CCOCCOCCCC=O 7a_100000210136_200011292268 [0,1,0,0,0,0|1,0,1]=3 4380 B10R0.71 CCOCCOCCCCBr 34a_100011216708_100000210147 [0,1,0,0,0,0|1,0,0]=2 4381 B10R0.71 CCOCCOCCCCCl 34a_100000210776_100000210147 [0,1,0,0,0,0|1,0,0]=2 4382 B10R0.71 CCOCCOCCCCCl 7a_100000210776_100011215890 [0,1,0,0,0,0|1,0,0]=2 4383 B10R0.71 CCOCCOCCCCF 34a_100000210136_100000729493 [0,1,0,0,0,0|1,0,0]=2 4384 B10R0.71 CCOCCOCCCCF 34a_100011995726_100000210147 [0,1,0,0,0,0|1,0,0]=2 4385 B10R0.71 CCOCCOCCCCF 7a_100000210136_100000729493 [0,1,0,0,0,0|1,0,0]=2 4386 B10R0.71 CCOCCOCCCCF 7a_100011995726_100011215890 [0,1,0,0,0,0|1,0,0]=2 4387 B10R0.71 CCOCCOCCCCI 34a_200012148704_100000210147 [0,1,0,0,0,0|1,0,0]=2 4388 B10R0.71 CCOCCOCCCCN 34a_100000750430_100000210147 [0,1,0,0,0,0|1,0,0]=2 4389 B10R0.71 CCOCCOCCCCO 34a_100000210136_100011216708 [0,1,0,0,0,0|1,0,0]=2 4390 B10R0.71 CCOCCOCCCCO 7a_100000210136_100000210776 [0,1,0,0,0,0|1,0,0]=2 4391 B10R0.71 CCOCCOCCCNC 34a_100000213112_100000210147 [0,1,0,0,0,0|1,0,0]=2 4392 B10R0.71 CCOCCOCCCOC 34a_100000210136_100000740836 [0,1,0,0,0,0|0,0,0]=1 4393 B10R0.71 CCOCCOCCCOC 34a_100000740835_100000210147 [0,1,0,0,0,0|0,0,0]=1 4394 B10R0.71 CCOCCOCCCOC 7a_100000210136_100000740836 [0,1,0,0,0,0|0,0,0]=1 4395 B10R0.71 CCOCCOCCCSC 34a_100000690336_100000210147 [0,1,0,0,0,0|0,1,0]=2 4396 B10R0.71 CCOCCOCCCSC 7a_100000690336_100011215890 [0,1,0,0,0,0|0,1,0]=2 4397 B10R0.71 CCOCCOCCNCF 34a_100102712874_100015361967 [0,1,0,0,0,0|1,0,0]=2 4398 B10R0.71 CCOCCOCCOCC 34a_100000210136_100000210147 [0,1,0,0,0,0|0,0,0]=1 4399 B10R0.71 CCOCCOCCOCC 34a_100000210240_100000210202 [0,1,0,0,0,0|0,0,0]=1 4400 B10R0.71 CCOCCOCCOCC 34a_100121572206_100011211534 [0,1,0,0,0,0|0,0,0]=1 4401 B10R0.71 CCOCCOCCOCC 7a_100000210136_100011215890 [0,1,0,0,0,0|0,0,0]=1 4402 B10R0.71 CCOCCOCCOCC 7a_100000210240_100000210202 [0,1,0,0,0,0|0,0,0]=1 4403 B10R0.71 CCOCCOCCOCF 34a_100000210240_100015361967 [0,1,0,0,0,0|0,0,0]=1 4404 B10R0.71 CCOCCOCCOCF 7a_100000210240_100015361967 [0,1,0,0,0,0|0,0,0]=1 4405 B10R0.71 CCOCCOCCSCC 34a_100000210136_100000757381 [0,1,0,0,0,0|0,1,0]=2 4406 B10R0.71 CCOCCOCCSCC 34a_100000212035_100000210147 [0,1,0,0,0,0|0,1,0]=2 4407 B10R0.71 CCOCCOCCSCC 62a_100000210202_100011211534 [0,1,0,0,0,0|0,1,0]=2 4408 B10R0.71 CCOCCOCCSCC 62a_100011211534_100000210202 [0,1,0,0,0,0|0,1,0]=2 4409 B10R0.71 CCOCCOCCSCC 7a_100000210136_100000757381 [0,1,0,0,0,0|0,1,0]=2 4410 B10R0.71 CCOCCOCCSCC 7a_100000212035_100011215890 [0,1,0,0,0,0|0,1,0]=2 4411 B10R0.71 CCOCCOCCSCF 62a_100011211534_100015361967 [0,1,0,0,0,0|0,1,0]=2 4412 B10R0.71 CCOCCOCCSCF 62a_100015361967_100011211534 [0,1,0,0,0,0|0,1,0]=2 4413 B10R0.71 CCOCCSCC#CCO 62a_100000210147_200000047223 [0,1,0,0,0,0|1,1,1]=4 4414 B10R0.71 CCOCCSCC#CCO 62a_200000047223_100011215890 [0,1,0,0,0,0|1,1,1]=4 4415 B10R0.71 CCOCCSCCCC#N 62a_100000210147_100000687738 [0,1,0,0,0,0|1,1,1]=4 4416 B10R0.71 CCOCCSCCCC#N 62a_100000687738_100011215890 [0,1,0,0,0,0|1,1,1]=4 4417 B10R0.71 CCOCCSCCCC=O 62a_100000210147_200011292268 [0,1,0,0,0,0|1,1,1]=4 4418 B10R0.71 CCOCCSCCCC=O 62a_200011292268_100011215890 [0,1,0,0,0,0|1,1,1]=4 4419 B10R0.71 CCOCCSCCCCF 62a_100000210147_100000729493 [0,1,0,0,0,0|1,1,0]=3 4420 B10R0.71 CCOCCSCCCCF 62a_100000729493_100011215890 [0,1,0,0,0,0|1,1,0]=3 4421 B10R0.71 CCOCCSCCCCO 62a_100000210147_100000210776 [0,1,0,0,0,0|1,1,0]=3 4422 B10R0.71 CCOCCSCCCCO 62a_100000210776_100011215890 [0,1,0,0,0,0|1,1,0]=3 4423 B10R0.71 CCOCCSCCCOC 62a_100000210147_100000709357 [0,1,0,0,0,0|0,1,0]=2 4424 B10R0.71 CCOCCSCCCOC 62a_100000709357_100011215890 [0,1,0,0,0,0|0,1,0]=2 4425 B10R0.71 CCOCCSCCOCC 62a_100000210147_100011215890 [0,1,0,0,0,0|0,1,0]=2 4426 B10R0.71 CCOCCSCCSC#N 62a_100000034367_100011215890 [0,1,0,0,0,0|0,2,1]=4 4427 B10R0.71 CCOCCSCCSC#N 62a_100000210147_100000034367 [0,1,0,0,0,0|0,2,1]=4 4428 B10R0.71 CCOCCSCCSCC 62a_100000210147_100000757381 [0,1,0,0,0,0|0,2,0]=3 4429 B10R0.71 CCOCCSCCSCC 62a_100000757381_100011215890 [0,1,0,0,0,0|0,2,0]=3 4430 B10R0.71 CCOCSCCCCC#N 62a_100000739092_100000211819 [0,1,0,0,0,0|3,0,0]=4 4431 B10R0.71 CCOCSCCCCC#N 62a_100011219923_100000739092 [0,1,0,0,0,0|3,0,0]=4 4432 B10R0.71 CCOCSCCCCC=O 62a_100000139335_100000739092 [0,1,0,0,0,0|3,0,0]=4 4433 B10R0.71 CCOCSCCCCC=O 62a_100000739092_100000139335 [0,1,0,0,0,0|3,0,0]=4 4434 B10R0.71 CCOCSCCCCCF 62a_100000729378_100000739092 [0,1,0,0,0,0|3,0,0]=4 4435 B10R0.71 CCOCSCCCCCF 62a_100000739092_100000729378 [0,1,0,0,0,0|3,0,0]=4 4436 B10R0.71 CCOCSCCCCCO 62a_100000739092_100000746330 [0,1,0,0,0,0|3,0,0]=4 4437 B10R0.71 CCOCSCCCCCO 62a_100000746330_100000739092 [0,1,0,0,0,0|3,0,0]=4 4438 B10R0.71 CCOCSCCCCOC 62a_100000730899_100000739092 [0,1,0,0,0,0|1,0,0]=2 4439 B10R0.71 CCOCSCCCCOC 62a_100000739092_100000730899 [0,1,0,0,0,0|1,0,0]=2 4440 B10R0.71 CCOCSCCOCCO 62a_100000739092_100011215305 [0,1,0,0,0,0|2,1,0]=4 4441 B10R0.71 CCOCSCCOCCO 62a_100011215305_100000739092 [0,1,0,0,0,0|2,1,0]=4 4442 B10R0.71 CCOCSCOCCOC 62a_100000231047_100000739092 [0,1,0,0,0,0|0,0,0]=1 4443 B10R0.71 CCOCSCOCCOC 62a_100000739092_100000231047 [0,1,0,0,0,0|0,0,0]=1 4444 B10R0.71 CCSCCCCCCCO 62a_100000210202_100000760002 [0,1,0,0,0,0|2,1,0]=4 4445 B10R0.71 CCSCCCCCCCO 62a_100000760002_100000210202 [0,1,0,0,0,0|2,1,0]=4 4446 B10R0.71 CCSCCCCCCOC 62a_100000210202_100011998445 [0,1,0,0,0,0|1,1,0]=3 4447 B10R0.71 CCSCCCCCCOC 62a_100011998445_100000210202 [0,1,0,0,0,0|1,1,0]=3 4448 B10R0.71 CCSCCCOCCC#N 7a_100011216438_100000184422 [0,1,0,0,0,0|2,1,0]=4 4449 B10R0.71 CCSCCCOCCCF 34a_100011216438_100011934791 [0,1,0,0,0,0|2,1,0]=4 4450 B10R0.71 CCSCCCOCCCF 7a_100011216438_100011934791 [0,1,0,0,0,0|2,1,0]=4 4451 B10R0.71 CCSCCCOCCCO 34a_100011216438_100000230001 [0,1,0,0,0,0|2,1,0]=4 4452 B10R0.71 CCSCCCOCCCO 7a_100011216438_100011215043 [0,1,0,0,0,0|2,1,0]=4 4453 B10R0.71 CCSCCCOCCOC 34a_100011216438_100011201679 [0,1,0,0,0,0|0,1,0]=2 4454 B10R0.71 CCSCCCOCCOC 62a_100000210202_100011216529 [0,1,0,0,0,0|0,1,0]=2 4455 B10R0.71 CCSCCCOCCOC 62a_100011216529_100000210202 [0,1,0,0,0,0|0,1,0]=2 4456 B10R0.71 CCSCCCOCCOC 7a_100011216438_100000233755 [0,1,0,0,0,0|0,1,0]=2 4457 B10R0.71 CCSCCCOCCSC 34a_100011216438_100000212216 [0,1,0,0,0,0|0,2,0]=3 4458 B10R0.71 CCSCCCOCCSC 7a_100011216438_100000212216 [0,1,0,0,0,0|0,2,0]=3 4459 B10R0.71 CCSCCNCCCCF 2230a_100000106463_100000729493 [0,1,0,0,0,0|2,1,0]=4 4460 B10R0.71 CCSCCNCCCCO 2230a_100000106463_100000210776 [0,1,0,0,0,0|2,1,0]=4 4461 B10R0.71 CCSCCNCCCCO 2230a_100000750430_100000757381 [0,1,0,0,0,0|2,1,0]=4 4462 B10R0.71 CCSCCNCCCCO 34a_100000750430_100000757381 [0,1,0,0,0,0|2,1,0]=4 4463 B10R0.71 CCSCCNCCCOC 2230a_100000106463_100000740836 [0,1,0,0,0,0|1,1,0]=3 4464 B10R0.71 CCSCCNCCCOC 34a_100150723488_100000757381 [0,1,0,0,0,0|1,1,0]=3 4465 B10R0.71 CCSCCNCCCSC 2230a_100000749238_100000757381 [0,1,0,0,0,0|1,2,0]=4 4466 B10R0.71 CCSCCNCCSCC 2230a_100000106463_100000757381 [0,1,0,0,0,0|1,2,0]=4 4467 B10R0.71 CCSCCOCC#CCCl 34a_200000047223_100000757381 [0,1,0,0,0,0|1,1,1]=4 4468 B10R0.71 CCSCCOCC#CCO 34a_100000212035_200000047223 [0,1,0,0,0,0|1,1,1]=4 4469 B10R0.71 CCSCCOCC#CCO 7a_100000212035_200000047223 [0,1,0,0,0,0|1,1,1]=4 4470 B10R0.71 CCSCCOCCCC#N 7a_100000212035_100000687738 [0,1,0,0,0,0|1,1,1]=4 4471 B10R0.71 CCSCCOCCCC=O 7a_100000212035_200011292268 [0,1,0,0,0,0|1,1,1]=4 4472 B10R0.71 CCSCCOCCCCBr 34a_100011216708_100000757381 [0,1,0,0,0,0|1,1,0]=3 4473 B10R0.71 CCSCCOCCCCCl 34a_100000210776_100000757381 [0,1,0,0,0,0|1,1,0]=3 4474 B10R0.71 CCSCCOCCCCCl 7a_100000210776_100000757381 [0,1,0,0,0,0|1,1,0]=3 4475 B10R0.71 CCSCCOCCCCF 34a_100000212035_100000729493 [0,1,0,0,0,0|1,1,0]=3 4476 B10R0.71 CCSCCOCCCCF 34a_100011995726_100000757381 [0,1,0,0,0,0|1,1,0]=3 4477 B10R0.71 CCSCCOCCCCF 7a_100000212035_100000729493 [0,1,0,0,0,0|1,1,0]=3 4478 B10R0.71 CCSCCOCCCCF 7a_100011995726_100000757381 [0,1,0,0,0,0|1,1,0]=3 4479 B10R0.71 CCSCCOCCCCI 34a_200012148704_100000757381 [0,1,0,0,0,0|1,1,0]=3 4480 B10R0.71 CCSCCOCCCCN 34a_100000750430_100000757381 [0,1,0,0,0,0|1,1,0]=3 4481 B10R0.71 CCSCCOCCCCO 34a_100000212035_100011216708 [0,1,0,0,0,0|1,1,0]=3 4482 B10R0.71 CCSCCOCCCCO 7a_100000212035_100000210776 [0,1,0,0,0,0|1,1,0]=3 4483 B10R0.71 CCSCCOCCCNC 34a_100000213112_100000757381 [0,1,0,0,0,0|1,1,0]=3 4484 B10R0.71 CCSCCOCCCOC 34a_100000212035_100000740836 [0,1,0,0,0,0|0,1,0]=2 4485 B10R0.71 CCSCCOCCCOC 34a_100000740835_100000757381 [0,1,0,0,0,0|0,1,0]=2 4486 B10R0.71 CCSCCOCCCOC 7a_100000212035_100000740836 [0,1,0,0,0,0|0,1,0]=2 4487 B10R0.71 CCSCCOCCCSC 34a_100000690336_100000757381 [0,1,0,0,0,0|0,2,0]=3 4488 B10R0.71 CCSCCOCCCSC 7a_100000690336_100000757381 [0,1,0,0,0,0|0,2,0]=3 4489 B10R0.71 CCSCCOCCSCC 34a_100000212035_100000757381 [0,1,0,0,0,0|0,2,0]=3 4490 B10R0.71 CCSCCOCCSCC 7a_100000212035_100000757381 [0,1,0,0,0,0|0,2,0]=3 4491 B10R0.71 CCSCCSCCCCF 62a_100000729493_100000757381 [0,1,0,0,0,0|1,2,0]=4 4492 B10R0.71 CCSCCSCCCCF 62a_100000757381_100000729493 [0,1,0,0,0,0|1,2,0]=4 4493 B10R0.71 CCSCCSCCCCO 62a_100000210776_100000757381 [0,1,0,0,0,0|1,2,0]=4 4494 B10R0.71 CCSCCSCCCCO 62a_100000757381_100000210776 [0,1,0,0,0,0|1,2,0]=4 4495 B10R0.71 CCSCCSCCCOC 62a_100000709357_100000757381 [0,1,0,0,0,0|0,2,0]=3 4496 B10R0.71 CCSCCSCCCOC 62a_100000757381_100000709357 [0,1,0,0,0,0|0,2,0]=3 4497 B10R0.71 CCSCCSCCSCC 62a_100000757381_100000757381 [0,1,0,0,0,0|0,3,0]=4 4498 B10R0.71 CNCCCCCCCCO 2230a_102515433106_200000210301 [0,1,0,0,0,0|3,0,0]=4 4499 B10R0.71 CNCCCCCCCCO 2230a_106832991635_100000033203 [0,1,0,0,0,0|3,0,0]=4 4500 B10R0.71 CNCCCCCCCCO 34a_100102657272_100000033203 [0,1,0,0,0,0|3,0,0]=4 4501 B10R0.71 CNCCCCCCCCO 34a_102515433106_200000210301 [0,1,0,0,0,0|3,0,0]=4 4502 B10R0.71 CNCCCCCCCCO 7a_106832991635_100000033203 [0,1,0,0,0,0|3,0,0]=4 4503 B10R0.71 CNCCCCCOCC=O 34a_100000722520_200009817547 [0,1,0,0,0,0|2,0,1]=4 4504 B10R0.71 CNCCCCCOCCF 34a_100000722520_100011217306 [0,1,0,0,0,0|2,0,0]=3 4505 B10R0.71 CNCCCCCOCCO 34a_100000722520_100000211926 [0,1,0,0,0,0|2,0,0]=3 4506 B10R0.71 CNCCCCCOCSC 34a_100000722520_100011218213 [0,1,0,0,0,0|2,0,0]=3 4507 B10R0.71 CNCCCOCCCCF 34a_100000213112_100000729493 [0,1,0,0,0,0|3,0,0]=4 4508 B10R0.71 CNCCCOCCCCO 34a_100000213112_100011216708 [0,1,0,0,0,0|3,0,0]=4 4509 B10R0.71 CNCCCOCCCOC 34a_100000213112_100000740836 [0,1,0,0,0,0|2,0,0]=3 4510 B10R0.71 CNCCOCCOCC=O 34a_100000228057_200009817547 [0,1,0,0,0,0|1,0,1]=3 4511 B10R0.71 CNCCOCCOCCF 34a_100000228057_100011217306 [0,1,0,0,0,0|1,0,0]=2 4512 B10R0.71 CNCCOCCOCCO 2230a_100011998139_200000210301 [0,1,0,0,0,0|1,0,0]=2 4513 B10R0.71 CNCCOCCOCCO 2230a_106832991635_100000032323 [0,1,0,0,0,0|1,0,0]=2 4514 B10R0.71 CNCCOCCOCCO 34a_100000228057_100000211926 [0,1,0,0,0,0|1,0,0]=2 4515 B10R0.71 CNCCOCCOCCO 34a_100011998139_200000210301 [0,1,0,0,0,0|1,0,0]=2 4516 B10R0.71 CNCCOCCOCCO 34a_100102657272_100000032323 [0,1,0,0,0,0|1,0,0]=2 4517 B10R0.71 CNCCOCCOCCO 7a_106832991635_100000032323 [0,1,0,0,0,0|1,0,0]=2 4518 B10R0.71 CNCCOCCOCSC 34a_100000228057_100011218213 [0,1,0,0,0,0|1,0,0]=2 4519 B10R0.71 COCCCCCCCCBr 34a_100009813846_200000210301 [0,1,0,0,0,0|2,0,0]=3 4520 B10R0.71 COCCCCCCCCBr 7a_100009813846_200000210301 [0,1,0,0,0,0|2,0,0]=3 4521 B10R0.71 COCCCCCCCCCl 34a_100000033203_200000210301 [0,1,0,0,0,0|2,0,0]=3 4522 B10R0.71 COCCCCCCCCCl 7a_100000033203_200000210301 [0,1,0,0,0,0|2,0,0]=3 4523 B10R0.71 COCCCCCCCCN 34a_102515433106_200000210301 [0,1,0,0,0,0|2,0,0]=3 4524 B10R0.71 COCCCCCCCCO 34a_100138415774_100000033203 [0,1,0,0,0,0|2,0,0]=3 4525 B10R0.71 COCCCCCCOCF 34a_200012092642_100015361967 [0,1,0,0,0,0|2,0,0]=3 4526 B10R0.71 COCCCCCCOCF 7a_200012092642_100015361967 [0,1,0,0,0,0|2,0,0]=3 4527 B10R0.71 COCCCCCCSCF 62a_100011998445_100015361967 [0,1,0,0,0,0|2,1,0]=4 4528 B10R0.71 COCCCCCCSCF 62a_100015361967_100011998445 [0,1,0,0,0,0|2,1,0]=4 4529 B10R0.71 COCCCCCNCC#N 2230a_100000747528_100011215382 [0,1,0,0,0,0|2,0,1]=4 4530 B10R0.71 COCCCCCNCC=O 2230a_100000747528_200015260668 [0,1,0,0,0,0|2,0,1]=4 4531 B10R0.71 COCCCCCNCC=O 34a_100000747528_200009817547 [0,1,0,0,0,0|2,0,1]=4 4532 B10R0.71 COCCCCCNCCF 2230a_100000747528_100011217306 [0,1,0,0,0,0|2,0,0]=3 4533 B10R0.71 COCCCCCNCCF 34a_100000747528_100011217306 [0,1,0,0,0,0|2,0,0]=3 4534 B10R0.71 COCCCCCNCCN 34a_103619048469_200000210301 [0,1,0,0,0,0|2,0,0]=3 4535 B10R0.71 COCCCCCNCCO 2230a_100000747528_100000211926 [0,1,0,0,0,0|2,0,0]=3 4536 B10R0.71 COCCCCCNCCO 34a_100000747528_100000211926 [0,1,0,0,0,0|2,0,0]=3 4537 B10R0.71 COCCCCCNCOC 2230a_100000747528_100000766300 [0,1,0,0,0,0|2,0,0]=3 4538 B10R0.71 COCCCCCNCSC 2230a_100000747528_100011218213 [0,1,0,0,0,0|2,0,0]=3 4539 B10R0.71 COCCCCCNCSC 34a_100000747528_100011218213 [0,1,0,0,0,0|2,0,0]=3 4540 B10R0.71 COCCCCNCCCF 2230a_100015189416_100000730899 [0,1,0,0,0,0|3,0,0]=4 4541 B10R0.71 COCCCCNCCCF 34a_100015189416_100000755781 [0,1,0,0,0,0|3,0,0]=4 4542 B10R0.71 COCCCCNCCOC 2230a_100000209980_100000730899 [0,1,0,0,0,0|2,0,0]=3 4543 B10R0.71 COCCCCNCCSC 2230a_100020590264_100000730899 [0,1,0,0,0,0|2,1,0]=4 4544 B10R0.71 COCCCCOCCCBr 34a_100011217188_100000755781 [0,1,0,0,0,0|3,0,0]=4 4545 B10R0.71 COCCCCOCCCCl 34a_100000230001_100000755781 [0,1,0,0,0,0|3,0,0]=4 4546 B10R0.71 COCCCCOCCCF 34a_100000740925_100011934791 [0,1,0,0,0,0|3,0,0]=4 4547 B10R0.71 COCCCCOCCCF 34a_100000759539_100000755781 [0,1,0,0,0,0|3,0,0]=4 4548 B10R0.71 COCCCCOCCCN 34a_100000182051_100000755781 [0,1,0,0,0,0|3,0,0]=4 4549 B10R0.71 COCCCCOCCCO 34a_100000740925_100000230001 [0,1,0,0,0,0|3,0,0]=4 4550 B10R0.71 COCCCCOCCOC 34a_100000210237_100000755781 [0,1,0,0,0,0|1,0,0]=2 4551 B10R0.71 COCCCCOCCOC 34a_100000740925_100011201679 [0,1,0,0,0,0|1,0,0]=2 4552 B10R0.71 COCCCCOCCON 34a_100000700252_100000755781 [0,1,0,0,0,0|2,0,0]=3 4553 B10R0.71 COCCCCOCCSC 34a_100000230434_100000755781 [0,1,0,0,0,0|1,1,0]=3 4554 B10R0.71 COCCCCOCCSC 34a_100000740925_100000212216 [0,1,0,0,0,0|1,1,0]=3 4555 B10R0.71 COCCCCOCCSC 7a_100000230434_100000730899 [0,1,0,0,0,0|1,1,0]=3 4556 B10R0.71 COCCCCSCCCF 62a_100000730899_100011934791 [0,1,0,0,0,0|3,0,0]=4 4557 B10R0.71 COCCCCSCCCF 62a_100011934791_100000730899 [0,1,0,0,0,0|3,0,0]=4 4558 B10R0.71 COCCCCSCCCO 62a_100000730899_100011215043 [0,1,0,0,0,0|3,0,0]=4 4559 B10R0.71 COCCCCSCCCO 62a_100011215043_100000730899 [0,1,0,0,0,0|3,0,0]=4 4560 B10R0.71 COCCCCSCCOC 62a_100000233755_100000730899 [0,1,0,0,0,0|1,1,0]=3 4561 B10R0.71 COCCCCSCCOC 62a_100000730899_100000233755 [0,1,0,0,0,0|1,1,0]=3 4562 B10R0.71 COCCCCSCCSC 62a_100000212216_100000730899 [0,1,0,0,0,0|1,2,0]=4 4563 B10R0.71 COCCCCSCCSC 62a_100000730899_100000751147 [0,1,0,0,0,0|1,2,0]=4 4564 B10R0.71 COCCCNCCCCF 34a_100150723488_100000729493 [0,1,0,0,0,0|3,0,0]=4 4565 B10R0.71 COCCCNCCCCO 2230a_100000750430_100000740836 [0,1,0,0,0,0|3,0,0]=4 4566 B10R0.71 COCCCNCCCCO 34a_100000750430_100000740836 [0,1,0,0,0,0|3,0,0]=4 4567 B10R0.71 COCCCNCCCCO 34a_100150723488_100011216708 [0,1,0,0,0,0|3,0,0]=4 4568 B10R0.71 COCCCNCCCOC 34a_100150723488_100000740836 [0,1,0,0,0,0|3,0,0]=4 4569 B10R0.71 COCCCNCCCSC 2230a_100000749238_100000740836 [0,1,0,0,0,0|3,0,0]=4 4570 B10R0.71 COCCCOCC#CCCl 34a_200000047223_100000740836 [0,1,0,0,0,0|2,0,1]=4 4571 B10R0.71 COCCCOCC#CCO 34a_100000740835_200000047223 [0,1,0,0,0,0|2,0,1]=4 4572 B10R0.71 COCCCOCCCCBr 34a_100011216708_100000740836 [0,1,0,0,0,0|2,0,0]=3 4573 B10R0.71 COCCCOCCCCCl 34a_100000210776_100000740836 [0,1,0,0,0,0|2,0,0]=3 4574 B10R0.71 COCCCOCCCCCl 7a_100000210776_100000740836 [0,1,0,0,0,0|2,0,0]=3 4575 B10R0.71 COCCCOCCCCF 34a_100000740835_100000729493 [0,1,0,0,0,0|2,0,0]=3 4576 B10R0.71 COCCCOCCCCF 34a_100011995726_100000740836 [0,1,0,0,0,0|2,0,0]=3 4577 B10R0.71 COCCCOCCCCF 7a_100011995726_100000740836 [0,1,0,0,0,0|2,0,0]=3 4578 B10R0.71 COCCCOCCCCI 34a_200012148704_100000740836 [0,1,0,0,0,0|2,0,0]=3 4579 B10R0.71 COCCCOCCCCN 34a_100000750430_100000740836 [0,1,0,0,0,0|2,0,0]=3 4580 B10R0.71 COCCCOCCCCO 34a_100000740835_100011216708 [0,1,0,0,0,0|2,0,0]=3 4581 B10R0.71 COCCCOCCCOC 34a_100000740835_100000740836 [0,1,0,0,0,0|2,0,0]=3 4582 B10R0.71 COCCCOCCCOC 34a_200011215475_200000210301 [0,1,0,0,0,0|2,0,0]=3 4583 B10R0.71 COCCCOCCCOC 7a_200011215475_200000210301 [0,1,0,0,0,0|2,0,0]=3 4584 B10R0.71 COCCCOCCCO[13CH3] 34a_200011215475_200025704644 [0,1,0,0,0,0|2,0,0]=3 4585 B10R0.71 COCCCOCCCO[13CH3] 7a_200011215475_200025704644 [0,1,0,0,0,0|2,0,0]=3 4586 B10R0.71 COCCCOCCCSC 34a_100000690336_100000740836 [0,1,0,0,0,0|2,0,0]=3 4587 B10R0.71 COCCCOCCCSC 7a_100000690336_100000740836 [0,1,0,0,0,0|2,0,0]=3 4588 B10R0.71 COCCCSCCCCF 62a_100000709357_100000729493 [0,1,0,0,0,0|2,1,0]=4 4589 B10R0.71 COCCCSCCCCF 62a_100000729493_100000709357 [0,1,0,0,0,0|2,1,0]=4 4590 B10R0.71 COCCCSCCCCO 62a_100000210776_100000709357 [0,1,0,0,0,0|2,1,0]=4 4591 B10R0.71 COCCCSCCCCO 62a_100000709357_100000210776 [0,1,0,0,0,0|2,1,0]=4 4592 B10R0.71 COCCCSCCCOC 62a_100000709357_100000709357 [0,1,0,0,0,0|2,1,0]=4 4593 B10R0.71 COCCNCCCCC#N 2230a_100000209980_100000211819 [0,1,0,0,0,0|2,0,1]=4 4594 B10R0.71 COCCNCCCCC=O 2230a_100000209980_100000139335 [0,1,0,0,0,0|2,0,1]=4 4595 B10R0.71 COCCNCCCCCF 2230a_100000209980_100000729378 [0,1,0,0,0,0|2,0,0]=3 4596 B10R0.71 COCCNCCCCCO 2230a_100000209980_100000746330 [0,1,0,0,0,0|2,0,0]=3 4597 B10R0.71 COCCNCCCCCO 2230a_100000762737_100011201679 [0,1,0,0,0,0|2,0,0]=3 4598 B10R0.71 COCCNCCCCCO 34a_100000762737_100011201679 [0,1,0,0,0,0|2,0,0]=3 4599 B10R0.71 COCCNCCOCC#N 2230a_100000209980_200000047693 [0,1,0,0,0,0|1,0,1]=3 4600 B10R0.71 COCCNCCOCCO 2230a_100000209980_100011215305 [0,1,0,0,0,0|1,0,0]=2 4601 B10R0.71 COCCNCCOCCO 2230a_100000211614_100011201679 [0,1,0,0,0,0|1,0,0]=2 4602 B10R0.71 COCCNCCOCCO 34a_100000211614_100011201679 [0,1,0,0,0,0|1,0,0]=2 4603 B10R0.71 COCCNCCSCCO 2230a_100011219999_100011201679 [0,1,0,0,0,0|1,1,0]=3 4604 B10R0.71 COCCNCOCCOC 2230a_100000209980_100000231047 [0,1,0,0,0,0|2,0,0]=3 4605 B10R0.71 COCCOCCCCCBr 34a_100000746331_100011201679 [0,1,0,0,0,0|1,0,0]=2 4606 B10R0.71 COCCOCCCCCBr 7a_100000746331_100000233755 [0,1,0,0,0,0|1,0,0]=2 4607 B10R0.71 COCCOCCCCCCl 34a_100000746330_100011201679 [0,1,0,0,0,0|1,0,0]=2 4608 B10R0.71 COCCOCCCCCCl 7a_100000746330_100000233755 [0,1,0,0,0,0|1,0,0]=2 4609 B10R0.71 COCCOCCCCCF 34a_100000210237_100000729378 [0,1,0,0,0,0|1,0,0]=2 4610 B10R0.71 COCCOCCCCCI 34a_200012148887_100011201679 [0,1,0,0,0,0|1,0,0]=2 4611 B10R0.71 COCCOCCCCCI 7a_200012148887_100000233755 [0,1,0,0,0,0|1,0,0]=2 4612 B10R0.71 COCCOCCCCCN 34a_100000762737_100011201679 [0,1,0,0,0,0|1,0,0]=2 4613 B10R0.71 COCCOCCCCCO 34a_100000210237_100000746330 [0,1,0,0,0,0|1,0,0]=2 4614 B10R0.71 COCCOCCCCSC 34a_100011217163_100011201679 [0,1,0,0,0,0|1,0,0]=2 4615 B10R0.71 COCCOCCCCSC 7a_100011217163_100000233755 [0,1,0,0,0,0|1,0,0]=2 4616 B10R0.71 COCCOCCCNCF 34a_100000206027_100015361967 [0,1,0,0,0,0|2,0,0]=3 4617 B10R0.71 COCCOCCCSCF 62a_100011216529_100015361967 [0,1,0,0,0,0|1,1,0]=3 4618 B10R0.71 COCCOCCCSCF 62a_100015361967_100011216529 [0,1,0,0,0,0|1,1,0]=3 4619 B10R0.71 COCCOCCNCC#N 2230a_100000745349_100011215382 [0,1,0,0,0,0|1,0,1]=3 4620 B10R0.71 COCCOCCNCC=O 2230a_100000745349_200015260668 [0,1,0,0,0,0|1,0,1]=3 4621 B10R0.71 COCCOCCNCC=O 34a_100000745349_200009817547 [0,1,0,0,0,0|1,0,1]=3 4622 B10R0.71 COCCOCCNCCF 2230a_100000745349_100011217306 [0,1,0,0,0,0|1,0,0]=2 4623 B10R0.71 COCCOCCNCCF 34a_100000724931_100000695917 [0,1,0,0,0,0|1,0,0]=2 4624 B10R0.71 COCCOCCNCCF 34a_100000745349_100011217306 [0,1,0,0,0,0|1,0,0]=2 4625 B10R0.71 COCCOCCNCCO 2230a_100000745349_100000211926 [0,1,0,0,0,0|1,0,0]=2 4626 B10R0.71 COCCOCCNCCO 2230a_100016997473_100000695917 [0,1,0,0,0,0|1,0,0]=2 4627 B10R0.71 COCCOCCNCCO 34a_100000745349_100000211926 [0,1,0,0,0,0|1,0,0]=2 4628 B10R0.71 COCCOCCNCCO 34a_100016990907_100000695917 [0,1,0,0,0,0|1,0,0]=2 4629 B10R0.71 COCCOCCNCOC 2230a_100000745349_100000766300 [0,1,0,0,0,0|1,0,0]=2 4630 B10R0.71 COCCOCCNCSC 2230a_100000745349_100011218213 [0,1,0,0,0,0|1,0,0]=2 4631 B10R0.71 COCCOCCNCSC 34a_100000745349_100011218213 [0,1,0,0,0,0|1,0,0]=2 4632 B10R0.71 COCCOCCOCC#N 7a_100011215163_100011215382 [0,1,0,0,0,0|0,0,1]=2 4633 B10R0.71 COCCOCCOCC=O 34a_100011215163_200009817547 [0,1,0,0,0,0|0,0,1]=2 4634 B10R0.71 COCCOCCOCC=O 7a_100011215163_200015260668 [0,1,0,0,0,0|0,0,1]=2 4635 B10R0.71 COCCOCCOCCBr 34a_100000211926_100000695917 [0,1,0,0,0,0|0,0,0]=1 4636 B10R0.71 COCCOCCOCCBr 34a_100000692535_100011201679 [0,1,0,0,0,0|0,0,0]=1 4637 B10R0.71 COCCOCCOCCBr 34a_100010132937_200000210301 [0,1,0,0,0,0|0,0,0]=1 4638 B10R0.71 COCCOCCOCCBr 7a_100000692535_100000233755 [0,1,0,0,0,0|0,0,0]=1 4639 B10R0.71 COCCOCCOCCBr 7a_100010132937_200000210301 [0,1,0,0,0,0|0,0,0]=1 4640 B10R0.71 COCCOCCOCCCl 34a_100000032323_200000210301 [0,1,0,0,0,0|0,0,0]=1 4641 B10R0.71 COCCOCCOCCCl 34a_100011215305_100011201679 [0,1,0,0,0,0|0,0,0]=1 4642 B10R0.71 COCCOCCOCCCl 7a_100000032323_200000210301 [0,1,0,0,0,0|0,0,0]=1 4643 B10R0.71 COCCOCCOCCCl 7a_100011215305_100000233755 [0,1,0,0,0,0|0,0,0]=1 4644 B10R0.71 COCCOCCOCCF 34a_100011215163_100011217306 [0,1,0,0,0,0|0,0,0]=1 4645 B10R0.71 COCCOCCOCCF 34a_200015357709_100011201679 [0,1,0,0,0,0|0,0,0]=1 4646 B10R0.71 COCCOCCOCCF 7a_100011215163_100011217306 [0,1,0,0,0,0|0,0,0]=1 4647 B10R0.71 COCCOCCOCCF 7a_200015357709_100000233755 [0,1,0,0,0,0|0,0,0]=1 4648 B10R0.71 COCCOCCOCCI 34a_100012149058_100011201679 [0,1,0,0,0,0|0,0,0]=1 4649 B10R0.71 COCCOCCOCCI 7a_100012149058_100000233755 [0,1,0,0,0,0|0,0,0]=1 4650 B10R0.71 COCCOCCOCCN 34a_100000210304_100000695917 [0,1,0,0,0,0|0,0,0]=1 4651 B10R0.71 COCCOCCOCCN 34a_100000211614_100011201679 [0,1,0,0,0,0|0,0,0]=1 4652 B10R0.71 COCCOCCOCCN 34a_100011998139_200000210301 [0,1,0,0,0,0|0,0,0]=1 4653 B10R0.71 COCCOCCOCCO 34a_100000210237_100000692535 [0,1,0,0,0,0|0,0,0]=1 4654 B10R0.71 COCCOCCOCCO 34a_100011215163_100000211926 [0,1,0,0,0,0|0,0,0]=1 4655 B10R0.71 COCCOCCOCCO 34a_100138415774_100000032323 [0,1,0,0,0,0|0,0,0]=1 4656 B10R0.71 COCCOCCOCCO 7a_100011215163_100000211926 [0,1,0,0,0,0|0,0,0]=1 4657 B10R0.71 COCCOCCOCSC 34a_100011215163_100011218213 [0,1,0,0,0,0|0,0,0]=1 4658 B10R0.71 COCCOCCSCC#N 62a_100000695917_100011215382 [0,1,0,0,0,0|0,1,1]=3 4659 B10R0.71 COCCOCCSCC#N 62a_100011215382_100000695917 [0,1,0,0,0,0|0,1,1]=3 4660 B10R0.71 COCCOCCSCC=O 62a_100000695917_200015260668 [0,1,0,0,0,0|0,1,1]=3 4661 B10R0.71 COCCOCCSCC=O 62a_200015260668_100000695917 [0,1,0,0,0,0|0,1,1]=3 4662 B10R0.71 COCCOCCSCCF 62a_100000695917_100011217306 [0,1,0,0,0,0|0,1,0]=2 4663 B10R0.71 COCCOCCSCCF 62a_100011217306_100000695917 [0,1,0,0,0,0|0,1,0]=2 4664 B10R0.71 COCCOCCSCCO 62a_100000211926_100000695917 [0,1,0,0,0,0|0,1,0]=2 4665 B10R0.71 COCCOCCSCCO 62a_100000695917_100000211926 [0,1,0,0,0,0|0,1,0]=2 4666 B10R0.71 COCCOCCSCOC 62a_100000695917_100000766300 [0,1,0,0,0,0|0,1,0]=2 4667 B10R0.71 COCCOCCSCOC 62a_100000766300_100000695917 [0,1,0,0,0,0|0,1,0]=2 4668 B10R0.71 COCCOCCSCSC 62a_100000695917_100011218213 [0,1,0,0,0,0|0,1,0]=2 4669 B10R0.71 COCCOCCSCSC 62a_100011218213_100000695917 [0,1,0,0,0,0|0,1,0]=2 4670 B10R0.71 COCCOCNCCCF 2230a_100015189416_100000231047 [0,1,0,0,0,0|2,0,0]=3 4671 B10R0.71 COCCOCNCCSC 2230a_100020590264_100000231047 [0,1,0,0,0,0|2,0,0]=3 4672 B10R0.71 COCCOCSCCC#N 62a_100000231047_100011215226 [0,1,0,0,0,0|2,0,1]=4 4673 B10R0.71 COCCOCSCCC#N 62a_100011215226_100000231047 [0,1,0,0,0,0|2,0,1]=4 4674 B10R0.71 COCCOCSCCCF 62a_100000231047_100011934791 [0,1,0,0,0,0|2,0,0]=3 4675 B10R0.71 COCCOCSCCCF 62a_100011934791_100000231047 [0,1,0,0,0,0|2,0,0]=3 4676 B10R0.71 COCCOCSCCCO 62a_100000231047_100011215043 [0,1,0,0,0,0|2,0,0]=3 4677 B10R0.71 COCCOCSCCCO 62a_100011215043_100000231047 [0,1,0,0,0,0|2,0,0]=3 4678 B10R0.71 COCCOCSCCOC 62a_100000231047_100000233755 [0,1,0,0,0,0|2,0,0]=3 4679 B10R0.71 COCCOCSCCOC 62a_100000233755_100000231047 [0,1,0,0,0,0|2,0,0]=3 4680 B10R0.71 COCCOCSCCSC 62a_100000212216_100000231047 [0,1,0,0,0,0|2,0,0]=3 4681 B10R0.71 COCCOCSCCSC 62a_100000231047_100000751147 [0,1,0,0,0,0|2,0,0]=3 4682 B10R0.71 COCCOCSCSC#N 62a_100000211825_100000231047 [0,1,0,0,0,0|1,1,1]=4 4683 B10R0.71 COCCOCSCSC#N 62a_100000231047_100000211825 [0,1,0,0,0,0|1,1,1]=4 4684 B10R0.71 COCCSCCCCC#N 62a_100000233755_100000211819 [0,1,0,0,0,0|1,1,1]=4 4685 B10R0.71 COCCSCCCCC#N 62a_100011219923_100000233755 [0,1,0,0,0,0|1,1,1]=4 4686 B10R0.71 COCCSCCCCC=O 62a_100000139335_100000233755 [0,1,0,0,0,0|1,1,1]=4 4687 B10R0.71 COCCSCCCCC=O 62a_100000233755_100000139335 [0,1,0,0,0,0|1,1,1]=4 4688 B10R0.71 COCCSCCCCCF 62a_100000233755_100000729378 [0,1,0,0,0,0|1,1,0]=3 4689 B10R0.71 COCCSCCCCCF 62a_100000729378_100000233755 [0,1,0,0,0,0|1,1,0]=3 4690 B10R0.71 COCCSCCCCCO 62a_100000233755_100000746330 [0,1,0,0,0,0|1,1,0]=3 4691 B10R0.71 COCCSCCCCCO 62a_100000746330_100000233755 [0,1,0,0,0,0|1,1,0]=3 4692 B10R0.71 COCCSCCOCC#N 62a_100000233755_200000047693 [0,1,0,0,0,0|0,1,1]=3 4693 B10R0.71 COCCSCCOCC#N 62a_200000047693_100000233755 [0,1,0,0,0,0|0,1,1]=3 4694 B10R0.71 COCCSCCOCCO 62a_100000233755_100011215305 [0,1,0,0,0,0|0,1,0]=2 4695 B10R0.71 COCCSCCOCCO 62a_100011215305_100000233755 [0,1,0,0,0,0|0,1,0]=2 4696 B10R0.71 COCNCCCCCCO 2230a_100000686447_100000766300 [0,1,0,0,0,0|3,0,0]=4 4697 B10R0.71 COCSCCCCCCF 62a_100000766300_100015922095 [0,1,0,0,0,0|3,0,0]=4 4698 B10R0.71 COCSCCCCCCF 62a_100015922095_100000766300 [0,1,0,0,0,0|3,0,0]=4 4699 B10R0.71 COCSCCCCCCO 62a_100000766143_100000766300 [0,1,0,0,0,0|3,0,0]=4 4700 B10R0.71 COCSCCCCCCO 62a_100000766300_100000766143 [0,1,0,0,0,0|3,0,0]=4 4701 B10R0.71 CSCCCCCCCCO 62a_100000033203_200000210301 [0,1,0,0,0,0|2,1,0]=4 4702 B10R0.71 CSCCCCCCCCO 62a_200000210301_100000033203 [0,1,0,0,0,0|2,1,0]=4 4703 B10R0.71 CSCCCCOCCC#N 7a_100011217163_100000184422 [0,1,0,0,0,0|3,0,0]=4 4704 B10R0.71 CSCCCCOCCCF 34a_100011217163_100011934791 [0,1,0,0,0,0|3,0,0]=4 4705 B10R0.71 CSCCCCOCCCF 7a_100011217163_100011934791 [0,1,0,0,0,0|3,0,0]=4 4706 B10R0.71 CSCCCCOCCCO 34a_100011217163_100000230001 [0,1,0,0,0,0|3,0,0]=4 4707 B10R0.71 CSCCCCOCCCO 7a_100011217163_100011215043 [0,1,0,0,0,0|3,0,0]=4 4708 B10R0.71 CSCCCCOCCSC 34a_100011217163_100000212216 [0,1,0,0,0,0|1,1,0]=3 4709 B10R0.71 CSCCCCOCCSC 7a_100011217163_100000212216 [0,1,0,0,0,0|1,1,0]=3 4710 B10R0.71 CSCCCOCCCCF 34a_100000690336_100000729493 [0,1,0,0,0,0|2,1,0]=4 4711 B10R0.71 CSCCCOCCCCF 7a_100000690336_100000729493 [0,1,0,0,0,0|2,1,0]=4 4712 B10R0.71 CSCCCOCCCCO 34a_100000690336_100011216708 [0,1,0,0,0,0|2,1,0]=4 4713 B10R0.71 CSCCCOCCCCO 7a_100000690336_100000210776 [0,1,0,0,0,0|2,1,0]=4 4714 B10R0.71 CSCCNCCCCCF 2230a_100020590264_100000729378 [0,1,0,0,0,0|2,1,0]=4 4715 B10R0.71 CSCCNCCCCCO 2230a_100000762737_100000751147 [0,1,0,0,0,0|2,1,0]=4 4716 B10R0.71 CSCCNCCCCCO 2230a_100020590264_100000746330 [0,1,0,0,0,0|2,1,0]=4 4717 B10R0.71 CSCCNCCCCCO 34a_100000762737_100000212216 [0,1,0,0,0,0|2,1,0]=4 4718 B10R0.71 CSCCNCCOCC#N 2230a_100020590264_200000047693 [0,1,0,0,0,0|1,1,1]=4 4719 B10R0.71 CSCCNCCOCCO 2230a_100000211614_100000751147 [0,1,0,0,0,0|1,1,0]=3 4720 B10R0.71 CSCCNCCOCCO 2230a_100020590264_100011215305 [0,1,0,0,0,0|1,1,0]=3 4721 B10R0.71 CSCCNCCOCCO 34a_100000211614_100000212216 [0,1,0,0,0,0|1,1,0]=3 4722 B10R0.71 CSCCNCCSCCO 2230a_100011219999_100000751147 [0,1,0,0,0,0|1,2,0]=4 4723 B10R0.71 CSCCOCCCCC#N 7a_100000230434_100000211819 [0,1,0,0,0,0|1,1,1]=4 4724 B10R0.71 CSCCOCCCCC=O 7a_100000230434_100000139335 [0,1,0,0,0,0|1,1,1]=4 4725 B10R0.71 CSCCOCCCCCBr 34a_100000746331_100000212216 [0,1,0,0,0,0|1,1,0]=3 4726 B10R0.71 CSCCOCCCCCBr 7a_100000746331_100000212216 [0,1,0,0,0,0|1,1,0]=3 4727 B10R0.71 CSCCOCCCCCCl 34a_100000746330_100000212216 [0,1,0,0,0,0|1,1,0]=3 4728 B10R0.71 CSCCOCCCCCCl 7a_100000746330_100000212216 [0,1,0,0,0,0|1,1,0]=3 4729 B10R0.71 CSCCOCCCCCF 34a_100000230434_100000729378 [0,1,0,0,0,0|1,1,0]=3 4730 B10R0.71 CSCCOCCCCCF 7a_100000230434_100000729378 [0,1,0,0,0,0|1,1,0]=3 4731 B10R0.71 CSCCOCCCCCI 34a_200012148887_100000212216 [0,1,0,0,0,0|1,1,0]=3 4732 B10R0.71 CSCCOCCCCCI 7a_200012148887_100000212216 [0,1,0,0,0,0|1,1,0]=3 4733 B10R0.71 CSCCOCCCCCN 34a_100000762737_100000212216 [0,1,0,0,0,0|1,1,0]=3 4734 B10R0.71 CSCCOCCCCCO 34a_100000230434_100000746330 [0,1,0,0,0,0|1,1,0]=3 4735 B10R0.71 CSCCOCCCCCO 7a_100000230434_100000746330 [0,1,0,0,0,0|1,1,0]=3 4736 B10R0.71 CSCCOCCOCC#N 7a_100000230434_200000047693 [0,1,0,0,0,0|0,1,1]=3 4737 B10R0.71 CSCCOCCOCCBr 34a_100000692535_100000212216 [0,1,0,0,0,0|0,1,0]=2 4738 B10R0.71 CSCCOCCOCCBr 7a_100000692535_100000212216 [0,1,0,0,0,0|0,1,0]=2 4739 B10R0.71 CSCCOCCOCCCl 34a_100011215305_100000212216 [0,1,0,0,0,0|0,1,0]=2 4740 B10R0.71 CSCCOCCOCCCl 7a_100011215305_100000212216 [0,1,0,0,0,0|0,1,0]=2 4741 B10R0.71 CSCCOCCOCCF 34a_200015357709_100000212216 [0,1,0,0,0,0|0,1,0]=2 4742 B10R0.71 CSCCOCCOCCF 7a_200015357709_100000212216 [0,1,0,0,0,0|0,1,0]=2 4743 B10R0.71 CSCCOCCOCCI 34a_100012149058_100000212216 [0,1,0,0,0,0|0,1,0]=2 4744 B10R0.71 CSCCOCCOCCI 7a_100012149058_100000212216 [0,1,0,0,0,0|0,1,0]=2 4745 B10R0.71 CSCCOCCOCCN 34a_100000211614_100000212216 [0,1,0,0,0,0|0,1,0]=2 4746 B10R0.71 CSCCOCCOCCO 34a_100000230434_100000692535 [0,1,0,0,0,0|0,1,0]=2 4747 B10R0.71 CSCCOCCOCCO 62a_100000032323_200000210301 [0,1,0,0,0,0|0,1,0]=2 4748 B10R0.71 CSCCOCCOCCO 62a_200000210301_100000032323 [0,1,0,0,0,0|0,1,0]=2 4749 B10R0.71 CSCCOCCOCCO 7a_100000230434_100011215305 [0,1,0,0,0,0|0,1,0]=2 4750 B10R0.71 CSCCSCCCCCF 62a_100000212216_100000729378 [0,1,0,0,0,0|1,2,0]=4 4751 B10R0.71 CSCCSCCCCCF 62a_100000729378_100000751147 [0,1,0,0,0,0|1,2,0]=4 4752 B10R0.71 CSCCSCCCCCO 62a_100000212216_100000746330 [0,1,0,0,0,0|1,2,0]=4 4753 B10R0.71 CSCCSCCCCCO 62a_100000746330_100000751147 [0,1,0,0,0,0|1,2,0]=4 4754 B10R0.71 CSCCSCCOCC#N 62a_100000212216_200000047693 [0,1,0,0,0,0|0,2,1]=4 4755 B10R0.71 CSCCSCCOCC#N 62a_200000047693_100000751147 [0,1,0,0,0,0|0,2,1]=4 4756 B10R0.71 CSCCSCCOCCO 62a_100000212216_100011215305 [0,1,0,0,0,0|0,2,0]=3 4757 B10R0.71 CSCCSCCOCCO 62a_100011215305_100000751147 [0,1,0,0,0,0|0,2,0]=3 4758 B10R0.71 CSCOCCCCCCBr 34a_100011215345_100011218213 [0,1,0,0,0,0|3,0,0]=4 4759 B10R0.71 CSCOCCCCCCCl 34a_100000766143_100011218213 [0,1,0,0,0,0|3,0,0]=4 4760 B10R0.71 CSCOCCCCCCF 34a_100000732779_100011218213 [0,1,0,0,0,0|3,0,0]=4 4761 B10R0.71 CSCOCCCCCCN 34a_100000686447_100011218213 [0,1,0,0,0,0|3,0,0]=4 4762 B10R0.71 FCCCCCCOCCBr 34a_100000211926_100015922095 [0,1,0,0,0,0|3,0,0]=4 4763 B10R0.71 FCCCCCCOCCF 34a_100000732779_100011217306 [0,1,0,0,0,0|3,0,0]=4 4764 B10R0.71 FCCCCCCOCCF 7a_100000732779_100011217306 [0,1,0,0,0,0|3,0,0]=4 4765 B10R0.71 FCCCCCOCCCBr 34a_100011217188_100000729378 [0,1,0,0,0,0|3,0,0]=4 4766 B10R0.71 FCCCCCOCCCCl 34a_100000230001_100000729378 [0,1,0,0,0,0|3,0,0]=4 4767 B10R0.71 FCCCCCOCCCF 34a_100000759539_100000729378 [0,1,0,0,0,0|3,0,0]=4 4768 B10R0.71 FCCCCOCCCCBr 34a_100011216708_100000729493 [0,1,0,0,0,0|3,0,0]=4 4769 B10R0.71 FCCCCOCCCCCl 34a_100000210776_100000729493 [0,1,0,0,0,0|3,0,0]=4 4770 B10R0.71 FCCCCOCCCCCl 7a_100000210776_100000729493 [0,1,0,0,0,0|3,0,0]=4 4771 B10R0.71 FCCCCOCCCCF 34a_100011995726_100000729493 [0,1,0,0,0,0|3,0,0]=4 4772 B10R0.71 FCCCCOCCCCF 7a_100011995726_100000729493 [0,1,0,0,0,0|3,0,0]=4 4773 B10R0.71 FCCCCOCCCCI 34a_200012148704_100000729493 [0,1,0,0,0,0|3,0,0]=4 4774 B10R0.71 FCCCOCCCCCBr 34a_100000746331_100011934791 [0,1,0,0,0,0|3,0,0]=4 4775 B10R0.71 FCCCOCCCCCBr 7a_100000746331_100011934791 [0,1,0,0,0,0|3,0,0]=4 4776 B10R0.71 FCCCOCCCCCCl 34a_100000746330_100011934791 [0,1,0,0,0,0|3,0,0]=4 4777 B10R0.71 FCCCOCCCCCCl 7a_100000746330_100011934791 [0,1,0,0,0,0|3,0,0]=4 4778 B10R0.71 FCCCOCCCCCI 34a_200012148887_100011934791 [0,1,0,0,0,0|3,0,0]=4 4779 B10R0.71 FCCCOCCCCCI 7a_200012148887_100011934791 [0,1,0,0,0,0|3,0,0]=4 4780 B10R0.71 FCCCOCCOCCBr 34a_100000692535_100011934791 [0,1,0,0,0,0|2,0,0]=3 4781 B10R0.71 FCCCOCCOCCBr 7a_100000692535_100011934791 [0,1,0,0,0,0|2,0,0]=3 4782 B10R0.71 FCCCOCCOCCCl 34a_100011215305_100011934791 [0,1,0,0,0,0|2,0,0]=3 4783 B10R0.71 FCCCOCCOCCCl 7a_100011215305_100011934791 [0,1,0,0,0,0|2,0,0]=3 4784 B10R0.71 FCCCOCCOCCF 34a_200015357709_100011934791 [0,1,0,0,0,0|2,0,0]=3 4785 B10R0.71 FCCCOCCOCCF 7a_200015357709_100011934791 [0,1,0,0,0,0|2,0,0]=3 4786 B10R0.71 FCCCOCCOCCI 34a_100012149058_100011934791 [0,1,0,0,0,0|2,0,0]=3 4787 B10R0.71 FCCCOCCOCCI 7a_100012149058_100011934791 [0,1,0,0,0,0|2,0,0]=3 4788 B10R0.71 FCCOCCCCCCBr 34a_100011215345_100011217306 [0,1,0,0,0,0|3,0,0]=4 4789 B10R0.71 FCCOCCCCCCBr 7a_100011215345_100011217306 [0,1,0,0,0,0|3,0,0]=4 4790 B10R0.71 FCCOCCCCCCCl 34a_100000766143_100011217306 [0,1,0,0,0,0|3,0,0]=4 4791 B10R0.71 FCCOCCCCCCCl 7a_100000766143_100011217306 [0,1,0,0,0,0|3,0,0]=4 4792 B10R0.71 FCOCCCCCCCBr 34a_100000760002_100015361967 [0,1,0,0,0,0|3,0,0]=4 4793 B10R0.71 FCOCCCCCCCBr 7a_100000760002_100015361967 [0,1,0,0,0,0|3,0,0]=4 4794 B10R0.71 N#CCCNCCOCCO 2230a_100000211614_100011215226 [0,1,0,0,0,0|3,0,0]=4 4795 B10R0.71 N#CCCOCCCCCBr 7a_100000746331_100000184422 [0,1,0,0,0,0|3,0,0]=4 4796 B10R0.71 N#CCCOCCCCCCl 7a_100000746330_100000184422 [0,1,0,0,0,0|3,0,0]=4 4797 B10R0.71 N#CCCOCCCCCI 7a_200012148887_100000184422 [0,1,0,0,0,0|3,0,0]=4 4798 B10R0.71 N#CCCOCCOCCBr 7a_100000692535_100000184422 [0,1,0,0,0,0|2,0,0]=3 4799 B10R0.71 N#CCCOCCOCCCl 7a_100011215305_100000184422 [0,1,0,0,0,0|2,0,0]=3 4800 B10R0.71 N#CCCOCCOCCF 7a_200015357709_100000184422 [0,1,0,0,0,0|2,0,0]=3 4801 B10R0.71 N#CCCOCCOCCI 7a_100012149058_100000184422 [0,1,0,0,0,0|2,0,0]=3 4802 B10R0.71 N#CCCSCCOCCO 62a_100011215226_100011215305 [0,1,0,0,0,0|2,1,0]=4 4803 B10R0.71 N#CCCSCCOCCO 62a_100011215305_100011215226 [0,1,0,0,0,0|2,1,0]=4 4804 B10R0.71 NCCCCCCCOCF 34a_100011996573_100015361967 [0,1,0,0,0,0|3,0,0]=4 4805 B10R0.71 NCCCCCCOCCF 34a_100000686447_100011217306 [0,1,0,0,0,0|3,0,0]=4 4806 B10R0.71 NCCCCCCOCCO 34a_100000686447_100000211926 [0,1,0,0,0,0|3,0,0]=4 4807 B10R0.71 NCCCCCOCCCF 34a_100000762737_100011934791 [0,1,0,0,0,0|3,0,0]=4 4808 B10R0.71 NCCCCCOCCCO 34a_100000762737_100000230001 [0,1,0,0,0,0|3,0,0]=4 4809 B10R0.71 NCCCCOCCCCF 34a_100000750430_100000729493 [0,1,0,0,0,0|3,0,0]=4 4810 B10R0.71 NCCCCOCCCCO 34a_100000750430_100011216708 [0,1,0,0,0,0|3,0,0]=4 4811 B10R0.71 NCCCOCCCCCF 34a_100000182051_100000729378 [0,1,0,0,0,0|3,0,0]=4 4812 B10R0.71 NCCCOCCCCCO 34a_100000182051_100000746330 [0,1,0,0,0,0|3,0,0]=4 4813 B10R0.71 NCCCOCCCOCF 34a_100011310245_100015361967 [0,1,0,0,0,0|3,0,0]=4 4814 B10R0.71 NCCCOCCOCCO 34a_100000182051_100000692535 [0,1,0,0,0,0|2,0,0]=3 4815 B10R0.71 NCCOCCCCCCF 34a_100000210304_100015922095 [0,1,0,0,0,0|3,0,0]=4 4816 B10R0.71 NCCOCCCCCCO 34a_100000210304_100000766143 [0,1,0,0,0,0|3,0,0]=4 4817 B10R0.71 NCCOCCOCCCF 34a_100000211614_100011934791 [0,1,0,0,0,0|2,0,0]=3 4818 B10R0.71 NCCOCCOCCCO 34a_100000211614_100000230001 [0,1,0,0,0,0|2,0,0]=3 4819 B10R0.71 NOCCOCCCCCF 34a_100000700252_100000729378 [0,1,0,0,0,0|2,0,0]=3 4820 B10R0.71 NOCCOCCCCCO 34a_100000700252_100000746330 [0,1,0,0,0,0|2,0,0]=3 4821 B10R0.71 NOCCOCCOCCO 34a_100000700252_100000692535 [0,1,0,0,0,0|1,0,0]=2 4822 B10R0.71 OCCCCCCOCCBr 34a_100000211926_100000766143 [0,1,0,0,0,0|3,0,0]=4 4823 B10R0.71 OCCCCCOCCCBr 34a_100011217188_100000746330 [0,1,0,0,0,0|3,0,0]=4 4824 B10R0.71 OCCCCCOCCCCl 34a_100000230001_100000746330 [0,1,0,0,0,0|3,0,0]=4 4825 B10R0.71 OCCCCCOCCCF 34a_100000759539_100000746330 [0,1,0,0,0,0|3,0,0]=4 4826 B10R0.71 OCCCCOCCCCBr 34a_100011216708_100011216708 [0,1,0,0,0,0|3,0,0]=4 4827 B10R0.71 OCCCCOCCCCCl 34a_100000210776_100011216708 [0,1,0,0,0,0|3,0,0]=4 4828 B10R0.71 OCCCCOCCCCCl 7a_100000210776_100000210776 [0,1,0,0,0,0|3,0,0]=4 4829 B10R0.71 OCCCCOCCCCF 34a_100011995726_100011216708 [0,1,0,0,0,0|3,0,0]=4 4830 B10R0.71 OCCCCOCCCCF 7a_100011995726_100000210776 [0,1,0,0,0,0|3,0,0]=4 4831 B10R0.71 OCCCCOCCCCI 34a_200012148704_100011216708 [0,1,0,0,0,0|3,0,0]=4 4832 B10R0.71 OCCCNCCOCCO 2230a_100000211614_100000230001 [0,1,0,0,0,0|3,0,0]=4 4833 B10R0.71 OCCCNCCOCCO 34a_100000211614_100000230001 [0,1,0,0,0,0|3,0,0]=4 4834 B10R0.71 OCCCOCCCCCBr 34a_100000746331_100000230001 [0,1,0,0,0,0|3,0,0]=4 4835 B10R0.71 OCCCOCCCCCBr 7a_100000746331_100011215043 [0,1,0,0,0,0|3,0,0]=4 4836 B10R0.71 OCCCOCCCCCCl 34a_100000746330_100000230001 [0,1,0,0,0,0|3,0,0]=4 4837 B10R0.71 OCCCOCCCCCCl 7a_100000746330_100011215043 [0,1,0,0,0,0|3,0,0]=4 4838 B10R0.71 OCCCOCCCCCI 34a_200012148887_100000230001 [0,1,0,0,0,0|3,0,0]=4 4839 B10R0.71 OCCCOCCCCCI 7a_200012148887_100011215043 [0,1,0,0,0,0|3,0,0]=4 4840 B10R0.71 OCCCOCCOCCBr 34a_100000692535_100000230001 [0,1,0,0,0,0|2,0,0]=3 4841 B10R0.71 OCCCOCCOCCBr 7a_100000692535_100011215043 [0,1,0,0,0,0|2,0,0]=3 4842 B10R0.71 OCCCOCCOCCCl 34a_100011215305_100000230001 [0,1,0,0,0,0|2,0,0]=3 4843 B10R0.71 OCCCOCCOCCCl 7a_100011215305_100011215043 [0,1,0,0,0,0|2,0,0]=3 4844 B10R0.71 OCCCOCCOCCF 34a_200015357709_100000230001 [0,1,0,0,0,0|2,0,0]=3 4845 B10R0.71 OCCCOCCOCCF 7a_200015357709_100011215043 [0,1,0,0,0,0|2,0,0]=3 4846 B10R0.71 OCCCOCCOCCI 34a_100012149058_100000230001 [0,1,0,0,0,0|2,0,0]=3 4847 B10R0.71 OCCCOCCOCCI 7a_100012149058_100011215043 [0,1,0,0,0,0|2,0,0]=3 4848 B10R0.71 OCCCSCCOCCO 62a_100011215043_100011215305 [0,1,0,0,0,0|2,1,0]=4 4849 B10R0.71 OCCCSCCOCCO 62a_100011215305_100011215043 [0,1,0,0,0,0|2,1,0]=4 4850 B10R0.71 OCCOCCCCCCBr 34a_100011215345_100000211926 [0,1,0,0,0,0|3,0,0]=4 4851 B10R0.71 OCCOCCCCCCBr 7a_100011215345_100000211926 [0,1,0,0,0,0|3,0,0]=4 4852 B10R0.71 OCCOCCCCCCCl 34a_100000766143_100000211926 [0,1,0,0,0,0|3,0,0]=4 4853 B10R0.71 OCCOCCCCCCCl 7a_100000766143_100000211926 [0,1,0,0,0,0|3,0,0]=4 4854 B10R0.71 OCCOCCCCCCF 34a_100000732779_100000211926 [0,1,0,0,0,0|3,0,0]=4 4855 B10R0.71 OCCOCCCCCCF 7a_100000732779_100000211926 [0,1,0,0,0,0|3,0,0]=4 4856 B10R0.71 OCCOCCNCCCF 2230a_100000211614_100011934791 [0,1,0,0,0,0|3,0,0]=4 4857 B10R0.71 OCCOCCNCCCF 2230a_100015189416_100011215305 [0,1,0,0,0,0|3,0,0]=4 4858 B10R0.71 OCCOCCNCCCF 34a_100000211614_100011934791 [0,1,0,0,0,0|3,0,0]=4 4859 B10R0.71 OCCOCCNCCCF 34a_100015189416_100000692535 [0,1,0,0,0,0|3,0,0]=4 4860 B10R0.71 OCCOCCOCCCBr 34a_100011217188_100000692535 [0,1,0,0,0,0|2,0,0]=3 4861 B10R0.71 OCCOCCOCCCCl 34a_100000230001_100000692535 [0,1,0,0,0,0|2,0,0]=3 4862 B10R0.71 OCCOCCOCCCF 34a_100000759539_100000692535 [0,1,0,0,0,0|2,0,0]=3 4863 B10R0.71 OCCOCCSCCCF 62a_100011215305_100011934791 [0,1,0,0,0,0|2,1,0]=4 4864 B10R0.71 OCCOCCSCCCF 62a_100011934791_100011215305 [0,1,0,0,0,0|2,1,0]=4 4865 B10R0.71 [13CH3]NCCCCCCCCO 2230a_102515433106_200025704644 [0,1,0,0,0,0|3,0,0]=4 4866 B10R0.71 [13CH3]NCCCCCCCCO 34a_102515433106_200025704644 [0,1,0,0,0,0|3,0,0]=4 4867 B10R0.71 [13CH3]NCCOCCOCCO 2230a_100011998139_200025704644 [0,1,0,0,0,0|1,0,0]=2 4868 B10R0.71 [13CH3]NCCOCCOCCO 34a_100011998139_200025704644 [0,1,0,0,0,0|1,0,0]=2 4869 B10R0.71 [13CH3]OCCCCCCCCBr 34a_100009813846_200025704644 [0,1,0,0,0,0|2,0,0]=3 4870 B10R0.71 [13CH3]OCCCCCCCCBr 7a_100009813846_200025704644 [0,1,0,0,0,0|2,0,0]=3 4871 B10R0.71 [13CH3]OCCCCCCCCCl 34a_100000033203_200025704644 [0,1,0,0,0,0|2,0,0]=3 4872 B10R0.71 [13CH3]OCCCCCCCCCl 7a_100000033203_200025704644 [0,1,0,0,0,0|2,0,0]=3 4873 B10R0.71 [13CH3]OCCCCCCCCN 34a_102515433106_200025704644 [0,1,0,0,0,0|2,0,0]=3 4874 B10R0.71 [13CH3]OCCCCCNCCN 34a_103619048469_200025704644 [0,1,0,0,0,0|2,0,0]=3 4875 B10R0.71 [13CH3]OCCOCCOCCBr 34a_100010132937_200025704644 [0,1,0,0,0,0|0,0,0]=1 4876 B10R0.71 [13CH3]OCCOCCOCCBr 7a_100010132937_200025704644 [0,1,0,0,0,0|0,0,0]=1 4877 B10R0.71 [13CH3]OCCOCCOCCCl 34a_100000032323_200025704644 [0,1,0,0,0,0|0,0,0]=1 4878 B10R0.71 [13CH3]OCCOCCOCCCl 7a_100000032323_200025704644 [0,1,0,0,0,0|0,0,0]=1 4879 B10R0.71 [13CH3]OCCOCCOCCN 34a_100011998139_200025704644 [0,1,0,0,0,0|0,0,0]=1 4880 B10R0.71 [13CH3]SCCCCCCCCO 62a_100000033203_200025704644 [0,1,0,0,0,0|2,1,0]=4 4881 B10R0.71 [13CH3]SCCCCCCCCO 62a_200025704644_100000033203 [0,1,0,0,0,0|2,1,0]=4 4882 B10R0.71 [13CH3]SCCOCCOCCO 62a_100000032323_200025704644 [0,1,0,0,0,0|0,1,0]=2 4883 B10R0.71 [13CH3]SCCOCCOCCO 62a_200025704644_100000032323 [0,1,0,0,0,0|0,1,0]=2 4884 B10R0.74 C#CC(=O)CCOCCOC 1458a_100000211873_100000695917 [0,1,0,0,0,0|1,0,2]=4 4885 B10R0.74 C#CCCCOCC(C)OC 34a_100000690652_100000695029 [0,1,0,0,0,0|1,0,2]=4 4886 B10R0.74 C#CCCOCCC(C)CC 7a_100011215188_100000688953 [0,1,0,0,0,0|2,0,1]=4 4887 B10R0.74 C/C=C/CCOCC(=O)OC 34a_100016278192_100000747449 [0,1,0,0,0,0|1,0,2]=4 4888 B10R0.74 C/C=C/CCOCC(C)CC 34a_100016278192_100000748023 [0,1,0,0,0,0|2,0,1]=4 4889 B10R0.74 C/C=C/CCOCC(O)CC 34a_100016278192_100011218378 [0,1,0,0,0,0|2,0,1]=4 4890 B10R0.74 C/C=C/CCOC[C@@H](C)CC 34a_100016278192_100009816398 [0,1,0,0,0,0|2,0,1]=4 4891 B10R0.74 C/C=C/COCCC(C)CC 7a_100011215188_100102629194 [0,1,0,0,0,0|2,0,1]=4 4892 B10R0.74 C=C(C#N)COCCOCC 34a_100000210136_100000694840 [0,1,0,0,0,0|2,0,1]=4 4893 B10R0.74 C=CC(=O)CCOCCOC 1458a_100000185746_100000695917 [0,1,0,0,0,0|1,0,2]=4 4894 B10R0.74 C=CC(C)COCCCCC 34a_100011215527_100000718602 [0,1,0,0,0,0|2,0,1]=4 4895 B10R0.74 C=CC(C)COCCCCC 7a_100011215527_100000210326 [0,1,0,0,0,0|2,0,1]=4 4896 B10R0.74 C=CC(C)COCCOCC 34a_100011215527_100000210147 [0,1,0,0,0,0|1,0,1]=3 4897 B10R0.74 C=CC(C)COCCOCC 7a_100011215527_100011215890 [0,1,0,0,0,0|1,0,1]=3 4898 B10R0.74 C=CC(C)COCCSCC 34a_100011215527_100000757381 [0,1,0,0,0,0|1,1,1]=4 4899 B10R0.74 C=CC(C)COCCSCC 7a_100011215527_100000757381 [0,1,0,0,0,0|1,1,1]=4 4900 B10R0.74 C=CC(O)CNCCOCC 2230a_102516460346_100000730141 [0,1,0,0,0,0|2,0,1]=4 4901 B10R0.74 C=CC(O)CNCCOCC 34a_102516460346_100000730141 [0,1,0,0,0,0|2,0,1]=4 4902 B10R0.74 C=CC(O)COCCCCC 34a_100000210253_100000730141 [0,1,0,0,0,0|2,0,1]=4 4903 B10R0.74 C=CC(O)COCCCCC 7a_100000210253_100000730141 [0,1,0,0,0,0|2,0,1]=4 4904 B10R0.74 C=CC(O)COCCOCC 34a_100000210136_100000730141 [0,1,0,0,0,0|1,0,1]=3 4905 B10R0.74 C=CC(O)COCCOCC 7a_100000210136_100000730141 [0,1,0,0,0,0|1,0,1]=3 4906 B10R0.74 C=CC(O)COCCSCC 34a_100000212035_100000730141 [0,1,0,0,0,0|1,1,1]=4 4907 B10R0.74 C=CC(O)COCCSCC 7a_100000212035_100000730141 [0,1,0,0,0,0|1,1,1]=4 4908 B10R0.74 C=CC(O)CSCCOCC 62a_100000210147_100000730141 [0,1,0,0,0,0|1,1,1]=4 4909 B10R0.74 C=CC(O)CSCCOCC 62a_100000730141_100011215890 [0,1,0,0,0,0|1,1,1]=4 4910 B10R0.74 C=CCCCOCC(C)OC 34a_100000690652_100000757094 [0,1,0,0,0,0|1,0,2]=4 4911 B10R0.74 C=CCCOCCC(C)CC 7a_100011215188_100000754431 [0,1,0,0,0,0|2,0,1]=4 4912 B10R0.74 C=COCCNC[C@@H](C)OC 2230a_100020591295_100000039644 [0,1,0,0,0,0|1,0,2]=4 4913 B10R0.74 C=COCCOCC(=O)OC 34a_100000033082_100000747449 [0,1,0,0,0,0|0,0,3]=4 4914 B10R0.74 C=COCCOCC(C)CC 34a_100000033082_100000748023 [0,1,0,0,0,0|1,0,2]=4 4915 B10R0.74 C=COCCOCC(C)OC 34a_100000690652_100000039644 [0,1,0,0,0,0|0,0,2]=3 4916 B10R0.74 C=COCCOCC(O)CC 34a_100000033082_100011218378 [0,1,0,0,0,0|1,0,2]=4 4917 B10R0.74 C=COCCOC[C@@H](C)CC 34a_100000033082_100009816398 [0,1,0,0,0,0|1,0,2]=4 4918 B10R0.74 C=COCCOC[C@@H](C)CC 7a_100009816381_100000039644 [0,1,0,0,0,0|1,0,2]=4 4919 B10R0.74 C=C[C@H](N)COCCCCC 34a_100016989147_100000718602 [0,1,0,0,0,0|2,0,1]=4 4920 B10R0.74 C=C[C@H](N)COCCOCC 34a_100016989147_100000210147 [0,1,0,0,0,0|1,0,1]=3 4921 B10R0.74 C=C[C@H](N)COCCSCC 34a_100016989147_100000757381 [0,1,0,0,0,0|1,1,1]=4 4922 B10R0.74 CC#CCCOCC(=O)OC 34a_100000750427_100000747449 [0,1,0,0,0,0|1,0,2]=4 4923 B10R0.74 CC#CCCOCC(C)CC 34a_100000750427_100000748023 [0,1,0,0,0,0|2,0,1]=4 4924 B10R0.74 CC#CCCOCC(O)CC 34a_100000750427_100011218378 [0,1,0,0,0,0|2,0,1]=4 4925 B10R0.74 CC#CCCOC[C@@H](C)CC 34a_100000750427_100009816398 [0,1,0,0,0,0|2,0,1]=4 4926 B10R0.74 CC#CCOCCC(C)CC 7a_100011215188_100000748600 [0,1,0,0,0,0|2,0,1]=4 4927 B10R0.74 CC/C=C\CNC[C@@H](C)OC 2230a_100020591295_100103147603 [0,1,0,0,0,0|2,0,1]=4 4928 B10R0.74 CC/C=C\COCC(=O)OC 34a_100016268518_100000747449 [0,1,0,0,0,0|1,0,2]=4 4929 B10R0.74 CC/C=C\COCC(C)CC 34a_100016268518_100000748023 [0,1,0,0,0,0|2,0,1]=4 4930 B10R0.74 CC/C=C\COCC(C)OC 34a_100000690652_100103147603 [0,1,0,0,0,0|1,0,1]=3 4931 B10R0.74 CC/C=C\COCC(O)CC 34a_100016268518_100011218378 [0,1,0,0,0,0|2,0,1]=4 4932 B10R0.74 CC/C=C\COC[C@@H](C)CC 34a_100016268518_100009816398 [0,1,0,0,0,0|2,0,1]=4 4933 B10R0.74 CC/C=C\COC[C@@H](C)CC 7a_100009816381_100103147603 [0,1,0,0,0,0|2,0,1]=4 4934 B10R0.74 CC=CCOCCC(C)CC 7a_100011215188_100000070051 [0,1,0,0,0,0|2,0,1]=4 4935 B10R0.74 CCC#CCNC[C@@H](C)OC 2230a_100020591295_100009813939 [0,1,0,0,0,0|2,0,1]=4 4936 B10R0.74 CCC#CCOCC(=O)OC 34a_100000032950_100000747449 [0,1,0,0,0,0|1,0,2]=4 4937 B10R0.74 CCC#CCOCC(C)CC 34a_100000032950_100000748023 [0,1,0,0,0,0|2,0,1]=4 4938 B10R0.74 CCC#CCOCC(C)OC 34a_100000690652_100009813939 [0,1,0,0,0,0|1,0,1]=3 4939 B10R0.74 CCC#CCOCC(O)CC 34a_100000032950_100011218378 [0,1,0,0,0,0|2,0,1]=4 4940 B10R0.74 CCC#CCOC[C@@H](C)CC 34a_100000032950_100009816398 [0,1,0,0,0,0|2,0,1]=4 4941 B10R0.74 CCC#CCOC[C@@H](C)CC 7a_100009816381_100009813939 [0,1,0,0,0,0|2,0,1]=4 4942 B10R0.74 CCC(=O)CCCCCOC 1458a_100011935119_100000210202 [0,1,0,0,0,0|2,0,0]=3 4943 B10R0.74 CCC(=O)CCOCCOC 1458a_100000210414_100000695917 [0,1,0,0,0,0|1,0,0]=2 4944 B10R0.74 CCC(=O)CCOCCOC 1458a_100000745395_100000210202 [0,1,0,0,0,0|1,0,0]=2 4945 B10R0.74 CCC(=O)COCCCOC 34a_100000725409_100000740836 [0,1,0,0,0,0|3,0,0]=4 4946 B10R0.74 CCC(=O)CSCCCOC 62a_100000709357_100000747405 [0,1,0,0,0,0|3,0,0]=4 4947 B10R0.74 CCC(=O)CSCCCOC 62a_100000747405_100000709357 [0,1,0,0,0,0|3,0,0]=4 4948 B10R0.74 CCC(C)CCCCCOC 7a_200000035636_200000210301 [0,1,0,0,0,0|2,0,0]=3 4949 B10R0.74 CCC(C)CCCCCO[13CH3] 7a_200000035636_200025704644 [0,1,0,0,0,0|2,0,0]=3 4950 B10R0.74 CCC(C)CCNCCOC 2230a_100020591266_100011201679 [0,1,0,0,0,0|2,0,0]=3 4951 B10R0.74 CCC(C)CCNCCSC 2230a_100020591266_100000751147 [0,1,0,0,0,0|2,1,0]=4 4952 B10R0.74 CCC(C)CCOCCC#N 7a_100011215188_100000184422 [0,1,0,0,0,0|3,0,0]=4 4953 B10R0.74 CCC(C)CCOCCCF 7a_100011215188_100011934791 [0,1,0,0,0,0|3,0,0]=4 4954 B10R0.74 CCC(C)CCOCCCO 7a_100011215188_100011215043 [0,1,0,0,0,0|3,0,0]=4 4955 B10R0.74 CCC(C)CCOCCOC 7a_100011215188_100000233755 [0,1,0,0,0,0|1,0,0]=2 4956 B10R0.74 CCC(C)CCOCCSC 7a_100011215188_100000212216 [0,1,0,0,0,0|1,1,0]=3 4957 B10R0.74 CCC(C)CNCCCOC 2230a_100020588543_100000740836 [0,1,0,0,0,0|3,0,0]=4 4958 B10R0.74 CCC(C)CNCCCOC 270004a_100150723488_100000243153 [0,1,0,0,0,0|3,0,0]=4 4959 B10R0.74 CCC(C)CNCCCOC 34a_100150723488_100000748023 [0,1,0,0,0,0|3,0,0]=4 4960 B10R0.74 CCC(C)COCCCCBr 34a_100011216708_100000748023 [0,1,0,0,0,0|3,0,0]=4 4961 B10R0.74 CCC(C)COCCCCCl 34a_100000210776_100000748023 [0,1,0,0,0,0|3,0,0]=4 4962 B10R0.74 CCC(C)COCCCCCl 7a_100000210776_100000748023 [0,1,0,0,0,0|3,0,0]=4 4963 B10R0.74 CCC(C)COCCCCF 34a_100011995726_100000748023 [0,1,0,0,0,0|3,0,0]=4 4964 B10R0.74 CCC(C)COCCCCF 7a_100011995726_100000748023 [0,1,0,0,0,0|3,0,0]=4 4965 B10R0.74 CCC(C)COCCCCI 34a_200012148704_100000748023 [0,1,0,0,0,0|3,0,0]=4 4966 B10R0.74 CCC(C)COCCCCN 34a_100000750430_100000748023 [0,1,0,0,0,0|3,0,0]=4 4967 B10R0.74 CCC(C)COCCCNC 34a_100000213112_100000748023 [0,1,0,0,0,0|3,0,0]=4 4968 B10R0.74 CCC(C)COCCCOC 34a_100000740835_100000748023 [0,1,0,0,0,0|3,0,0]=4 4969 B10R0.74 CCC(C)COCCCSC 34a_100000690336_100000748023 [0,1,0,0,0,0|3,0,0]=4 4970 B10R0.74 CCC(C)COCCCSC 7a_100000690336_100000748023 [0,1,0,0,0,0|3,0,0]=4 4971 B10R0.74 CCC(C)CSCCCOC 62a_100000709357_100000748023 [0,1,0,0,0,0|3,0,0]=4 4972 B10R0.74 CCC(C)CSCCCOC 62a_100000748023_100000709357 [0,1,0,0,0,0|3,0,0]=4 4973 B10R0.74 CCC(C)NCCCCOC 2230a_100000209981_100000730899 [0,1,0,0,0,0|3,0,0]=4 4974 B10R0.74 CCC(C)NCOCCOC 2230a_100000209981_100000231047 [0,1,0,0,0,0|2,0,0]=3 4975 B10R0.74 CCC(C)OCCCCOC 34a_100000740925_100011215416 [0,1,0,0,0,0|3,0,0]=4 4976 B10R0.74 CCC(C)OCCCCOC 7a_100000210228_100000730899 [0,1,0,0,0,0|3,0,0]=4 4977 B10R0.74 CCC(C)SCCCCOC 62a_100000730899_100000758301 [0,1,0,0,0,0|3,0,0]=4 4978 B10R0.74 CCC(C)SCCCCOC 62a_100000758301_100000730899 [0,1,0,0,0,0|3,0,0]=4 4979 B10R0.74 CCC(C)SCOCCOC 62a_100000231047_100000758301 [0,1,0,0,0,0|2,0,0]=3 4980 B10R0.74 CCC(C)SCOCCOC 62a_100000758301_100000231047 [0,1,0,0,0,0|2,0,0]=3 4981 B10R0.74 CCC(O)CNCCCOC 2230a_100011218483_100000740836 [0,1,0,0,0,0|3,0,0]=4 4982 B10R0.74 CCC(O)CNCCCOC 34a_100150723488_100011218378 [0,1,0,0,0,0|3,0,0]=4 4983 B10R0.74 CCC(O)COCCCCBr 34a_100011216708_100011218378 [0,1,0,0,0,0|3,0,0]=4 4984 B10R0.74 CCC(O)COCCCCCl 34a_100000210776_100011218378 [0,1,0,0,0,0|3,0,0]=4 4985 B10R0.74 CCC(O)COCCCCCl 7a_100000210776_100011218378 [0,1,0,0,0,0|3,0,0]=4 4986 B10R0.74 CCC(O)COCCCCF 34a_100011995726_100011218378 [0,1,0,0,0,0|3,0,0]=4 4987 B10R0.74 CCC(O)COCCCCF 7a_100011995726_100011218378 [0,1,0,0,0,0|3,0,0]=4 4988 B10R0.74 CCC(O)COCCCCI 34a_200012148704_100011218378 [0,1,0,0,0,0|3,0,0]=4 4989 B10R0.74 CCC(O)COCCCCN 34a_100000750430_100011218378 [0,1,0,0,0,0|3,0,0]=4 4990 B10R0.74 CCC(O)COCCCNC 34a_100000213112_100011218378 [0,1,0,0,0,0|3,0,0]=4 4991 B10R0.74 CCC(O)COCCCOC 34a_100000740835_100011218378 [0,1,0,0,0,0|3,0,0]=4 4992 B10R0.74 CCC(O)COCCCSC 34a_100000690336_100011218378 [0,1,0,0,0,0|3,0,0]=4 4993 B10R0.74 CCC(O)COCCCSC 7a_100000690336_100011218378 [0,1,0,0,0,0|3,0,0]=4 4994 B10R0.74 CCC(O)CSCCCOC 62a_100000709357_100011218378 [0,1,0,0,0,0|3,0,0]=4 4995 B10R0.74 CCC(O)CSCCCOC 62a_100011218378_100000709357 [0,1,0,0,0,0|3,0,0]=4 4996 B10R0.74 CCCCCCCC(=O)CC 1458a_100000210414_100000210614 [0,1,0,0,0,0|3,0,0]=4 4997 B10R0.74 CCCCCCCC(=O)CC 1458a_100000211969_100000210202 [0,1,0,0,0,0|3,0,0]=4 4998 B10R0.74 CCCCCCCC(C)NC 2230a_106832991635_200011218727 [0,1,0,0,0,0|3,0,0]=4 4999 B10R0.74 CCCCCCCC(C)NC 270004a_106832991635_100000210596 [0,1,0,0,0,0|3,0,0]=4 5000 B10R0.74 CCCCCCCC(C)NC 34a_100102657272_200011218727 [0,1,0,0,0,0|3,0,0]=4 5001 B10R0.74 CCCCCCCC(C)NC 7a_106832991635_200011218727 [0,1,0,0,0,0|3,0,0]=4 5002 B10R0.74 CCCCCCCC(C)OC 34a_100138415774_200011218727 [0,1,0,0,0,0|2,0,0]=3 5003 B10R0.74 CCCCCCCC(C)OC 34a_200011215852_200000210301 [0,1,0,0,0,0|2,0,0]=3 5004 B10R0.74 CCCCCCCC(C)OC 7a_200011215852_200000210301 [0,1,0,0,0,0|2,0,0]=3 5005 B10R0.74 CCCCCCCC(C)O[13CH3] 34a_200011215852_200025704644 [0,1,0,0,0,0|2,0,0]=3 5006 B10R0.74 CCCCCCCC(C)O[13CH3] 7a_200011215852_200025704644 [0,1,0,0,0,0|2,0,0]=3 5007 B10R0.74 CCCCCCCC(C)SC 62a_200000210301_200011218727 [0,1,0,0,0,0|2,1,0]=4 5008 B10R0.74 CCCCCCCC(C)SC 62a_200011218727_200000210301 [0,1,0,0,0,0|2,1,0]=4 5009 B10R0.74 CCCCCCCC(C)S[13CH3] 62a_200011218727_200025704644 [0,1,0,0,0,0|2,1,0]=4 5010 B10R0.74 CCCCCCCC(C)S[13CH3] 62a_200025704644_200011218727 [0,1,0,0,0,0|2,1,0]=4 5011 B10R0.74 CCCCCCCN(C)CC 2230a_100000225621_100000210681 [0,1,0,0,0,0|3,0,0]=4 5012 B10R0.74 CCCCCCCN(C)CC 2230a_100000228206_100000210202 [0,1,0,0,0,0|3,0,0]=4 5013 B10R0.74 CCCCCCCN(C)CC 2230a_100000228213_200000210301 [0,1,0,0,0,0|3,0,0]=4 5014 B10R0.74 CCCCCCCN(C)CC 269982a_100000225621_100000210681 [0,1,0,0,0,0|3,0,0]=4 5015 B10R0.74 CCCCCCCN(C)CC 269982a_100000228206_100000204670 [0,1,0,0,0,0|3,0,0]=4 5016 B10R0.74 CCCCCCCN(C)CC 269982a_100000228213_200000210301 [0,1,0,0,0,0|3,0,0]=4 5017 B10R0.74 CCCCCCCN([13CH3])CC 2230a_100000228213_200025704644 [0,1,0,0,0,0|3,0,0]=4 5018 B10R0.74 CCCCCCCN([13CH3])CC 269982a_100000228213_200025704644 [0,1,0,0,0,0|3,0,0]=4 5019 B10R0.74 CCCCCCSC(C)OC 62a_100000210314_100009879195 [0,1,0,0,0,0|3,0,0]=4 5020 B10R0.74 CCCCCCSC(C)OC 62a_100009879195_100000210757 [0,1,0,0,0,0|3,0,0]=4 5021 B10R0.74 CCCCCNCC(=O)OC 2230a_100000209983_100000747449 [0,1,0,0,0,0|2,0,1]=4 5022 B10R0.74 CCCCCNCC(C)CC 2230a_100000209983_100000748023 [0,1,0,0,0,0|3,0,0]=4 5023 B10R0.74 CCCCCNCC(C)CC 2230a_100020588543_100000210326 [0,1,0,0,0,0|3,0,0]=4 5024 B10R0.74 CCCCCNCC(C)CC 270004a_100000209983_100000243153 [0,1,0,0,0,0|3,0,0]=4 5025 B10R0.74 CCCCCNCC(O)CC 2230a_100000209983_100011218378 [0,1,0,0,0,0|3,0,0]=4 5026 B10R0.74 CCCCCNCC(O)CC 2230a_100011218483_100000210326 [0,1,0,0,0,0|3,0,0]=4 5027 B10R0.74 CCCCCNC[C@@H](C)CC 2230a_100000209983_100009816398 [0,1,0,0,0,0|3,0,0]=4 5028 B10R0.74 CCCCCNC[C@@H](C)OC 2230a_100020591295_100000210326 [0,1,0,0,0,0|2,0,0]=3 5029 B10R0.74 CCCCCOCC(=O)CC 34a_100000725409_100000718602 [0,1,0,0,0,0|2,0,1]=4 5030 B10R0.74 CCCCCOCC(=O)CC 7a_100000210253_100000747405 [0,1,0,0,0,0|2,0,1]=4 5031 B10R0.74 CCCCCOCC(=O)NC 34a_100000210253_100000183359 [0,1,0,0,0,0|2,0,1]=4 5032 B10R0.74 CCCCCOCC(=O)NC 34a_100000750040_100000718602 [0,1,0,0,0,0|2,0,1]=4 5033 B10R0.74 CCCCCOCC(=O)NC 7a_100000210253_100000183359 [0,1,0,0,0,0|2,0,1]=4 5034 B10R0.74 CCCCCOCC(=O)OC 34a_100000210253_100000747449 [0,1,0,0,0,0|1,0,1]=3 5035 B10R0.74 CCCCCOCC(=O)OC 7a_100000210253_100000747449 [0,1,0,0,0,0|1,0,1]=3 5036 B10R0.74 CCCCCOCC(C)CC 34a_100000210253_100000748023 [0,1,0,0,0,0|2,0,0]=3 5037 B10R0.74 CCCCCOCC(C)CC 7a_100000210253_100000748023 [0,1,0,0,0,0|2,0,0]=3 5038 B10R0.74 CCCCCOCC(C)CN 34a_100000744482_100000718602 [0,1,0,0,0,0|3,0,0]=4 5039 B10R0.74 CCCCCOCC(C)OC 34a_100000690652_100000718602 [0,1,0,0,0,0|1,0,0]=2 5040 B10R0.74 CCCCCOCC(Cl)CCl 34a_100000033668_100000718602 [0,1,0,0,0,0|3,0,0]=4 5041 B10R0.74 CCCCCOCC(O)CC 34a_100000210253_100011218378 [0,1,0,0,0,0|2,0,0]=3 5042 B10R0.74 CCCCCOCC(O)CC 7a_100000210253_100011218378 [0,1,0,0,0,0|2,0,0]=3 5043 B10R0.74 CCCCCOCC(O)CO 34a_100000210253_100011219619 [0,1,0,0,0,0|3,0,0]=4 5044 B10R0.74 CCCCCOCC(O)CO 7a_100000210253_100011219619 [0,1,0,0,0,0|3,0,0]=4 5045 B10R0.74 CCCCCOC[C@@H](C)CC 34a_100000210253_100009816398 [0,1,0,0,0,0|2,0,0]=3 5046 B10R0.74 CCCCCOC[C@@H](C)CC 7a_100000210253_100009816398 [0,1,0,0,0,0|2,0,0]=3 5047 B10R0.74 CCCCCOC[C@@H](C)CC 7a_100009816381_100000210326 [0,1,0,0,0,0|2,0,0]=3 5048 B10R0.74 CCCCCOC[C@@H](C)CO 34a_100000210253_100000059175 [0,1,0,0,0,0|3,0,0]=4 5049 B10R0.74 CCCCCOC[C@@H](C)CO 7a_100000210253_100000059175 [0,1,0,0,0,0|3,0,0]=4 5050 B10R0.74 CCCCCOC[C@@H](O)CF 34a_100000210253_100015614560 [0,1,0,0,0,0|3,0,0]=4 5051 B10R0.74 CCCCCOC[C@@H](O)CF 7a_100000210253_100015614560 [0,1,0,0,0,0|3,0,0]=4 5052 B10R0.74 CCCCCOC[C@@H](O)CO 34a_100000210253_100009815848 [0,1,0,0,0,0|3,0,0]=4 5053 B10R0.74 CCCCCOC[C@@H](O)CO 7a_100000210253_100009815848 [0,1,0,0,0,0|3,0,0]=4 5054 B10R0.74 CCCCCOC[C@H](F)CN 34a_100015665980_100000718602 [0,1,0,0,0,0|3,0,0]=4 5055 B10R0.74 CCCCCSCC(=O)OC 62a_100000210326_100000747449 [0,1,0,0,0,0|1,1,1]=4 5056 B10R0.74 CCCCCSCC(=O)OC 62a_100000747449_100000210326 [0,1,0,0,0,0|1,1,1]=4 5057 B10R0.74 CCCCCSCC(C)CC 62a_100000210326_100000748023 [0,1,0,0,0,0|2,1,0]=4 5058 B10R0.74 CCCCCSCC(C)CC 62a_100000748023_100000210326 [0,1,0,0,0,0|2,1,0]=4 5059 B10R0.74 CCCCCSCC(O)CC 62a_100000210326_100011218378 [0,1,0,0,0,0|2,1,0]=4 5060 B10R0.74 CCCCCSCC(O)CC 62a_100011218378_100000210326 [0,1,0,0,0,0|2,1,0]=4 5061 B10R0.74 CCCCCSC[C@@H](C)CC 62a_100000210326_100009816398 [0,1,0,0,0,0|2,1,0]=4 5062 B10R0.74 CCCCCSC[C@@H](C)CC 62a_100009816398_100000210326 [0,1,0,0,0,0|2,1,0]=4 5063 B10R0.74 CCCCNCCC(C)CC 2230a_100020591266_100000210211 [0,1,0,0,0,0|3,0,0]=4 5064 B10R0.74 CCCCOCCC(=O)CC 1458a_100000210414_100000743108 [0,1,0,0,0,0|2,0,0]=3 5065 B10R0.74 CCCCOCCC(=O)CO 1458a_100000210174_100000743108 [0,1,0,0,0,0|3,0,0]=4 5066 B10R0.74 CCCCOCCC(=O)NC 34a_100000210227_100012179268 [0,1,0,0,0,0|3,0,0]=4 5067 B10R0.74 CCCCOCCC(=O)NC 34a_100000754576_100000210210 [0,1,0,0,0,0|3,0,0]=4 5068 B10R0.74 CCCCOCCC(=O)NC 7a_100000210227_100000737683 [0,1,0,0,0,0|3,0,0]=4 5069 B10R0.74 CCCCOCCC(=O)OC 34a_100000210227_100000742370 [0,1,0,0,0,0|3,0,0]=4 5070 B10R0.74 CCCCOCCC(=O)OC 7a_100000210227_100000204255 [0,1,0,0,0,0|3,0,0]=4 5071 B10R0.74 CCCCOCCC(C)CC 7a_100011215188_100000210211 [0,1,0,0,0,0|2,0,0]=3 5072 B10R0.74 CCCCOCCC(C)OC 7a_100000764861_100000210211 [0,1,0,0,0,0|3,0,0]=4 5073 B10R0.74 CCCCOCCN(C)CC 2230a_100000225621_100000743108 [0,1,0,0,0,0|2,0,0]=3 5074 B10R0.74 CCCCOCCN(C)CC 269982a_100000225621_100000743108 [0,1,0,0,0,0|2,0,0]=3 5075 B10R0.74 CCCCOCNC(C)CC 2230a_100000209981_100011995733 [0,1,0,0,0,0|3,0,0]=4 5076 B10R0.74 CCCCOCSC(C)CC 62a_100000758301_100011995733 [0,1,0,0,0,0|3,0,0]=4 5077 B10R0.74 CCCCOCSC(C)CC 62a_100011995733_100000758301 [0,1,0,0,0,0|3,0,0]=4 5078 B10R0.74 CCN(C)CCCSCOC 62a_100000766300_100015186262 [0,1,0,0,0,0|3,0,0]=4 5079 B10R0.74 CCN(C)CCOCCOC 2230a_100000225621_100000695917 [0,1,0,0,0,0|1,0,0]=2 5080 B10R0.74 CCN(C)CCOCCOC 269982a_100000225621_100000695917 [0,1,0,0,0,0|1,0,0]=2 5081 B10R0.74 CCNCCCCC(=O)OC 2230a_100015525214_100000204269 [0,1,0,0,0,0|2,0,1]=4 5082 B10R0.74 CCNCCOCC(=O)OC 2230a_100015525214_100000090808 [0,1,0,0,0,0|1,0,1]=3 5083 B10R0.74 CCOCCCCC(=O)OC 34a_100000059025_100000210202 [0,1,0,0,0,0|1,0,1]=3 5084 B10R0.74 CCOCCCCC(=O)OC 34a_100121572206_100000204269 [0,1,0,0,0,0|1,0,1]=3 5085 B10R0.74 CCOCCCCC(=O)OC 7a_100000059025_100000210202 [0,1,0,0,0,0|1,0,1]=3 5086 B10R0.74 CCOCCCNC(C)CC 2230a_100000209981_100012232248 [0,1,0,0,0,0|3,0,0]=4 5087 B10R0.74 CCOCCCNC(C)CC 2230a_100000210961_100000758301 [0,1,0,0,0,0|3,0,0]=4 5088 B10R0.74 CCOCCCNC(C)CC 34a_100000210961_100011215416 [0,1,0,0,0,0|3,0,0]=4 5089 B10R0.74 CCOCCCOC(C)CC 34a_100000757476_100011215416 [0,1,0,0,0,0|3,0,0]=4 5090 B10R0.74 CCOCCCOC(C)CC 7a_100000210228_100012232248 [0,1,0,0,0,0|3,0,0]=4 5091 B10R0.74 CCOCCCOC(C)CC 7a_100000757476_100000758301 [0,1,0,0,0,0|3,0,0]=4 5092 B10R0.74 CCOCCCSC(C)CC 62a_100000758301_100012232248 [0,1,0,0,0,0|3,0,0]=4 5093 B10R0.74 CCOCCCSC(C)CC 62a_100012232248_100000758301 [0,1,0,0,0,0|3,0,0]=4 5094 B10R0.74 CCOCCCSC(C)OC 62a_100009879195_100012232248 [0,1,0,0,0,0|2,0,0]=3 5095 B10R0.74 CCOCCCSC(C)OC 62a_100012232248_100009879195 [0,1,0,0,0,0|2,0,0]=3 5096 B10R0.74 CCOCCNCC(=O)NC 2230a_100000693194_100011215890 [0,1,0,0,0,0|2,0,1]=4 5097 B10R0.74 CCOCCNCC(=O)NC 2230a_102516460346_100000183359 [0,1,0,0,0,0|2,0,1]=4 5098 B10R0.74 CCOCCNCC(=O)NC 34a_102516460346_100000183359 [0,1,0,0,0,0|2,0,1]=4 5099 B10R0.74 CCOCCNCC(=O)OC 2230a_102516460346_100000747449 [0,1,0,0,0,0|1,0,1]=3 5100 B10R0.74 CCOCCNCC(=O)OC 34a_102516460346_100000747449 [0,1,0,0,0,0|1,0,1]=3 5101 B10R0.74 CCOCCNCC(C)CC 2230a_100020588543_100011215890 [0,1,0,0,0,0|2,0,0]=3 5102 B10R0.74 CCOCCNCC(C)CC 2230a_102516460346_100000748023 [0,1,0,0,0,0|2,0,0]=3 5103 B10R0.74 CCOCCNCC(C)CC 270004a_102516460346_100000243153 [0,1,0,0,0,0|2,0,0]=3 5104 B10R0.74 CCOCCNCC(C)CC 34a_102516460346_100000748023 [0,1,0,0,0,0|2,0,0]=3 5105 B10R0.74 CCOCCNCC(C)CO 34a_100000744482_100000210147 [0,1,0,0,0,0|3,0,0]=4 5106 B10R0.74 CCOCCNCC(O)CC 2230a_100011218483_100011215890 [0,1,0,0,0,0|2,0,0]=3 5107 B10R0.74 CCOCCNCC(O)CC 2230a_102516460346_100011218378 [0,1,0,0,0,0|2,0,0]=3 5108 B10R0.74 CCOCCNCC(O)CC 34a_102516460346_100011218378 [0,1,0,0,0,0|2,0,0]=3 5109 B10R0.74 CCOCCNCC(O)CO 2230a_102516460346_100011219619 [0,1,0,0,0,0|3,0,0]=4 5110 B10R0.74 CCOCCNCC(O)CO 34a_102516460346_100011219619 [0,1,0,0,0,0|3,0,0]=4 5111 B10R0.74 CCOCCNC[C@@H](C)CC 2230a_102516460346_100009816398 [0,1,0,0,0,0|2,0,0]=3 5112 B10R0.74 CCOCCNC[C@@H](C)CC 34a_102516460346_100009816398 [0,1,0,0,0,0|2,0,0]=3 5113 B10R0.74 CCOCCNC[C@@H](C)CO 2230a_102516460346_100000059175 [0,1,0,0,0,0|3,0,0]=4 5114 B10R0.74 CCOCCNC[C@@H](C)CO 34a_102516460346_100000059175 [0,1,0,0,0,0|3,0,0]=4 5115 B10R0.74 CCOCCNC[C@@H](C)OC 2230a_100020591295_100011215890 [0,1,0,0,0,0|1,0,0]=2 5116 B10R0.74 CCOCCNC[C@@H](F)CO 34a_100015665980_100000210147 [0,1,0,0,0,0|3,0,0]=4 5117 B10R0.74 CCOCCNC[C@@H](O)CF 2230a_102516460346_100015614560 [0,1,0,0,0,0|3,0,0]=4 5118 B10R0.74 CCOCCNC[C@@H](O)CF 34a_102516460346_100015614560 [0,1,0,0,0,0|3,0,0]=4 5119 B10R0.74 CCOCCNC[C@@H](O)CO 2230a_102516460346_100009815848 [0,1,0,0,0,0|3,0,0]=4 5120 B10R0.74 CCOCCNC[C@@H](O)CO 34a_102516460346_100009815848 [0,1,0,0,0,0|3,0,0]=4 5121 B10R0.74 CCOCCNC[C@H](O)CO 2230a_100020644852_100011215890 [0,1,0,0,0,0|3,0,0]=4 5122 B10R0.74 CCOCCOCC(=O)CC 34a_100000725409_100000210147 [0,1,0,0,0,0|1,0,1]=3 5123 B10R0.74 CCOCCOCC(=O)CC 7a_100000210136_100000747405 [0,1,0,0,0,0|1,0,1]=3 5124 B10R0.74 CCOCCOCC(=O)NC 34a_100000210136_100000183359 [0,1,0,0,0,0|1,0,1]=3 5125 B10R0.74 CCOCCOCC(=O)NC 34a_100000750040_100000210147 [0,1,0,0,0,0|1,0,1]=3 5126 B10R0.74 CCOCCOCC(=O)NC 7a_100000210136_100000183359 [0,1,0,0,0,0|1,0,1]=3 5127 B10R0.74 CCOCCOCC(=O)OC 34a_100000210136_100000747449 [0,1,0,0,0,0|0,0,1]=2 5128 B10R0.74 CCOCCOCC(=O)OC 34a_100121572206_100000090808 [0,1,0,0,0,0|0,0,1]=2 5129 B10R0.74 CCOCCOCC(=O)OC 7a_100000210136_100000747449 [0,1,0,0,0,0|0,0,1]=2 5130 B10R0.74 CCOCCOCC(C)CC 34a_100000210136_100000748023 [0,1,0,0,0,0|1,0,0]=2 5131 B10R0.74 CCOCCOCC(C)CC 7a_100000210136_100000748023 [0,1,0,0,0,0|1,0,0]=2 5132 B10R0.74 CCOCCOCC(C)CN 34a_100000744482_100000210147 [0,1,0,0,0,0|2,0,0]=3 5133 B10R0.74 CCOCCOCC(C)OC 34a_100000690652_100000210147 [0,1,0,0,0,0|0,0,0]=1 5134 B10R0.74 CCOCCOCC(Cl)CCl 34a_100000033668_100000210147 [0,1,0,0,0,0|2,0,0]=3 5135 B10R0.74 CCOCCOCC(O)CC 34a_100000210136_100011218378 [0,1,0,0,0,0|1,0,0]=2 5136 B10R0.74 CCOCCOCC(O)CC 7a_100000210136_100011218378 [0,1,0,0,0,0|1,0,0]=2 5137 B10R0.74 CCOCCOCC(O)CO 34a_100000210136_100011219619 [0,1,0,0,0,0|2,0,0]=3 5138 B10R0.74 CCOCCOCC(O)CO 7a_100000210136_100011219619 [0,1,0,0,0,0|2,0,0]=3 5139 B10R0.74 CCOCCOC[C@@H](C)CC 34a_100000210136_100009816398 [0,1,0,0,0,0|1,0,0]=2 5140 B10R0.74 CCOCCOC[C@@H](C)CC 7a_100000210136_100009816398 [0,1,0,0,0,0|1,0,0]=2 5141 B10R0.74 CCOCCOC[C@@H](C)CC 7a_100009816381_100011215890 [0,1,0,0,0,0|1,0,0]=2 5142 B10R0.74 CCOCCOC[C@@H](C)CO 34a_100000210136_100000059175 [0,1,0,0,0,0|2,0,0]=3 5143 B10R0.74 CCOCCOC[C@@H](C)CO 7a_100000210136_100000059175 [0,1,0,0,0,0|2,0,0]=3 5144 B10R0.74 CCOCCOC[C@@H](O)CF 34a_100000210136_100015614560 [0,1,0,0,0,0|2,0,0]=3 5145 B10R0.74 CCOCCOC[C@@H](O)CF 7a_100000210136_100015614560 [0,1,0,0,0,0|2,0,0]=3 5146 B10R0.74 CCOCCOC[C@@H](O)CO 34a_100000210136_100009815848 [0,1,0,0,0,0|2,0,0]=3 5147 B10R0.74 CCOCCOC[C@@H](O)CO 7a_100000210136_100009815848 [0,1,0,0,0,0|2,0,0]=3 5148 B10R0.74 CCOCCOC[C@H](F)CN 34a_100015665980_100000210147 [0,1,0,0,0,0|2,0,0]=3 5149 B10R0.74 CCOCCSCC(=O)CC 62a_100000210147_100000747405 [0,1,0,0,0,0|1,1,1]=4 5150 B10R0.74 CCOCCSCC(=O)CC 62a_100000747405_100011215890 [0,1,0,0,0,0|1,1,1]=4 5151 B10R0.74 CCOCCSCC(=O)NC 62a_100000183359_100011215890 [0,1,0,0,0,0|1,1,1]=4 5152 B10R0.74 CCOCCSCC(=O)NC 62a_100000210147_100000183359 [0,1,0,0,0,0|1,1,1]=4 5153 B10R0.74 CCOCCSCC(=O)OC 62a_100000210147_100000747449 [0,1,0,0,0,0|0,1,1]=3 5154 B10R0.74 CCOCCSCC(=O)OC 62a_100000747449_100011215890 [0,1,0,0,0,0|0,1,1]=3 5155 B10R0.74 CCOCCSCC(C)CC 62a_100000210147_100000748023 [0,1,0,0,0,0|1,1,0]=3 5156 B10R0.74 CCOCCSCC(C)CC 62a_100000748023_100011215890 [0,1,0,0,0,0|1,1,0]=3 5157 B10R0.74 CCOCCSCC(O)CC 62a_100000210147_100011218378 [0,1,0,0,0,0|1,1,0]=3 5158 B10R0.74 CCOCCSCC(O)CC 62a_100011218378_100011215890 [0,1,0,0,0,0|1,1,0]=3 5159 B10R0.74 CCOCCSCC(O)CO 62a_100000210147_100011219619 [0,1,0,0,0,0|2,1,0]=4 5160 B10R0.74 CCOCCSCC(O)CO 62a_100011219619_100011215890 [0,1,0,0,0,0|2,1,0]=4 5161 B10R0.74 CCOCCSC[C@@H](C)CC 62a_100000210147_100009816398 [0,1,0,0,0,0|1,1,0]=3 5162 B10R0.74 CCOCCSC[C@@H](C)CC 62a_100009816398_100011215890 [0,1,0,0,0,0|1,1,0]=3 5163 B10R0.74 CCOCCSC[C@@H](C)CO 62a_100000059175_100011215890 [0,1,0,0,0,0|2,1,0]=4 5164 B10R0.74 CCOCCSC[C@@H](C)CO 62a_100000210147_100000059175 [0,1,0,0,0,0|2,1,0]=4 5165 B10R0.74 CCOCCSC[C@@H](O)CF 62a_100000210147_100015614560 [0,1,0,0,0,0|2,1,0]=4 5166 B10R0.74 CCOCCSC[C@@H](O)CF 62a_100015614560_100011215890 [0,1,0,0,0,0|2,1,0]=4 5167 B10R0.74 CCOCCSC[C@@H](O)CO 62a_100000210147_100009815848 [0,1,0,0,0,0|2,1,0]=4 5168 B10R0.74 CCOCCSC[C@@H](O)CO 62a_100009815848_100011215890 [0,1,0,0,0,0|2,1,0]=4 5169 B10R0.74 CCOCSCCC(=O)OC 62a_100000204255_100000739092 [0,1,0,0,0,0|2,0,1]=4 5170 B10R0.74 CCOCSCCC(=O)OC 62a_100000739092_100000204255 [0,1,0,0,0,0|2,0,1]=4 5171 B10R0.74 CCSCCCCC(=O)OC 62a_100000204269_100000210202 [0,1,0,0,0,0|1,1,1]=4 5172 B10R0.74 CCSCCCCC(=O)OC 62a_100000210202_100000204269 [0,1,0,0,0,0|1,1,1]=4 5173 B10R0.74 CCSCCNCC(=O)OC 2230a_100000106463_100000747449 [0,1,0,0,0,0|1,1,1]=4 5174 B10R0.74 CCSCCNCC(C)CC 2230a_100000106463_100000748023 [0,1,0,0,0,0|2,1,0]=4 5175 B10R0.74 CCSCCNCC(C)CC 2230a_100020588543_100000757381 [0,1,0,0,0,0|2,1,0]=4 5176 B10R0.74 CCSCCNCC(C)CC 270004a_100000106463_100000243153 [0,1,0,0,0,0|2,1,0]=4 5177 B10R0.74 CCSCCNCC(O)CC 2230a_100000106463_100011218378 [0,1,0,0,0,0|2,1,0]=4 5178 B10R0.74 CCSCCNCC(O)CC 2230a_100011218483_100000757381 [0,1,0,0,0,0|2,1,0]=4 5179 B10R0.74 CCSCCNC[C@@H](C)CC 2230a_100000106463_100009816398 [0,1,0,0,0,0|2,1,0]=4 5180 B10R0.74 CCSCCNC[C@@H](C)OC 2230a_100020591295_100000757381 [0,1,0,0,0,0|1,1,0]=3 5181 B10R0.74 CCSCCOCC(=O)CC 34a_100000725409_100000757381 [0,1,0,0,0,0|1,1,1]=4 5182 B10R0.74 CCSCCOCC(=O)CC 7a_100000212035_100000747405 [0,1,0,0,0,0|1,1,1]=4 5183 B10R0.74 CCSCCOCC(=O)NC 34a_100000212035_100000183359 [0,1,0,0,0,0|1,1,1]=4 5184 B10R0.74 CCSCCOCC(=O)NC 34a_100000750040_100000757381 [0,1,0,0,0,0|1,1,1]=4 5185 B10R0.74 CCSCCOCC(=O)NC 7a_100000212035_100000183359 [0,1,0,0,0,0|1,1,1]=4 5186 B10R0.74 CCSCCOCC(=O)OC 34a_100000212035_100000747449 [0,1,0,0,0,0|0,1,1]=3 5187 B10R0.74 CCSCCOCC(=O)OC 62a_100000090808_100000210202 [0,1,0,0,0,0|0,1,1]=3 5188 B10R0.74 CCSCCOCC(=O)OC 62a_100000210202_100000090808 [0,1,0,0,0,0|0,1,1]=3 5189 B10R0.74 CCSCCOCC(=O)OC 7a_100000212035_100000747449 [0,1,0,0,0,0|0,1,1]=3 5190 B10R0.74 CCSCCOCC(C)CC 34a_100000212035_100000748023 [0,1,0,0,0,0|1,1,0]=3 5191 B10R0.74 CCSCCOCC(C)CC 7a_100000212035_100000748023 [0,1,0,0,0,0|1,1,0]=3 5192 B10R0.74 CCSCCOCC(C)CN 34a_100000744482_100000757381 [0,1,0,0,0,0|2,1,0]=4 5193 B10R0.74 CCSCCOCC(C)OC 34a_100000690652_100000757381 [0,1,0,0,0,0|0,1,0]=2 5194 B10R0.74 CCSCCOCC(Cl)CCl 34a_100000033668_100000757381 [0,1,0,0,0,0|2,1,0]=4 5195 B10R0.74 CCSCCOCC(O)CC 34a_100000212035_100011218378 [0,1,0,0,0,0|1,1,0]=3 5196 B10R0.74 CCSCCOCC(O)CC 7a_100000212035_100011218378 [0,1,0,0,0,0|1,1,0]=3 5197 B10R0.74 CCSCCOCC(O)CO 34a_100000212035_100011219619 [0,1,0,0,0,0|2,1,0]=4 5198 B10R0.74 CCSCCOCC(O)CO 7a_100000212035_100011219619 [0,1,0,0,0,0|2,1,0]=4 5199 B10R0.74 CCSCCOC[C@@H](C)CC 34a_100000212035_100009816398 [0,1,0,0,0,0|1,1,0]=3 5200 B10R0.74 CCSCCOC[C@@H](C)CC 7a_100000212035_100009816398 [0,1,0,0,0,0|1,1,0]=3 5201 B10R0.74 CCSCCOC[C@@H](C)CC 7a_100009816381_100000757381 [0,1,0,0,0,0|1,1,0]=3 5202 B10R0.74 CCSCCOC[C@@H](C)CO 34a_100000212035_100000059175 [0,1,0,0,0,0|2,1,0]=4 5203 B10R0.74 CCSCCOC[C@@H](C)CO 7a_100000212035_100000059175 [0,1,0,0,0,0|2,1,0]=4 5204 B10R0.74 CCSCCOC[C@@H](O)CF 34a_100000212035_100015614560 [0,1,0,0,0,0|2,1,0]=4 5205 B10R0.74 CCSCCOC[C@@H](O)CF 7a_100000212035_100015614560 [0,1,0,0,0,0|2,1,0]=4 5206 B10R0.74 CCSCCOC[C@@H](O)CO 34a_100000212035_100009815848 [0,1,0,0,0,0|2,1,0]=4 5207 B10R0.74 CCSCCOC[C@@H](O)CO 7a_100000212035_100009815848 [0,1,0,0,0,0|2,1,0]=4 5208 B10R0.74 CCSCCOC[C@H](F)CN 34a_100015665980_100000757381 [0,1,0,0,0,0|2,1,0]=4 5209 B10R0.74 CCSCCSCC(=O)OC 62a_100000747449_100000757381 [0,1,0,0,0,0|0,2,1]=4 5210 B10R0.74 CCSCCSCC(=O)OC 62a_100000757381_100000747449 [0,1,0,0,0,0|0,2,1]=4 5211 B10R0.74 CCSCCSCC(C)CC 62a_100000748023_100000757381 [0,1,0,0,0,0|1,2,0]=4 5212 B10R0.74 CCSCCSCC(C)CC 62a_100000757381_100000748023 [0,1,0,0,0,0|1,2,0]=4 5213 B10R0.74 CCSCCSCC(O)CC 62a_100000757381_100011218378 [0,1,0,0,0,0|1,2,0]=4 5214 B10R0.74 CCSCCSCC(O)CC 62a_100011218378_100000757381 [0,1,0,0,0,0|1,2,0]=4 5215 B10R0.74 CCSCCSC[C@@H](C)CC 62a_100000757381_100009816398 [0,1,0,0,0,0|1,2,0]=4 5216 B10R0.74 CCSCCSC[C@@H](C)CC 62a_100009816398_100000757381 [0,1,0,0,0,0|1,2,0]=4 5217 B10R0.74 CC[C@H](C)CNCCCOC 34a_100150723488_100009816398 [0,1,0,0,0,0|3,0,0]=4 5218 B10R0.74 CC[C@H](C)COCCCCBr 34a_100011216708_100009816398 [0,1,0,0,0,0|3,0,0]=4 5219 B10R0.74 CC[C@H](C)COCCCCCl 34a_100000210776_100009816398 [0,1,0,0,0,0|3,0,0]=4 5220 B10R0.74 CC[C@H](C)COCCCCCl 7a_100000210776_100009816398 [0,1,0,0,0,0|3,0,0]=4 5221 B10R0.74 CC[C@H](C)COCCCCF 34a_100011995726_100009816398 [0,1,0,0,0,0|3,0,0]=4 5222 B10R0.74 CC[C@H](C)COCCCCF 7a_100009816381_100000729493 [0,1,0,0,0,0|3,0,0]=4 5223 B10R0.74 CC[C@H](C)COCCCCF 7a_100011995726_100009816398 [0,1,0,0,0,0|3,0,0]=4 5224 B10R0.74 CC[C@H](C)COCCCCI 34a_200012148704_100009816398 [0,1,0,0,0,0|3,0,0]=4 5225 B10R0.74 CC[C@H](C)COCCCCN 34a_100000750430_100009816398 [0,1,0,0,0,0|3,0,0]=4 5226 B10R0.74 CC[C@H](C)COCCCCO 7a_100009816381_100000210776 [0,1,0,0,0,0|3,0,0]=4 5227 B10R0.74 CC[C@H](C)COCCCNC 34a_100000213112_100009816398 [0,1,0,0,0,0|3,0,0]=4 5228 B10R0.74 CC[C@H](C)COCCCOC 34a_100000740835_100009816398 [0,1,0,0,0,0|3,0,0]=4 5229 B10R0.74 CC[C@H](C)COCCCOC 7a_100009816381_100000740836 [0,1,0,0,0,0|3,0,0]=4 5230 B10R0.74 CC[C@H](C)COCCCSC 34a_100000690336_100009816398 [0,1,0,0,0,0|3,0,0]=4 5231 B10R0.74 CC[C@H](C)COCCCSC 7a_100000690336_100009816398 [0,1,0,0,0,0|3,0,0]=4 5232 B10R0.74 CC[C@H](C)CSCCCOC 62a_100000709357_100009816398 [0,1,0,0,0,0|3,0,0]=4 5233 B10R0.74 CC[C@H](C)CSCCCOC 62a_100009816398_100000709357 [0,1,0,0,0,0|3,0,0]=4 5234 B10R0.74 CNC(=O)CCCCCOC 11a_106832991635_100011935119 [0,1,0,0,0,0|3,0,0]=4 5235 B10R0.74 CNC(=O)CCCCCOC 1626a_100102657272_100011935119 [0,1,0,0,0,0|3,0,0]=4 5236 B10R0.74 CNC(=O)CCCCCOC 240690a_100102657272_100011935119 [0,1,0,0,0,0|3,0,0]=4 5237 B10R0.74 CNC(=O)CCCCCOC 527a_100102657272_100011935119 [0,1,0,0,0,0|3,0,0]=4 5238 B10R0.74 CNC(=O)CCNCCOC 2230a_100000209980_100000737683 [0,1,0,0,0,0|3,0,0]=4 5239 B10R0.74 CNC(=O)CCNCCOC 2230a_100000738227_100011201679 [0,1,0,0,0,0|3,0,0]=4 5240 B10R0.74 CNC(=O)CCNCCOC 34a_100000738227_100011201679 [0,1,0,0,0,0|3,0,0]=4 5241 B10R0.74 CNC(=O)CCOCCOC 11a_106832991635_100000745395 [0,1,0,0,0,0|2,0,0]=3 5242 B10R0.74 CNC(=O)CCOCCOC 1626a_100102657272_100000745395 [0,1,0,0,0,0|2,0,0]=3 5243 B10R0.74 CNC(=O)CCOCCOC 240690a_100102657272_100000745395 [0,1,0,0,0,0|2,0,0]=3 5244 B10R0.74 CNC(=O)CCOCCOC 34a_100000210237_100012179268 [0,1,0,0,0,0|2,0,0]=3 5245 B10R0.74 CNC(=O)CCOCCOC 34a_100000754576_100011201679 [0,1,0,0,0,0|2,0,0]=3 5246 B10R0.74 CNC(=O)CCOCCOC 527a_100102657272_100000745395 [0,1,0,0,0,0|2,0,0]=3 5247 B10R0.74 CNC(=O)CCOCCON 34a_100000700252_100012179268 [0,1,0,0,0,0|3,0,0]=4 5248 B10R0.74 CNC(=O)CCOCCSC 34a_100000230434_100012179268 [0,1,0,0,0,0|2,1,0]=4 5249 B10R0.74 CNC(=O)CCOCCSC 34a_100000754576_100000212216 [0,1,0,0,0,0|2,1,0]=4 5250 B10R0.74 CNC(=O)CCOCCSC 7a_100000230434_100000737683 [0,1,0,0,0,0|2,1,0]=4 5251 B10R0.74 CNC(=O)CCSCCOC 62a_100000233755_100000737683 [0,1,0,0,0,0|2,1,0]=4 5252 B10R0.74 CNC(=O)CCSCCOC 62a_100000737683_100000233755 [0,1,0,0,0,0|2,1,0]=4 5253 B10R0.74 CNCCCOCC(=O)OC 34a_100000213112_100000747449 [0,1,0,0,0,0|2,0,1]=4 5254 B10R0.74 COC(=O)CCCCCO[13CH3] 34a_100000074720_200025704644 [0,1,0,0,0,0|3,0,0]=4 5255 B10R0.74 COC(=O)CCCCCO[13CH3] 7a_100000074720_200025704644 [0,1,0,0,0,0|3,0,0]=4 5256 B10R0.74 COC(=O)CCCCOCF 34a_100000059025_100015361967 [0,1,0,0,0,0|2,0,1]=4 5257 B10R0.74 COC(=O)CCCCOCF 7a_100000059025_100015361967 [0,1,0,0,0,0|2,0,1]=4 5258 B10R0.74 COC(=O)CCOCCON 34a_100000700252_100000742370 [0,1,0,0,0,0|3,0,0]=4 5259 B10R0.74 COC(=O)CCOCCSC 34a_100000230434_100000742370 [0,1,0,0,0,0|2,1,0]=4 5260 B10R0.74 COC(=O)CCOCCSC 7a_100000230434_100000204255 [0,1,0,0,0,0|2,1,0]=4 5261 B10R0.74 COC(=O)COCCCCBr 34a_100011216708_100000747449 [0,1,0,0,0,0|2,0,1]=4 5262 B10R0.74 COC(=O)COCCCCCl 34a_100000210776_100000747449 [0,1,0,0,0,0|2,0,1]=4 5263 B10R0.74 COC(=O)COCCCCCl 7a_100000210776_100000747449 [0,1,0,0,0,0|2,0,1]=4 5264 B10R0.74 COC(=O)COCCCCF 34a_100011995726_100000747449 [0,1,0,0,0,0|2,0,1]=4 5265 B10R0.74 COC(=O)COCCCCF 7a_100011995726_100000747449 [0,1,0,0,0,0|2,0,1]=4 5266 B10R0.74 COC(=O)COCCCCI 34a_200012148704_100000747449 [0,1,0,0,0,0|2,0,1]=4 5267 B10R0.74 COC(=O)COCCCCN 34a_100000750430_100000747449 [0,1,0,0,0,0|2,0,1]=4 5268 B10R0.74 COC(=O)COCCCSC 34a_100000690336_100000747449 [0,1,0,0,0,0|2,0,1]=4 5269 B10R0.74 COC(=O)COCCCSC 7a_100000690336_100000747449 [0,1,0,0,0,0|2,0,1]=4 5270 B10R0.74 COC(=O)COCCSCF 62a_100000090808_100015361967 [0,1,0,0,0,0|1,1,1]=4 5271 B10R0.74 COC(=O)COCCSCF 62a_100015361967_100000090808 [0,1,0,0,0,0|1,1,1]=4 5272 B10R0.74 COC(C)CCOCCSC 7a_100000764861_100000212216 [0,1,0,0,0,0|2,1,0]=4 5273 B10R0.74 COC(C)COCC#CCO 34a_100000690652_200000047223 [0,1,0,0,0,0|2,0,1]=4 5274 B10R0.74 COC(C)COCCCCF 34a_100000690652_100000729493 [0,1,0,0,0,0|2,0,0]=3 5275 B10R0.74 COC(C)COCCCCO 34a_100000690652_100011216708 [0,1,0,0,0,0|2,0,0]=3 5276 B10R0.74 COCCCCCC(=O)CF 1458a_100011935119_100015361967 [0,1,0,0,0,0|3,0,0]=4 5277 B10R0.74 COCCCCCC(=O)OC 34a_100000074720_200000210301 [0,1,0,0,0,0|3,0,0]=4 5278 B10R0.74 COCCCCCC(=O)OC 34a_100138415774_100009816466 [0,1,0,0,0,0|3,0,0]=4 5279 B10R0.74 COCCCCCC(=O)OC 7a_100000074720_200000210301 [0,1,0,0,0,0|3,0,0]=4 5280 B10R0.74 COCCCNC[C@@H](C)OC 2230a_100020591295_100000740836 [0,1,0,0,0,0|3,0,0]=4 5281 B10R0.74 COCCCOCC(=O)OC 34a_100000740835_100000747449 [0,1,0,0,0,0|2,0,1]=4 5282 B10R0.74 COCCCOCC(C)OC 34a_100000690652_100000740836 [0,1,0,0,0,0|2,0,0]=3 5283 B10R0.74 COCCNCCC(=O)OC 2230a_100000209980_100000204255 [0,1,0,0,0,0|3,0,0]=4 5284 B10R0.74 COCCNCCC(C)CO 2230a_106354213184_100011201679 [0,1,0,0,0,0|3,0,0]=4 5285 B10R0.74 COCCNCCC(C)CO 34a_106354213184_100011201679 [0,1,0,0,0,0|3,0,0]=4 5286 B10R0.74 COCCOCCC(=NO)N 34a_100000749954_100011201679 [0,1,0,0,0,0|3,0,0]=4 5287 B10R0.74 COCCOCCC(=O)CF 1458a_100000745395_100015361967 [0,1,0,0,0,0|2,0,0]=3 5288 B10R0.74 COCCOCCC(=O)CO 1458a_100000210174_100000695917 [0,1,0,0,0,0|2,0,0]=3 5289 B10R0.74 COCCOCCC(=O)OC 34a_100000210237_100000742370 [0,1,0,0,0,0|2,0,0]=3 5290 B10R0.74 COCCOCCC(C)OC 7a_100000764861_100000233755 [0,1,0,0,0,0|2,0,0]=3 5291 B10R0.74 COCCOCN[C@H](C)CO 2230a_100000737577_100000231047 [0,1,0,0,0,0|3,0,0]=4 5292 B10R0.74 COCCOCSC(C)CO 62a_100012180447_100000231047 [0,1,0,0,0,0|3,0,0]=4 5293 B10R0.74 COCCOCSC(C)OC 62a_100000231047_100009879195 [0,1,0,0,0,0|3,0,0]=4 5294 B10R0.74 COCCOCSC(C)OC 62a_100009879195_100000231047 [0,1,0,0,0,0|3,0,0]=4 5295 B10R0.74 COCCOCS[C@H](C)CO 62a_100000231047_100016084084 [0,1,0,0,0,0|3,0,0]=4 5296 B10R0.74 COCCOCS[C@H](C)CO 62a_100016084084_100000231047 [0,1,0,0,0,0|3,0,0]=4 5297 B10R0.74 COCCSCCC(=O)OC 62a_100000204255_100000233755 [0,1,0,0,0,0|2,1,0]=4 5298 B10R0.74 COCCSCCC(=O)OC 62a_100000233755_100000204255 [0,1,0,0,0,0|2,1,0]=4 5299 B10R0.74 CO[C@H](C)CNCCCCF 2230a_100020591295_100000729493 [0,1,0,0,0,0|3,0,0]=4 5300 B10R0.74 CO[C@H](C)CNCCCCO 2230a_100020591295_100000210776 [0,1,0,0,0,0|3,0,0]=4 5301 B10R0.91 C#CCCC(=O)CCOCC 1458a_100000692101_100011215890 [0,1,0,0,0,0|2,0,1]=4 5302 B10R0.91 C#CCCC(=O)CCOCC 1458a_100000749530_100000753159 [0,1,0,0,0,0|2,0,1]=4 5303 B10R0.91 C#CCCC(=O)CCOCC 34a_100011064465_100000210202 [0,1,0,0,0,0|2,0,1]=4 5304 B10R0.91 C#CCCC(=O)CCOCC 7a_100011064465_100000210202 [0,1,0,0,0,0|2,0,1]=4 5305 B10R0.91 C#CCCOC(C)CCCC 34a_100000687866_100000688953 [0,1,0,0,0,0|2,0,1]=4 5306 B10R0.91 C#CCCOC(C)CCCC 34a_100011215631_200011215066 [0,1,0,0,0,0|2,0,1]=4 5307 B10R0.91 C#CCCOC(C)CCCC 7a_100000687866_100000688953 [0,1,0,0,0,0|2,0,1]=4 5308 B10R0.91 C#CCCOC(C)COCC 34a_100000718985_100000688953 [0,1,0,0,0,0|1,0,1]=3 5309 B10R0.91 C#CCCOC(C)COCC 7a_100000718985_100000688953 [0,1,0,0,0,0|1,0,1]=3 5310 B10R0.91 C/C=C/CC(=O)CCOCC 1458a_100000749530_100102629194 [0,1,0,0,0,0|2,0,1]=4 5311 B10R0.91 C/C=C/COC(C)CCCC 34a_100000687866_100102629194 [0,1,0,0,0,0|2,0,1]=4 5312 B10R0.91 C/C=C/COC(C)CCCC 34a_100016270725_200011215066 [0,1,0,0,0,0|2,0,1]=4 5313 B10R0.91 C/C=C/COC(C)CCCC 7a_100000687866_100102629194 [0,1,0,0,0,0|2,0,1]=4 5314 B10R0.91 C/C=C/COC(C)COCC 34a_100000718985_100102629194 [0,1,0,0,0,0|1,0,1]=3 5315 B10R0.91 C/C=C/COC(C)COCC 7a_100000718985_100102629194 [0,1,0,0,0,0|1,0,1]=3 5316 B10R0.91 C=CCCC(=O)CCOCC 1458a_100000749530_100000754431 [0,1,0,0,0,0|2,0,1]=4 5317 B10R0.91 C=CCCC(=O)CCOCC 1458a_100000749702_100011215890 [0,1,0,0,0,0|2,0,1]=4 5318 B10R0.91 C=CCCC(C)OCCOC 34a_100000765329_100011201679 [0,1,0,0,0,0|1,0,2]=4 5319 B10R0.91 C=CCCC(C)OCCOC 7a_100000765329_100000233755 [0,1,0,0,0,0|1,0,2]=4 5320 B10R0.91 C=CCCN(C)CCOCC 2230a_100020639649_100011215890 [0,1,0,0,0,0|2,0,1]=4 5321 B10R0.91 C=CCCN(C)CCOCC 269982a_100020639649_100011215890 [0,1,0,0,0,0|2,0,1]=4 5322 B10R0.91 C=CCCOC(C)CCCC 34a_100000687866_100000754431 [0,1,0,0,0,0|2,0,1]=4 5323 B10R0.91 C=CCCOC(C)CCCC 34a_100011205117_200011215066 [0,1,0,0,0,0|2,0,1]=4 5324 B10R0.91 C=CCCOC(C)CCCC 7a_100000687866_100000754431 [0,1,0,0,0,0|2,0,1]=4 5325 B10R0.91 C=CCCOC(C)COCC 34a_100000718985_100000754431 [0,1,0,0,0,0|1,0,1]=3 5326 B10R0.91 C=CCCOC(C)COCC 7a_100000718985_100000754431 [0,1,0,0,0,0|1,0,1]=3 5327 B10R0.91 C=COCCC(=O)CCOC 1458a_100000749529_100000039644 [0,1,0,0,0,0|1,0,2]=4 5328 B10R0.91 C=COCCN(C)CCOC 2230a_100000743101_100000039644 [0,1,0,0,0,0|1,0,2]=4 5329 B10R0.91 C=COCCN(C)CCOC 269982a_100000743101_100000039644 [0,1,0,0,0,0|1,0,2]=4 5330 B10R0.91 CC#CCC(=O)CCOCC 1458a_100000749530_100000748600 [0,1,0,0,0,0|2,0,1]=4 5331 B10R0.91 CC#CCOC(C)CCCC 34a_100000687866_100000748600 [0,1,0,0,0,0|2,0,1]=4 5332 B10R0.91 CC#CCOC(C)CCCC 34a_100000761923_200011215066 [0,1,0,0,0,0|2,0,1]=4 5333 B10R0.91 CC#CCOC(C)CCCC 7a_100000687866_100000748600 [0,1,0,0,0,0|2,0,1]=4 5334 B10R0.91 CC#CCOC(C)COCC 34a_100000718985_100000748600 [0,1,0,0,0,0|1,0,1]=3 5335 B10R0.91 CC#CCOC(C)COCC 7a_100000718985_100000748600 [0,1,0,0,0,0|1,0,1]=3 5336 B10R0.91 CC/C=C/CC(=O)CCOC 1458a_100016274230_100000233755 [0,1,0,0,0,0|2,0,1]=4 5337 B10R0.91 CC/C=C\CC(=O)CCOC 1458a_100000749529_100103147603 [0,1,0,0,0,0|2,0,1]=4 5338 B10R0.91 CC/C=C\CN(C)CCOC 2230a_100000743101_100103147603 [0,1,0,0,0,0|2,0,1]=4 5339 B10R0.91 CC/C=C\CN(C)CCOC 269982a_100000743101_100103147603 [0,1,0,0,0,0|2,0,1]=4 5340 B10R0.91 CC=CCC(=O)CCOCC 1458a_100000749530_100000070051 [0,1,0,0,0,0|2,0,1]=4 5341 B10R0.91 CC=CCC(=O)CCOCC 1458a_100121576822_100011215890 [0,1,0,0,0,0|2,0,1]=4 5342 B10R0.91 CC=CCOC(C)CCCC 34a_100000687866_100000070051 [0,1,0,0,0,0|2,0,1]=4 5343 B10R0.91 CC=CCOC(C)CCCC 7a_100000687866_100000070051 [0,1,0,0,0,0|2,0,1]=4 5344 B10R0.91 CC=CCOC(C)COCC 34a_100000718985_100000070051 [0,1,0,0,0,0|1,0,1]=3 5345 B10R0.91 CC=CCOC(C)COCC 7a_100000718985_100000070051 [0,1,0,0,0,0|1,0,1]=3 5346 B10R0.91 CCC#CC(C)OCCCC 34a_100000033903_100000210210 [0,1,0,0,0,0|2,0,1]=4 5347 B10R0.91 CCC#CC(C)OCCCC 7a_100000033903_100000210211 [0,1,0,0,0,0|2,0,1]=4 5348 B10R0.91 CCC#CC(C)OCCOC 34a_100000033903_100011201679 [0,1,0,0,0,0|1,0,1]=3 5349 B10R0.91 CCC#CC(C)OCCOC 7a_100000033903_100000233755 [0,1,0,0,0,0|1,0,1]=3 5350 B10R0.91 CCC#CC(C)OCCSC 34a_100000033903_100000212216 [0,1,0,0,0,0|1,1,1]=4 5351 B10R0.91 CCC#CC(C)OCCSC 7a_100000033903_100000212216 [0,1,0,0,0,0|1,1,1]=4 5352 B10R0.91 CCC#CCC(=O)CCOC 1458a_100000749529_100009813939 [0,1,0,0,0,0|2,0,1]=4 5353 B10R0.91 CCC#CCN(C)CCOC 2230a_100000743101_100009813939 [0,1,0,0,0,0|2,0,1]=4 5354 B10R0.91 CCCCC(=O)CCCOC 1458a_100000210183_100000740836 [0,1,0,0,0,0|2,0,1]=4 5355 B10R0.91 CCCCC(=O)CCCOC 1458a_100000741012_100000210211 [0,1,0,0,0,0|2,0,1]=4 5356 B10R0.91 CCCCC(=O)CCOCC 1458a_100000210183_100011215890 [0,1,0,0,0,0|2,0,0]=3 5357 B10R0.91 CCCCC(=O)CCOCC 1458a_100000749530_100000210211 [0,1,0,0,0,0|2,0,0]=3 5358 B10R0.91 CCCCC(=O)CCSCC 1458a_100000210183_100000757381 [0,1,0,0,0,0|2,1,0]=4 5359 B10R0.91 CCCCC(=O)CCSCC 1458a_100000230768_100000210211 [0,1,0,0,0,0|2,1,0]=4 5360 B10R0.91 CCCCC(=O)NCCOC 1626a_100000209980_100000210183 [0,1,0,0,0,0|2,0,1]=4 5361 B10R0.91 CCCCC(=O)NCCOC 240690a_100000209980_100000210183 [0,1,0,0,0,0|2,0,1]=4 5362 B10R0.91 CCCCC(=O)NCCOC 527a_100000209980_100000210183 [0,1,0,0,0,0|2,0,1]=4 5363 B10R0.91 CCCCC(C)NCCOC 2230a_100000126638_100011201679 [0,1,0,0,0,0|2,0,0]=3 5364 B10R0.91 CCCCC(C)NCCOC 2230a_100000209980_200011215066 [0,1,0,0,0,0|2,0,0]=3 5365 B10R0.91 CCCCC(C)NCCOC 270004a_100000209980_100000210087 [0,1,0,0,0,0|2,0,0]=3 5366 B10R0.91 CCCCC(C)NCCSC 2230a_100000126638_100000751147 [0,1,0,0,0,0|2,1,0]=4 5367 B10R0.91 CCCCC(C)NCCSC 2230a_100020590264_200011215066 [0,1,0,0,0,0|2,1,0]=4 5368 B10R0.91 CCCCC(C)NCCSC 270004a_100020590264_100000210087 [0,1,0,0,0,0|2,1,0]=4 5369 B10R0.91 CCCCC(C)OCCC#N 7a_100000687866_100000184422 [0,1,0,0,0,0|3,0,0]=4 5370 B10R0.91 CCCCC(C)OCCCBr 34a_100011217188_200011215066 [0,1,0,0,0,0|3,0,0]=4 5371 B10R0.91 CCCCC(C)OCCCCl 34a_100000230001_200011215066 [0,1,0,0,0,0|3,0,0]=4 5372 B10R0.91 CCCCC(C)OCCCF 34a_100000687866_100011934791 [0,1,0,0,0,0|3,0,0]=4 5373 B10R0.91 CCCCC(C)OCCCF 34a_100000759539_200011215066 [0,1,0,0,0,0|3,0,0]=4 5374 B10R0.91 CCCCC(C)OCCCF 7a_100000687866_100011934791 [0,1,0,0,0,0|3,0,0]=4 5375 B10R0.91 CCCCC(C)OCCCN 34a_100000182051_200011215066 [0,1,0,0,0,0|3,0,0]=4 5376 B10R0.91 CCCCC(C)OCCCO 34a_100000687866_100000230001 [0,1,0,0,0,0|3,0,0]=4 5377 B10R0.91 CCCCC(C)OCCCO 7a_100000687866_100011215043 [0,1,0,0,0,0|3,0,0]=4 5378 B10R0.91 CCCCC(C)OCCOC 34a_100000210237_200011215066 [0,1,0,0,0,0|1,0,0]=2 5379 B10R0.91 CCCCC(C)OCCOC 34a_100000687866_100011201679 [0,1,0,0,0,0|1,0,0]=2 5380 B10R0.91 CCCCC(C)OCCOC 7a_100000687866_100000233755 [0,1,0,0,0,0|1,0,0]=2 5381 B10R0.91 CCCCC(C)OCCON 34a_100000700252_200011215066 [0,1,0,0,0,0|2,0,0]=3 5382 B10R0.91 CCCCC(C)OCCSC 34a_100000230434_200011215066 [0,1,0,0,0,0|1,1,0]=3 5383 B10R0.91 CCCCC(C)OCCSC 34a_100000687866_100000212216 [0,1,0,0,0,0|1,1,0]=3 5384 B10R0.91 CCCCC(C)OCCSC 7a_100000230434_200011215066 [0,1,0,0,0,0|1,1,0]=3 5385 B10R0.91 CCCCC(C)OCCSC 7a_100000687866_100000212216 [0,1,0,0,0,0|1,1,0]=3 5386 B10R0.91 CCCCC(C)SCCOC 62a_100000233755_200011215066 [0,1,0,0,0,0|1,1,0]=3 5387 B10R0.91 CCCCC(C)SCCOC 62a_200011215066_100000233755 [0,1,0,0,0,0|1,1,0]=3 5388 B10R0.91 CCCCC(C)SCCSC 62a_100000212216_200011215066 [0,1,0,0,0,0|1,2,0]=4 5389 B10R0.91 CCCCC(C)SCCSC 62a_200011215066_100000751147 [0,1,0,0,0,0|1,2,0]=4 5390 B10R0.91 CCCCC(C)SCOCC 62a_100000739092_200011215066 [0,1,0,0,0,0|3,0,0]=4 5391 B10R0.91 CCCCC(C)SCOCC 62a_200011215066_100000739092 [0,1,0,0,0,0|3,0,0]=4 5392 B10R0.91 CCCCCC(=O)CCCC 1458a_100000210183_100000210326 [0,1,0,0,0,0|3,0,0]=4 5393 B10R0.91 CCCCCC(=O)CCCC 1458a_100000212188_100000210211 [0,1,0,0,0,0|3,0,0]=4 5394 B10R0.91 CCCCCC(=O)CCOC 1458a_100000212188_100000233755 [0,1,0,0,0,0|2,0,0]=3 5395 B10R0.91 CCCCCC(=O)CCOC 1458a_100000749529_100000210326 [0,1,0,0,0,0|2,0,0]=3 5396 B10R0.91 CCCCCC(=O)CCSC 1458a_100000174002_100000210326 [0,1,0,0,0,0|2,1,0]=4 5397 B10R0.91 CCCCCC(=O)CCSC 1458a_100000212188_100000751147 [0,1,0,0,0,0|2,1,0]=4 5398 B10R0.91 CCCCCC(=O)COCC 1458a_100000211967_100000210326 [0,1,0,0,0,0|2,0,1]=4 5399 B10R0.91 CCCCCC(=O)COCC 34a_100121572206_200012276598 [0,1,0,0,0,0|2,0,1]=4 5400 B10R0.91 CCCCCC(C)NCOC 2230a_100000211957_100000766300 [0,1,0,0,0,0|3,0,0]=4 5401 B10R0.91 CCCCCC(C)SCOC 62a_100000766300_200011218191 [0,1,0,0,0,0|3,0,0]=4 5402 B10R0.91 CCCCCC(C)SCOC 62a_200011218191_100000766300 [0,1,0,0,0,0|3,0,0]=4 5403 B10R0.91 CCCCCN(C)CCCC 2230a_100000207549_100000210326 [0,1,0,0,0,0|3,0,0]=4 5404 B10R0.91 CCCCCN(C)CCCC 2230a_100000223495_100000210211 [0,1,0,0,0,0|3,0,0]=4 5405 B10R0.91 CCCCCN(C)CCCC 269982a_100000207549_100000210215 [0,1,0,0,0,0|3,0,0]=4 5406 B10R0.91 CCCCCN(C)CCCC 269982a_100000223495_100000210211 [0,1,0,0,0,0|3,0,0]=4 5407 B10R0.91 CCCCCN(C)CCOC 2230a_100000223495_100011201679 [0,1,0,0,0,0|2,0,0]=3 5408 B10R0.91 CCCCCN(C)CCOC 2230a_100000743101_100000210326 [0,1,0,0,0,0|2,0,0]=3 5409 B10R0.91 CCCCCN(C)CCOC 269982a_100000223495_100000233755 [0,1,0,0,0,0|2,0,0]=3 5410 B10R0.91 CCCCCN(C)CCOC 269982a_100000743101_100000210215 [0,1,0,0,0,0|2,0,0]=3 5411 B10R0.91 CCCCCN(C)CCSC 2230a_100000223495_100000751147 [0,1,0,0,0,0|2,1,0]=4 5412 B10R0.91 CCCCCN(C)CCSC 2230a_100000686725_100000210326 [0,1,0,0,0,0|2,1,0]=4 5413 B10R0.91 CCCCCN(C)CCSC 269982a_100000223495_100000212216 [0,1,0,0,0,0|2,1,0]=4 5414 B10R0.91 CCCCCN(C)CCSC 269982a_100000686725_100000210215 [0,1,0,0,0,0|2,1,0]=4 5415 B10R0.91 CCCCCN(C)COCC 269982a_100000223495_100000739092 [0,1,0,0,0,0|3,0,0]=4 5416 B10R0.91 CCCCN(C)CCCOC 2230a_100000207549_100000740836 [0,1,0,0,0,0|3,0,0]=4 5417 B10R0.91 CCCCN(C)CCCOC 2230a_100000224831_100000210211 [0,1,0,0,0,0|3,0,0]=4 5418 B10R0.91 CCCCN(C)CCCOC 269982a_100000207549_100000740836 [0,1,0,0,0,0|3,0,0]=4 5419 B10R0.91 CCCCN(C)CCCOC 269982a_100000224831_100000210211 [0,1,0,0,0,0|3,0,0]=4 5420 B10R0.91 CCCCN(C)CCOCC 2230a_100000207549_100011215890 [0,1,0,0,0,0|2,0,0]=3 5421 B10R0.91 CCCCN(C)CCOCC 269982a_100000207549_100011215890 [0,1,0,0,0,0|2,0,0]=3 5422 B10R0.91 CCCCN(C)CCSCC 2230a_100000207549_100000757381 [0,1,0,0,0,0|2,1,0]=4 5423 B10R0.91 CCCCN(C)CCSCC 269982a_100000207549_100000757381 [0,1,0,0,0,0|2,1,0]=4 5424 B10R0.91 CCCCNC(=O)CCOC 11a_100000102301_100000749529 [0,1,0,0,0,0|3,0,0]=4 5425 B10R0.91 CCCCNC(=O)CCOC 1626a_100000102301_100000749529 [0,1,0,0,0,0|3,0,0]=4 5426 B10R0.91 CCCCNC(=O)CCOC 240690a_100000102301_100000749529 [0,1,0,0,0,0|3,0,0]=4 5427 B10R0.91 CCCCNC(=O)CCOC 527a_100000102301_100000749529 [0,1,0,0,0,0|3,0,0]=4 5428 B10R0.91 CCCCNC(=O)COCC 11a_100000102301_100000211967 [0,1,0,0,0,0|2,0,1]=4 5429 B10R0.91 CCCCNC(=O)COCC 1626a_100000102301_100000211967 [0,1,0,0,0,0|2,0,1]=4 5430 B10R0.91 CCCCNC(=O)COCC 240690a_100000102301_100000211967 [0,1,0,0,0,0|2,0,1]=4 5431 B10R0.91 CCCCNC(=O)COCC 34a_100121572206_100000182744 [0,1,0,0,0,0|2,0,1]=4 5432 B10R0.91 CCCCNC(=O)COCC 527a_100000102301_100000211967 [0,1,0,0,0,0|2,0,1]=4 5433 B10R0.91 CCCCNC(C)CCCC 2230a_100000102301_200011215066 [0,1,0,0,0,0|3,0,0]=4 5434 B10R0.91 CCCCNC(C)CCCC 2230a_100000126638_100000210211 [0,1,0,0,0,0|3,0,0]=4 5435 B10R0.91 CCCCNC(C)CCCC 270004a_100000102301_100000210087 [0,1,0,0,0,0|3,0,0]=4 5436 B10R0.91 CCCCNC(C)CCCC 7a_106832991798_200011215066 [0,1,0,0,0,0|3,0,0]=4 5437 B10R0.91 CCCCNC(C)CCOC 270004a_100000102301_100000742357 [0,1,0,0,0,0|3,0,0]=4 5438 B10R0.91 CCCCNC(C)CSCC 270004a_100000102301_200011216171 [0,1,0,0,0,0|2,1,0]=4 5439 B10R0.91 CCCCOC(=O)CNCC 2230a_100015525214_100000211628 [0,1,0,0,0,0|2,0,1]=4 5440 B10R0.91 CCCCOC(=O)COCC 34a_100121572206_100000211628 [0,1,0,0,0,0|1,0,1]=3 5441 B10R0.91 CCCCOC(=O)CSCC 62a_100000210202_100000211628 [0,1,0,0,0,0|1,1,1]=4 5442 B10R0.91 CCCCOC(=O)CSCC 62a_100000211628_100000210202 [0,1,0,0,0,0|1,1,1]=4 5443 B10R0.91 CCCCOC(C)CCCC 34a_100000210227_200011215066 [0,1,0,0,0,0|2,0,0]=3 5444 B10R0.91 CCCCOC(C)CCCC 34a_100000687866_100000210210 [0,1,0,0,0,0|2,0,0]=3 5445 B10R0.91 CCCCOC(C)CCCC 7a_100000210227_200011215066 [0,1,0,0,0,0|2,0,0]=3 5446 B10R0.91 CCCCOC(C)CCCC 7a_100000687866_100000210211 [0,1,0,0,0,0|2,0,0]=3 5447 B10R0.91 CCCCOC(C)CCCCl 34a_200000718107_100000210210 [0,1,0,0,0,0|3,0,0]=4 5448 B10R0.91 CCCCOC(C)CCCCl 7a_200000718107_100000210211 [0,1,0,0,0,0|3,0,0]=4 5449 B10R0.91 CCCCOC(C)COCC 34a_100000718985_100000210210 [0,1,0,0,0,0|1,0,0]=2 5450 B10R0.91 CCCCOC(C)COCC 7a_100000718985_100000210211 [0,1,0,0,0,0|1,0,0]=2 5451 B10R0.91 CCCCSC(C)CCCC 62a_100000210211_200011215066 [0,1,0,0,0,0|2,1,0]=4 5452 B10R0.91 CCCCSC(C)CCCC 62a_200011215066_100000210210 [0,1,0,0,0,0|2,1,0]=4 5453 B10R0.91 CCCNC(=O)CCOCC 11a_100020643023_100000749530 [0,1,0,0,0,0|3,0,0]=4 5454 B10R0.91 CCCNC(=O)CCOCC 1626a_100020643023_100000749530 [0,1,0,0,0,0|3,0,0]=4 5455 B10R0.91 CCCNC(=O)CCOCC 240690a_100020643023_100000749530 [0,1,0,0,0,0|3,0,0]=4 5456 B10R0.91 CCCNC(=O)CCOCC 527a_100020643023_100000749530 [0,1,0,0,0,0|3,0,0]=4 5457 B10R0.91 CCCNC(C)CCOCC 270004a_100020643023_200011216536 [0,1,0,0,0,0|3,0,0]=4 5458 B10R0.91 CCCNCC(O)COCC 2230a_102515437182_100000210303 [0,1,0,0,0,0|3,0,0]=4 5459 B10R0.91 CCCNCC(O)COCC 34a_102515437182_100000210303 [0,1,0,0,0,0|3,0,0]=4 5460 B10R0.91 CCCOC(C)CCCOC 34a_200011539412_100000210303 [0,1,0,0,0,0|3,0,0]=4 5461 B10R0.91 CCCOC(C)CCCOC 7a_200011539412_100000210303 [0,1,0,0,0,0|3,0,0]=4 5462 B10R0.91 CCCOCC(=O)CCOC 1458a_100000745993_100000233755 [0,1,0,0,0,0|3,0,0]=4 5463 B10R0.91 CCCSCC(=O)CCOC 1458a_100000217233_100000233755 [0,1,0,0,0,0|3,0,0]=4 5464 B10R0.91 CCNCC(=O)NCCOC 2230a_100000754632_100000210202 [0,1,0,0,0,0|2,0,1]=4 5465 B10R0.91 CCNCC(=O)NCCOC 2230a_100015525214_100000183275 [0,1,0,0,0,0|2,0,1]=4 5466 B10R0.91 CCNCC(=O)OCCOC 2230a_100015525214_200000040189 [0,1,0,0,0,0|1,0,1]=3 5467 B10R0.91 CCOC=CC(=O)CCOC 1458a_100016266692_100000233755 [0,1,0,0,0,0|1,0,2]=4 5468 B10R0.91 CCOCC(=O)CCCOC 1458a_100000211967_100000740836 [0,1,0,0,0,0|1,0,1]=3 5469 B10R0.91 CCOCC(=O)NCCOC 1626a_100000209980_100000211967 [0,1,0,0,0,0|1,0,1]=3 5470 B10R0.91 CCOCC(=O)NCCOC 240690a_100000209980_100000211967 [0,1,0,0,0,0|1,0,1]=3 5471 B10R0.91 CCOCC(=O)NCCOC 34a_100121572206_100000183275 [0,1,0,0,0,0|1,0,1]=3 5472 B10R0.91 CCOCC(=O)NCCOC 527a_100000209980_100000211967 [0,1,0,0,0,0|1,0,1]=3 5473 B10R0.91 CCOCC(=O)NCCSC 11a_100020590264_100000211967 [0,1,0,0,0,0|1,1,1]=4 5474 B10R0.91 CCOCC(=O)NCCSC 1626a_100020590264_100000211967 [0,1,0,0,0,0|1,1,1]=4 5475 B10R0.91 CCOCC(=O)NCCSC 240690a_100020590264_100000211967 [0,1,0,0,0,0|1,1,1]=4 5476 B10R0.91 CCOCC(=O)NCCSC 527a_100020590264_100000211967 [0,1,0,0,0,0|1,1,1]=4 5477 B10R0.91 CCOCC(=O)OCCOC 34a_100121572206_200000040189 [0,1,0,0,0,0|0,0,1]=2 5478 B10R0.91 CCOCC(C)OCCC#N 7a_100000718985_100000184422 [0,1,0,0,0,0|2,0,0]=3 5479 B10R0.91 CCOCC(C)OCCCF 34a_100000718985_100011934791 [0,1,0,0,0,0|2,0,0]=3 5480 B10R0.91 CCOCC(C)OCCCF 7a_100000718985_100011934791 [0,1,0,0,0,0|2,0,0]=3 5481 B10R0.91 CCOCC(C)OCCCO 34a_100000718985_100000230001 [0,1,0,0,0,0|2,0,0]=3 5482 B10R0.91 CCOCC(C)OCCCO 7a_100000718985_100011215043 [0,1,0,0,0,0|2,0,0]=3 5483 B10R0.91 CCOCC(C)OCCOC 34a_100000718985_100011201679 [0,1,0,0,0,0|0,0,0]=1 5484 B10R0.91 CCOCC(C)OCCOC 7a_100000718985_100000233755 [0,1,0,0,0,0|0,0,0]=1 5485 B10R0.91 CCOCC(C)OCCSC 34a_100000718985_100000212216 [0,1,0,0,0,0|0,1,0]=2 5486 B10R0.91 CCOCC(C)OCCSC 7a_100000718985_100000212216 [0,1,0,0,0,0|0,1,0]=2 5487 B10R0.91 CCOCC(O)CNCOC 2230a_102515437182_100000766300 [0,1,0,0,0,0|2,0,0]=3 5488 B10R0.91 CCOCC(O)CNCSC 2230a_102515437182_100011218213 [0,1,0,0,0,0|2,1,0]=4 5489 B10R0.91 CCOCC(O)CNCSC 34a_102515437182_100011218213 [0,1,0,0,0,0|2,1,0]=4 5490 B10R0.91 CCOCCC(=O)C=COC 1458a_100016268678_100011215890 [0,1,0,0,0,0|1,0,2]=4 5491 B10R0.91 CCOCCC(=O)CCC#N 1458a_100000749530_100011215226 [0,1,0,0,0,0|3,0,0]=4 5492 B10R0.91 CCOCCC(=O)CCC#N 1458a_100011934036_100011215890 [0,1,0,0,0,0|3,0,0]=4 5493 B10R0.91 CCOCCC(=O)CCCF 1458a_100000749530_100011934791 [0,1,0,0,0,0|3,0,0]=4 5494 B10R0.91 CCOCCC(=O)CCCO 1458a_100000749530_100011215043 [0,1,0,0,0,0|3,0,0]=4 5495 B10R0.91 CCOCCC(=O)CCOC 1458a_100000749529_100011215890 [0,1,0,0,0,0|1,0,0]=2 5496 B10R0.91 CCOCCC(=O)CCOC 1458a_100000749530_100000233755 [0,1,0,0,0,0|1,0,0]=2 5497 B10R0.91 CCOCCC(=O)CCSC 1458a_100000174002_100011215890 [0,1,0,0,0,0|1,1,0]=3 5498 B10R0.91 CCOCCC(=O)CCSC 1458a_100000749530_100000751147 [0,1,0,0,0,0|1,1,0]=3 5499 B10R0.91 CCOCCC(=O)COCC 1458a_100000211967_100011215890 [0,1,0,0,0,0|3,0,0]=4 5500 B10R0.91 CCOCCC(=O)CSCC 1458a_100000230394_100011215890 [0,1,0,0,0,0|3,0,0]=4 5501 B10R0.91 CCOCCN(C)CCC#N 2230a_100000184479_100011215890 [0,1,0,0,0,0|3,0,0]=4 5502 B10R0.91 CCOCCN(C)CCCO 2230a_100000213112_100011215890 [0,1,0,0,0,0|3,0,0]=4 5503 B10R0.91 CCOCCN(C)CCCO 269982a_100000213112_100011215890 [0,1,0,0,0,0|3,0,0]=4 5504 B10R0.91 CCOCCN(C)CCOC 2230a_100000743101_100011215890 [0,1,0,0,0,0|1,0,0]=2 5505 B10R0.91 CCOCCN(C)CCOC 269982a_100000743101_100011215890 [0,1,0,0,0,0|1,0,0]=2 5506 B10R0.91 CCOCCN(C)CCSC 2230a_100000686725_100011215890 [0,1,0,0,0,0|1,1,0]=3 5507 B10R0.91 CCOCCN(C)CCSC 269982a_100000686725_100011215890 [0,1,0,0,0,0|1,1,0]=3 5508 B10R0.91 CCOCN(C)CCCOC 269982a_100000224831_100000739092 [0,1,0,0,0,0|2,0,0]=3 5509 B10R0.91 CCOC[C@@H](N)CCCCN 34a_100016993712_100000210202 [0,1,0,0,0,0|3,0,0]=4 5510 B10R0.91 CCSCC(=O)CCCOC 1458a_100000230394_100000740836 [0,1,0,0,0,0|1,1,1]=4 5511 B10R0.91 CCSCC(=O)NCCOC 1626a_100000209980_100000230394 [0,1,0,0,0,0|1,1,1]=4 5512 B10R0.91 CCSCC(=O)NCCOC 240690a_100000209980_100000230394 [0,1,0,0,0,0|1,1,1]=4 5513 B10R0.91 CCSCC(=O)NCCOC 527a_100000209980_100000230394 [0,1,0,0,0,0|1,1,1]=4 5514 B10R0.91 CCSCC(=O)NCCOC 62a_100000183275_100000210202 [0,1,0,0,0,0|1,1,1]=4 5515 B10R0.91 CCSCC(=O)NCCOC 62a_100000210202_100000183275 [0,1,0,0,0,0|1,1,1]=4 5516 B10R0.91 CCSCC(=O)OCCOC 62a_100000210202_200000040189 [0,1,0,0,0,0|0,1,1]=3 5517 B10R0.91 CCSCC(=O)OCCOC 62a_200000040189_100000210202 [0,1,0,0,0,0|0,1,1]=3 5518 B10R0.91 CCSCC(C)NCCOC 270004a_100000209980_200011216171 [0,1,0,0,0,0|1,1,0]=3 5519 B10R0.91 CCSCC(C)NCCSC 270004a_100020590264_200011216171 [0,1,0,0,0,0|1,2,0]=4 5520 B10R0.91 CCSCCC(=O)CCOC 1458a_100000230768_100000233755 [0,1,0,0,0,0|1,1,0]=3 5521 B10R0.91 CCSCCC(=O)CCOC 1458a_100000749529_100000757381 [0,1,0,0,0,0|1,1,0]=3 5522 B10R0.91 CCSCCC(=O)CCSC 1458a_100000174002_100000757381 [0,1,0,0,0,0|1,2,0]=4 5523 B10R0.91 CCSCCC(=O)CCSC 1458a_100000230768_100000751147 [0,1,0,0,0,0|1,2,0]=4 5524 B10R0.91 CCSCCN(C)CCOC 2230a_100000743101_100000757381 [0,1,0,0,0,0|1,1,0]=3 5525 B10R0.91 CCSCCN(C)CCOC 269982a_100000743101_100000757381 [0,1,0,0,0,0|1,1,0]=3 5526 B10R0.91 CCSCCN(C)CCSC 2230a_100000686725_100000757381 [0,1,0,0,0,0|1,2,0]=4 5527 B10R0.91 CCSCCN(C)CCSC 269982a_100000686725_100000757381 [0,1,0,0,0,0|1,2,0]=4 5528 B10R0.91 COCCC(=O)CCCCF 1458a_100000749529_100000729493 [0,1,0,0,0,0|3,0,0]=4 5529 B10R0.91 COCCC(=O)CCCCO 1458a_100000695505_100000233755 [0,1,0,0,0,0|3,0,0]=4 5530 B10R0.91 COCCC(=O)CCCCO 1458a_100000749529_100000210776 [0,1,0,0,0,0|3,0,0]=4 5531 B10R0.91 COCCC(=O)CCCSC 1458a_100000173376_100000233755 [0,1,0,0,0,0|3,0,0]=4 5532 B10R0.91 COCCCC(=O)CCOC 1458a_100000741012_100000233755 [0,1,0,0,0,0|3,0,0]=4 5533 B10R0.91 COCCCC(=O)CCOC 1458a_100000749529_100000740836 [0,1,0,0,0,0|3,0,0]=4 5534 B10R0.91 COCCCN(C)CCOC 2230a_100000224831_100011201679 [0,1,0,0,0,0|3,0,0]=4 5535 B10R0.91 COCCCN(C)CCOC 2230a_100000743101_100000740836 [0,1,0,0,0,0|3,0,0]=4 5536 B10R0.91 COCCCN(C)CCOC 269982a_100000224831_100000233755 [0,1,0,0,0,0|3,0,0]=4 5537 B10R0.91 COCCCN(C)CCOC 269982a_100000743101_100000740836 [0,1,0,0,0,0|3,0,0]=4 5538 B10R0.91 COCCN(C)CCCCF 2230a_100000743101_100000729493 [0,1,0,0,0,0|3,0,0]=4 5539 B10R0.91 COCCN(C)CCCCF 269982a_100000743101_100000729493 [0,1,0,0,0,0|3,0,0]=4 5540 B10R0.91 COCCN(C)CCCCO 2230a_100000717598_100011201679 [0,1,0,0,0,0|3,0,0]=4 5541 B10R0.91 COCCN(C)CCCCO 2230a_100000743101_100000210776 [0,1,0,0,0,0|3,0,0]=4 5542 B10R0.91 COCCN(C)CCCCO 269982a_100000717598_100000233755 [0,1,0,0,0,0|3,0,0]=4 5543 B10R0.91 COCCN(C)CCCCO 269982a_100000743101_100000210776 [0,1,0,0,0,0|3,0,0]=4 5544 B10R0.91 COCCNC(C)CCOC 270004a_100000209980_100000742357 [0,1,0,0,0,0|3,0,0]=4 5545 B10R0.91 COCCNC(C)CCSC 270004a_100000209980_100011217047 [0,1,0,0,0,0|3,0,0]=4 5546 B10R0.91 COCCOC(=O)CSCF 62a_100015361967_200000040189 [0,1,0,0,0,0|1,1,1]=4 5547 B10R0.91 COCCOC(=O)CSCF 62a_200000040189_100015361967 [0,1,0,0,0,0|1,1,1]=4 5548 B10R0.91 COCCOC(C)CCCCl 34a_200000718107_100011201679 [0,1,0,0,0,0|2,0,0]=3 5549 B10R0.91 COCCOC(C)CCCCl 7a_200000718107_100000233755 [0,1,0,0,0,0|2,0,0]=3 5550 B10R0.91 CSCCOC(C)CCCCl 34a_200000718107_100000212216 [0,1,0,0,0,0|2,1,0]=4 5551 B10R0.91 CSCCOC(C)CCCCl 7a_200000718107_100000212216 [0,1,0,0,0,0|2,1,0]=4 5552 B10R1.4 CC1CCCCC1OCF 34a_100000211207_100015361967 [0,0,0,1,0,0|3,0,0]=4 5553 B10R1.4 CC1CCCCC1OCF 7a_100000211207_100015361967 [0,0,0,1,0,0|3,0,0]=4 5554 B10R1.4 CC1CCNCC1OCF 34a_100000696640_100015361967 [0,0,0,1,0,0|3,0,0]=4 5555 B10R1.4 CCCC1CCCCN1C 2230a_100000701414_200000210301 [0,0,0,1,0,0|3,0,0]=4 5556 B10R1.4 CCCC1CCCCN1C 269982a_100000701414_200000210301 [0,0,0,1,0,0|3,0,0]=4 5557 B10R1.4 CCCC1CCCCN1C 34a_100000701414_200000210301 [0,0,0,1,0,0|3,0,0]=4 5558 B10R1.4 CCCC1CCCCN1[13CH3] 2230a_100000701414_200025704644 [0,0,0,1,0,0|3,0,0]=4 5559 B10R1.4 CCCC1CCCCN1[13CH3] 269982a_100000701414_200025704644 [0,0,0,1,0,0|3,0,0]=4 5560 B10R1.4 CCCC1CCCCN1[13CH3] 34a_100000701414_200025704644 [0,0,0,1,0,0|3,0,0]=4 5561 B10R1.4 CCCC1COCCN1C 2230a_102495339903_200000210301 [0,0,0,1,0,0|2,0,0]=3 5562 B10R1.4 CCCC1COCCN1C 269982a_102495339903_200000210301 [0,0,0,1,0,0|2,0,0]=3 5563 B10R1.4 CCCC1COCCN1C 34a_102495339903_200000210301 [0,0,0,1,0,0|2,0,0]=3 5564 B10R1.4 CCCC1COCCN1[13CH3] 2230a_102495339903_200025704644 [0,0,0,1,0,0|2,0,0]=3 5565 B10R1.4 CCCC1COCCN1[13CH3] 269982a_102495339903_200025704644 [0,0,0,1,0,0|2,0,0]=3 5566 B10R1.4 CCCC1COCCN1[13CH3] 34a_102495339903_200025704644 [0,0,0,1,0,0|2,0,0]=3 5567 B10R1.4 CCNC1CCCCC1C 2230a_100000211402_100000210202 [0,0,0,1,0,0|3,0,0]=4 5568 B10R1.4 CCNC1CCCCC1C 269862a_100015525214_100000210921 [0,0,0,1,0,0|3,0,0]=4 5569 B10R1.4 CCNC1CCCCC1C 270004a_100015525214_100000210921 [0,0,0,1,0,0|3,0,0]=4 5570 B10R1.4 CCNC1CCCCC1C 34a_100000211402_100000210202 [0,0,0,1,0,0|3,0,0]=4 5571 B10R1.4 CCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000210202 [0,0,0,1,0,0|3,0,0]=4 5572 B10R1.4 CCOC1CCCCC1=O 34a_100011214950_100000210202 [0,0,0,1,0,0|3,0,0]=4 5573 B10R1.4 CCOC1CCCCC1=O 34a_100121572206_100000754470 [0,0,0,1,0,0|3,0,0]=4 5574 B10R1.4 CCOC1CCCCC1C 34a_100000211207_100000210202 [0,0,0,1,0,0|2,0,0]=3 5575 B10R1.4 CCOC1CCCCC1C 7a_100000211207_100000210202 [0,0,0,1,0,0|2,0,0]=3 5576 B10R1.4 CCOC1CCCCC1Cl 34a_100000038908_100000210202 [0,0,0,1,0,0|3,0,0]=4 5577 B10R1.4 CCOC1CCCCC1Cl 7a_100000038908_100000210202 [0,0,0,1,0,0|3,0,0]=4 5578 B10R1.4 CCOC1CCCCC1F 34a_100121572206_100015423560 [0,0,0,1,0,0|3,0,0]=4 5579 B10R1.4 CCOC1CCCCC1O 34a_100121572206_100000038908 [0,0,0,1,0,0|3,0,0]=4 5580 B10R1.4 CCOC1CCNCC1C 34a_100011998114_100000210202 [0,0,0,1,0,0|3,0,0]=4 5581 B10R1.4 CCOC1CNCCC1C 34a_100000696640_100000210202 [0,0,0,1,0,0|2,0,0]=3 5582 B10R1.4 CCOC1COCCC1=O 34a_100121572206_100012180262 [0,0,0,1,0,0|2,0,0]=3 5583 B10R1.4 CCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000210202 [0,0,0,1,0,0|3,0,0]=4 5584 B10R1.4 CCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000210202 [0,0,0,1,0,0|3,0,0]=4 5585 B10R1.4 CCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000210202 [0,0,0,1,0,0|3,0,0]=4 5586 B10R1.4 CCO[C@H]1COCC[C@H]1N 34a_100016994285_100000210202 [0,0,0,1,0,0|2,0,0]=3 5587 B10R1.4 CCSC1COCCC1=O 62a_100000210202_100012180262 [0,0,0,1,0,0|2,1,0]=4 5588 B10R1.4 CCSC1COCCC1=O 62a_100012180262_100000210202 [0,0,0,1,0,0|2,1,0]=4 5589 B10R1.4 CN1CCCCC1CO[13CH3] 34a_100000225079_200025704644 [0,0,0,1,0,0|3,0,0]=4 5590 B10R1.4 CN1CCOCC1CO[13CH3] 34a_100013547906_200025704644 [0,0,0,1,0,0|3,0,0]=4 5591 B10R1.4 COCC1CCCCN1C 2230a_100015184032_200000210301 [0,0,0,1,0,0|3,0,0]=4 5592 B10R1.4 COCC1CCCCN1C 269982a_100015184032_200000210301 [0,0,0,1,0,0|3,0,0]=4 5593 B10R1.4 COCC1CCCCN1C 34a_100000225079_200000210301 [0,0,0,1,0,0|3,0,0]=4 5594 B10R1.4 COCC1CCCCN1C 34a_100015184032_200000210301 [0,0,0,1,0,0|3,0,0]=4 5595 B10R1.4 COCC1CCCCN1C 34a_100138415774_100015186950 [0,0,0,1,0,0|3,0,0]=4 5596 B10R1.4 COCC1CCCCN1[13CH3] 2230a_100015184032_200025704644 [0,0,0,1,0,0|3,0,0]=4 5597 B10R1.4 COCC1CCCCN1[13CH3] 269982a_100015184032_200025704644 [0,0,0,1,0,0|3,0,0]=4 5598 B10R1.4 COCC1CCCCN1[13CH3] 34a_100015184032_200025704644 [0,0,0,1,0,0|3,0,0]=4 5599 B10R1.4 COCC1COCCN1C 34a_100013547906_200000210301 [0,0,0,1,0,0|3,0,0]=4 5600 B10R1.4 COCN1CCCCC1C 2230a_100000211376_100000766300 [0,0,0,1,0,0|3,0,0]=4 5601 B10R1.4 COCN1CCCCC1C 269982a_100000211376_100000766300 [0,0,0,1,0,0|3,0,0]=4 5602 B10R1.4 COC[C@H]1COCCN1C 2230a_100016989928_200000210301 [0,0,0,1,0,0|3,0,0]=4 5603 B10R1.4 COC[C@H]1COCCN1C 269982a_100016989928_200000210301 [0,0,0,1,0,0|3,0,0]=4 5604 B10R1.4 COC[C@H]1COCCN1C 34a_100016989928_200000210301 [0,0,0,1,0,0|3,0,0]=4 5605 B10R1.4 COC[C@H]1COCCN1[13CH3] 2230a_100016989928_200025704644 [0,0,0,1,0,0|3,0,0]=4 5606 B10R1.4 COC[C@H]1COCCN1[13CH3] 269982a_100016989928_200025704644 [0,0,0,1,0,0|3,0,0]=4 5607 B10R1.4 COC[C@H]1COCCN1[13CH3] 34a_100016989928_200025704644 [0,0,0,1,0,0|3,0,0]=4 5608 B10R1.4 N[C@@H]1CCOC[C@@H]1OCF 34a_100016994285_100015361967 [0,0,0,1,0,0|3,0,0]=4 5609 B10R1.5 CCC1CCCN1COC 2230a_100000754278_100000766300 [0,0,0,1,0,0|3,0,0]=4 5610 B10R1.5 CCC1CCCN1COC 269982a_100000754278_100000766300 [0,0,0,1,0,0|3,0,0]=4 5611 B10R1.5 CCCC1CCCC1NC 269862a_106832991636_100000723119 [0,0,0,1,0,0|3,0,0]=4 5612 B10R1.5 CCCC1CCCC1NC 270004a_106832991635_100000723119 [0,0,0,1,0,0|3,0,0]=4 5613 B10R1.5 CCN1CCCC1CNC 2230a_100000211693_200000210301 [0,0,0,1,0,0|3,0,0]=4 5614 B10R1.5 CCN1CCCC1CN[13CH3] 2230a_100000211693_200025704644 [0,0,0,1,0,0|3,0,0]=4 5615 B10R1.5 CCN1CCC[C@@H]1COC 34a_100011739246_200000210301 [0,0,0,1,0,0|2,0,0]=3 5616 B10R1.5 CCN1CCC[C@@H]1COC 7a_100011739246_200000210301 [0,0,0,1,0,0|2,0,0]=3 5617 B10R1.5 CCN1CCC[C@@H]1CO[13CH3] 34a_100011739246_200025704644 [0,0,0,1,0,0|2,0,0]=3 5618 B10R1.5 CCN1CCC[C@@H]1CO[13CH3] 7a_100011739246_200025704644 [0,0,0,1,0,0|2,0,0]=3 5619 B10R1.5 CCN1CCC[C@H]1COC 2230a_100020646714_100000210202 [0,0,0,1,0,0|2,0,0]=3 5620 B10R1.5 CCN1CCC[C@H]1COC 269982a_100020646714_100000204670 [0,0,0,1,0,0|2,0,0]=3 5621 B10R1.5 CCN1CCC[C@H]1COC 34a_100020646714_100000210202 [0,0,0,1,0,0|2,0,0]=3 5622 B10R1.5 CCNC1CCCC1CC 269862a_100015525214_100000749056 [0,0,0,1,0,0|3,0,0]=4 5623 B10R1.5 CCNC1CCCC1CC 270004a_100015525214_100000749056 [0,0,0,1,0,0|3,0,0]=4 5624 B10R1.5 CCO[C@@H]1CCC[C@H]1C#N 34a_100011907464_100000210202 [0,0,0,1,0,0|3,0,0]=4 5625 B10R1.5 CCO[C@@H]1CCC[C@H]1C#N 7a_100011907464_100000210202 [0,0,0,1,0,0|3,0,0]=4 5626 B10R1.5 COC[C@@H]1CCCN1CF 269982a_100020646714_100015361967 [0,0,0,1,0,0|3,0,0]=4 5627 B10R1.5 COC[C@@H]1CCCN1CF 34a_100020646714_100015361967 [0,0,0,1,0,0|3,0,0]=4 5628 B10R1.17 C#CCCN1CCOCC1 2230a_100015191051_100000688953 [0,0,0,1,0,0|2,0,1]=4 5629 B10R1.17 C#CCCN1CCOCC1 269982a_100015191051_100000730999 [0,0,0,1,0,0|2,0,1]=4 5630 B10R1.17 C#CCCN1CCOCC1 34a_100015191051_100000688953 [0,0,0,1,0,0|2,0,1]=4 5631 B10R1.17 C/C=C/CN1CCOCC1 269982a_100015191051_100102629194 [0,0,0,1,0,0|2,0,1]=4 5632 B10R1.17 C/C=C/CN1CCOCC1 34a_100015191051_100102629194 [0,0,0,1,0,0|2,0,1]=4 5633 B10R1.17 C=CCCN1CCOCC1 2230a_100015191051_100000754431 [0,0,0,1,0,0|2,0,1]=4 5634 B10R1.17 C=CCCN1CCOCC1 269982a_100015191051_100000754431 [0,0,0,1,0,0|2,0,1]=4 5635 B10R1.17 C=CCCN1CCOCC1 34a_100015191051_100000754431 [0,0,0,1,0,0|2,0,1]=4 5636 B10R1.17 CC#CCN1CCOCC1 2230a_100015191051_100000748600 [0,0,0,1,0,0|2,0,1]=4 5637 B10R1.17 CC#CCN1CCOCC1 34a_100015191051_100000748600 [0,0,0,1,0,0|2,0,1]=4 5638 B10R1.17 CC=CCN1CCOCC1 2230a_100015191051_100000070051 [0,0,0,1,0,0|2,0,1]=4 5639 B10R1.17 CC=CCN1CCOCC1 34a_100015191051_100000070051 [0,0,0,1,0,0|2,0,1]=4 5640 B10R1.17 CCCCN1CCCOC1 2230a_100000131196_100000210211 [0,0,0,1,0,0|3,0,0]=4 5641 B10R1.17 CCCCN1CCCOC1 269982a_100000131196_100000210211 [0,0,0,1,0,0|3,0,0]=4 5642 B10R1.17 CCCCN1CCCOC1 34a_100000131196_100000210210 [0,0,0,1,0,0|3,0,0]=4 5643 B10R1.17 CCCCN1CCOCC1 2230a_100015191051_100000210211 [0,0,0,1,0,0|2,0,0]=3 5644 B10R1.17 CCCCN1CCOCC1 269982a_100015191051_100000210211 [0,0,0,1,0,0|2,0,0]=3 5645 B10R1.17 CCCCN1CCOCC1 34a_100015191051_100000210210 [0,0,0,1,0,0|2,0,0]=3 5646 B10R1.17 CCCCN1CCSCC1 2230a_100000737611_100000210211 [0,0,0,1,0,0|2,1,0]=4 5647 B10R1.17 CCCCN1CCSCC1 269982a_100000737611_100000210211 [0,0,0,1,0,0|2,1,0]=4 5648 B10R1.17 CCCNC1CCCOC1 2230a_100000719290_100000210303 [0,0,0,1,0,0|3,0,0]=4 5649 B10R1.17 CCCNC1CCCOC1 270004a_100020643023_100000753404 [0,0,0,1,0,0|3,0,0]=4 5650 B10R1.17 CCCNC1CCCOC1 34a_100000719290_100000210303 [0,0,0,1,0,0|3,0,0]=4 5651 B10R1.17 CCCNC1CCOCC1 2230a_100000741149_100000210303 [0,0,0,1,0,0|3,0,0]=4 5652 B10R1.17 CCCNC1CCOCC1 270004a_100020643023_100011217826 [0,0,0,1,0,0|3,0,0]=4 5653 B10R1.17 CCCNC1CCOCC1 34a_100000741149_100000210303 [0,0,0,1,0,0|3,0,0]=4 5654 B10R1.17 CCCOC1CCCCO1 34a_100000033831_100000210303 [0,0,0,1,0,0|3,0,0]=4 5655 B10R1.17 CCCOC1CCCOC1 34a_100000210258_100000693364 [0,0,0,1,0,0|3,0,0]=4 5656 B10R1.17 CCCOC1CCCOC1 34a_100000754041_100000210303 [0,0,0,1,0,0|3,0,0]=4 5657 B10R1.17 CCCOC1CCOCC1 34a_100000744328_100000210303 [0,0,0,1,0,0|3,0,0]=4 5658 B10R1.17 CCCSC1CCCOC1 62a_100000210303_100000693364 [0,0,0,1,0,0|3,0,0]=4 5659 B10R1.17 CCCSC1CCOCC1 62a_100000210303_100011324220 [0,0,0,1,0,0|3,0,0]=4 5660 B10R1.17 CCNCC1CCCCC1 2230a_100000210473_100000210202 [0,0,0,1,0,0|3,0,0]=4 5661 B10R1.17 CCNCC1CCCCC1 2230a_100015525214_100000211423 [0,0,0,1,0,0|3,0,0]=4 5662 B10R1.17 CCNCC1CCCCC1 269862a_100015525214_100000211278 [0,0,0,1,0,0|3,0,0]=4 5663 B10R1.17 CCNCC1CCCCC1 34a_100000210473_100000210202 [0,0,0,1,0,0|3,0,0]=4 5664 B10R1.17 CCNCC1CCCCO1 2230a_100000174945_100000210202 [0,0,0,1,0,0|2,0,0]=3 5665 B10R1.17 CCNCC1CCCCO1 2230a_100015525214_100000211543 [0,0,0,1,0,0|2,0,0]=3 5666 B10R1.17 CCNCC1CCCCO1 34a_100000174945_100000210202 [0,0,0,1,0,0|2,0,0]=3 5667 B10R1.17 CCNCC1CCCOC1 2230a_100000720124_100000210202 [0,0,0,1,0,0|2,0,0]=3 5668 B10R1.17 CCNCC1CCCOC1 2230a_100015525214_100000741521 [0,0,0,1,0,0|2,0,0]=3 5669 B10R1.17 CCNCC1CCCOC1 34a_100000720124_100000210202 [0,0,0,1,0,0|2,0,0]=3 5670 B10R1.17 CCNCC1CCOCC1 2230a_100000746373_100000210202 [0,0,0,1,0,0|3,0,0]=4 5671 B10R1.17 CCNCC1CCOCC1 2230a_100015525214_100000754603 [0,0,0,1,0,0|3,0,0]=4 5672 B10R1.17 CCNCC1CCOCC1 269862a_100015525214_100000749017 [0,0,0,1,0,0|3,0,0]=4 5673 B10R1.17 CCNCC1CCOCC1 34a_100000746373_100000210202 [0,0,0,1,0,0|3,0,0]=4 5674 B10R1.17 CCNC[C@H]1COCCO1 2230a_100010981119_100000210202 [0,0,0,1,0,0|1,0,0]=2 5675 B10R1.17 CCNC[C@H]1COCCO1 34a_100010981119_100000210202 [0,0,0,1,0,0|1,0,0]=2 5676 B10R1.17 CCOCC1CC=CCC1 34a_100000210713_100000210202 [0,0,0,1,0,0|2,0,1]=4 5677 B10R1.17 CCOCC1CCC=CO1 34a_100011217868_100000210202 [0,0,0,1,0,0|1,0,2]=4 5678 B10R1.17 CCOCC1CCCCC1 34a_100000212181_100000210202 [0,0,0,1,0,0|2,0,0]=3 5679 B10R1.17 CCOCC1CCCCC1 34a_100121572206_100000211423 [0,0,0,1,0,0|2,0,0]=3 5680 B10R1.17 CCOCC1CCCCC1 7a_100000212181_100000210202 [0,0,0,1,0,0|2,0,0]=3 5681 B10R1.17 CCOCC1CCCCN1 34a_100000210821_100000210202 [0,0,0,1,0,0|2,0,0]=3 5682 B10R1.17 CCOCC1CCCCO1 34a_100000211370_100000210202 [0,0,0,1,0,0|1,0,0]=2 5683 B10R1.17 CCOCC1CCCCO1 34a_100121572206_100000211543 [0,0,0,1,0,0|1,0,0]=2 5684 B10R1.17 CCOCC1CCCCO1 7a_100000211370_100000210202 [0,0,0,1,0,0|1,0,0]=2 5685 B10R1.17 CCOCC1CCCNC1 34a_100000211344_100000210202 [0,0,0,1,0,0|2,0,0]=3 5686 B10R1.17 CCOCC1CCCOC1 34a_100000741520_100000210202 [0,0,0,1,0,0|1,0,0]=2 5687 B10R1.17 CCOCC1CCCOC1 34a_100121572206_100000741521 [0,0,0,1,0,0|1,0,0]=2 5688 B10R1.17 CCOCC1CCNCC1 34a_100000738675_100000210202 [0,0,0,1,0,0|3,0,0]=4 5689 B10R1.17 CCOCC1CCOCC1 34a_100000749013_100000210202 [0,0,0,1,0,0|3,0,0]=4 5690 B10R1.17 CCOCC1CCOCC1 34a_100121572206_100000754603 [0,0,0,1,0,0|3,0,0]=4 5691 B10R1.17 CCOCC1CCSCC1 34a_100000070558_100000210202 [0,0,0,1,0,0|3,0,0]=4 5692 B10R1.17 CCOCC1CCSCC1 7a_100000070558_100000210202 [0,0,0,1,0,0|3,0,0]=4 5693 B10R1.17 CCOCN1CCCOC1 269982a_100000131196_100000739092 [0,0,0,1,0,0|2,0,0]=3 5694 B10R1.17 CCOCN1CCOCC1 269982a_100015191051_100000739092 [0,0,0,1,0,0|3,0,0]=4 5695 B10R1.17 CCOC[C@@H]1CNCCO1 34a_100015189573_100000210202 [0,0,0,1,0,0|1,0,0]=2 5696 B10R1.17 CCOC[C@@H]1COCCN1 34a_100000717676_100000210202 [0,0,0,1,0,0|1,0,0]=2 5697 B10R1.17 CCOC[C@H]1COCCO1 34a_100009875890_100000210202 [0,0,0,1,0,0|0,0,0]=1 5698 B10R1.17 CCSCC1CCCCC1 62a_100000210202_100000211423 [0,0,0,1,0,0|2,1,0]=4 5699 B10R1.17 CCSCC1CCCCC1 62a_100000211423_100000210202 [0,0,0,1,0,0|2,1,0]=4 5700 B10R1.17 CCSCC1CCCCO1 62a_100000210202_100000211543 [0,0,0,1,0,0|1,1,0]=3 5701 B10R1.17 CCSCC1CCCCO1 62a_100000211543_100000210202 [0,0,0,1,0,0|1,1,0]=3 5702 B10R1.17 CCSCC1CCCOC1 62a_100000210202_100000741521 [0,0,0,1,0,0|1,1,0]=3 5703 B10R1.17 CCSCC1CCCOC1 62a_100000741521_100000210202 [0,0,0,1,0,0|1,1,0]=3 5704 B10R1.17 CCSCC1CCOCC1 62a_100000210202_100000749018 [0,0,0,1,0,0|3,0,0]=4 5705 B10R1.17 CCSCC1CCOCC1 62a_100000754603_100000210202 [0,0,0,1,0,0|3,0,0]=4 5706 B10R1.17 CNCCC1CCCCC1 2230a_100000738074_200000210301 [0,0,0,1,0,0|3,0,0]=4 5707 B10R1.17 CNCCC1CCCCC1 2230a_106832991635_100012355289 [0,0,0,1,0,0|3,0,0]=4 5708 B10R1.17 CNCCC1CCCCC1 270004a_106832991635_100011713444 [0,0,0,1,0,0|3,0,0]=4 5709 B10R1.17 CNCCC1CCCCC1 34a_100000738074_200000210301 [0,0,0,1,0,0|3,0,0]=4 5710 B10R1.17 CNCCC1CCCCC1 34a_100102657272_100011209188 [0,0,0,1,0,0|3,0,0]=4 5711 B10R1.17 CNCCC1CCCCC1 7a_106832991635_100011273959 [0,0,0,1,0,0|3,0,0]=4 5712 B10R1.17 CNCCC1CCCCO1 2230a_100015183643_200000210301 [0,0,0,1,0,0|3,0,0]=4 5713 B10R1.17 CNCCC1CCCCO1 34a_100015183643_200000210301 [0,0,0,1,0,0|3,0,0]=4 5714 B10R1.17 CNCCC1CCOCC1 2230a_100000755988_200000210301 [0,0,0,1,0,0|2,0,0]=3 5715 B10R1.17 CNCCC1CCOCC1 2230a_106832991635_100011934994 [0,0,0,1,0,0|2,0,0]=3 5716 B10R1.17 CNCCC1CCOCC1 34a_100000755988_200000210301 [0,0,0,1,0,0|2,0,0]=3 5717 B10R1.17 CNCCC1CCOCC1 34a_100102657272_100011934994 [0,0,0,1,0,0|2,0,0]=3 5718 B10R1.17 CNCCC1CCOCC1 7a_106832991635_100011934994 [0,0,0,1,0,0|2,0,0]=3 5719 B10R1.17 CNCCN1CCCCC1 2230a_106832991635_100000739454 [0,0,0,1,0,0|3,0,0]=4 5720 B10R1.17 CNCCN1CCCCC1 34a_100102657272_100000739454 [0,0,0,1,0,0|3,0,0]=4 5721 B10R1.17 CNCCN1CCCCC1 7a_106832991635_100000739454 [0,0,0,1,0,0|3,0,0]=4 5722 B10R1.17 CNCCN1CCOCC1 2230a_106832991635_100025781966 [0,0,0,1,0,0|2,0,0]=3 5723 B10R1.17 CNCCN1CCOCC1 7a_106832991635_100000211760 [0,0,0,1,0,0|2,0,0]=3 5724 B10R1.17 CNCCN1CCSCC1 2230a_100000755026_200000210301 [0,0,0,1,0,0|2,1,0]=4 5725 B10R1.17 COCCC1CCCCC1 34a_100011217863_200000210301 [0,0,0,1,0,0|2,0,0]=3 5726 B10R1.17 COCCC1CCCCC1 34a_100138415774_100011209188 [0,0,0,1,0,0|2,0,0]=3 5727 B10R1.17 COCCC1CCCCC1 7a_100011217863_200000210301 [0,0,0,1,0,0|2,0,0]=3 5728 B10R1.17 COCCC1CCCCN1 34a_100000211664_200000210301 [0,0,0,1,0,0|3,0,0]=4 5729 B10R1.17 COCCC1CCCNC1 34a_100000752241_200000210301 [0,0,0,1,0,0|3,0,0]=4 5730 B10R1.17 COCCC1CCNCC1 34a_100015190746_200000210301 [0,0,0,1,0,0|2,0,0]=3 5731 B10R1.17 COCCC1CCOCC1 34a_100011933979_200000210301 [0,0,0,1,0,0|1,0,0]=2 5732 B10R1.17 COCCC1CCOCC1 34a_100138415774_100011934994 [0,0,0,1,0,0|1,0,0]=2 5733 B10R1.17 COCCC1CCOCC1 7a_100011933979_200000210301 [0,0,0,1,0,0|1,0,0]=2 5734 B10R1.17 COCCN1CC=CCC1 2230a_100000698166_100011201679 [0,0,0,1,0,0|2,0,1]=4 5735 B10R1.17 COCCN1CC=CCC1 269982a_100000698166_100000233755 [0,0,0,1,0,0|2,0,1]=4 5736 B10R1.17 COCCN1CC=CCC1 34a_100000698166_100011201679 [0,0,0,1,0,0|2,0,1]=4 5737 B10R1.17 COCCN1CCCCC1 34a_100138415774_100000739454 [0,0,0,1,0,0|2,0,0]=3 5738 B10R1.17 COCCN1CCCOC1 2230a_100000131196_100011201679 [0,0,0,1,0,0|3,0,0]=4 5739 B10R1.17 COCCN1CCCOC1 269982a_100000131196_100000233755 [0,0,0,1,0,0|3,0,0]=4 5740 B10R1.17 COCCN1CCCOC1 34a_100000131196_100011201679 [0,0,0,1,0,0|3,0,0]=4 5741 B10R1.17 COCCN1CCOCC1 2230a_100015191051_100011201679 [0,0,0,1,0,0|1,0,0]=2 5742 B10R1.17 COCCN1CCOCC1 269982a_100015191051_100000233755 [0,0,0,1,0,0|1,0,0]=2 5743 B10R1.17 COCCN1CCOCC1 34a_100015191051_100011201679 [0,0,0,1,0,0|1,0,0]=2 5744 B10R1.17 COCCN1CCSCC1 2230a_100000737611_100011201679 [0,0,0,1,0,0|1,1,0]=3 5745 B10R1.17 COCCN1CCSCC1 269982a_100000737611_100000233755 [0,0,0,1,0,0|1,1,0]=3 5746 B10R1.17 COCCN1CCSCC1 7a_100000686052_200000210301 [0,0,0,1,0,0|1,1,0]=3 5747 B10R1.17 COCNC1CCCCC1 2230a_100000182618_100000766300 [0,0,0,1,0,0|3,0,0]=4 5748 B10R1.17 COCNC1CCOCC1 2230a_100000741149_100000766300 [0,0,0,1,0,0|2,0,0]=3 5749 B10R1.17 COCNC1CCSCC1 2230a_100000748639_100000766300 [0,0,0,1,0,0|2,1,0]=4 5750 B10R1.17 COCOC1CCCCC1 34a_100138415774_100011935260 [0,0,0,1,0,0|3,0,0]=4 5751 B10R1.17 COCSC1CCCCC1 62a_100000210327_100000766300 [0,0,0,1,0,0|3,0,0]=4 5752 B10R1.17 COCSC1CCCCC1 62a_100000766300_100000210327 [0,0,0,1,0,0|3,0,0]=4 5753 B10R1.17 COCSC1CCOCC1 62a_100000766300_100011324220 [0,0,0,1,0,0|2,0,0]=3 5754 B10R1.17 COCSC1CCSCC1 62a_100000766300_100000069128 [0,0,0,1,0,0|2,1,0]=4 5755 B10R1.17 CSCCC1CCCCC1 62a_100012355289_200000210301 [0,0,0,1,0,0|2,1,0]=4 5756 B10R1.17 CSCCC1CCCCC1 62a_200000210301_100012355289 [0,0,0,1,0,0|2,1,0]=4 5757 B10R1.17 CSCCC1CCOCC1 62a_100011934994_200000210301 [0,0,0,1,0,0|1,1,0]=3 5758 B10R1.17 CSCCC1CCOCC1 62a_200000210301_100011934994 [0,0,0,1,0,0|1,1,0]=3 5759 B10R1.17 CSCCN1CCCCC1 62a_100000739454_200000210301 [0,0,0,1,0,0|2,1,0]=4 5760 B10R1.17 CSCCN1CCCCC1 62a_200000210301_100000739454 [0,0,0,1,0,0|2,1,0]=4 5761 B10R1.17 CSCCN1CCOCC1 2230a_100015191051_100000751147 [0,0,0,1,0,0|1,1,0]=3 5762 B10R1.17 CSCCN1CCOCC1 269982a_100015191051_100000212216 [0,0,0,1,0,0|1,1,0]=3 5763 B10R1.17 CSCCN1CCOCC1 34a_100015191051_100000212216 [0,0,0,1,0,0|1,1,0]=3 5764 B10R1.17 CSCCN1CCOCC1 62a_200000210301_100000211760 [0,0,0,1,0,0|1,1,0]=3 5765 B10R1.17 CSCCN1CCSCC1 2230a_100000737611_100000751147 [0,0,0,1,0,0|1,2,0]=4 5766 B10R1.17 CSCCN1CCSCC1 269982a_100000737611_100000212216 [0,0,0,1,0,0|1,2,0]=4 5767 B10R1.17 CSCNC1CCOCC1 2230a_100000741149_100011218213 [0,0,0,1,0,0|2,1,0]=4 5768 B10R1.17 CSCNC1CCOCC1 34a_100000741149_100011218213 [0,0,0,1,0,0|2,1,0]=4 5769 B10R1.17 CSCOC1CCOCC1 34a_100000744328_100011218213 [0,0,0,1,0,0|2,1,0]=4 5770 B10R1.17 CSCSC1CCOCC1 62a_100011218213_100011324220 [0,0,0,1,0,0|2,1,0]=4 5771 B10R1.17 FCCCN1CCOCC1 2230a_100015191051_100011934791 [0,0,0,1,0,0|3,0,0]=4 5772 B10R1.17 FCCCN1CCOCC1 269982a_100015191051_100011934791 [0,0,0,1,0,0|3,0,0]=4 5773 B10R1.17 FCCCN1CCOCC1 34a_100015191051_100011934791 [0,0,0,1,0,0|3,0,0]=4 5774 B10R1.17 FCNCC1CCCCO1 34a_100000174945_100015361967 [0,0,0,1,0,0|3,0,0]=4 5775 B10R1.17 FCNCC1CCCOC1 34a_100000720124_100015361967 [0,0,0,1,0,0|3,0,0]=4 5776 B10R1.17 FCNC[C@H]1COCCO1 34a_100010981119_100015361967 [0,0,0,1,0,0|2,0,0]=3 5777 B10R1.17 FCOCC1CCCCC1 34a_100000212181_100015361967 [0,0,0,1,0,0|3,0,0]=4 5778 B10R1.17 FCOCC1CCCCC1 7a_100000212181_100015361967 [0,0,0,1,0,0|3,0,0]=4 5779 B10R1.17 FCOCC1CCCCN1 34a_100000210821_100015361967 [0,0,0,1,0,0|3,0,0]=4 5780 B10R1.17 FCOCC1CCCCO1 34a_100000211370_100015361967 [0,0,0,1,0,0|2,0,0]=3 5781 B10R1.17 FCOCC1CCCCO1 7a_100000211370_100015361967 [0,0,0,1,0,0|2,0,0]=3 5782 B10R1.17 FCOCC1CCCNC1 34a_100000211344_100015361967 [0,0,0,1,0,0|3,0,0]=4 5783 B10R1.17 FCOCC1CCCOC1 34a_100000741520_100015361967 [0,0,0,1,0,0|2,0,0]=3 5784 B10R1.17 FCOC[C@@H]1CNCCO1 34a_100015189573_100015361967 [0,0,0,1,0,0|2,0,0]=3 5785 B10R1.17 FCOC[C@@H]1COCCN1 34a_100000717676_100015361967 [0,0,0,1,0,0|2,0,0]=3 5786 B10R1.17 FCOC[C@H]1COCCO1 34a_100009875890_100015361967 [0,0,0,1,0,0|1,0,0]=2 5787 B10R1.17 FCSCC1CCCCO1 62a_100000211543_100015361967 [0,0,0,1,0,0|2,1,0]=4 5788 B10R1.17 FCSCC1CCCCO1 62a_100015361967_100000211543 [0,0,0,1,0,0|2,1,0]=4 5789 B10R1.17 FCSCC1CCCOC1 62a_100000741521_100015361967 [0,0,0,1,0,0|2,1,0]=4 5790 B10R1.17 FCSCC1CCCOC1 62a_100015361967_100000741521 [0,0,0,1,0,0|2,1,0]=4 5791 B10R1.17 N#CCCN1CCOCC1 2230a_100015191051_100011215226 [0,0,0,1,0,0|3,0,0]=4 5792 B10R1.17 N#CCCN1CCOCC1 269982a_100015191051_100011215226 [0,0,0,1,0,0|3,0,0]=4 5793 B10R1.17 OCCCN1CCOCC1 2230a_100015191051_100000230001 [0,0,0,1,0,0|3,0,0]=4 5794 B10R1.17 OCCCN1CCOCC1 269982a_100015191051_100011215043 [0,0,0,1,0,0|3,0,0]=4 5795 B10R1.17 OCCCN1CCOCC1 34a_100015191051_100000230001 [0,0,0,1,0,0|3,0,0]=4 5796 B10R1.17 [13CH3]NCCC1CCCCC1 2230a_100000738074_200025704644 [0,0,0,1,0,0|3,0,0]=4 5797 B10R1.17 [13CH3]NCCC1CCCCC1 34a_100000738074_200025704644 [0,0,0,1,0,0|3,0,0]=4 5798 B10R1.17 [13CH3]NCCC1CCCCO1 2230a_100015183643_200025704644 [0,0,0,1,0,0|3,0,0]=4 5799 B10R1.17 [13CH3]NCCC1CCCCO1 34a_100015183643_200025704644 [0,0,0,1,0,0|3,0,0]=4 5800 B10R1.17 [13CH3]NCCC1CCOCC1 2230a_100000755988_200025704644 [0,0,0,1,0,0|2,0,0]=3 5801 B10R1.17 [13CH3]NCCC1CCOCC1 34a_100000755988_200025704644 [0,0,0,1,0,0|2,0,0]=3 5802 B10R1.17 [13CH3]NCCN1CCSCC1 2230a_100000755026_200025704644 [0,0,0,1,0,0|2,1,0]=4 5803 B10R1.17 [13CH3]OCCC1CCCCC1 34a_100011217863_200025704644 [0,0,0,1,0,0|2,0,0]=3 5804 B10R1.17 [13CH3]OCCC1CCCCC1 7a_100011217863_200025704644 [0,0,0,1,0,0|2,0,0]=3 5805 B10R1.17 [13CH3]OCCC1CCCCN1 34a_100000211664_200025704644 [0,0,0,1,0,0|3,0,0]=4 5806 B10R1.17 [13CH3]OCCC1CCCNC1 34a_100000752241_200025704644 [0,0,0,1,0,0|3,0,0]=4 5807 B10R1.17 [13CH3]OCCC1CCNCC1 34a_100015190746_200025704644 [0,0,0,1,0,0|2,0,0]=3 5808 B10R1.17 [13CH3]OCCC1CCOCC1 34a_100011933979_200025704644 [0,0,0,1,0,0|1,0,0]=2 5809 B10R1.17 [13CH3]OCCC1CCOCC1 7a_100011933979_200025704644 [0,0,0,1,0,0|1,0,0]=2 5810 B10R1.17 [13CH3]OCCN1CCSCC1 7a_100000686052_200025704644 [0,0,0,1,0,0|1,1,0]=3 5811 B10R1.17 [13CH3]SCCC1CCCCC1 62a_100012355289_200025704644 [0,0,0,1,0,0|2,1,0]=4 5812 B10R1.17 [13CH3]SCCC1CCCCC1 62a_200025704644_100012355289 [0,0,0,1,0,0|2,1,0]=4 5813 B10R1.17 [13CH3]SCCC1CCOCC1 62a_100011934994_200025704644 [0,0,0,1,0,0|1,1,0]=3 5814 B10R1.17 [13CH3]SCCC1CCOCC1 62a_200025704644_100011934994 [0,0,0,1,0,0|1,1,0]=3 5815 B10R1.17 [13CH3]SCCN1CCCCC1 62a_100000739454_200025704644 [0,0,0,1,0,0|2,1,0]=4 5816 B10R1.17 [13CH3]SCCN1CCCCC1 62a_200025704644_100000739454 [0,0,0,1,0,0|2,1,0]=4 5817 B10R1.17 [13CH3]SCCN1CCOCC1 62a_200025704644_100000211760 [0,0,0,1,0,0|1,1,0]=3 5818 B10R1.20 CCC1CCCCC1NC 269862a_106832991636_100000757040 [0,0,0,1,0,0|3,0,0]=4 5819 B10R1.20 CCC1CCCCC1NC 270004a_106832991635_100000757040 [0,0,0,1,0,0|3,0,0]=4 5820 B10R1.20 CCC1CCCCC1OC 34a_100000210738_200000210301 [0,0,0,1,0,0|2,0,0]=3 5821 B10R1.20 CCC1CCCCC1OC 7a_100000210738_200000210301 [0,0,0,1,0,0|2,0,0]=3 5822 B10R1.20 CCC1CCCCC1O[13CH3] 34a_100000210738_200025704644 [0,0,0,1,0,0|2,0,0]=3 5823 B10R1.20 CCC1CCCCC1O[13CH3] 7a_100000210738_200025704644 [0,0,0,1,0,0|2,0,0]=3 5824 B10R1.20 CCC1CCCCN1CC 2230a_100000210034_100000210202 [0,0,0,1,0,0|3,0,0]=4 5825 B10R1.20 CCC1CCCCN1CC 269982a_100000210034_100000204670 [0,0,0,1,0,0|3,0,0]=4 5826 B10R1.20 CCC1CCCCN1CC 34a_100000210034_100000210202 [0,0,0,1,0,0|3,0,0]=4 5827 B10R1.20 CCN1CCOC[C@H]1CO 2230a_100000717676_100000210202 [0,0,0,1,0,0|3,0,0]=4 5828 B10R1.20 CCN1CCOC[C@H]1CO 269982a_100000717676_100000204670 [0,0,0,1,0,0|3,0,0]=4 5829 B10R1.20 CCN1CCOC[C@H]1CO 34a_100000717676_100000210202 [0,0,0,1,0,0|3,0,0]=4 5830 B10R1.20 CC[C@H]1COCCN1CC 2230a_100016988097_100000210202 [0,0,0,1,0,0|2,0,0]=3 5831 B10R1.20 CC[C@H]1COCCN1CC 269982a_100016988097_100000204670 [0,0,0,1,0,0|2,0,0]=3 5832 B10R1.20 CC[C@H]1COCCN1CC 34a_100016988097_100000210202 [0,0,0,1,0,0|2,0,0]=3 5833 B10R1.20 CC[C@H]1COCCN1CF 269982a_100016988097_100015361967 [0,0,0,1,0,0|3,0,0]=4 5834 B10R1.20 CC[C@H]1COCCN1CF 34a_100016988097_100015361967 [0,0,0,1,0,0|3,0,0]=4 5835 B10R1.20 CNC1CCCCC1OC 270004a_106832991635_100000740605 [0,0,0,1,0,0|3,0,0]=4 5836 B10R1.20 CNC1CCCCC1OC 34a_100011208099_200000210301 [0,0,0,1,0,0|3,0,0]=4 5837 B10R1.20 CNC1CCOCC1OC 270004a_106832991635_100000095984 [0,0,0,1,0,0|2,0,0]=3 5838 B10R1.20 CN[C@@H]1CCCC[C@H]1OC 34a_100000708425_200000210301 [0,0,0,1,0,0|3,0,0]=4 5839 B10R1.20 CN[C@@H]1CCCC[C@H]1O[13CH3] 34a_100000708425_200025704644 [0,0,0,1,0,0|3,0,0]=4 5840 B10R1.20 COC1CCCCC1CN 34a_100011216029_200000210301 [0,0,0,1,0,0|3,0,0]=4 5841 B10R1.20 COC1CCCCC1N[13CH3] 34a_100011208099_200025704644 [0,0,0,1,0,0|3,0,0]=4 5842 B10R1.20 CO[C@H]1CCCC[C@@H]1OC 34a_200009815850_200000210301 [0,0,0,1,0,0|3,0,0]=4 5843 B10R1.20 CO[C@H]1CCCC[C@@H]1OC 7a_200009815850_200000210301 [0,0,0,1,0,0|3,0,0]=4 5844 B10R1.20 CO[C@H]1CCCC[C@@H]1O[13CH3] 34a_200009815850_200025704644 [0,0,0,1,0,0|3,0,0]=4 5845 B10R1.20 CO[C@H]1CCCC[C@@H]1O[13CH3] 7a_200009815850_200025704644 [0,0,0,1,0,0|3,0,0]=4 5846 B10R1.20 [13CH3]OC1CCCCC1CN 34a_100011216029_200025704644 [0,0,0,1,0,0|3,0,0]=4 5847 B10R1.21 BrCCCOC1CCCC1 34a_100011217188_100000179811 [0,0,0,1,0,0|3,0,0]=4 5848 B10R1.21 BrCCCOC1CCOC1 34a_100011217188_100000690089 [0,0,0,1,0,0|2,0,0]=3 5849 B10R1.21 C#CCCNC1CCOC1 34a_100000755551_100000690089 [0,0,0,1,0,0|2,0,1]=4 5850 B10R1.21 C#CCCN[C@@H]1CCOC1 2230a_200015188469_100000688953 [0,0,0,1,0,0|2,0,1]=4 5851 B10R1.21 C#CCCN[C@H]1CCOC1 2230a_100015188467_100000688953 [0,0,0,1,0,0|2,0,1]=4 5852 B10R1.21 C#CCCN[C@H]1CCOC1 34a_100015188467_100000688953 [0,0,0,1,0,0|2,0,1]=4 5853 B10R1.21 C#CCCOC1CCCC1 34a_100000210269_100000688953 [0,0,0,1,0,0|2,0,1]=4 5854 B10R1.21 C#CCCOC1CCCC1 34a_100011215631_100000179811 [0,0,0,1,0,0|2,0,1]=4 5855 B10R1.21 C#CCCOC1CCCC1 7a_100000210269_100000688953 [0,0,0,1,0,0|2,0,1]=4 5856 B10R1.21 C#CCCOC1CCOC1 34a_100011215631_100000690089 [0,0,0,1,0,0|1,0,1]=3 5857 B10R1.21 C#CCCOC1CCSC1 7a_100011232664_100000688953 [0,0,0,1,0,0|1,1,1]=4 5858 B10R1.21 C#CCCO[C@H]1CCOC1 34a_100000717292_100000688953 [0,0,0,1,0,0|1,0,1]=3 5859 B10R1.21 C#CCCSC1CCOC1 62a_100000688953_100000690089 [0,0,0,1,0,0|1,1,1]=4 5860 B10R1.21 C/C=C/CN[C@H]1CCOC1 34a_100015188467_100102629194 [0,0,0,1,0,0|2,0,1]=4 5861 B10R1.21 C/C=C/COC1CCCC1 34a_100000210269_100102629194 [0,0,0,1,0,0|2,0,1]=4 5862 B10R1.21 C/C=C/COC1CCCC1 34a_100016270725_100000179811 [0,0,0,1,0,0|2,0,1]=4 5863 B10R1.21 C/C=C/COC1CCCC1 7a_100000210269_100102629194 [0,0,0,1,0,0|2,0,1]=4 5864 B10R1.21 C/C=C/COC1CCOC1 34a_100016270725_100000690089 [0,0,0,1,0,0|1,0,1]=3 5865 B10R1.21 C/C=C/COC1CCSC1 7a_100011232664_100102629194 [0,0,0,1,0,0|1,1,1]=4 5866 B10R1.21 C/C=C/CO[C@H]1CCOC1 34a_100000717292_100102629194 [0,0,0,1,0,0|1,0,1]=3 5867 B10R1.21 C/C=C/CSC1CCOC1 62a_100102629194_100000690089 [0,0,0,1,0,0|1,1,1]=4 5868 B10R1.21 C=CCCNC1CCOC1 2230a_100015191253_100000731011 [0,0,0,1,0,0|2,0,1]=4 5869 B10R1.21 C=CCCNC1CCOC1 270004a_100015191253_100000752484 [0,0,0,1,0,0|2,0,1]=4 5870 B10R1.21 C=CCCN[C@@H]1CCOC1 2230a_200015188469_100000754431 [0,0,0,1,0,0|2,0,1]=4 5871 B10R1.21 C=CCCN[C@H]1CCOC1 2230a_100015188467_100000754431 [0,0,0,1,0,0|2,0,1]=4 5872 B10R1.21 C=CCCN[C@H]1CCOC1 34a_100015188467_100000754431 [0,0,0,1,0,0|2,0,1]=4 5873 B10R1.21 C=CCCOC1CCCC1 34a_100000210269_100000754431 [0,0,0,1,0,0|2,0,1]=4 5874 B10R1.21 C=CCCOC1CCCC1 34a_100011205117_100000179811 [0,0,0,1,0,0|2,0,1]=4 5875 B10R1.21 C=CCCOC1CCCC1 7a_100000210269_100000754431 [0,0,0,1,0,0|2,0,1]=4 5876 B10R1.21 C=CCCOC1CCOC1 34a_100011205117_100000690089 [0,0,0,1,0,0|1,0,1]=3 5877 B10R1.21 C=CCCOC1CCSC1 7a_100011232664_100000754431 [0,0,0,1,0,0|1,1,1]=4 5878 B10R1.21 C=CCCO[C@H]1CCOC1 34a_100000717292_100000754431 [0,0,0,1,0,0|1,0,1]=3 5879 B10R1.21 C=CCCSC1CCOC1 62a_100000754431_100000690089 [0,0,0,1,0,0|1,1,1]=4 5880 B10R1.21 CC#CCNC1CCOC1 2230a_100000685387_100000731011 [0,0,0,1,0,0|2,0,1]=4 5881 B10R1.21 CC#CCNC1CCOC1 34a_100000685387_100000690089 [0,0,0,1,0,0|2,0,1]=4 5882 B10R1.21 CC#CCN[C@@H]1CCOC1 2230a_200015188469_100000748600 [0,0,0,1,0,0|2,0,1]=4 5883 B10R1.21 CC#CCN[C@H]1CCOC1 2230a_100015188467_100000748600 [0,0,0,1,0,0|2,0,1]=4 5884 B10R1.21 CC#CCN[C@H]1CCOC1 34a_100015188467_100000748600 [0,0,0,1,0,0|2,0,1]=4 5885 B10R1.21 CC#CCOC1CCCC1 34a_100000210269_100000748600 [0,0,0,1,0,0|2,0,1]=4 5886 B10R1.21 CC#CCOC1CCCC1 34a_100000761923_100000179811 [0,0,0,1,0,0|2,0,1]=4 5887 B10R1.21 CC#CCOC1CCCC1 7a_100000210269_100000748600 [0,0,0,1,0,0|2,0,1]=4 5888 B10R1.21 CC#CCOC1CCOC1 34a_100000761923_100000690089 [0,0,0,1,0,0|1,0,1]=3 5889 B10R1.21 CC#CCOC1CCSC1 7a_100011232664_100000748600 [0,0,0,1,0,0|1,1,1]=4 5890 B10R1.21 CC#CCO[C@H]1CCOC1 34a_100000717292_100000748600 [0,0,0,1,0,0|1,0,1]=3 5891 B10R1.21 CC#CCSC1CCOC1 62a_100000748600_100000690089 [0,0,0,1,0,0|1,1,1]=4 5892 B10R1.21 CC=CCN[C@@H]1CCOC1 2230a_200015188469_100000070051 [0,0,0,1,0,0|2,0,1]=4 5893 B10R1.21 CC=CCN[C@H]1CCOC1 2230a_100015188467_100000070051 [0,0,0,1,0,0|2,0,1]=4 5894 B10R1.21 CC=CCN[C@H]1CCOC1 34a_100015188467_100000070051 [0,0,0,1,0,0|2,0,1]=4 5895 B10R1.21 CC=CCOC1CCCC1 34a_100000210269_100000070051 [0,0,0,1,0,0|2,0,1]=4 5896 B10R1.21 CC=CCOC1CCCC1 7a_100000210269_100000070051 [0,0,0,1,0,0|2,0,1]=4 5897 B10R1.21 CC=CCOC1CCSC1 7a_100011232664_100000070051 [0,0,0,1,0,0|1,1,1]=4 5898 B10R1.21 CC=CCO[C@H]1CCOC1 34a_100000717292_100000070051 [0,0,0,1,0,0|1,0,1]=3 5899 B10R1.21 CC=CCSC1CCOC1 62a_100000070051_100000690089 [0,0,0,1,0,0|1,1,1]=4 5900 B10R1.21 CCCCCN1CCCC1 2230a_100000188435_100000210326 [0,0,0,1,0,0|3,0,0]=4 5901 B10R1.21 CCCCCN1CCCC1 269982a_100000188435_100000210215 [0,0,0,1,0,0|3,0,0]=4 5902 B10R1.21 CCCCCN1CCSC1 2230a_100011215254_100000210326 [0,0,0,1,0,0|2,1,0]=4 5903 B10R1.21 CCCCCN1CCSC1 269982a_100011215254_100000210215 [0,0,0,1,0,0|2,1,0]=4 5904 B10R1.21 CCCCNC1CCCC1 2230a_100000102301_100000179811 [0,0,0,1,0,0|3,0,0]=4 5905 B10R1.21 CCCCNC1CCCC1 2230a_100000211070_100000210211 [0,0,0,1,0,0|3,0,0]=4 5906 B10R1.21 CCCCNC1CCCC1 270004a_100000102301_100000210133 [0,0,0,1,0,0|3,0,0]=4 5907 B10R1.21 CCCCNC1CCCC1 34a_100000211070_100000210210 [0,0,0,1,0,0|3,0,0]=4 5908 B10R1.21 CCCCNC1CCCC1 7a_106832991798_100000179811 [0,0,0,1,0,0|3,0,0]=4 5909 B10R1.21 CCCCNC1CCOC1 2230a_100000102301_100000731011 [0,0,0,1,0,0|2,0,0]=3 5910 B10R1.21 CCCCNC1CCOC1 270004a_100000102301_100000752484 [0,0,0,1,0,0|2,0,0]=3 5911 B10R1.21 CCCCNC1CCOC1 7a_106832991798_100000731011 [0,0,0,1,0,0|2,0,0]=3 5912 B10R1.21 CCCCNC1CCSC1 270004a_100000102301_100000212027 [0,0,0,1,0,0|2,1,0]=4 5913 B10R1.21 CCCCN[C@@H]1CCOC1 2230a_200015188469_100000210211 [0,0,0,1,0,0|2,0,0]=3 5914 B10R1.21 CCCCN[C@H]1CCOC1 2230a_100015188467_100000210211 [0,0,0,1,0,0|2,0,0]=3 5915 B10R1.21 CCCCN[C@H]1CCOC1 34a_100015188467_100000210210 [0,0,0,1,0,0|2,0,0]=3 5916 B10R1.21 CCCCOC1CCCC1 34a_100000210227_100000179811 [0,0,0,1,0,0|2,0,0]=3 5917 B10R1.21 CCCCOC1CCCC1 34a_100000210269_100000210210 [0,0,0,1,0,0|2,0,0]=3 5918 B10R1.21 CCCCOC1CCCC1 7a_100000210227_100000179811 [0,0,0,1,0,0|2,0,0]=3 5919 B10R1.21 CCCCOC1CCCC1 7a_100000210269_100000210211 [0,0,0,1,0,0|2,0,0]=3 5920 B10R1.21 CCCCOC1CCCO1 34a_100000085407_100000210210 [0,0,0,1,0,0|3,0,0]=4 5921 B10R1.21 CCCCOC1CCOC1 34a_100000210227_100000690089 [0,0,0,1,0,0|1,0,0]=2 5922 B10R1.21 CCCCOC1CCOC1 7a_100000210227_100000731011 [0,0,0,1,0,0|1,0,0]=2 5923 B10R1.21 CCCCOC1CCSC1 7a_100011232664_100000210211 [0,0,0,1,0,0|1,1,0]=3 5924 B10R1.21 CCCCO[C@H]1CCOC1 34a_100000717292_100000210210 [0,0,0,1,0,0|1,0,0]=2 5925 B10R1.21 CCCCSC1CCCC1 62a_100000210211_100000179811 [0,0,0,1,0,0|2,1,0]=4 5926 B10R1.21 CCCCSC1CCCC1 62a_100011217020_100000210210 [0,0,0,1,0,0|2,1,0]=4 5927 B10R1.21 CCCCSC1CCOC1 62a_100000210211_100000690089 [0,0,0,1,0,0|1,1,0]=3 5928 B10R1.21 CCCNCC1CCOC1 2230a_100000737293_100000210303 [0,0,0,1,0,0|3,0,0]=4 5929 B10R1.21 CCCNCC1CCOC1 34a_100000737293_100000210303 [0,0,0,1,0,0|3,0,0]=4 5930 B10R1.21 CCCOCC1CCOC1 34a_100000210258_100011261433 [0,0,0,1,0,0|3,0,0]=4 5931 B10R1.21 CCCOCC1CCOC1 34a_100000740260_100000210303 [0,0,0,1,0,0|3,0,0]=4 5932 B10R1.21 CCCSCC1CCOC1 62a_100000210303_100000702531 [0,0,0,1,0,0|3,0,0]=4 5933 B10R1.21 CCCSCC1CCOC1 62a_100000702531_100000210303 [0,0,0,1,0,0|3,0,0]=4 5934 B10R1.21 CCNCCC1CCCC1 2230a_100000739158_100000210202 [0,0,0,1,0,0|3,0,0]=4 5935 B10R1.21 CCNCCC1CCCC1 2230a_100015525214_100000760354 [0,0,0,1,0,0|3,0,0]=4 5936 B10R1.21 CCNCCC1CCCC1 34a_100000739158_100000210202 [0,0,0,1,0,0|3,0,0]=4 5937 B10R1.21 CCOCCC1CCCC1 34a_100000749090_100000210202 [0,0,0,1,0,0|2,0,0]=3 5938 B10R1.21 CCOCCC1CCCC1 34a_100121572206_100000760354 [0,0,0,1,0,0|2,0,0]=3 5939 B10R1.21 CCOCCC1CCCC1 7a_100000749090_100000210202 [0,0,0,1,0,0|2,0,0]=3 5940 B10R1.21 CCOCCC1CCNC1 34a_100016987287_100000210202 [0,0,0,1,0,0|2,0,0]=3 5941 B10R1.21 CCOCCC1CCOC1 34a_100011879284_100000210202 [0,0,0,1,0,0|1,0,0]=2 5942 B10R1.21 CCOCCN1CC=CC1 269982a_100015195280_100011215890 [0,0,0,1,0,0|2,0,1]=4 5943 B10R1.21 CCOCCN1CCCC1 2230a_100000188435_100011215890 [0,0,0,1,0,0|2,0,0]=3 5944 B10R1.21 CCOCCN1CCCC1 269982a_100000188435_100011215890 [0,0,0,1,0,0|2,0,0]=3 5945 B10R1.21 CCOCCN1CCSC1 2230a_100011215254_100011215890 [0,0,0,1,0,0|1,1,0]=3 5946 B10R1.21 CCOCCN1CCSC1 269982a_100011215254_100011215890 [0,0,0,1,0,0|1,1,0]=3 5947 B10R1.21 CCOCSC1CCCC1 62a_100000739092_100000179811 [0,0,0,1,0,0|3,0,0]=4 5948 B10R1.21 CCOCSC1CCCC1 62a_100011217020_100000739092 [0,0,0,1,0,0|3,0,0]=4 5949 B10R1.21 CCOCSC1CCOC1 62a_100000739092_100000690089 [0,0,0,1,0,0|2,0,0]=3 5950 B10R1.21 CCSCCC1CCCC1 62a_100000210202_100000760354 [0,0,0,1,0,0|2,1,0]=4 5951 B10R1.21 CCSCCC1CCCC1 62a_100000760354_100000210202 [0,0,0,1,0,0|2,1,0]=4 5952 B10R1.21 CCSCCN1CCCC1 2230a_100000188435_100000757381 [0,0,0,1,0,0|2,1,0]=4 5953 B10R1.21 CCSCCN1CCCC1 269982a_100000188435_100000757381 [0,0,0,1,0,0|2,1,0]=4 5954 B10R1.21 CCSCCN1CCCC1 62a_100000210202_100000004467 [0,0,0,1,0,0|2,1,0]=4 5955 B10R1.21 CCSCCN1CCCC1 62a_100000700749_100000210202 [0,0,0,1,0,0|2,1,0]=4 5956 B10R1.21 CCSCCN1CCSC1 2230a_100011215254_100000757381 [0,0,0,1,0,0|1,2,0]=4 5957 B10R1.21 CCSCCN1CCSC1 269982a_100011215254_100000757381 [0,0,0,1,0,0|1,2,0]=4 5958 B10R1.21 CNCCCC1CCCC1 2230a_100000736752_200000210301 [0,0,0,1,0,0|3,0,0]=4 5959 B10R1.21 CNCCCC1CCCC1 2230a_106832991635_100011713738 [0,0,0,1,0,0|3,0,0]=4 5960 B10R1.21 CNCCCC1CCCC1 34a_100000736752_200000210301 [0,0,0,1,0,0|3,0,0]=4 5961 B10R1.21 CNCCCC1CCCC1 34a_100102657272_100011713738 [0,0,0,1,0,0|3,0,0]=4 5962 B10R1.21 CNCCCC1CCCC1 7a_106832991635_100011713738 [0,0,0,1,0,0|3,0,0]=4 5963 B10R1.21 CNCCOC1CCCC1 34a_100000741755_200000210301 [0,0,0,1,0,0|2,0,0]=3 5964 B10R1.21 COCCCC1CCCC1 34a_100011215328_200000210301 [0,0,0,1,0,0|2,0,0]=3 5965 B10R1.21 COCCCC1CCCC1 34a_100138415774_100011713738 [0,0,0,1,0,0|2,0,0]=3 5966 B10R1.21 COCCCC1CCCC1 7a_100011215328_200000210301 [0,0,0,1,0,0|2,0,0]=3 5967 B10R1.21 COCCCN1CCCC1 2230a_100000188435_100000740836 [0,0,0,1,0,0|3,0,0]=4 5968 B10R1.21 COCCCN1CCCC1 269982a_100000188435_100000740836 [0,0,0,1,0,0|3,0,0]=4 5969 B10R1.21 COCCCN1CCCC1 34a_100138415774_100016991639 [0,0,0,1,0,0|3,0,0]=4 5970 B10R1.21 COCCCN1CCSC1 2230a_100011215254_100000740836 [0,0,0,1,0,0|2,1,0]=4 5971 B10R1.21 COCCCN1CCSC1 269982a_100011215254_100000740836 [0,0,0,1,0,0|2,1,0]=4 5972 B10R1.21 COCCNC1CC=CC1 2230a_100015188752_100011201679 [0,0,0,1,0,0|2,0,1]=4 5973 B10R1.21 COCCNC1CCCC1 2230a_100000209980_100000179811 [0,0,0,1,0,0|2,0,0]=3 5974 B10R1.21 COCCNC1CCCC1 2230a_100000211070_100011201679 [0,0,0,1,0,0|2,0,0]=3 5975 B10R1.21 COCCNC1CCCC1 270004a_100000209980_100000210133 [0,0,0,1,0,0|2,0,0]=3 5976 B10R1.21 COCCNC1CCCC1 34a_100000211070_100011201679 [0,0,0,1,0,0|2,0,0]=3 5977 B10R1.21 COCCNC1CCCC1 34a_200000200444_200000210301 [0,0,0,1,0,0|2,0,0]=3 5978 B10R1.21 COCCNC1CCOC1 2230a_100000209980_100000731011 [0,0,0,1,0,0|1,0,0]=2 5979 B10R1.21 COCCNC1CCOC1 270004a_100000209980_100000752484 [0,0,0,1,0,0|1,0,0]=2 5980 B10R1.21 COCCNC1CCSC1 270004a_100000209980_100000212027 [0,0,0,1,0,0|1,1,0]=3 5981 B10R1.21 COCCN[C@@H]1CCOC1 2230a_200015188469_100011201679 [0,0,0,1,0,0|1,0,0]=2 5982 B10R1.21 COCCN[C@H]1CCOC1 2230a_100015188467_100011201679 [0,0,0,1,0,0|1,0,0]=2 5983 B10R1.21 COCCN[C@H]1CCOC1 34a_100015188467_100011201679 [0,0,0,1,0,0|1,0,0]=2 5984 B10R1.21 COCCOC1CCCC1 34a_100000210237_100000179811 [0,0,0,1,0,0|1,0,0]=2 5985 B10R1.21 COCCOC1CCCC1 34a_100000210269_100011201679 [0,0,0,1,0,0|1,0,0]=2 5986 B10R1.21 COCCOC1CCCC1 34a_100000738311_200000210301 [0,0,0,1,0,0|1,0,0]=2 5987 B10R1.21 COCCOC1CCCC1 7a_100000210269_100000233755 [0,0,0,1,0,0|1,0,0]=2 5988 B10R1.21 COCCOC1CCCC1 7a_100000738311_200000210301 [0,0,0,1,0,0|1,0,0]=2 5989 B10R1.21 COCCOC1CCCO1 34a_100000085407_100011201679 [0,0,0,1,0,0|2,0,0]=3 5990 B10R1.21 COCCOC1CCOC1 34a_100000210237_100000690089 [0,0,0,1,0,0|0,0,0]=1 5991 B10R1.21 COCCOC1CCSC1 7a_100011232664_100000233755 [0,0,0,1,0,0|0,1,0]=2 5992 B10R1.21 COCCO[C@H]1CCOC1 34a_100000717292_100011201679 [0,0,0,1,0,0|0,0,0]=1 5993 B10R1.21 COCCSC1CCCC1 62a_100000233755_100000179811 [0,0,0,1,0,0|1,1,0]=3 5994 B10R1.21 COCCSC1CCCC1 62a_100011217020_100000233755 [0,0,0,1,0,0|1,1,0]=3 5995 B10R1.21 COCCSC1CCOC1 62a_100000233755_100000690089 [0,0,0,1,0,0|0,1,0]=2 5996 B10R1.21 COCNCC1CCCC1 2230a_100000737975_100000766300 [0,0,0,1,0,0|3,0,0]=4 5997 B10R1.21 COCNCC1CCOC1 2230a_100000737293_100000766300 [0,0,0,1,0,0|2,0,0]=3 5998 B10R1.21 COCSCC1CCCC1 62a_100000740388_100000766300 [0,0,0,1,0,0|3,0,0]=4 5999 B10R1.21 COCSCC1CCCC1 62a_100000766300_100000740388 [0,0,0,1,0,0|3,0,0]=4 6000 B10R1.21 COCSCC1CCOC1 62a_100000702531_100000766300 [0,0,0,1,0,0|2,0,0]=3 6001 B10R1.21 COCSCC1CCOC1 62a_100000766300_100000702531 [0,0,0,1,0,0|2,0,0]=3 6002 B10R1.21 CSCCCC1CCCC1 62a_100011713738_200000210301 [0,0,0,1,0,0|2,1,0]=4 6003 B10R1.21 CSCCCC1CCCC1 62a_200000210301_100011713738 [0,0,0,1,0,0|2,1,0]=4 6004 B10R1.21 CSCCNC1CCCC1 2230a_100000211070_100000751147 [0,0,0,1,0,0|2,1,0]=4 6005 B10R1.21 CSCCNC1CCCC1 2230a_100020590264_100000179811 [0,0,0,1,0,0|2,1,0]=4 6006 B10R1.21 CSCCNC1CCCC1 270004a_100020590264_100000210133 [0,0,0,1,0,0|2,1,0]=4 6007 B10R1.21 CSCCNC1CCCC1 34a_100000211070_100000212216 [0,0,0,1,0,0|2,1,0]=4 6008 B10R1.21 CSCCNC1CCOC1 2230a_100020590264_100000731011 [0,0,0,1,0,0|1,1,0]=3 6009 B10R1.21 CSCCNC1CCOC1 270004a_100020590264_100000752484 [0,0,0,1,0,0|1,1,0]=3 6010 B10R1.21 CSCCNC1CCSC1 270004a_100020590264_100000212027 [0,0,0,1,0,0|1,2,0]=4 6011 B10R1.21 CSCCN[C@@H]1CCOC1 2230a_200015188469_100000751147 [0,0,0,1,0,0|1,1,0]=3 6012 B10R1.21 CSCCN[C@H]1CCOC1 2230a_100015188467_100000751147 [0,0,0,1,0,0|1,1,0]=3 6013 B10R1.21 CSCCN[C@H]1CCOC1 34a_100015188467_100000212216 [0,0,0,1,0,0|1,1,0]=3 6014 B10R1.21 CSCCOC1CCCC1 34a_100000210269_100000212216 [0,0,0,1,0,0|1,1,0]=3 6015 B10R1.21 CSCCOC1CCCC1 34a_100000230434_100000179811 [0,0,0,1,0,0|1,1,0]=3 6016 B10R1.21 CSCCOC1CCCC1 7a_100000210269_100000212216 [0,0,0,1,0,0|1,1,0]=3 6017 B10R1.21 CSCCOC1CCCC1 7a_100000230434_100000179811 [0,0,0,1,0,0|1,1,0]=3 6018 B10R1.21 CSCCOC1CCCO1 34a_100000085407_100000212216 [0,0,0,1,0,0|2,1,0]=4 6019 B10R1.21 CSCCOC1CCOC1 34a_100000230434_100000690089 [0,0,0,1,0,0|0,1,0]=2 6020 B10R1.21 CSCCOC1CCOC1 7a_100000230434_100000731011 [0,0,0,1,0,0|0,1,0]=2 6021 B10R1.21 CSCCOC1CCSC1 7a_100011232664_100000212216 [0,0,0,1,0,0|0,2,0]=3 6022 B10R1.21 CSCCO[C@H]1CCOC1 34a_100000717292_100000212216 [0,0,0,1,0,0|0,1,0]=2 6023 B10R1.21 CSCCSC1CCCC1 62a_100000212216_100000179811 [0,0,0,1,0,0|1,2,0]=4 6024 B10R1.21 CSCCSC1CCCC1 62a_100011217020_100000751147 [0,0,0,1,0,0|1,2,0]=4 6025 B10R1.21 CSCCSC1CCOC1 62a_100000212216_100000690089 [0,0,0,1,0,0|0,2,0]=3 6026 B10R1.21 CSCNCC1CCOC1 2230a_100000737293_100011218213 [0,0,0,1,0,0|2,1,0]=4 6027 B10R1.21 CSCNCC1CCOC1 34a_100000737293_100011218213 [0,0,0,1,0,0|2,1,0]=4 6028 B10R1.21 CSCOCC1CCOC1 34a_100000740260_100011218213 [0,0,0,1,0,0|2,1,0]=4 6029 B10R1.21 CSCSCC1CCOC1 62a_100000702531_100011218213 [0,0,0,1,0,0|2,1,0]=4 6030 B10R1.21 CSCSCC1CCOC1 62a_100011218213_100000702531 [0,0,0,1,0,0|2,1,0]=4 6031 B10R1.21 ClCCCOC1CCCC1 34a_100000230001_100000179811 [0,0,0,1,0,0|3,0,0]=4 6032 B10R1.21 ClCCCOC1CCOC1 34a_100000230001_100000690089 [0,0,0,1,0,0|2,0,0]=3 6033 B10R1.21 FCCCNC1CCOC1 2230a_100015189416_100000731011 [0,0,0,1,0,0|3,0,0]=4 6034 B10R1.21 FCCCNC1CCOC1 270004a_100015189416_100000752484 [0,0,0,1,0,0|3,0,0]=4 6035 B10R1.21 FCCCNC1CCOC1 34a_100015189416_100000690089 [0,0,0,1,0,0|3,0,0]=4 6036 B10R1.21 FCCCN[C@@H]1CCOC1 2230a_200015188469_100011934791 [0,0,0,1,0,0|3,0,0]=4 6037 B10R1.21 FCCCN[C@H]1CCOC1 2230a_100015188467_100011934791 [0,0,0,1,0,0|3,0,0]=4 6038 B10R1.21 FCCCN[C@H]1CCOC1 34a_100015188467_100011934791 [0,0,0,1,0,0|3,0,0]=4 6039 B10R1.21 FCCCOC1CCCC1 34a_100000210269_100011934791 [0,0,0,1,0,0|3,0,0]=4 6040 B10R1.21 FCCCOC1CCCC1 34a_100000759539_100000179811 [0,0,0,1,0,0|3,0,0]=4 6041 B10R1.21 FCCCOC1CCCC1 7a_100000210269_100011934791 [0,0,0,1,0,0|3,0,0]=4 6042 B10R1.21 FCCCOC1CCOC1 34a_100000759539_100000690089 [0,0,0,1,0,0|2,0,0]=3 6043 B10R1.21 FCCCOC1CCSC1 7a_100011232664_100011934791 [0,0,0,1,0,0|2,1,0]=4 6044 B10R1.21 FCCCO[C@H]1CCOC1 34a_100000717292_100011934791 [0,0,0,1,0,0|2,0,0]=3 6045 B10R1.21 FCCCSC1CCOC1 62a_100011934791_100000690089 [0,0,0,1,0,0|2,1,0]=4 6046 B10R1.21 FCOCCC1CCCC1 34a_100000749090_100015361967 [0,0,0,1,0,0|3,0,0]=4 6047 B10R1.21 FCOCCC1CCCC1 7a_100000749090_100015361967 [0,0,0,1,0,0|3,0,0]=4 6048 B10R1.21 FCOCCC1CCNC1 34a_100016987287_100015361967 [0,0,0,1,0,0|3,0,0]=4 6049 B10R1.21 FCOCCC1CCOC1 34a_100011879284_100015361967 [0,0,0,1,0,0|2,0,0]=3 6050 B10R1.21 N#CCCNC1CCOC1 270004a_100000720768_100000752484 [0,0,0,1,0,0|3,0,0]=4 6051 B10R1.21 N#CCCN[C@@H]1CCOC1 2230a_200015188469_100011215226 [0,0,0,1,0,0|3,0,0]=4 6052 B10R1.21 N#CCCN[C@H]1CCOC1 2230a_100015188467_100011215226 [0,0,0,1,0,0|3,0,0]=4 6053 B10R1.21 N#CCCOC1CCCC1 7a_100000210269_100000184422 [0,0,0,1,0,0|3,0,0]=4 6054 B10R1.21 N#CCCOC1CCSC1 7a_100011232664_100000184422 [0,0,0,1,0,0|2,1,0]=4 6055 B10R1.21 N#CCCSC1CCOC1 62a_100011215226_100000690089 [0,0,0,1,0,0|2,1,0]=4 6056 B10R1.21 NCCCOC1CCCC1 34a_100000182051_100000179811 [0,0,0,1,0,0|3,0,0]=4 6057 B10R1.21 NCCCOC1CCOC1 34a_100000182051_100000690089 [0,0,0,1,0,0|2,0,0]=3 6058 B10R1.21 NOCCOC1CCCC1 34a_100000700252_100000179811 [0,0,0,1,0,0|2,0,0]=3 6059 B10R1.21 NOCCOC1CCOC1 34a_100000700252_100000690089 [0,0,0,1,0,0|1,0,0]=2 6060 B10R1.21 OCCCNC1CCOC1 270004a_100000182051_100000752484 [0,0,0,1,0,0|3,0,0]=4 6061 B10R1.21 OCCCN[C@@H]1CCOC1 2230a_200015188469_100000230001 [0,0,0,1,0,0|3,0,0]=4 6062 B10R1.21 OCCCN[C@H]1CCOC1 2230a_100015188467_100000230001 [0,0,0,1,0,0|3,0,0]=4 6063 B10R1.21 OCCCN[C@H]1CCOC1 34a_100015188467_100000230001 [0,0,0,1,0,0|3,0,0]=4 6064 B10R1.21 OCCCOC1CCCC1 34a_100000210269_100000230001 [0,0,0,1,0,0|3,0,0]=4 6065 B10R1.21 OCCCOC1CCCC1 7a_100000210269_100011215043 [0,0,0,1,0,0|3,0,0]=4 6066 B10R1.21 OCCCOC1CCSC1 7a_100011232664_100011215043 [0,0,0,1,0,0|2,1,0]=4 6067 B10R1.21 OCCCO[C@H]1CCOC1 34a_100000717292_100000230001 [0,0,0,1,0,0|2,0,0]=3 6068 B10R1.21 OCCCSC1CCOC1 62a_100011215043_100000690089 [0,0,0,1,0,0|2,1,0]=4 6069 B10R1.21 [13CH3]NCCCC1CCCC1 2230a_100000736752_200025704644 [0,0,0,1,0,0|3,0,0]=4 6070 B10R1.21 [13CH3]NCCCC1CCCC1 34a_100000736752_200025704644 [0,0,0,1,0,0|3,0,0]=4 6071 B10R1.21 [13CH3]NCCOC1CCCC1 34a_100000741755_200025704644 [0,0,0,1,0,0|2,0,0]=3 6072 B10R1.21 [13CH3]OCCCC1CCCC1 34a_100011215328_200025704644 [0,0,0,1,0,0|2,0,0]=3 6073 B10R1.21 [13CH3]OCCCC1CCCC1 7a_100011215328_200025704644 [0,0,0,1,0,0|2,0,0]=3 6074 B10R1.21 [13CH3]OCCNC1CCCC1 34a_200000200444_200025704644 [0,0,0,1,0,0|2,0,0]=3 6075 B10R1.21 [13CH3]OCCOC1CCCC1 34a_100000738311_200025704644 [0,0,0,1,0,0|1,0,0]=2 6076 B10R1.21 [13CH3]OCCOC1CCCC1 7a_100000738311_200025704644 [0,0,0,1,0,0|1,0,0]=2 6077 B10R1.21 [13CH3]SCCCC1CCCC1 62a_100011713738_200025704644 [0,0,0,1,0,0|2,1,0]=4 6078 B10R1.21 [13CH3]SCCCC1CCCC1 62a_200025704644_100011713738 [0,0,0,1,0,0|2,1,0]=4 6079 B10R1.29 CCCCN1CCC[C@@H]1C 2230a_100020605311_100000210211 [0,0,0,1,0,0|3,0,0]=4 6080 B10R1.29 CCCCN1CCC[C@@H]1C 269982a_100020605311_100000210211 [0,0,0,1,0,0|3,0,0]=4 6081 B10R1.29 CCCCN1CCC[C@H]1C 2230a_100015189458_100000210211 [0,0,0,1,0,0|3,0,0]=4 6082 B10R1.29 CCCCN1CCC[C@H]1C 269982a_100015189458_100000210211 [0,0,0,1,0,0|3,0,0]=4 6083 B10R1.29 CCCCN1CCC[C@H]1C 34a_100015189458_100000210210 [0,0,0,1,0,0|3,0,0]=4 6084 B10R1.29 CCCCN1CCSC1C 2230a_200011216479_100000210211 [0,0,0,1,0,0|2,1,0]=4 6085 B10R1.29 CCCCN1CCSC1C 269982a_200011216479_100000210211 [0,0,0,1,0,0|2,1,0]=4 6086 B10R1.29 CCCCN1CCSC1C 34a_200011216479_100000210210 [0,0,0,1,0,0|2,1,0]=4 6087 B10R1.29 CCCNC1CCOC1C 270004a_100020643023_100000691750 [0,0,0,1,0,0|3,0,0]=4 6088 B10R1.29 CCOCC1CCCN1C 34a_100000743107_100000210202 [0,0,0,1,0,0|2,0,0]=3 6089 B10R1.29 CCOCN1CCC[C@@H]1C 269982a_100020605311_100000739092 [0,0,0,1,0,0|3,0,0]=4 6090 B10R1.29 CCOCN1CCC[C@H]1C 269982a_100015189458_100000739092 [0,0,0,1,0,0|3,0,0]=4 6091 B10R1.29 CN1CCCC1CCO[13CH3] 34a_100011215177_200025704644 [0,0,0,1,0,0|3,0,0]=4 6092 B10R1.29 CN1CCCC1CCO[13CH3] 7a_100011215177_200025704644 [0,0,0,1,0,0|3,0,0]=4 6093 B10R1.29 CN1CCCC1COCF 34a_100000743107_100015361967 [0,0,0,1,0,0|3,0,0]=4 6094 B10R1.29 COCCC1CCCN1C 34a_100011215177_200000210301 [0,0,0,1,0,0|3,0,0]=4 6095 B10R1.29 COCCC1CCCN1C 34a_100138415774_100000005710 [0,0,0,1,0,0|3,0,0]=4 6096 B10R1.29 COCCC1CCCN1C 7a_100011215177_200000210301 [0,0,0,1,0,0|3,0,0]=4 6097 B10R1.29 COCCN1CCC[C@@H]1C 2230a_100020605311_100011201679 [0,0,0,1,0,0|2,0,0]=3 6098 B10R1.29 COCCN1CCC[C@@H]1C 269982a_100020605311_100000233755 [0,0,0,1,0,0|2,0,0]=3 6099 B10R1.29 COCCN1CCC[C@H]1C 2230a_100015189458_100011201679 [0,0,0,1,0,0|2,0,0]=3 6100 B10R1.29 COCCN1CCC[C@H]1C 269982a_100015189458_100000233755 [0,0,0,1,0,0|2,0,0]=3 6101 B10R1.29 COCCN1CCC[C@H]1C 34a_100015189458_100011201679 [0,0,0,1,0,0|2,0,0]=3 6102 B10R1.29 COCCN1CCSC1C 2230a_200011216479_100011201679 [0,0,0,1,0,0|1,1,0]=3 6103 B10R1.29 COCCN1CCSC1C 269982a_200011216479_100000233755 [0,0,0,1,0,0|1,1,0]=3 6104 B10R1.29 COCCN1CCSC1C 34a_200011216479_100011201679 [0,0,0,1,0,0|1,1,0]=3 6105 B10R1.29 CSCCN1CCC[C@@H]1C 2230a_100020605311_100000751147 [0,0,0,1,0,0|2,1,0]=4 6106 B10R1.29 CSCCN1CCC[C@@H]1C 269982a_100020605311_100000212216 [0,0,0,1,0,0|2,1,0]=4 6107 B10R1.29 CSCCN1CCC[C@H]1C 2230a_100015189458_100000751147 [0,0,0,1,0,0|2,1,0]=4 6108 B10R1.29 CSCCN1CCC[C@H]1C 269982a_100015189458_100000212216 [0,0,0,1,0,0|2,1,0]=4 6109 B10R1.29 CSCCN1CCC[C@H]1C 34a_100015189458_100000212216 [0,0,0,1,0,0|2,1,0]=4 6110 B10R1.29 CSCCN1CCSC1C 2230a_200011216479_100000751147 [0,0,0,1,0,0|1,2,0]=4 6111 B10R1.29 CSCCN1CCSC1C 269982a_200011216479_100000212216 [0,0,0,1,0,0|1,2,0]=4 6112 B10R1.29 CSCCN1CCSC1C 34a_200011216479_100000212216 [0,0,0,1,0,0|1,2,0]=4 6113 B10R1.37 CCCCCN1CCC1C 269982a_100000755817_100000210215 [0,0,0,1,0,0|3,0,0]=4 6114 B10R1.37 CCCCCN1CCC1C 34a_100000755817_100000718602 [0,0,0,1,0,0|3,0,0]=4 6115 B10R1.37 CCOCCN1CCC1C 269982a_100000755817_100011215890 [0,0,0,1,0,0|2,0,0]=3 6116 B10R1.37 CCOCCN1CCC1C 34a_100000755817_100000210147 [0,0,0,1,0,0|2,0,0]=3 6117 B10R1.37 CCSCCN1CCC1C 269982a_100000755817_100000757381 [0,0,0,1,0,0|2,1,0]=4 6118 B10R1.37 CCSCCN1CCC1C 34a_100000755817_100000757381 [0,0,0,1,0,0|2,1,0]=4 6119 B10R1.37 COCCCN1CCC1C 269982a_100000755817_100000740836 [0,0,0,1,0,0|3,0,0]=4 6120 B10R1.37 COCCCN1CCC1C 34a_100000755817_100000740836 [0,0,0,1,0,0|3,0,0]=4 6121 B10R1.37 COCCOC1CCC1=O 34a_100000210237_100009892977 [0,0,0,1,0,0|2,0,1]=4 6122 B10R1.56 C#CCCOCC1CC1C 34a_100000744939_100000688953 [0,0,0,1,0,0|2,0,1]=4 6123 B10R1.56 C#CCCOCC1CC1C 7a_100000744939_100000688953 [0,0,0,1,0,0|2,0,1]=4 6124 B10R1.56 C/C=C/COCC1CC1C 34a_100000744939_100102629194 [0,0,0,1,0,0|2,0,1]=4 6125 B10R1.56 C/C=C/COCC1CC1C 7a_100000744939_100102629194 [0,0,0,1,0,0|2,0,1]=4 6126 B10R1.56 C=CCCOCC1CC1C 34a_100000744939_100000754431 [0,0,0,1,0,0|2,0,1]=4 6127 B10R1.56 C=CCCOCC1CC1C 7a_100000744939_100000754431 [0,0,0,1,0,0|2,0,1]=4 6128 B10R1.56 CC#CCOCC1CC1C 34a_100000744939_100000748600 [0,0,0,1,0,0|2,0,1]=4 6129 B10R1.56 CC#CCOCC1CC1C 7a_100000744939_100000748600 [0,0,0,1,0,0|2,0,1]=4 6130 B10R1.56 CC1CC1COCCC#N 7a_100000744939_100000184422 [0,0,0,1,0,0|3,0,0]=4 6131 B10R1.56 CC1CC1COCCCF 34a_100000744939_100011934791 [0,0,0,1,0,0|3,0,0]=4 6132 B10R1.56 CC1CC1COCCCF 7a_100000744939_100011934791 [0,0,0,1,0,0|3,0,0]=4 6133 B10R1.56 CC1CC1COCCCO 34a_100000744939_100000230001 [0,0,0,1,0,0|3,0,0]=4 6134 B10R1.56 CC1CC1COCCCO 7a_100000744939_100011215043 [0,0,0,1,0,0|3,0,0]=4 6135 B10R1.56 CC=CCOCC1CC1C 34a_100000744939_100000070051 [0,0,0,1,0,0|2,0,1]=4 6136 B10R1.56 CC=CCOCC1CC1C 7a_100000744939_100000070051 [0,0,0,1,0,0|2,0,1]=4 6137 B10R1.56 CCCCOCC1CC1C 34a_100000744939_100000210210 [0,0,0,1,0,0|2,0,0]=3 6138 B10R1.56 CCCCOCC1CC1C 7a_100000744939_100000210211 [0,0,0,1,0,0|2,0,0]=3 6139 B10R1.56 CCOCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100011215890 [0,0,0,1,0,0|3,0,0]=4 6140 B10R1.56 CCOCCN[C@@H]1C[C@H]1F 2230a_100025746932_100011215890 [0,0,0,1,0,0|3,0,0]=4 6141 B10R1.56 CCOCCN[C@@H]1C[C@H]1F 34a_100025746932_100000210147 [0,0,0,1,0,0|3,0,0]=4 6142 B10R1.56 COCCOCC1CC1C 34a_100000744939_100011201679 [0,0,0,1,0,0|1,0,0]=2 6143 B10R1.56 COCCOCC1CC1C 7a_100000744939_100000233755 [0,0,0,1,0,0|1,0,0]=2 6144 B10R1.56 CSCCOCC1CC1C 34a_100000744939_100000212216 [0,0,0,1,0,0|1,1,0]=3 6145 B10R1.56 CSCCOCC1CC1C 7a_100000744939_100000212216 [0,0,0,1,0,0|1,1,0]=3 6146 B10R1.57 BrCCCCOC1CCC1 34a_100011216708_100000749161 [0,0,0,1,0,0|3,0,0]=4 6147 B10R1.57 BrCCCCOC1COC1 34a_100011216708_100009818527 [0,0,0,1,0,0|2,0,0]=3 6148 B10R1.57 BrCCCOCC1CCC1 34a_100011217188_100000763275 [0,0,0,1,0,0|3,0,0]=4 6149 B10R1.57 BrCCCOCC1CCO1 34a_100011217188_100000103362 [0,0,0,1,0,0|2,0,0]=3 6150 B10R1.57 C#CCCCOC1COC1 34a_100000215630_100009818527 [0,0,0,1,0,0|1,0,2]=4 6151 B10R1.57 C#CCCCOC1COC1 7a_100000215630_100009818527 [0,0,0,1,0,0|1,0,2]=4 6152 B10R1.57 C#CCCNCC1CCO1 34a_100000755551_100000103362 [0,0,0,1,0,0|2,0,1]=4 6153 B10R1.57 C#CCCNC[C@@H]1CCO1 2230a_100020831831_100000688953 [0,0,0,1,0,0|2,0,1]=4 6154 B10R1.57 C#CCCNC[C@@H]1CCO1 34a_100020831831_100000688953 [0,0,0,1,0,0|2,0,1]=4 6155 B10R1.57 C#CCCOCC1CCC1 34a_100000760304_100000688953 [0,0,0,1,0,0|2,0,1]=4 6156 B10R1.57 C#CCCOCC1CCC1 34a_100011215631_100000763275 [0,0,0,1,0,0|2,0,1]=4 6157 B10R1.57 C#CCCOCC1CCO1 34a_100000039022_100000688953 [0,0,0,1,0,0|1,0,1]=3 6158 B10R1.57 C#CCCOCC1CCO1 34a_100011215631_100000103362 [0,0,0,1,0,0|1,0,1]=3 6159 B10R1.57 C#CCCSCC1CCO1 62a_100000103362_100000688953 [0,0,0,1,0,0|1,1,1]=4 6160 B10R1.57 C#CCCSCC1CCO1 62a_100000688953_100000103362 [0,0,0,1,0,0|1,1,1]=4 6161 B10R1.57 C/C=C/CCOC1CCC1 34a_100016278192_100000749161 [0,0,0,1,0,0|2,0,1]=4 6162 B10R1.57 C/C=C/CCOC1COC1 34a_100016278192_100009818527 [0,0,0,1,0,0|1,0,1]=3 6163 B10R1.57 C/C=C/CNC[C@@H]1CCO1 34a_100020831831_100102629194 [0,0,0,1,0,0|2,0,1]=4 6164 B10R1.57 C/C=C/COCC1CCC1 34a_100000760304_100102629194 [0,0,0,1,0,0|2,0,1]=4 6165 B10R1.57 C/C=C/COCC1CCC1 34a_100016270725_100000763275 [0,0,0,1,0,0|2,0,1]=4 6166 B10R1.57 C/C=C/COCC1CCO1 34a_100000039022_100102629194 [0,0,0,1,0,0|1,0,1]=3 6167 B10R1.57 C/C=C/COCC1CCO1 34a_100016270725_100000103362 [0,0,0,1,0,0|1,0,1]=3 6168 B10R1.57 C/C=C/CSCC1CCO1 62a_100000103362_100102629194 [0,0,0,1,0,0|1,1,1]=4 6169 B10R1.57 C/C=C/CSCC1CCO1 62a_100102629194_100000103362 [0,0,0,1,0,0|1,1,1]=4 6170 B10R1.57 C=CCCCOC1COC1 34a_100000758997_100009818527 [0,0,0,1,0,0|1,0,2]=4 6171 B10R1.57 C=CCCCOC1COC1 7a_100000758997_100009818527 [0,0,0,1,0,0|1,0,2]=4 6172 B10R1.57 C=CCCNCC1CCO1 2230a_100015191253_100000103362 [0,0,0,1,0,0|2,0,1]=4 6173 B10R1.57 C=CCCNC[C@@H]1CCO1 2230a_100020831831_100000754431 [0,0,0,1,0,0|2,0,1]=4 6174 B10R1.57 C=CCCNC[C@@H]1CCO1 34a_100020831831_100000754431 [0,0,0,1,0,0|2,0,1]=4 6175 B10R1.57 C=CCCOCC1CCC1 34a_100000760304_100000754431 [0,0,0,1,0,0|2,0,1]=4 6176 B10R1.57 C=CCCOCC1CCC1 34a_100011205117_100000763275 [0,0,0,1,0,0|2,0,1]=4 6177 B10R1.57 C=CCCOCC1CCO1 34a_100000039022_100000754431 [0,0,0,1,0,0|1,0,1]=3 6178 B10R1.57 C=CCCOCC1CCO1 34a_100011205117_100000103362 [0,0,0,1,0,0|1,0,1]=3 6179 B10R1.57 C=CCCSCC1CCO1 62a_100000103362_100000754431 [0,0,0,1,0,0|1,1,1]=4 6180 B10R1.57 C=CCCSCC1CCO1 62a_100000754431_100000103362 [0,0,0,1,0,0|1,1,1]=4 6181 B10R1.57 C=COCCNC1COC1 2230a_100016991112_100000039644 [0,0,0,1,0,0|1,0,2]=4 6182 B10R1.57 C=COCCOC1CCC1 34a_100000033082_100000749161 [0,0,0,1,0,0|1,0,2]=4 6183 B10R1.57 C=COCCOC1CCC1 34a_100000748187_100000039644 [0,0,0,1,0,0|1,0,2]=4 6184 B10R1.57 C=COCCOC1COC1 34a_100000033082_100009818527 [0,0,0,1,0,0|0,0,2]=3 6185 B10R1.57 C=COCCOC1CSC1 7a_100000072292_100000039644 [0,0,0,1,0,0|0,1,2]=4 6186 B10R1.57 C=COCCSC1COC1 62a_100000039644_100009818527 [0,0,0,1,0,0|0,1,2]=4 6187 B10R1.57 CC#CCCOC1CCC1 34a_100000750427_100000749161 [0,0,0,1,0,0|2,0,1]=4 6188 B10R1.57 CC#CCCOC1COC1 34a_100000750427_100009818527 [0,0,0,1,0,0|1,0,1]=3 6189 B10R1.57 CC#CCNCC1CCO1 2230a_100000685387_100000103362 [0,0,0,1,0,0|2,0,1]=4 6190 B10R1.57 CC#CCNCC1CCO1 34a_100000685387_100000103362 [0,0,0,1,0,0|2,0,1]=4 6191 B10R1.57 CC#CCNC[C@@H]1CCO1 2230a_100020831831_100000748600 [0,0,0,1,0,0|2,0,1]=4 6192 B10R1.57 CC#CCNC[C@@H]1CCO1 34a_100020831831_100000748600 [0,0,0,1,0,0|2,0,1]=4 6193 B10R1.57 CC#CCOCC1CCC1 34a_100000760304_100000748600 [0,0,0,1,0,0|2,0,1]=4 6194 B10R1.57 CC#CCOCC1CCC1 34a_100000761923_100000763275 [0,0,0,1,0,0|2,0,1]=4 6195 B10R1.57 CC#CCOCC1CCO1 34a_100000039022_100000748600 [0,0,0,1,0,0|1,0,1]=3 6196 B10R1.57 CC#CCOCC1CCO1 34a_100000761923_100000103362 [0,0,0,1,0,0|1,0,1]=3 6197 B10R1.57 CC#CCSCC1CCO1 62a_100000103362_100000748600 [0,0,0,1,0,0|1,1,1]=4 6198 B10R1.57 CC#CCSCC1CCO1 62a_100000748600_100000103362 [0,0,0,1,0,0|1,1,1]=4 6199 B10R1.57 CC/C=C\CNC1COC1 2230a_100016991112_100103147603 [0,0,0,1,0,0|2,0,1]=4 6200 B10R1.57 CC/C=C\COC1CCC1 34a_100000748187_100103147603 [0,0,0,1,0,0|2,0,1]=4 6201 B10R1.57 CC/C=C\COC1CCC1 34a_100016268518_100000749161 [0,0,0,1,0,0|2,0,1]=4 6202 B10R1.57 CC/C=C\COC1COC1 34a_100016268518_100009818527 [0,0,0,1,0,0|1,0,1]=3 6203 B10R1.57 CC/C=C\COC1CSC1 7a_100000072292_100103147603 [0,0,0,1,0,0|1,1,1]=4 6204 B10R1.57 CC/C=C\CSC1COC1 62a_100103147603_100009818527 [0,0,0,1,0,0|1,1,1]=4 6205 B10R1.57 CC=CCNC[C@@H]1CCO1 2230a_100020831831_100000070051 [0,0,0,1,0,0|2,0,1]=4 6206 B10R1.57 CC=CCNC[C@@H]1CCO1 34a_100020831831_100000070051 [0,0,0,1,0,0|2,0,1]=4 6207 B10R1.57 CC=CCOCC1CCC1 34a_100000760304_100000070051 [0,0,0,1,0,0|2,0,1]=4 6208 B10R1.57 CC=CCOCC1CCO1 34a_100000039022_100000070051 [0,0,0,1,0,0|1,0,1]=3 6209 B10R1.57 CC=CCSCC1CCO1 62a_100000070051_100000103362 [0,0,0,1,0,0|1,1,1]=4 6210 B10R1.57 CC=CCSCC1CCO1 62a_100000103362_100000070051 [0,0,0,1,0,0|1,1,1]=4 6211 B10R1.57 CCC#CCNC1COC1 2230a_100016991112_100009813939 [0,0,0,1,0,0|2,0,1]=4 6212 B10R1.57 CCC#CCOC1CCC1 34a_100000032950_100000749161 [0,0,0,1,0,0|2,0,1]=4 6213 B10R1.57 CCC#CCOC1CCC1 34a_100000748187_100009813939 [0,0,0,1,0,0|2,0,1]=4 6214 B10R1.57 CCC#CCOC1COC1 34a_100000032950_100009818527 [0,0,0,1,0,0|1,0,1]=3 6215 B10R1.57 CCC#CCOC1CSC1 7a_100000072292_100009813939 [0,0,0,1,0,0|1,1,1]=4 6216 B10R1.57 CCC#CCSC1COC1 62a_100009813939_100009818527 [0,0,0,1,0,0|1,1,1]=4 6217 B10R1.57 CCCCCNC1CCC1 2230a_100000749019_100000210326 [0,0,0,1,0,0|3,0,0]=4 6218 B10R1.57 CCCCCNC1CCC1 270004a_100000209983_100000241760 [0,0,0,1,0,0|3,0,0]=4 6219 B10R1.57 CCCCCNC1CCC1 34a_100000749019_100000718602 [0,0,0,1,0,0|3,0,0]=4 6220 B10R1.57 CCCCCNC1COC1 2230a_100016991112_100000210326 [0,0,0,1,0,0|2,0,0]=3 6221 B10R1.57 CCCCCOC1CCC1 34a_100000210253_100000749161 [0,0,0,1,0,0|2,0,0]=3 6222 B10R1.57 CCCCCOC1CCC1 34a_100000748187_100000718602 [0,0,0,1,0,0|2,0,0]=3 6223 B10R1.57 CCCCCOC1COC1 34a_100000210253_100009818527 [0,0,0,1,0,0|1,0,0]=2 6224 B10R1.57 CCCCCOC1COC1 7a_100000210253_100009818527 [0,0,0,1,0,0|1,0,0]=2 6225 B10R1.57 CCCCCOC1CSC1 7a_100000072292_100000210326 [0,0,0,1,0,0|1,1,0]=3 6226 B10R1.57 CCCCCSC1CCC1 62a_100000210326_100000749161 [0,0,0,1,0,0|2,1,0]=4 6227 B10R1.57 CCCCCSC1COC1 62a_100000210326_100009818527 [0,0,0,1,0,0|1,1,0]=3 6228 B10R1.57 CCCCNCC1CCC1 2230a_100000102301_100000763275 [0,0,0,1,0,0|3,0,0]=4 6229 B10R1.57 CCCCNCC1CCC1 2230a_100000738700_100000210211 [0,0,0,1,0,0|3,0,0]=4 6230 B10R1.57 CCCCNCC1CCC1 269862a_100000102301_100000753134 [0,0,0,1,0,0|3,0,0]=4 6231 B10R1.57 CCCCNCC1CCC1 34a_100000738700_100000210210 [0,0,0,1,0,0|3,0,0]=4 6232 B10R1.57 CCCCNCC1CCC1 7a_106832991798_100000763275 [0,0,0,1,0,0|3,0,0]=4 6233 B10R1.57 CCCCNCC1CCO1 2230a_100000102301_100000103362 [0,0,0,1,0,0|2,0,0]=3 6234 B10R1.57 CCCCNCC1CCO1 7a_106832991798_100000103362 [0,0,0,1,0,0|2,0,0]=3 6235 B10R1.57 CCCCNCC1COC1 2230a_100000102301_100010264016 [0,0,0,1,0,0|3,0,0]=4 6236 B10R1.57 CCCCNCC1COC1 2230a_100015281925_100000210211 [0,0,0,1,0,0|3,0,0]=4 6237 B10R1.57 CCCCNCC1COC1 34a_100015281925_100000210210 [0,0,0,1,0,0|3,0,0]=4 6238 B10R1.57 CCCCNCC1COC1 7a_106832991798_100010264016 [0,0,0,1,0,0|3,0,0]=4 6239 B10R1.57 CCCCNC[C@@H]1CCO1 2230a_100020831831_100000210211 [0,0,0,1,0,0|2,0,0]=3 6240 B10R1.57 CCCCNC[C@@H]1CCO1 34a_100020831831_100000210210 [0,0,0,1,0,0|2,0,0]=3 6241 B10R1.57 CCCCOCC1CCC1 34a_100000210227_100000763275 [0,0,0,1,0,0|2,0,0]=3 6242 B10R1.57 CCCCOCC1CCC1 34a_100000760304_100000210210 [0,0,0,1,0,0|2,0,0]=3 6243 B10R1.57 CCCCOCC1CCC1 7a_100000210227_100000763275 [0,0,0,1,0,0|2,0,0]=3 6244 B10R1.57 CCCCOCC1CCO1 34a_100000039022_100000210210 [0,0,0,1,0,0|1,0,0]=2 6245 B10R1.57 CCCCOCC1CCO1 34a_100000210227_100000103362 [0,0,0,1,0,0|1,0,0]=2 6246 B10R1.57 CCCCOCC1CCO1 7a_100000210227_100000103362 [0,0,0,1,0,0|1,0,0]=2 6247 B10R1.57 CCCCOCC1CNC1 34a_100016987283_100000210210 [0,0,0,1,0,0|3,0,0]=4 6248 B10R1.57 CCCCOCC1COC1 34a_100000060846_100000210210 [0,0,0,1,0,0|3,0,0]=4 6249 B10R1.57 CCCCOCC1COC1 34a_100000210227_100010264016 [0,0,0,1,0,0|3,0,0]=4 6250 B10R1.57 CCCCOCC1COC1 7a_100000210227_100010264016 [0,0,0,1,0,0|3,0,0]=4 6251 B10R1.57 CCCCOCN1CCC1 269982a_100000754969_100011995733 [0,0,0,1,0,0|3,0,0]=4 6252 B10R1.57 CCCCSCC1CCC1 62a_100000210211_100000763275 [0,0,0,1,0,0|2,1,0]=4 6253 B10R1.57 CCCCSCC1CCC1 62a_100000763275_100000210210 [0,0,0,1,0,0|2,1,0]=4 6254 B10R1.57 CCCCSCC1CCO1 62a_100000103362_100000210210 [0,0,0,1,0,0|1,1,0]=3 6255 B10R1.57 CCCCSCC1CCO1 62a_100000210211_100000103362 [0,0,0,1,0,0|1,1,0]=3 6256 B10R1.57 CCCCSCC1COC1 62a_100000210211_100010264016 [0,0,0,1,0,0|3,0,0]=4 6257 B10R1.57 CCCCSCC1COC1 62a_100010264016_100000210210 [0,0,0,1,0,0|3,0,0]=4 6258 B10R1.57 CCCOCCC1COC1 34a_100009855314_100000210303 [0,0,0,1,0,0|3,0,0]=4 6259 B10R1.57 CCOCCCN1CCC1 269982a_100000754969_100012232248 [0,0,0,1,0,0|3,0,0]=4 6260 B10R1.57 CCOCCNC1CCC1 2230a_100000749019_100011215890 [0,0,0,1,0,0|2,0,0]=3 6261 B10R1.57 CCOCCNC1CCC1 270004a_102516460346_100000241760 [0,0,0,1,0,0|2,0,0]=3 6262 B10R1.57 CCOCCNC1CCC1 34a_100000749019_100000210147 [0,0,0,1,0,0|2,0,0]=3 6263 B10R1.57 CCOCCNC1CCC1 34a_102516460346_100000749161 [0,0,0,1,0,0|2,0,0]=3 6264 B10R1.57 CCOCCNC1COC1 2230a_100016991112_100011215890 [0,0,0,1,0,0|1,0,0]=2 6265 B10R1.57 CCOCCNC1COC1 34a_102516460346_100009818527 [0,0,0,1,0,0|1,0,0]=2 6266 B10R1.57 CCOCCOC1CCC1 34a_100000210136_100000749161 [0,0,0,1,0,0|1,0,0]=2 6267 B10R1.57 CCOCCOC1CCC1 34a_100000748187_100000210147 [0,0,0,1,0,0|1,0,0]=2 6268 B10R1.57 CCOCCOC1COC1 34a_100000210136_100009818527 [0,0,0,1,0,0|0,0,0]=1 6269 B10R1.57 CCOCCOC1COC1 7a_100000210136_100009818527 [0,0,0,1,0,0|0,0,0]=1 6270 B10R1.57 CCOCCOC1CSC1 7a_100000072292_100011215890 [0,0,0,1,0,0|0,1,0]=2 6271 B10R1.57 CCOCCSC1CCC1 62a_100000210147_100000749161 [0,0,0,1,0,0|1,1,0]=3 6272 B10R1.57 CCOCCSC1COC1 62a_100000210147_100009818527 [0,0,0,1,0,0|0,1,0]=2 6273 B10R1.57 CCOCSCC1CCC1 62a_100000739092_100000763275 [0,0,0,1,0,0|3,0,0]=4 6274 B10R1.57 CCOCSCC1CCC1 62a_100000763275_100000739092 [0,0,0,1,0,0|3,0,0]=4 6275 B10R1.57 CCOCSCC1CCO1 62a_100000103362_100000739092 [0,0,0,1,0,0|2,1,0]=4 6276 B10R1.57 CCOCSCC1CCO1 62a_100000739092_100000103362 [0,0,0,1,0,0|2,1,0]=4 6277 B10R1.57 CCOCSCC1COC1 62a_100000739092_100010264016 [0,0,0,1,0,0|2,0,0]=3 6278 B10R1.57 CCOCSCC1COC1 62a_100010264016_100000739092 [0,0,0,1,0,0|2,0,0]=3 6279 B10R1.57 CCSCCNC1CCC1 2230a_100000749019_100000757381 [0,0,0,1,0,0|2,1,0]=4 6280 B10R1.57 CCSCCNC1CCC1 270004a_100000106463_100000241760 [0,0,0,1,0,0|2,1,0]=4 6281 B10R1.57 CCSCCNC1CCC1 34a_100000749019_100000757381 [0,0,0,1,0,0|2,1,0]=4 6282 B10R1.57 CCSCCNC1COC1 2230a_100016991112_100000757381 [0,0,0,1,0,0|1,1,0]=3 6283 B10R1.57 CCSCCOC1CCC1 34a_100000212035_100000749161 [0,0,0,1,0,0|1,1,0]=3 6284 B10R1.57 CCSCCOC1CCC1 34a_100000748187_100000757381 [0,0,0,1,0,0|1,1,0]=3 6285 B10R1.57 CCSCCOC1COC1 34a_100000212035_100009818527 [0,0,0,1,0,0|0,1,0]=2 6286 B10R1.57 CCSCCOC1COC1 7a_100000212035_100009818527 [0,0,0,1,0,0|0,1,0]=2 6287 B10R1.57 CCSCCOC1CSC1 7a_100000072292_100000757381 [0,0,0,1,0,0|0,2,0]=3 6288 B10R1.57 CCSCCSC1CCC1 62a_100000757381_100000749161 [0,0,0,1,0,0|1,2,0]=4 6289 B10R1.57 CCSCCSC1COC1 62a_100000757381_100009818527 [0,0,0,1,0,0|0,2,0]=3 6290 B10R1.57 CNCCCOC1CCC1 34a_100000213112_100000749161 [0,0,0,1,0,0|3,0,0]=4 6291 B10R1.57 CNCCCOC1COC1 34a_100000213112_100009818527 [0,0,0,1,0,0|2,0,0]=3 6292 B10R1.57 COCCCCN1CCC1 269982a_100000754969_100000730899 [0,0,0,1,0,0|3,0,0]=4 6293 B10R1.57 COCCCNC1CCC1 2230a_100000749019_100000740836 [0,0,0,1,0,0|3,0,0]=4 6294 B10R1.57 COCCCNC1CCC1 270004a_100150723488_100000241760 [0,0,0,1,0,0|3,0,0]=4 6295 B10R1.57 COCCCNC1CCC1 34a_100000749019_100000740836 [0,0,0,1,0,0|3,0,0]=4 6296 B10R1.57 COCCCNC1CCC1 34a_100150723488_100000749161 [0,0,0,1,0,0|3,0,0]=4 6297 B10R1.57 COCCCNC1COC1 2230a_100016991112_100000740836 [0,0,0,1,0,0|3,0,0]=4 6298 B10R1.57 COCCCNC1COC1 34a_100150723488_100009818527 [0,0,0,1,0,0|3,0,0]=4 6299 B10R1.57 COCCCOC1CCC1 34a_100000740835_100000749161 [0,0,0,1,0,0|3,0,0]=4 6300 B10R1.57 COCCCOC1CCC1 34a_100000748187_100000740836 [0,0,0,1,0,0|3,0,0]=4 6301 B10R1.57 COCCCOC1COC1 34a_100000740835_100009818527 [0,0,0,1,0,0|2,0,0]=3 6302 B10R1.57 COCCCOC1CSC1 7a_100000072292_100000740836 [0,0,0,1,0,0|2,1,0]=4 6303 B10R1.57 COCCCSC1CCC1 62a_100000709357_100000749161 [0,0,0,1,0,0|3,0,0]=4 6304 B10R1.57 COCCCSC1COC1 62a_100000709357_100009818527 [0,0,0,1,0,0|2,1,0]=4 6305 B10R1.57 COCCNCC1CCC1 2230a_100000209980_100000763275 [0,0,0,1,0,0|2,0,0]=3 6306 B10R1.57 COCCNCC1CCC1 2230a_100000738700_100011201679 [0,0,0,1,0,0|2,0,0]=3 6307 B10R1.57 COCCNCC1CCC1 269862a_100000209980_100000753134 [0,0,0,1,0,0|2,0,0]=3 6308 B10R1.57 COCCNCC1CCC1 34a_100000738700_100011201679 [0,0,0,1,0,0|2,0,0]=3 6309 B10R1.57 COCCNCC1CCO1 2230a_100000209980_100000103362 [0,0,0,1,0,0|1,0,0]=2 6310 B10R1.57 COCCNCC1COC1 2230a_100000209980_100010264016 [0,0,0,1,0,0|3,0,0]=4 6311 B10R1.57 COCCNCC1COC1 2230a_100015281925_100011201679 [0,0,0,1,0,0|3,0,0]=4 6312 B10R1.57 COCCNCC1COC1 34a_100015281925_100011201679 [0,0,0,1,0,0|3,0,0]=4 6313 B10R1.57 COCCNC[C@@H]1CCO1 2230a_100020831831_100011201679 [0,0,0,1,0,0|1,0,0]=2 6314 B10R1.57 COCCNC[C@@H]1CCO1 34a_100020831831_100011201679 [0,0,0,1,0,0|1,0,0]=2 6315 B10R1.57 COCCOCC1CCC1 34a_100000210237_100000763275 [0,0,0,1,0,0|1,0,0]=2 6316 B10R1.57 COCCOCC1CCC1 34a_100000760304_100011201679 [0,0,0,1,0,0|1,0,0]=2 6317 B10R1.57 COCCOCC1CCO1 34a_100000039022_100011201679 [0,0,0,1,0,0|0,0,0]=1 6318 B10R1.57 COCCOCC1CCO1 34a_100000210237_100000103362 [0,0,0,1,0,0|0,0,0]=1 6319 B10R1.57 COCCOCC1CNC1 34a_100016987283_100011201679 [0,0,0,1,0,0|2,0,0]=3 6320 B10R1.57 COCCOCC1COC1 34a_100000060846_100011201679 [0,0,0,1,0,0|2,0,0]=3 6321 B10R1.57 COCCOCC1COC1 34a_100000210237_100010264016 [0,0,0,1,0,0|2,0,0]=3 6322 B10R1.57 COCCOCN1CCC1 269982a_100000754969_100000231047 [0,0,0,1,0,0|2,0,0]=3 6323 B10R1.57 COCCSCC1CCC1 62a_100000233755_100000763275 [0,0,0,1,0,0|1,1,0]=3 6324 B10R1.57 COCCSCC1CCC1 62a_100000763275_100000233755 [0,0,0,1,0,0|1,1,0]=3 6325 B10R1.57 COCCSCC1CCO1 62a_100000103362_100000233755 [0,0,0,1,0,0|0,1,0]=2 6326 B10R1.57 COCCSCC1CCO1 62a_100000233755_100000103362 [0,0,0,1,0,0|0,1,0]=2 6327 B10R1.57 COCCSCC1COC1 62a_100000233755_100010264016 [0,0,0,1,0,0|2,1,0]=4 6328 B10R1.57 COCCSCC1COC1 62a_100010264016_100000233755 [0,0,0,1,0,0|2,1,0]=4 6329 B10R1.57 CSCCCOC1CCC1 34a_100000690336_100000749161 [0,0,0,1,0,0|3,0,0]=4 6330 B10R1.57 CSCCCOC1COC1 34a_100000690336_100009818527 [0,0,0,1,0,0|2,0,0]=3 6331 B10R1.57 CSCCCOC1COC1 7a_100000690336_100009818527 [0,0,0,1,0,0|2,0,0]=3 6332 B10R1.57 CSCCNCC1CCC1 2230a_100000738700_100000751147 [0,0,0,1,0,0|2,1,0]=4 6333 B10R1.57 CSCCNCC1CCC1 2230a_100020590264_100000763275 [0,0,0,1,0,0|2,1,0]=4 6334 B10R1.57 CSCCNCC1CCC1 269862a_100020590264_100000753134 [0,0,0,1,0,0|2,1,0]=4 6335 B10R1.57 CSCCNCC1CCC1 34a_100000738700_100000212216 [0,0,0,1,0,0|2,1,0]=4 6336 B10R1.57 CSCCNCC1CCO1 2230a_100020590264_100000103362 [0,0,0,1,0,0|1,1,0]=3 6337 B10R1.57 CSCCNC[C@@H]1CCO1 2230a_100020831831_100000751147 [0,0,0,1,0,0|1,1,0]=3 6338 B10R1.57 CSCCNC[C@@H]1CCO1 34a_100020831831_100000212216 [0,0,0,1,0,0|1,1,0]=3 6339 B10R1.57 CSCCOCC1CCC1 34a_100000230434_100000763275 [0,0,0,1,0,0|1,1,0]=3 6340 B10R1.57 CSCCOCC1CCC1 34a_100000760304_100000212216 [0,0,0,1,0,0|1,1,0]=3 6341 B10R1.57 CSCCOCC1CCC1 7a_100000230434_100000763275 [0,0,0,1,0,0|1,1,0]=3 6342 B10R1.57 CSCCOCC1CCO1 34a_100000039022_100000212216 [0,0,0,1,0,0|0,1,0]=2 6343 B10R1.57 CSCCOCC1CCO1 34a_100000230434_100000103362 [0,0,0,1,0,0|0,1,0]=2 6344 B10R1.57 CSCCOCC1CCO1 7a_100000230434_100000103362 [0,0,0,1,0,0|0,1,0]=2 6345 B10R1.57 CSCCOCC1CNC1 34a_100016987283_100000212216 [0,0,0,1,0,0|2,1,0]=4 6346 B10R1.57 CSCCOCC1COC1 34a_100000060846_100000212216 [0,0,0,1,0,0|2,1,0]=4 6347 B10R1.57 CSCCOCC1COC1 34a_100000230434_100010264016 [0,0,0,1,0,0|2,1,0]=4 6348 B10R1.57 CSCCOCC1COC1 7a_100000230434_100010264016 [0,0,0,1,0,0|2,1,0]=4 6349 B10R1.57 CSCCSCC1CCC1 62a_100000212216_100000763275 [0,0,0,1,0,0|1,2,0]=4 6350 B10R1.57 CSCCSCC1CCC1 62a_100000763275_100000751147 [0,0,0,1,0,0|1,2,0]=4 6351 B10R1.57 CSCCSCC1CCO1 62a_100000103362_100000751147 [0,0,0,1,0,0|0,2,0]=3 6352 B10R1.57 CSCCSCC1CCO1 62a_100000212216_100000103362 [0,0,0,1,0,0|0,2,0]=3 6353 B10R1.57 ClCC#CCOC1COC1 34a_200000047223_100009818527 [0,0,0,1,0,0|2,0,1]=4 6354 B10R1.57 ClCCCCOC1CCC1 34a_100000210776_100000749161 [0,0,0,1,0,0|3,0,0]=4 6355 B10R1.57 ClCCCCOC1COC1 34a_100000210776_100009818527 [0,0,0,1,0,0|2,0,0]=3 6356 B10R1.57 ClCCCCOC1COC1 7a_100000210776_100009818527 [0,0,0,1,0,0|2,0,0]=3 6357 B10R1.57 ClCCCOCC1CCC1 34a_100000230001_100000763275 [0,0,0,1,0,0|3,0,0]=4 6358 B10R1.57 ClCCCOCC1CCO1 34a_100000230001_100000103362 [0,0,0,1,0,0|2,0,0]=3 6359 B10R1.57 FCCCCNC1COC1 2230a_100016991112_100000729493 [0,0,0,1,0,0|3,0,0]=4 6360 B10R1.57 FCCCCOC1CCC1 34a_100000748187_100000729493 [0,0,0,1,0,0|3,0,0]=4 6361 B10R1.57 FCCCCOC1CCC1 34a_100011995726_100000749161 [0,0,0,1,0,0|3,0,0]=4 6362 B10R1.57 FCCCCOC1COC1 34a_100011995726_100009818527 [0,0,0,1,0,0|2,0,0]=3 6363 B10R1.57 FCCCCOC1COC1 7a_100011995726_100009818527 [0,0,0,1,0,0|2,0,0]=3 6364 B10R1.57 FCCCCOC1CSC1 7a_100000072292_100000729493 [0,0,0,1,0,0|2,1,0]=4 6365 B10R1.57 FCCCCSC1COC1 62a_100000729493_100009818527 [0,0,0,1,0,0|2,1,0]=4 6366 B10R1.57 FCCCNCC1CCO1 2230a_100015189416_100000103362 [0,0,0,1,0,0|3,0,0]=4 6367 B10R1.57 FCCCNCC1CCO1 34a_100015189416_100000103362 [0,0,0,1,0,0|3,0,0]=4 6368 B10R1.57 FCCCNC[C@@H]1CCO1 2230a_100020831831_100011934791 [0,0,0,1,0,0|3,0,0]=4 6369 B10R1.57 FCCCNC[C@@H]1CCO1 34a_100020831831_100011934791 [0,0,0,1,0,0|3,0,0]=4 6370 B10R1.57 FCCCOCC1CCC1 34a_100000759539_100000763275 [0,0,0,1,0,0|3,0,0]=4 6371 B10R1.57 FCCCOCC1CCC1 34a_100000760304_100011934791 [0,0,0,1,0,0|3,0,0]=4 6372 B10R1.57 FCCCOCC1CCO1 34a_100000039022_100011934791 [0,0,0,1,0,0|2,0,0]=3 6373 B10R1.57 FCCCOCC1CCO1 34a_100000759539_100000103362 [0,0,0,1,0,0|2,0,0]=3 6374 B10R1.57 FCCCSCC1CCO1 62a_100000103362_100011934791 [0,0,0,1,0,0|2,1,0]=4 6375 B10R1.57 FCCCSCC1CCO1 62a_100011934791_100000103362 [0,0,0,1,0,0|2,1,0]=4 6376 B10R1.57 ICCCCOC1CCC1 34a_200012148704_100000749161 [0,0,0,1,0,0|3,0,0]=4 6377 B10R1.57 ICCCCOC1COC1 34a_200012148704_100009818527 [0,0,0,1,0,0|2,0,0]=3 6378 B10R1.57 N#CCCNC[C@@H]1CCO1 2230a_100020831831_100011215226 [0,0,0,1,0,0|3,0,0]=4 6379 B10R1.57 N#CCCSCC1CCO1 62a_100000103362_100011215226 [0,0,0,1,0,0|2,1,0]=4 6380 B10R1.57 N#CCCSCC1CCO1 62a_100011215226_100000103362 [0,0,0,1,0,0|2,1,0]=4 6381 B10R1.57 NCCCCOC1CCC1 34a_100000750430_100000749161 [0,0,0,1,0,0|3,0,0]=4 6382 B10R1.57 NCCCCOC1COC1 34a_100000750430_100009818527 [0,0,0,1,0,0|2,0,0]=3 6383 B10R1.57 NCCCOCC1CCC1 34a_100000182051_100000763275 [0,0,0,1,0,0|3,0,0]=4 6384 B10R1.57 NCCCOCC1CCO1 34a_100000182051_100000103362 [0,0,0,1,0,0|2,0,0]=3 6385 B10R1.57 NOCCOCC1CCC1 34a_100000700252_100000763275 [0,0,0,1,0,0|2,0,0]=3 6386 B10R1.57 NOCCOCC1CCO1 34a_100000700252_100000103362 [0,0,0,1,0,0|1,0,0]=2 6387 B10R1.57 NOCCOCC1COC1 34a_100000700252_100010264016 [0,0,0,1,0,0|3,0,0]=4 6388 B10R1.57 OCCCCNC1COC1 2230a_100016991112_100000210776 [0,0,0,1,0,0|3,0,0]=4 6389 B10R1.57 OCCCCNC1COC1 34a_100000750430_100009818527 [0,0,0,1,0,0|3,0,0]=4 6390 B10R1.57 OCCCCOC1CCC1 34a_100000748187_100011216708 [0,0,0,1,0,0|3,0,0]=4 6391 B10R1.57 OCCCCOC1CSC1 7a_100000072292_100000210776 [0,0,0,1,0,0|2,1,0]=4 6392 B10R1.57 OCCCCSC1COC1 62a_100000210776_100009818527 [0,0,0,1,0,0|2,1,0]=4 6393 B10R1.57 OCCCNC[C@@H]1CCO1 2230a_100020831831_100000230001 [0,0,0,1,0,0|3,0,0]=4 6394 B10R1.57 OCCCNC[C@@H]1CCO1 34a_100020831831_100000230001 [0,0,0,1,0,0|3,0,0]=4 6395 B10R1.57 OCCCOCC1CCC1 34a_100000760304_100000230001 [0,0,0,1,0,0|3,0,0]=4 6396 B10R1.57 OCCCOCC1CCO1 34a_100000039022_100000230001 [0,0,0,1,0,0|2,0,0]=3 6397 B10R1.57 OCCCSCC1CCO1 62a_100000103362_100011215043 [0,0,0,1,0,0|2,1,0]=4 6398 B10R1.57 OCCCSCC1CCO1 62a_100011215043_100000103362 [0,0,0,1,0,0|2,1,0]=4 6399 B10R1.78 CN1CCCCCCCC1 2230a_100000039187_200000210301 [0,0,0,1,0,0|3,0,0]=4 6400 B10R1.78 CN1CCCCCCCC1 269982a_100000039187_200000210301 [0,0,0,1,0,0|3,0,0]=4 6401 B10R1.78 CN1CCCCCCCC1 34a_100000039187_200000210301 [0,0,0,1,0,0|3,0,0]=4 6402 B10R1.78 [13CH3]N1CCCCCCCC1 2230a_100000039187_200025704644 [0,0,0,1,0,0|3,0,0]=4 6403 B10R1.78 [13CH3]N1CCCCCCCC1 269982a_100000039187_200025704644 [0,0,0,1,0,0|3,0,0]=4 6404 B10R1.78 [13CH3]N1CCCCCCCC1 34a_100000039187_200025704644 [0,0,0,1,0,0|3,0,0]=4 6405 B10R1.85 CCCN1CCCOCC1 2230a_100000685342_100000210303 [0,0,0,1,0,0|3,0,0]=4 6406 B10R1.85 CCCN1CCCOCC1 269982a_100000685342_100000210303 [0,0,0,1,0,0|3,0,0]=4 6407 B10R1.85 CCCN1CCCOCC1 34a_100000685342_100000210303 [0,0,0,1,0,0|3,0,0]=4 6408 B10R1.85 CCNC1CCCCCC1 2230a_100000210984_100000210202 [0,0,0,1,0,0|3,0,0]=4 6409 B10R1.85 CCNC1CCCCCC1 270004a_100015525214_100000210131 [0,0,0,1,0,0|3,0,0]=4 6410 B10R1.85 CCNC1CCCCCC1 34a_100000210984_100000210202 [0,0,0,1,0,0|3,0,0]=4 6411 B10R1.85 CCNC1CSCCSC1 270004a_100015525214_100000068409 [0,0,0,1,0,0|1,2,0]=4 6412 B10R1.85 CCOC1CCCCCC1 34a_100000210887_100000210202 [0,0,0,1,0,0|2,0,0]=3 6413 B10R1.85 CCOC1CCCCCC1 34a_100121572206_100011217769 [0,0,0,1,0,0|2,0,0]=3 6414 B10R1.85 CCOC1CCCCCC1 7a_100000210887_100000210202 [0,0,0,1,0,0|2,0,0]=3 6415 B10R1.85 CCSC1CCCCCC1 62a_100000210202_100011217769 [0,0,0,1,0,0|2,1,0]=4 6416 B10R1.85 CCSC1CCCCCC1 62a_100011217769_100000210202 [0,0,0,1,0,0|2,1,0]=4 6417 B10R1.85 CNCC1CCCCCC1 2230a_100015204231_200000210301 [0,0,0,1,0,0|3,0,0]=4 6418 B10R1.85 CNCC1CCCCCC1 2230a_106832991635_200000696569 [0,0,0,1,0,0|3,0,0]=4 6419 B10R1.85 CNCC1CCCCCC1 269862a_106832991636_200000763224 [0,0,0,1,0,0|3,0,0]=4 6420 B10R1.85 CNCC1CCCCCC1 34a_100015204231_200000210301 [0,0,0,1,0,0|3,0,0]=4 6421 B10R1.85 CNCC1CCCCCC1 34a_100102657272_200000696569 [0,0,0,1,0,0|3,0,0]=4 6422 B10R1.85 CNCC1CCCCCC1 7a_106832991635_200000696569 [0,0,0,1,0,0|3,0,0]=4 6423 B10R1.85 COCC1CCCCCC1 34a_100000699130_200000210301 [0,0,0,1,0,0|2,0,0]=3 6424 B10R1.85 COCC1CCCCCC1 34a_100138415774_200000696569 [0,0,0,1,0,0|2,0,0]=3 6425 B10R1.85 COCC1CCCCCC1 7a_100000699130_200000210301 [0,0,0,1,0,0|2,0,0]=3 6426 B10R1.85 COCC1CNCCOC1 34a_100103147999_200000210301 [0,0,0,1,0,0|3,0,0]=4 6427 B10R1.85 COCN1CCCCCC1 2230a_100000185865_100000766300 [0,0,0,1,0,0|3,0,0]=4 6428 B10R1.85 COCN1CCCCCC1 269982a_100000185865_100000766300 [0,0,0,1,0,0|3,0,0]=4 6429 B10R1.85 COCN1CCCOCC1 2230a_100000685342_100000766300 [0,0,0,1,0,0|2,0,0]=3 6430 B10R1.85 COCN1CCCOCC1 269982a_100000685342_100000766300 [0,0,0,1,0,0|2,0,0]=3 6431 B10R1.85 CSCC1CCCCCC1 62a_200000210301_200000696569 [0,0,0,1,0,0|2,1,0]=4 6432 B10R1.85 CSCC1CCCCCC1 62a_200000696569_200000210301 [0,0,0,1,0,0|2,1,0]=4 6433 B10R1.85 CSCN1CCCOCC1 2230a_100000685342_100011218213 [0,0,0,1,0,0|2,1,0]=4 6434 B10R1.85 CSCN1CCCOCC1 269982a_100000685342_100011218213 [0,0,0,1,0,0|2,1,0]=4 6435 B10R1.85 CSCN1CCCOCC1 34a_100000685342_100011218213 [0,0,0,1,0,0|2,1,0]=4 6436 B10R1.85 FCOC1CCCCCC1 34a_100000210887_100015361967 [0,0,0,1,0,0|3,0,0]=4 6437 B10R1.85 FCOC1CCCCCC1 7a_100000210887_100015361967 [0,0,0,1,0,0|3,0,0]=4 6438 B10R1.85 [13CH3]NCC1CCCCCC1 2230a_100015204231_200025704644 [0,0,0,1,0,0|3,0,0]=4 6439 B10R1.85 [13CH3]NCC1CCCCCC1 34a_100015204231_200025704644 [0,0,0,1,0,0|3,0,0]=4 6440 B10R1.85 [13CH3]OCC1CCCCCC1 34a_100000699130_200025704644 [0,0,0,1,0,0|2,0,0]=3 6441 B10R1.85 [13CH3]OCC1CCCCCC1 7a_100000699130_200025704644 [0,0,0,1,0,0|2,0,0]=3 6442 B10R1.85 [13CH3]OCC1CNCCOC1 34a_100103147999_200025704644 [0,0,0,1,0,0|3,0,0]=4 6443 B10R1.85 [13CH3]SCC1CCCCCC1 62a_200000696569_200025704644 [0,0,0,1,0,0|2,1,0]=4 6444 B10R1.85 [13CH3]SCC1CCCCCC1 62a_200025704644_200000696569 [0,0,0,1,0,0|2,1,0]=4 6445 B10R1.132 CCCN1CCC1COC 2230a_100015195929_100000210303 [0,0,0,1,0,0|3,0,0]=4 6446 B10R1.132 CCCN1CCC1COC 269982a_100015195929_100000210303 [0,0,0,1,0,0|3,0,0]=4 6447 B10R1.132 CCCN1CCC1COC 34a_100015195929_100000210303 [0,0,0,1,0,0|3,0,0]=4 6448 B10R1.161 CCN1CCCCCCC1 2230a_100000211400_100000210202 [0,0,0,1,0,0|3,0,0]=4 6449 B10R1.161 CCN1CCCCCCC1 269982a_100000211400_100000204670 [0,0,0,1,0,0|3,0,0]=4 6450 B10R1.161 CCN1CCCCCCC1 34a_100000211400_100000210202 [0,0,0,1,0,0|3,0,0]=4 6451 B10R1.161 CNC1CCCCCCC1 2230a_100000211152_200000210301 [0,0,0,1,0,0|3,0,0]=4 6452 B10R1.161 CNC1CCCCCCC1 270004a_106832991635_100000210524 [0,0,0,1,0,0|3,0,0]=4 6453 B10R1.161 CNC1CCCCCCC1 34a_100000211152_200000210301 [0,0,0,1,0,0|3,0,0]=4 6454 B10R1.161 COC1C=CCCCCC1 34a_100000688657_200000210301 [0,0,0,1,0,0|2,0,1]=4 6455 B10R1.161 COC1CC/C=C\CCC1 34a_100016989180_200000210301 [0,0,0,1,0,0|2,0,1]=4 6456 B10R1.161 COC1CC/C=C\CCC1 34a_100138415774_100021000466 [0,0,0,1,0,0|2,0,1]=4 6457 B10R1.161 COC1CCCCCCC1 34a_100000210054_200000210301 [0,0,0,1,0,0|2,0,0]=3 6458 B10R1.161 COC1CCCCCCC1 7a_100000210054_200000210301 [0,0,0,1,0,0|2,0,0]=3 6459 B10R1.161 [13CH3]NC1CCCCCCC1 2230a_100000211152_200025704644 [0,0,0,1,0,0|3,0,0]=4 6460 B10R1.161 [13CH3]NC1CCCCCCC1 34a_100000211152_200025704644 [0,0,0,1,0,0|3,0,0]=4 6461 B10R1.161 [13CH3]OC1C=CCCCCC1 34a_100000688657_200025704644 [0,0,0,1,0,0|2,0,1]=4 6462 B10R1.161 [13CH3]OC1CC/C=C\CCC1 34a_100016989180_200025704644 [0,0,0,1,0,0|2,0,1]=4 6463 B10R1.161 [13CH3]OC1CCCCCCC1 34a_100000210054_200025704644 [0,0,0,1,0,0|2,0,0]=3 6464 B10R1.161 [13CH3]OC1CCCCCCC1 7a_100000210054_200025704644 [0,0,0,1,0,0|2,0,0]=3 6465 B10R1.177 BrCCCCOCC1CC1 34a_100011216708_100000742324 [0,0,0,1,0,0|3,0,0]=4 6466 B10R1.177 BrCCCCOCC1CO1 34a_100011216708_102125554688 [0,0,0,1,0,0|2,0,0]=3 6467 B10R1.177 BrCCCOCCC1CC1 34a_100011217188_100000694398 [0,0,0,1,0,0|3,0,0]=4 6468 B10R1.177 C#CCCCOCC1CO1 34a_100000215630_102125554688 [0,0,0,1,0,0|1,0,2]=4 6469 B10R1.177 C#CCCCOCC1CO1 7a_100000215630_102125554688 [0,0,0,1,0,0|1,0,2]=4 6470 B10R1.177 C#CCCCOC[C@@H]1CO1 34a_100000757423_100000695029 [0,0,0,1,0,0|1,0,2]=4 6471 B10R1.177 C#CCCCOC[C@@H]1CO1 7a_100000215630_100000745022 [0,0,0,1,0,0|1,0,2]=4 6472 B10R1.177 C#CCCOCCC1CC1 34a_100000754188_100000688953 [0,0,0,1,0,0|2,0,1]=4 6473 B10R1.177 C#CCCOCCC1CC1 34a_100011215631_100000694398 [0,0,0,1,0,0|2,0,1]=4 6474 B10R1.177 C#CCCOCCC1CC1 7a_100000754188_100000688953 [0,0,0,1,0,0|2,0,1]=4 6475 B10R1.177 C/C=C/CCOCC1CC1 34a_100016278192_100000742324 [0,0,0,1,0,0|2,0,1]=4 6476 B10R1.177 C/C=C/CCOCC1CO1 34a_100016278192_102125554688 [0,0,0,1,0,0|1,0,1]=3 6477 B10R1.177 C/C=C/COCCC1CC1 34a_100000754188_100102629194 [0,0,0,1,0,0|2,0,1]=4 6478 B10R1.177 C/C=C/COCCC1CC1 34a_100016270725_100000694398 [0,0,0,1,0,0|2,0,1]=4 6479 B10R1.177 C/C=C/COCCC1CC1 7a_100000754188_100102629194 [0,0,0,1,0,0|2,0,1]=4 6480 B10R1.177 C=CCCCOCC1CO1 34a_100000758997_102125554688 [0,0,0,1,0,0|1,0,2]=4 6481 B10R1.177 C=CCCCOCC1CO1 7a_100000758997_102125554688 [0,0,0,1,0,0|1,0,2]=4 6482 B10R1.177 C=CCCCOC[C@@H]1CO1 34a_100000757423_100000757094 [0,0,0,1,0,0|1,0,2]=4 6483 B10R1.177 C=CCCCOC[C@@H]1CO1 7a_100000758997_100000745022 [0,0,0,1,0,0|1,0,2]=4 6484 B10R1.177 C=CCCOCCC1CC1 34a_100000754188_100000754431 [0,0,0,1,0,0|2,0,1]=4 6485 B10R1.177 C=CCCOCCC1CC1 34a_100011205117_100000694398 [0,0,0,1,0,0|2,0,1]=4 6486 B10R1.177 C=CCCOCCC1CC1 7a_100000754188_100000754431 [0,0,0,1,0,0|2,0,1]=4 6487 B10R1.177 C=COCCOCC1CC1 34a_100000033082_100000742324 [0,0,0,1,0,0|1,0,2]=4 6488 B10R1.177 C=COCCOCC1CC1 34a_100000211283_100000039644 [0,0,0,1,0,0|1,0,2]=4 6489 B10R1.177 C=COCCOCC1CO1 34a_100000033082_102125554688 [0,0,0,1,0,0|0,0,2]=3 6490 B10R1.177 C=COCCOC[C@@H]1CO1 34a_100000757423_100000039644 [0,0,0,1,0,0|0,0,2]=3 6491 B10R1.177 C=COCCSCC1CO1 62a_100000039644_102125554688 [0,0,0,1,0,0|0,1,2]=4 6492 B10R1.177 C=COCCSCC1CO1 62a_102125554688_100000039644 [0,0,0,1,0,0|0,1,2]=4 6493 B10R1.177 C=COCCSC[C@@H]1CO1 62a_100000039644_100000745022 [0,0,0,1,0,0|0,1,2]=4 6494 B10R1.177 C=COCCSC[C@@H]1CO1 62a_100000745022_100000039644 [0,0,0,1,0,0|0,1,2]=4 6495 B10R1.177 CC#CCCOCC1CC1 34a_100000750427_100000742324 [0,0,0,1,0,0|2,0,1]=4 6496 B10R1.177 CC#CCCOCC1CO1 34a_100000750427_102125554688 [0,0,0,1,0,0|1,0,1]=3 6497 B10R1.177 CC#CCOCCC1CC1 34a_100000754188_100000748600 [0,0,0,1,0,0|2,0,1]=4 6498 B10R1.177 CC#CCOCCC1CC1 34a_100000761923_100000694398 [0,0,0,1,0,0|2,0,1]=4 6499 B10R1.177 CC#CCOCCC1CC1 7a_100000754188_100000748600 [0,0,0,1,0,0|2,0,1]=4 6500 B10R1.177 CC/C=C\COCC1CC1 34a_100000211283_100103147603 [0,0,0,1,0,0|2,0,1]=4 6501 B10R1.177 CC/C=C\COCC1CC1 34a_100016268518_100000742324 [0,0,0,1,0,0|2,0,1]=4 6502 B10R1.177 CC/C=C\COCC1CO1 34a_100016268518_102125554688 [0,0,0,1,0,0|1,0,1]=3 6503 B10R1.177 CC/C=C\COC[C@@H]1CO1 34a_100000757423_100103147603 [0,0,0,1,0,0|1,0,1]=3 6504 B10R1.177 CC/C=C\CSCC1CO1 62a_100103147603_102125554688 [0,0,0,1,0,0|1,1,1]=4 6505 B10R1.177 CC/C=C\CSCC1CO1 62a_102125554688_100103147603 [0,0,0,1,0,0|1,1,1]=4 6506 B10R1.177 CC/C=C\CSC[C@@H]1CO1 62a_100000745022_100103147603 [0,0,0,1,0,0|1,1,1]=4 6507 B10R1.177 CC/C=C\CSC[C@@H]1CO1 62a_100103147603_100000745022 [0,0,0,1,0,0|1,1,1]=4 6508 B10R1.177 CC=CCOCCC1CC1 34a_100000754188_100000070051 [0,0,0,1,0,0|2,0,1]=4 6509 B10R1.177 CC=CCOCCC1CC1 7a_100000754188_100000070051 [0,0,0,1,0,0|2,0,1]=4 6510 B10R1.177 CCC#CCOCC1CC1 34a_100000032950_100000742324 [0,0,0,1,0,0|2,0,1]=4 6511 B10R1.177 CCC#CCOCC1CC1 34a_100000211283_100009813939 [0,0,0,1,0,0|2,0,1]=4 6512 B10R1.177 CCC#CCOCC1CO1 34a_100000032950_102125554688 [0,0,0,1,0,0|1,0,1]=3 6513 B10R1.177 CCC#CCOC[C@@H]1CO1 34a_100000757423_100009813939 [0,0,0,1,0,0|1,0,1]=3 6514 B10R1.177 CCC#CCSCC1CO1 62a_100009813939_102125554688 [0,0,0,1,0,0|1,1,1]=4 6515 B10R1.177 CCC#CCSCC1CO1 62a_102125554688_100009813939 [0,0,0,1,0,0|1,1,1]=4 6516 B10R1.177 CCC#CCSC[C@@H]1CO1 62a_100000745022_100009813939 [0,0,0,1,0,0|1,1,1]=4 6517 B10R1.177 CCC#CCSC[C@@H]1CO1 62a_100009813939_100000745022 [0,0,0,1,0,0|1,1,1]=4 6518 B10R1.177 CCCCCNCC1CC1 2230a_100000209983_100000742324 [0,0,0,1,0,0|3,0,0]=4 6519 B10R1.177 CCCCCNCC1CC1 2230a_100000735609_100000210326 [0,0,0,1,0,0|3,0,0]=4 6520 B10R1.177 CCCCCNCC1CC1 269862a_100000209983_100000741477 [0,0,0,1,0,0|3,0,0]=4 6521 B10R1.177 CCCCCNCC1CC1 34a_100000735609_100000718602 [0,0,0,1,0,0|3,0,0]=4 6522 B10R1.177 CCCCCNCC1CO1 2230a_100000209983_100011216344 [0,0,0,1,0,0|2,0,0]=3 6523 B10R1.177 CCCCCOCC1CC1 34a_100000210253_100000742324 [0,0,0,1,0,0|2,0,0]=3 6524 B10R1.177 CCCCCOCC1CC1 34a_100000211283_100000718602 [0,0,0,1,0,0|2,0,0]=3 6525 B10R1.177 CCCCCOCC1CC1 7a_100000210253_100000742324 [0,0,0,1,0,0|2,0,0]=3 6526 B10R1.177 CCCCCOCC1CO1 34a_100000210253_102125554688 [0,0,0,1,0,0|1,0,0]=2 6527 B10R1.177 CCCCCOCC1CO1 7a_100000210253_102125554688 [0,0,0,1,0,0|1,0,0]=2 6528 B10R1.177 CCCCCOCC1CS1 7a_100000210253_100000031435 [0,0,0,1,0,0|1,1,0]=3 6529 B10R1.177 CCCCCOC[C@@H]1CO1 34a_100000757423_100000718602 [0,0,0,1,0,0|1,0,0]=2 6530 B10R1.177 CCCCCOC[C@@H]1CO1 7a_100000210253_100000745022 [0,0,0,1,0,0|1,0,0]=2 6531 B10R1.177 CCCCCSCC1CC1 62a_100000210326_100000742324 [0,0,0,1,0,0|2,1,0]=4 6532 B10R1.177 CCCCCSCC1CC1 62a_100000756562_100000210326 [0,0,0,1,0,0|2,1,0]=4 6533 B10R1.177 CCCCCSCC1CO1 62a_100000210326_102125554688 [0,0,0,1,0,0|1,1,0]=3 6534 B10R1.177 CCCCCSCC1CO1 62a_102125554688_100000210326 [0,0,0,1,0,0|1,1,0]=3 6535 B10R1.177 CCCCCSCC1CS1 62a_100000031435_100000210326 [0,0,0,1,0,0|1,2,0]=4 6536 B10R1.177 CCCCCSCC1CS1 62a_100000210326_100000031435 [0,0,0,1,0,0|1,2,0]=4 6537 B10R1.177 CCCCCSC[C@@H]1CO1 62a_100000210326_100000745022 [0,0,0,1,0,0|1,1,0]=3 6538 B10R1.177 CCCCCSC[C@@H]1CO1 62a_100000745022_100000210326 [0,0,0,1,0,0|1,1,0]=3 6539 B10R1.177 CCCCNCCC1CC1 2230a_100000102301_100000694398 [0,0,0,1,0,0|3,0,0]=4 6540 B10R1.177 CCCCNCCC1CC1 34a_100000764129_100000210210 [0,0,0,1,0,0|3,0,0]=4 6541 B10R1.177 CCCCNCCC1CC1 7a_106832991798_100000764125 [0,0,0,1,0,0|3,0,0]=4 6542 B10R1.177 CCCCNCCC1CO1 2230a_100000102301_100000732470 [0,0,0,1,0,0|3,0,0]=4 6543 B10R1.177 CCCCNCCC1CO1 7a_106832991798_100000732470 [0,0,0,1,0,0|3,0,0]=4 6544 B10R1.177 CCCCOCCC1CC1 34a_100000210227_100000694398 [0,0,0,1,0,0|2,0,0]=3 6545 B10R1.177 CCCCOCCC1CC1 34a_100000754188_100000210210 [0,0,0,1,0,0|2,0,0]=3 6546 B10R1.177 CCCCOCCC1CC1 7a_100000210227_100000764125 [0,0,0,1,0,0|2,0,0]=3 6547 B10R1.177 CCCCOCCC1CC1 7a_100000754188_100000210211 [0,0,0,1,0,0|2,0,0]=3 6548 B10R1.177 CCCCOCCC1CO1 34a_100000210227_100000732470 [0,0,0,1,0,0|3,0,0]=4 6549 B10R1.177 CCCCOCCC1CO1 7a_100000210227_100000732470 [0,0,0,1,0,0|3,0,0]=4 6550 B10R1.177 CCCCOCC[C@@H]1CO1 34a_100009820653_100000210210 [0,0,0,1,0,0|3,0,0]=4 6551 B10R1.177 CCCCOCNC1CC1 34a_100000212008_100011995733 [0,0,0,1,0,0|3,0,0]=4 6552 B10R1.177 CCCCOCSC1CC1 62a_100011995733_100000211595 [0,0,0,1,0,0|3,0,0]=4 6553 B10R1.177 CCCCSCCC1CC1 62a_100000210211_100000764125 [0,0,0,1,0,0|2,1,0]=4 6554 B10R1.177 CCCCSCCC1CC1 62a_100000764125_100000210210 [0,0,0,1,0,0|2,1,0]=4 6555 B10R1.177 CCCCSCCC1CO1 62a_100000210211_100000732470 [0,0,0,1,0,0|3,0,0]=4 6556 B10R1.177 CCCCSCCC1CO1 62a_100000732470_100000210210 [0,0,0,1,0,0|3,0,0]=4 6557 B10R1.177 CCCOCCCC1CO1 34a_100000210258_100000733510 [0,0,0,1,0,0|3,0,0]=4 6558 B10R1.177 CCCSCCCC1CO1 62a_100000210303_100000733510 [0,0,0,1,0,0|3,0,0]=4 6559 B10R1.177 CCCSCCCC1CO1 62a_100000733510_100000210303 [0,0,0,1,0,0|3,0,0]=4 6560 B10R1.177 CCOCCCNC1CC1 34a_100000210961_100000211595 [0,0,0,1,0,0|3,0,0]=4 6561 B10R1.177 CCOCCCNC1CC1 34a_100000212008_100012232248 [0,0,0,1,0,0|3,0,0]=4 6562 B10R1.177 CCOCCCOC1CC1 34a_100000757476_100000211595 [0,0,0,1,0,0|3,0,0]=4 6563 B10R1.177 CCOCCCSC1CC1 62a_100012232248_100000211595 [0,0,0,1,0,0|3,0,0]=4 6564 B10R1.177 CCOCCNCC1CC1 2230a_100000735609_100011215890 [0,0,0,1,0,0|2,0,0]=3 6565 B10R1.177 CCOCCNCC1CC1 2230a_102516460346_100000742324 [0,0,0,1,0,0|2,0,0]=3 6566 B10R1.177 CCOCCNCC1CC1 269862a_100011200944_100000741477 [0,0,0,1,0,0|2,0,0]=3 6567 B10R1.177 CCOCCNCC1CC1 34a_100000735609_100000210147 [0,0,0,1,0,0|2,0,0]=3 6568 B10R1.177 CCOCCNCC1CC1 34a_102516460346_100000742324 [0,0,0,1,0,0|2,0,0]=3 6569 B10R1.177 CCOCCNCC1CO1 2230a_102516460346_100011216344 [0,0,0,1,0,0|1,0,0]=2 6570 B10R1.177 CCOCCNCC1CO1 34a_102516460346_102125554688 [0,0,0,1,0,0|1,0,0]=2 6571 B10R1.177 CCOCCOCC1CC1 34a_100000210136_100000742324 [0,0,0,1,0,0|1,0,0]=2 6572 B10R1.177 CCOCCOCC1CC1 34a_100000211283_100000210147 [0,0,0,1,0,0|1,0,0]=2 6573 B10R1.177 CCOCCOCC1CC1 7a_100000210136_100000742324 [0,0,0,1,0,0|1,0,0]=2 6574 B10R1.177 CCOCCOCC1CO1 34a_100000210136_102125554688 [0,0,0,1,0,0|0,0,0]=1 6575 B10R1.177 CCOCCOCC1CO1 7a_100000210136_102125554688 [0,0,0,1,0,0|0,0,0]=1 6576 B10R1.177 CCOCCOCC1CS1 7a_100000210136_100000031435 [0,0,0,1,0,0|0,1,0]=2 6577 B10R1.177 CCOCCOC[C@@H]1CO1 34a_100000757423_100000210147 [0,0,0,1,0,0|0,0,0]=1 6578 B10R1.177 CCOCCOC[C@@H]1CO1 7a_100000210136_100000745022 [0,0,0,1,0,0|0,0,0]=1 6579 B10R1.177 CCOCCSCC1CC1 62a_100000210147_100000742324 [0,0,0,1,0,0|1,1,0]=3 6580 B10R1.177 CCOCCSCC1CC1 62a_100000756562_100011215890 [0,0,0,1,0,0|1,1,0]=3 6581 B10R1.177 CCOCCSCC1CO1 62a_100000210147_102125554688 [0,0,0,1,0,0|0,1,0]=2 6582 B10R1.177 CCOCCSCC1CO1 62a_102125554688_100011215890 [0,0,0,1,0,0|0,1,0]=2 6583 B10R1.177 CCOCCSCC1CS1 62a_100000031435_100011215890 [0,0,0,1,0,0|0,2,0]=3 6584 B10R1.177 CCOCCSCC1CS1 62a_100000210147_100000031435 [0,0,0,1,0,0|0,2,0]=3 6585 B10R1.177 CCOCCSC[C@@H]1CO1 62a_100000210147_100000745022 [0,0,0,1,0,0|0,1,0]=2 6586 B10R1.177 CCOCCSC[C@@H]1CO1 62a_100000745022_100011215890 [0,0,0,1,0,0|0,1,0]=2 6587 B10R1.177 CCOCSCCC1CC1 62a_100000739092_100000764125 [0,0,0,1,0,0|3,0,0]=4 6588 B10R1.177 CCOCSCCC1CC1 62a_100000764125_100000739092 [0,0,0,1,0,0|3,0,0]=4 6589 B10R1.177 CCOCSCCC1CO1 62a_100000732470_100000739092 [0,0,0,1,0,0|2,0,0]=3 6590 B10R1.177 CCOCSCCC1CO1 62a_100000739092_100000732470 [0,0,0,1,0,0|2,0,0]=3 6591 B10R1.177 CCSCCNCC1CC1 2230a_100000106463_100000742324 [0,0,0,1,0,0|2,1,0]=4 6592 B10R1.177 CCSCCNCC1CC1 2230a_100000735609_100000757381 [0,0,0,1,0,0|2,1,0]=4 6593 B10R1.177 CCSCCNCC1CC1 269862a_100000106463_100000741477 [0,0,0,1,0,0|2,1,0]=4 6594 B10R1.177 CCSCCNCC1CC1 34a_100000735609_100000757381 [0,0,0,1,0,0|2,1,0]=4 6595 B10R1.177 CCSCCNCC1CO1 2230a_100000106463_100011216344 [0,0,0,1,0,0|1,1,0]=3 6596 B10R1.177 CCSCCOCC1CC1 34a_100000211283_100000757381 [0,0,0,1,0,0|1,1,0]=3 6597 B10R1.177 CCSCCOCC1CC1 34a_100000212035_100000742324 [0,0,0,1,0,0|1,1,0]=3 6598 B10R1.177 CCSCCOCC1CC1 7a_100000212035_100000742324 [0,0,0,1,0,0|1,1,0]=3 6599 B10R1.177 CCSCCOCC1CO1 34a_100000212035_102125554688 [0,0,0,1,0,0|0,1,0]=2 6600 B10R1.177 CCSCCOCC1CO1 7a_100000212035_102125554688 [0,0,0,1,0,0|0,1,0]=2 6601 B10R1.177 CCSCCOCC1CS1 7a_100000212035_100000031435 [0,0,0,1,0,0|0,2,0]=3 6602 B10R1.177 CCSCCOC[C@@H]1CO1 34a_100000757423_100000757381 [0,0,0,1,0,0|0,1,0]=2 6603 B10R1.177 CCSCCOC[C@@H]1CO1 7a_100000212035_100000745022 [0,0,0,1,0,0|0,1,0]=2 6604 B10R1.177 CCSCCSCC1CC1 62a_100000756562_100000757381 [0,0,0,1,0,0|1,2,0]=4 6605 B10R1.177 CCSCCSCC1CC1 62a_100000757381_100000742324 [0,0,0,1,0,0|1,2,0]=4 6606 B10R1.177 CCSCCSCC1CO1 62a_100000757381_102125554688 [0,0,0,1,0,0|0,2,0]=3 6607 B10R1.177 CCSCCSCC1CO1 62a_102125554688_100000757381 [0,0,0,1,0,0|0,2,0]=3 6608 B10R1.177 CCSCCSCC1CS1 62a_100000031435_100000757381 [0,0,0,1,0,0|0,3,0]=4 6609 B10R1.177 CCSCCSCC1CS1 62a_100000757381_100000031435 [0,0,0,1,0,0|0,3,0]=4 6610 B10R1.177 CCSCCSC[C@@H]1CO1 62a_100000745022_100000757381 [0,0,0,1,0,0|0,2,0]=3 6611 B10R1.177 CCSCCSC[C@@H]1CO1 62a_100000757381_100000745022 [0,0,0,1,0,0|0,2,0]=3 6612 B10R1.177 CNCCCOCC1CC1 34a_100000213112_100000742324 [0,0,0,1,0,0|3,0,0]=4 6613 B10R1.177 CNCCCOCC1CO1 34a_100000213112_102125554688 [0,0,0,1,0,0|2,0,0]=3 6614 B10R1.177 COCCCCNC1CC1 34a_100000212008_100000755781 [0,0,0,1,0,0|3,0,0]=4 6615 B10R1.177 COCCCCOC1CC1 34a_100000740925_100000211595 [0,0,0,1,0,0|3,0,0]=4 6616 B10R1.177 COCCCCSC1CC1 62a_100000730899_100000211595 [0,0,0,1,0,0|3,0,0]=4 6617 B10R1.177 COCCCNCC1CC1 2230a_100000735609_100000740836 [0,0,0,1,0,0|3,0,0]=4 6618 B10R1.177 COCCCNCC1CC1 269862a_100150723488_100000741477 [0,0,0,1,0,0|3,0,0]=4 6619 B10R1.177 COCCCNCC1CC1 34a_100000735609_100000740836 [0,0,0,1,0,0|3,0,0]=4 6620 B10R1.177 COCCCNCC1CC1 34a_100150723488_100000742324 [0,0,0,1,0,0|3,0,0]=4 6621 B10R1.177 COCCCNCC1CO1 34a_100150723488_102125554688 [0,0,0,1,0,0|3,0,0]=4 6622 B10R1.177 COCCCOCC1CC1 34a_100000211283_100000740836 [0,0,0,1,0,0|3,0,0]=4 6623 B10R1.177 COCCCOCC1CC1 34a_100000740835_100000742324 [0,0,0,1,0,0|3,0,0]=4 6624 B10R1.177 COCCCOCC1CO1 34a_100000740835_102125554688 [0,0,0,1,0,0|2,0,0]=3 6625 B10R1.177 COCCCOC[C@@H]1CO1 34a_100000757423_100000740836 [0,0,0,1,0,0|2,0,0]=3 6626 B10R1.177 COCCCSCC1CC1 62a_100000709357_100000742324 [0,0,0,1,0,0|3,0,0]=4 6627 B10R1.177 COCCCSCC1CC1 62a_100000756562_100000709357 [0,0,0,1,0,0|3,0,0]=4 6628 B10R1.177 COCCCSCC1CO1 62a_100000709357_102125554688 [0,0,0,1,0,0|2,1,0]=4 6629 B10R1.177 COCCCSCC1CO1 62a_102125554688_100000709357 [0,0,0,1,0,0|2,1,0]=4 6630 B10R1.177 COCCCSC[C@@H]1CO1 62a_100000709357_100000745022 [0,0,0,1,0,0|2,1,0]=4 6631 B10R1.177 COCCCSC[C@@H]1CO1 62a_100000745022_100000709357 [0,0,0,1,0,0|2,1,0]=4 6632 B10R1.177 COCCNCCC1CC1 2230a_100000209980_100000694398 [0,0,0,1,0,0|2,0,0]=3 6633 B10R1.177 COCCNCCC1CC1 34a_100000764129_100011201679 [0,0,0,1,0,0|2,0,0]=3 6634 B10R1.177 COCCNCCC1CO1 2230a_100000209980_100000732470 [0,0,0,1,0,0|3,0,0]=4 6635 B10R1.177 COCCOCCC1CC1 34a_100000210237_100000694398 [0,0,0,1,0,0|1,0,0]=2 6636 B10R1.177 COCCOCCC1CC1 34a_100000754188_100011201679 [0,0,0,1,0,0|1,0,0]=2 6637 B10R1.177 COCCOCCC1CC1 7a_100000754188_100000233755 [0,0,0,1,0,0|1,0,0]=2 6638 B10R1.177 COCCOCCC1CO1 34a_100000210237_100000732470 [0,0,0,1,0,0|2,0,0]=3 6639 B10R1.177 COCCOCC[C@@H]1CO1 34a_100009820653_100011201679 [0,0,0,1,0,0|2,0,0]=3 6640 B10R1.177 COCCOCSC1CC1 62a_100000231047_100000211595 [0,0,0,1,0,0|2,0,0]=3 6641 B10R1.177 COCCSCCC1CC1 62a_100000233755_100000764125 [0,0,0,1,0,0|1,1,0]=3 6642 B10R1.177 COCCSCCC1CC1 62a_100000764125_100000233755 [0,0,0,1,0,0|1,1,0]=3 6643 B10R1.177 COCCSCCC1CO1 62a_100000233755_100000732470 [0,0,0,1,0,0|2,1,0]=4 6644 B10R1.177 COCCSCCC1CO1 62a_100000732470_100000233755 [0,0,0,1,0,0|2,1,0]=4 6645 B10R1.177 CSCCCNCC1CO1 2230a_100000749238_100011216344 [0,0,0,1,0,0|3,0,0]=4 6646 B10R1.177 CSCCCOCC1CC1 34a_100000690336_100000742324 [0,0,0,1,0,0|3,0,0]=4 6647 B10R1.177 CSCCCOCC1CC1 7a_100000690336_100000742324 [0,0,0,1,0,0|3,0,0]=4 6648 B10R1.177 CSCCCOCC1CO1 34a_100000690336_102125554688 [0,0,0,1,0,0|2,0,0]=3 6649 B10R1.177 CSCCCOCC1CO1 7a_100000690336_102125554688 [0,0,0,1,0,0|2,0,0]=3 6650 B10R1.177 CSCCCOCC1CS1 7a_100000690336_100000031435 [0,0,0,1,0,0|2,1,0]=4 6651 B10R1.177 CSCCCOC[C@@H]1CO1 7a_100000690336_100000745022 [0,0,0,1,0,0|2,0,0]=3 6652 B10R1.177 CSCCNCCC1CC1 2230a_100020590264_100000694398 [0,0,0,1,0,0|2,1,0]=4 6653 B10R1.177 CSCCNCCC1CC1 34a_100000764129_100000212216 [0,0,0,1,0,0|2,1,0]=4 6654 B10R1.177 CSCCOCCC1CC1 34a_100000230434_100000694398 [0,0,0,1,0,0|1,1,0]=3 6655 B10R1.177 CSCCOCCC1CC1 34a_100000754188_100000212216 [0,0,0,1,0,0|1,1,0]=3 6656 B10R1.177 CSCCOCCC1CC1 7a_100000230434_100000764125 [0,0,0,1,0,0|1,1,0]=3 6657 B10R1.177 CSCCOCCC1CC1 7a_100000754188_100000212216 [0,0,0,1,0,0|1,1,0]=3 6658 B10R1.177 CSCCOCCC1CO1 34a_100000230434_100000732470 [0,0,0,1,0,0|2,1,0]=4 6659 B10R1.177 CSCCOCCC1CO1 7a_100000230434_100000732470 [0,0,0,1,0,0|2,1,0]=4 6660 B10R1.177 CSCCOCC[C@@H]1CO1 34a_100009820653_100000212216 [0,0,0,1,0,0|2,1,0]=4 6661 B10R1.177 CSCCSCCC1CC1 62a_100000212216_100000764125 [0,0,0,1,0,0|1,2,0]=4 6662 B10R1.177 CSCCSCCC1CC1 62a_100000764125_100000751147 [0,0,0,1,0,0|1,2,0]=4 6663 B10R1.177 ClCC#CCOCC1CO1 34a_200000047223_102125554688 [0,0,0,1,0,0|2,0,1]=4 6664 B10R1.177 ClCCCCOCC1CC1 34a_100000210776_100000742324 [0,0,0,1,0,0|3,0,0]=4 6665 B10R1.177 ClCCCCOCC1CC1 7a_100000210776_100000742324 [0,0,0,1,0,0|3,0,0]=4 6666 B10R1.177 ClCCCCOCC1CO1 34a_100000210776_102125554688 [0,0,0,1,0,0|2,0,0]=3 6667 B10R1.177 ClCCCCOCC1CO1 7a_100000210776_102125554688 [0,0,0,1,0,0|2,0,0]=3 6668 B10R1.177 ClCCCCOCC1CS1 7a_100000210776_100000031435 [0,0,0,1,0,0|2,1,0]=4 6669 B10R1.177 ClCCCCOC[C@@H]1CO1 7a_100000210776_100000745022 [0,0,0,1,0,0|2,0,0]=3 6670 B10R1.177 ClCCCOCCC1CC1 34a_100000230001_100000694398 [0,0,0,1,0,0|3,0,0]=4 6671 B10R1.177 FCCCCOCC1CC1 34a_100000211283_100000729493 [0,0,0,1,0,0|3,0,0]=4 6672 B10R1.177 FCCCCOCC1CC1 34a_100011995726_100000742324 [0,0,0,1,0,0|3,0,0]=4 6673 B10R1.177 FCCCCOCC1CC1 7a_100011995726_100000742324 [0,0,0,1,0,0|3,0,0]=4 6674 B10R1.177 FCCCCOCC1CO1 34a_100011995726_102125554688 [0,0,0,1,0,0|2,0,0]=3 6675 B10R1.177 FCCCCOCC1CO1 7a_100011995726_102125554688 [0,0,0,1,0,0|2,0,0]=3 6676 B10R1.177 FCCCCOCC1CS1 7a_100011995726_100000031435 [0,0,0,1,0,0|2,1,0]=4 6677 B10R1.177 FCCCCOC[C@@H]1CO1 34a_100000757423_100000729493 [0,0,0,1,0,0|2,0,0]=3 6678 B10R1.177 FCCCCOC[C@@H]1CO1 7a_100011995726_100000745022 [0,0,0,1,0,0|2,0,0]=3 6679 B10R1.177 FCCCCSCC1CO1 62a_100000729493_102125554688 [0,0,0,1,0,0|2,1,0]=4 6680 B10R1.177 FCCCCSCC1CO1 62a_102125554688_100000729493 [0,0,0,1,0,0|2,1,0]=4 6681 B10R1.177 FCCCCSC[C@@H]1CO1 62a_100000729493_100000745022 [0,0,0,1,0,0|2,1,0]=4 6682 B10R1.177 FCCCCSC[C@@H]1CO1 62a_100000745022_100000729493 [0,0,0,1,0,0|2,1,0]=4 6683 B10R1.177 FCCCOCCC1CC1 34a_100000754188_100011934791 [0,0,0,1,0,0|3,0,0]=4 6684 B10R1.177 FCCCOCCC1CC1 34a_100000759539_100000694398 [0,0,0,1,0,0|3,0,0]=4 6685 B10R1.177 FCCCOCCC1CC1 7a_100000754188_100011934791 [0,0,0,1,0,0|3,0,0]=4 6686 B10R1.177 ICCCCOCC1CC1 34a_200012148704_100000742324 [0,0,0,1,0,0|3,0,0]=4 6687 B10R1.177 ICCCCOCC1CO1 34a_200012148704_102125554688 [0,0,0,1,0,0|2,0,0]=3 6688 B10R1.177 N#CCCOCCC1CC1 7a_100000754188_100000184422 [0,0,0,1,0,0|3,0,0]=4 6689 B10R1.177 NCCCCOCC1CC1 34a_100000750430_100000742324 [0,0,0,1,0,0|3,0,0]=4 6690 B10R1.177 NCCCCOCC1CO1 34a_100000750430_102125554688 [0,0,0,1,0,0|2,0,0]=3 6691 B10R1.177 NCCCOCCC1CC1 34a_100000182051_100000694398 [0,0,0,1,0,0|3,0,0]=4 6692 B10R1.177 NOCCOCCC1CC1 34a_100000700252_100000694398 [0,0,0,1,0,0|2,0,0]=3 6693 B10R1.177 NOCCOCCC1CO1 34a_100000700252_100000732470 [0,0,0,1,0,0|3,0,0]=4 6694 B10R1.177 OCC#CCOC[C@@H]1CO1 34a_100000757423_200000047223 [0,0,0,1,0,0|2,0,1]=4 6695 B10R1.177 OCCCCNCC1CO1 2230a_100000750430_100011216344 [0,0,0,1,0,0|3,0,0]=4 6696 B10R1.177 OCCCCNCC1CO1 34a_100000750430_102125554688 [0,0,0,1,0,0|3,0,0]=4 6697 B10R1.177 OCCCCOCC1CC1 34a_100000211283_100011216708 [0,0,0,1,0,0|3,0,0]=4 6698 B10R1.177 OCCCCOC[C@@H]1CO1 34a_100000757423_100011216708 [0,0,0,1,0,0|2,0,0]=3 6699 B10R1.177 OCCCCSCC1CO1 62a_100000210776_102125554688 [0,0,0,1,0,0|2,1,0]=4 6700 B10R1.177 OCCCCSCC1CO1 62a_102125554688_100000210776 [0,0,0,1,0,0|2,1,0]=4 6701 B10R1.177 OCCCCSC[C@@H]1CO1 62a_100000210776_100000745022 [0,0,0,1,0,0|2,1,0]=4 6702 B10R1.177 OCCCCSC[C@@H]1CO1 62a_100000745022_100000210776 [0,0,0,1,0,0|2,1,0]=4 6703 B10R1.177 OCCCOCCC1CC1 34a_100000754188_100000230001 [0,0,0,1,0,0|3,0,0]=4 6704 B10R1.177 OCCCOCCC1CC1 7a_100000754188_100011215043 [0,0,0,1,0,0|3,0,0]=4 6705 B7R0.1 C#CCCCCOC 34a_100000766709_200000210301 [2,0,0,0,0,0|0,0,2]=4 6706 B7R0.1 C#CCCCCOC 34a_100138415774_100010269958 [2,0,0,0,0,0|0,0,2]=4 6707 B7R0.1 C#CCCCCOC 7a_100000766709_200000210301 [2,0,0,0,0,0|0,0,2]=4 6708 B7R0.1 C#CCCCCO[13CH3] 34a_100000766709_200025704644 [2,0,0,0,0,0|0,0,2]=4 6709 B7R0.1 C#CCCCCO[13CH3] 7a_100000766709_200025704644 [2,0,0,0,0,0|0,0,2]=4 6710 B7R0.1 C#CCCCOCC 34a_100000215630_100000210202 [2,0,0,0,0,0|0,0,2]=4 6711 B7R0.1 C#CCCCOCC 34a_100121572206_100000695029 [2,0,0,0,0,0|0,0,2]=4 6712 B7R0.1 C#CCCCOCC 7a_100000215630_100000210202 [2,0,0,0,0,0|0,0,2]=4 6713 B7R0.1 C#CCCOCCC 34a_100000210258_100000688953 [2,0,0,0,0,0|0,0,2]=4 6714 B7R0.1 C#CCCOCCC 34a_100011215631_100000210303 [2,0,0,0,0,0|0,0,2]=4 6715 B7R0.1 C#CCCOCCO 34a_100011215631_100000211926 [2,0,0,0,0,0|0,0,2]=4 6716 B7R0.1 C#CCOCCCC 34a_100000210227_100000184674 [2,0,0,0,0,0|0,0,2]=4 6717 B7R0.1 C#CCOCCCC 34a_100000210247_100000210210 [2,0,0,0,0,0|0,0,2]=4 6718 B7R0.1 C#CCOCCCC 7a_100000210227_100000038162 [2,0,0,0,0,0|0,0,2]=4 6719 B7R0.1 C#CCOCCOC 34a_100000054580_200000210301 [2,0,0,0,0,0|0,0,2]=4 6720 B7R0.1 C#CCOCCOC 34a_100000210237_100000184674 [2,0,0,0,0,0|0,0,2]=4 6721 B7R0.1 C#CCOCCOC 34a_100000210247_100011201679 [2,0,0,0,0,0|0,0,2]=4 6722 B7R0.1 C#CCOCCOC 34a_100138415774_100010402529 [2,0,0,0,0,0|0,0,2]=4 6723 B7R0.1 C#CCOCCOC 7a_100000054580_200000210301 [2,0,0,0,0,0|0,0,2]=4 6724 B7R0.1 C#CCOCCO[13CH3] 34a_100000054580_200025704644 [2,0,0,0,0,0|0,0,2]=4 6725 B7R0.1 C#CCOCCO[13CH3] 7a_100000054580_200025704644 [2,0,0,0,0,0|0,0,2]=4 6726 B7R0.1 C/C=C/CCOCC 34a_100016278192_100000210202 [2,0,0,0,0,0|0,0,2]=4 6727 B7R0.1 C/C=C/COCCC 34a_100000210258_100102629194 [2,0,0,0,0,0|0,0,2]=4 6728 B7R0.1 C/C=C/COCCC 34a_100016270725_100000210303 [2,0,0,0,0,0|0,0,2]=4 6729 B7R0.1 C/C=C/COCCO 34a_100016270725_100000211926 [2,0,0,0,0,0|0,0,2]=4 6730 B7R0.1 C=CCCCCOC 34a_100000766645_200000210301 [2,0,0,0,0,0|0,0,2]=4 6731 B7R0.1 C=CCCCCOC 34a_100138415774_100011215482 [2,0,0,0,0,0|0,0,2]=4 6732 B7R0.1 C=CCCCCOC 7a_100000766645_200000210301 [2,0,0,0,0,0|0,0,2]=4 6733 B7R0.1 C=CCCCCO[13CH3] 34a_100000766645_200025704644 [2,0,0,0,0,0|0,0,2]=4 6734 B7R0.1 C=CCCCCO[13CH3] 7a_100000766645_200025704644 [2,0,0,0,0,0|0,0,2]=4 6735 B7R0.1 C=CCCCOCC 34a_100000758997_100000210202 [2,0,0,0,0,0|0,0,2]=4 6736 B7R0.1 C=CCCCOCC 34a_100121572206_100000757094 [2,0,0,0,0,0|0,0,2]=4 6737 B7R0.1 C=CCCCOCC 7a_100000758997_100000210202 [2,0,0,0,0,0|0,0,2]=4 6738 B7R0.1 C=CCCOCCC 34a_100000210258_100000754431 [2,0,0,0,0,0|0,0,2]=4 6739 B7R0.1 C=CCCOCCC 34a_100011205117_100000210303 [2,0,0,0,0,0|0,0,2]=4 6740 B7R0.1 C=CCCOCCO 34a_100011205117_100000211926 [2,0,0,0,0,0|0,0,2]=4 6741 B7R0.1 C=CCOCCCC 34a_100000210227_100015514636 [2,0,0,0,0,0|0,0,2]=4 6742 B7R0.1 C=CCOCCCC 34a_200000210373_100000210210 [2,0,0,0,0,0|0,0,2]=4 6743 B7R0.1 C=CCOCCCC 7a_100000210227_100015514636 [2,0,0,0,0,0|0,0,2]=4 6744 B7R0.1 C=CCOCCOC 34a_100000037705_200000210301 [2,0,0,0,0,0|0,0,2]=4 6745 B7R0.1 C=CCOCCOC 34a_100000210237_100015514636 [2,0,0,0,0,0|0,0,2]=4 6746 B7R0.1 C=CCOCCOC 34a_200000210373_100011201679 [2,0,0,0,0,0|0,0,2]=4 6747 B7R0.1 C=CCOCCOC 7a_100000037705_200000210301 [2,0,0,0,0,0|0,0,2]=4 6748 B7R0.1 C=CCOCCO[13CH3] 34a_100000037705_200025704644 [2,0,0,0,0,0|0,0,2]=4 6749 B7R0.1 C=CCOCCO[13CH3] 7a_100000037705_200025704644 [2,0,0,0,0,0|0,0,2]=4 6750 B7R0.1 C=COCCOCC 34a_100000033082_100000210202 [2,0,0,0,0,0|0,0,2]=4 6751 B7R0.1 C=COCCOCC 34a_100121572206_100000039644 [2,0,0,0,0,0|0,0,2]=4 6752 B7R0.1 CC#CCCOCC 34a_100000750427_100000210202 [2,0,0,0,0,0|0,0,2]=4 6753 B7R0.1 CC#CCOCCC 34a_100000210258_100000748600 [2,0,0,0,0,0|0,0,2]=4 6754 B7R0.1 CC#CCOCCC 34a_100000761923_100000210303 [2,0,0,0,0,0|0,0,2]=4 6755 B7R0.1 CC#CCOCCO 34a_100000761923_100000211926 [2,0,0,0,0,0|0,0,2]=4 6756 B7R0.1 CC/C=C\CCOC 34a_100016288707_200000210301 [2,0,0,0,0,0|0,0,2]=4 6757 B7R0.1 CC/C=C\CCOC 34a_100138415774_100015370543 [2,0,0,0,0,0|0,0,2]=4 6758 B7R0.1 CC/C=C\CCOC 7a_100016288707_200000210301 [2,0,0,0,0,0|0,0,2]=4 6759 B7R0.1 CC/C=C\CCO[13CH3] 34a_100016288707_200025704644 [2,0,0,0,0,0|0,0,2]=4 6760 B7R0.1 CC/C=C\CCO[13CH3] 7a_100016288707_200025704644 [2,0,0,0,0,0|0,0,2]=4 6761 B7R0.1 CC/C=C\COCC 34a_100016268518_100000210202 [2,0,0,0,0,0|0,0,2]=4 6762 B7R0.1 CC/C=C\COCC 34a_100121572206_100103147603 [2,0,0,0,0,0|0,0,2]=4 6763 B7R0.1 CC=CCCCOC 34a_100020645299_200000210301 [2,0,0,0,0,0|0,0,2]=4 6764 B7R0.1 CC=CCCCO[13CH3] 34a_100020645299_200025704644 [2,0,0,0,0,0|0,0,2]=4 6765 B7R0.1 CC=CCOCCC 34a_100000210258_100000070051 [2,0,0,0,0,0|0,0,2]=4 6766 B7R0.1 CCC#CCCOC 34a_100000036655_200000210301 [2,0,0,0,0,0|0,0,2]=4 6767 B7R0.1 CCC#CCCOC 7a_100000036655_200000210301 [2,0,0,0,0,0|0,0,2]=4 6768 B7R0.1 CCC#CCCO[13CH3] 34a_100000036655_200025704644 [2,0,0,0,0,0|0,0,2]=4 6769 B7R0.1 CCC#CCCO[13CH3] 7a_100000036655_200025704644 [2,0,0,0,0,0|0,0,2]=4 6770 B7R0.1 CCC#CCOCC 34a_100000032950_100000210202 [2,0,0,0,0,0|0,0,2]=4 6771 B7R0.1 CCC#CCOCC 34a_100121572206_100009813939 [2,0,0,0,0,0|0,0,2]=4 6772 B7R0.1 CCC/C=C/COC 34a_100016278788_200000210301 [2,0,0,0,0,0|0,0,2]=4 6773 B7R0.1 CCC/C=C/COC 7a_100016278788_200000210301 [2,0,0,0,0,0|0,0,2]=4 6774 B7R0.1 CCC/C=C/CO[13CH3] 34a_100016278788_200025704644 [2,0,0,0,0,0|0,0,2]=4 6775 B7R0.1 CCC/C=C/CO[13CH3] 7a_100016278788_200025704644 [2,0,0,0,0,0|0,0,2]=4 6776 B7R0.1 CCCC#CCOC 34a_100000034806_200000210301 [2,0,0,0,0,0|0,0,2]=4 6777 B7R0.1 CCCC#CCOC 7a_100000034806_200000210301 [2,0,0,0,0,0|0,0,2]=4 6778 B7R0.1 CCCC#CCO[13CH3] 34a_100000034806_200025704644 [2,0,0,0,0,0|0,0,2]=4 6779 B7R0.1 CCCC#CCO[13CH3] 7a_100000034806_200025704644 [2,0,0,0,0,0|0,0,2]=4 6780 B7R0.1 CCCCCCNC 2230a_100000210581_200000210301 [2,0,0,0,0,0|1,0,0]=3 6781 B7R0.1 CCCCCCNC 2230a_106832991635_100000210314 [2,0,0,0,0,0|1,0,0]=3 6782 B7R0.1 CCCCCCNC 34a_100102657272_100000210314 [2,0,0,0,0,0|1,0,0]=3 6783 B7R0.1 CCCCCCNC 7a_106832991635_100000210314 [2,0,0,0,0,0|1,0,0]=3 6784 B7R0.1 CCCCCCN[13CH3] 2230a_100000210581_200025704644 [2,0,0,0,0,0|1,0,0]=3 6785 B7R0.1 CCCCCCOC 34a_100000210259_200000210301 [2,0,0,0,0,0|0,0,0]=2 6786 B7R0.1 CCCCCCOC 34a_100138415774_100000210314 [2,0,0,0,0,0|0,0,0]=2 6787 B7R0.1 CCCCCCOC 7a_100000210259_200000210301 [2,0,0,0,0,0|0,0,0]=2 6788 B7R0.1 CCCCCCO[13CH3] 34a_100000210259_200025704644 [2,0,0,0,0,0|0,0,0]=2 6789 B7R0.1 CCCCCCO[13CH3] 7a_100000210259_200025704644 [2,0,0,0,0,0|0,0,0]=2 6790 B7R0.1 CCCCCCSC 62a_100000210314_200000210301 [2,0,0,0,0,0|0,1,0]=3 6791 B7R0.1 CCCCCCSC 62a_200000210301_100000210757 [2,0,0,0,0,0|0,1,0]=3 6792 B7R0.1 CCCCCCS[13CH3] 62a_100000210314_200025704644 [2,0,0,0,0,0|0,1,0]=3 6793 B7R0.1 CCCCCCS[13CH3] 62a_200025704644_100000210757 [2,0,0,0,0,0|0,1,0]=3 6794 B7R0.1 CCCCCNCC 2230a_100000209983_100000210202 [2,0,0,0,0,0|1,0,0]=3 6795 B7R0.1 CCCCCNCC 2230a_100015525214_100000210326 [2,0,0,0,0,0|1,0,0]=3 6796 B7R0.1 CCCCCOCC 34a_100000210253_100000210202 [2,0,0,0,0,0|0,0,0]=2 6797 B7R0.1 CCCCCOCC 34a_100121572206_100000718602 [2,0,0,0,0,0|0,0,0]=2 6798 B7R0.1 CCCCCOCC 7a_100000210253_100000210202 [2,0,0,0,0,0|0,0,0]=2 6799 B7R0.1 CCCCCOCF 34a_100000210253_100015361967 [2,0,0,0,0,0|1,0,0]=3 6800 B7R0.1 CCCCCOCF 7a_100000210253_100015361967 [2,0,0,0,0,0|1,0,0]=3 6801 B7R0.1 CCCCCSCC 62a_100000210202_100000210326 [2,0,0,0,0,0|0,1,0]=3 6802 B7R0.1 CCCCCSCC 62a_100000210326_100000210202 [2,0,0,0,0,0|0,1,0]=3 6803 B7R0.1 CCCCCSCF 62a_100000210326_100015361967 [2,0,0,0,0,0|1,1,0]=4 6804 B7R0.1 CCCCCSCF 62a_100015361967_100000210326 [2,0,0,0,0,0|1,1,0]=4 6805 B7R0.1 CCCCNCCC 2230a_100000102301_100000210303 [2,0,0,0,0,0|1,0,0]=3 6806 B7R0.1 CCCCNCCC 7a_106832991798_100000210303 [2,0,0,0,0,0|1,0,0]=3 6807 B7R0.1 CCCCNCCF 2230a_100000102301_100011217306 [2,0,0,0,0,0|2,0,0]=4 6808 B7R0.1 CCCCNCCF 34a_100000724931_100000210210 [2,0,0,0,0,0|2,0,0]=4 6809 B7R0.1 CCCCNCCF 7a_106832991798_100011217306 [2,0,0,0,0,0|2,0,0]=4 6810 B7R0.1 CCCCNCCO 2230a_100000102301_100000211926 [2,0,0,0,0,0|1,0,0]=3 6811 B7R0.1 CCCCNCCO 2230a_100016997473_100000210211 [2,0,0,0,0,0|1,0,0]=3 6812 B7R0.1 CCCCNCCO 34a_100016990907_100000210210 [2,0,0,0,0,0|1,0,0]=3 6813 B7R0.1 CCCCNCCO 7a_106832991798_100000211926 [2,0,0,0,0,0|1,0,0]=3 6814 B7R0.1 CCCCNCOC 2230a_100000102301_100000766300 [2,0,0,0,0,0|1,0,0]=3 6815 B7R0.1 CCCCNCSC 2230a_100000102301_100011218213 [2,0,0,0,0,0|1,1,0]=4 6816 B7R0.1 CCCCOCC#N 7a_100000210227_100011215382 [2,0,0,0,0,0|1,0,1]=4 6817 B7R0.1 CCCCOCC=O 34a_100000210227_200009817547 [2,0,0,0,0,0|0,0,2]=4 6818 B7R0.1 CCCCOCC=O 7a_100000210227_200015260668 [2,0,0,0,0,0|0,0,2]=4 6819 B7R0.1 CCCCOCCBr 34a_100000211926_100000210210 [2,0,0,0,0,0|1,0,0]=3 6820 B7R0.1 CCCCOCCC 34a_100000210227_100000210303 [2,0,0,0,0,0|0,0,0]=2 6821 B7R0.1 CCCCOCCC 34a_100000210258_100000210210 [2,0,0,0,0,0|0,0,0]=2 6822 B7R0.1 CCCCOCCC 7a_100000210227_100000210303 [2,0,0,0,0,0|0,0,0]=2 6823 B7R0.1 CCCCOCCF 34a_100000210227_100011217306 [2,0,0,0,0,0|1,0,0]=3 6824 B7R0.1 CCCCOCCF 7a_100000210227_100011217306 [2,0,0,0,0,0|1,0,0]=3 6825 B7R0.1 CCCCOCCN 34a_100000210304_100000210210 [2,0,0,0,0,0|1,0,0]=3 6826 B7R0.1 CCCCOCCO 34a_100000210227_100000211926 [2,0,0,0,0,0|0,0,0]=2 6827 B7R0.1 CCCCOCCO 7a_100000210227_100000211926 [2,0,0,0,0,0|0,0,0]=2 6828 B7R0.1 CCCCOCNC 2230a_106832991635_100011995733 [2,0,0,0,0,0|1,0,0]=3 6829 B7R0.1 CCCCOCNC 34a_100102657272_100011995733 [2,0,0,0,0,0|1,0,0]=3 6830 B7R0.1 CCCCOCOC 34a_100138415774_100011995733 [2,0,0,0,0,0|0,0,0]=2 6831 B7R0.1 CCCCOCSC 34a_100000210227_100011218213 [2,0,0,0,0,0|0,1,0]=3 6832 B7R0.1 CCCCOCSC 62a_100011995733_200000210301 [2,0,0,0,0,0|0,1,0]=3 6833 B7R0.1 CCCCOCSC 62a_200000210301_100011995733 [2,0,0,0,0,0|0,1,0]=3 6834 B7R0.1 CCCCOCS[13CH3] 62a_100011995733_200025704644 [2,0,0,0,0,0|0,1,0]=3 6835 B7R0.1 CCCCOCS[13CH3] 62a_200025704644_100011995733 [2,0,0,0,0,0|0,1,0]=3 6836 B7R0.1 CCCCSCCC 62a_100000210211_100000210303 [2,0,0,0,0,0|0,1,0]=3 6837 B7R0.1 CCCCSCCC 62a_100000210303_100000210210 [2,0,0,0,0,0|0,1,0]=3 6838 B7R0.1 CCCCSCCF 62a_100000210211_100011217306 [2,0,0,0,0,0|1,1,0]=4 6839 B7R0.1 CCCCSCCF 62a_100011217306_100000210210 [2,0,0,0,0,0|1,1,0]=4 6840 B7R0.1 CCCCSCCO 62a_100000210211_100000211926 [2,0,0,0,0,0|0,1,0]=3 6841 B7R0.1 CCCCSCCO 62a_100000211926_100000210210 [2,0,0,0,0,0|0,1,0]=3 6842 B7R0.1 CCCCSCOC 62a_100000210211_100000766300 [2,0,0,0,0,0|0,1,0]=3 6843 B7R0.1 CCCCSCOC 62a_100000766300_100000210210 [2,0,0,0,0,0|0,1,0]=3 6844 B7R0.1 CCCCSCSC 62a_100000210211_100011218213 [2,0,0,0,0,0|0,2,0]=4 6845 B7R0.1 CCCCSCSC 62a_100011218213_100000210210 [2,0,0,0,0,0|0,2,0]=4 6846 B7R0.1 CCCNCCCF 2230a_100015189416_100000210303 [2,0,0,0,0,0|2,0,0]=4 6847 B7R0.1 CCCNCCCF 34a_100015189416_100000210303 [2,0,0,0,0,0|2,0,0]=4 6848 B7R0.1 CCCNCCOC 2230a_100000209980_100000210303 [2,0,0,0,0,0|1,0,0]=3 6849 B7R0.1 CCCNCCSC 2230a_100020590264_100000210303 [2,0,0,0,0,0|1,1,0]=4 6850 B7R0.1 CCCOCCCBr 34a_100011217188_100000210303 [2,0,0,0,0,0|1,0,0]=3 6851 B7R0.1 CCCOCCCCl 34a_100000230001_100000210303 [2,0,0,0,0,0|1,0,0]=3 6852 B7R0.1 CCCOCCCF 34a_100000210258_100011934791 [2,0,0,0,0,0|1,0,0]=3 6853 B7R0.1 CCCOCCCF 34a_100000759539_100000210303 [2,0,0,0,0,0|1,0,0]=3 6854 B7R0.1 CCCOCCCN 34a_100000182051_100000210303 [2,0,0,0,0,0|1,0,0]=3 6855 B7R0.1 CCCOCCCO 34a_100000210258_100000230001 [2,0,0,0,0,0|1,0,0]=3 6856 B7R0.1 CCCOCCNC 2230a_100161115042_200000210301 [2,0,0,0,0,0|1,0,0]=3 6857 B7R0.1 CCCOCCNC 2230a_106832991635_100011215938 [2,0,0,0,0,0|1,0,0]=3 6858 B7R0.1 CCCOCCNC 34a_100102657272_100011215938 [2,0,0,0,0,0|1,0,0]=3 6859 B7R0.1 CCCOCCNC 34a_100161115042_200000210301 [2,0,0,0,0,0|1,0,0]=3 6860 B7R0.1 CCCOCCNC 7a_106832991635_100011215938 [2,0,0,0,0,0|1,0,0]=3 6861 B7R0.1 CCCOCCN[13CH3] 2230a_100161115042_200025704644 [2,0,0,0,0,0|1,0,0]=3 6862 B7R0.1 CCCOCCN[13CH3] 34a_100161115042_200025704644 [2,0,0,0,0,0|1,0,0]=3 6863 B7R0.1 CCCOCCOC 34a_100000210237_100000210303 [2,0,0,0,0,0|0,0,0]=2 6864 B7R0.1 CCCOCCOC 34a_100000210258_100011201679 [2,0,0,0,0,0|0,0,0]=2 6865 B7R0.1 CCCOCCOC 34a_100000752267_200000210301 [2,0,0,0,0,0|0,0,0]=2 6866 B7R0.1 CCCOCCOC 34a_100138415774_100011215938 [2,0,0,0,0,0|0,0,0]=2 6867 B7R0.1 CCCOCCOC 7a_100000752267_200000210301 [2,0,0,0,0,0|0,0,0]=2 6868 B7R0.1 CCCOCCON 34a_100000700252_100000210303 [2,0,0,0,0,0|1,0,0]=3 6869 B7R0.1 CCCOCCO[13CH3] 34a_100000752267_200025704644 [2,0,0,0,0,0|0,0,0]=2 6870 B7R0.1 CCCOCCO[13CH3] 7a_100000752267_200025704644 [2,0,0,0,0,0|0,0,0]=2 6871 B7R0.1 CCCOCCSC 34a_100000210258_100000212216 [2,0,0,0,0,0|0,1,0]=3 6872 B7R0.1 CCCOCCSC 34a_100000230434_100000210303 [2,0,0,0,0,0|0,1,0]=3 6873 B7R0.1 CCCOCCSC 62a_100011215938_200000210301 [2,0,0,0,0,0|0,1,0]=3 6874 B7R0.1 CCCOCCSC 62a_200000210301_100011215938 [2,0,0,0,0,0|0,1,0]=3 6875 B7R0.1 CCCOCCSC 7a_100000230434_100000210303 [2,0,0,0,0,0|0,1,0]=3 6876 B7R0.1 CCCOCCS[13CH3] 62a_100011215938_200025704644 [2,0,0,0,0,0|0,1,0]=3 6877 B7R0.1 CCCOCCS[13CH3] 62a_200025704644_100011215938 [2,0,0,0,0,0|0,1,0]=3 6878 B7R0.1 CCCSCCCF 62a_100000210303_100011934791 [2,0,0,0,0,0|1,1,0]=4 6879 B7R0.1 CCCSCCCF 62a_100011934791_100000210303 [2,0,0,0,0,0|1,1,0]=4 6880 B7R0.1 CCCSCCCO 62a_100000210303_100011215043 [2,0,0,0,0,0|1,1,0]=4 6881 B7R0.1 CCCSCCCO 62a_100011215043_100000210303 [2,0,0,0,0,0|1,1,0]=4 6882 B7R0.1 CCCSCCNC 2230a_100020603323_200000210301 [2,0,0,0,0,0|1,1,0]=4 6883 B7R0.1 CCCSCCN[13CH3] 2230a_100020603323_200025704644 [2,0,0,0,0,0|1,1,0]=4 6884 B7R0.1 CCCSCCOC 34a_200000230433_200000210301 [2,0,0,0,0,0|0,1,0]=3 6885 B7R0.1 CCCSCCOC 62a_100000210303_100000233755 [2,0,0,0,0,0|0,1,0]=3 6886 B7R0.1 CCCSCCOC 62a_100000233755_100000210303 [2,0,0,0,0,0|0,1,0]=3 6887 B7R0.1 CCCSCCOC 7a_200000230433_200000210301 [2,0,0,0,0,0|0,1,0]=3 6888 B7R0.1 CCCSCCO[13CH3] 34a_200000230433_200025704644 [2,0,0,0,0,0|0,1,0]=3 6889 B7R0.1 CCCSCCO[13CH3] 7a_200000230433_200025704644 [2,0,0,0,0,0|0,1,0]=3 6890 B7R0.1 CCCSCCSC 62a_100000210303_100000751147 [2,0,0,0,0,0|0,2,0]=4 6891 B7R0.1 CCCSCCSC 62a_100000212216_100000210303 [2,0,0,0,0,0|0,2,0]=4 6892 B7R0.1 CCCSCOCC 62a_100000210303_100000739092 [2,0,0,0,0,0|0,1,0]=3 6893 B7R0.1 CCCSCOCC 62a_100000739092_100000210303 [2,0,0,0,0,0|0,1,0]=3 6894 B7R0.1 CCNCCCCF 2230a_100015525214_100000729493 [2,0,0,0,0,0|2,0,0]=4 6895 B7R0.1 CCNCCCCO 2230a_100000750430_100000210202 [2,0,0,0,0,0|1,0,0]=3 6896 B7R0.1 CCNCCCCO 2230a_100015525214_100000210776 [2,0,0,0,0,0|1,0,0]=3 6897 B7R0.1 CCNCCCCO 34a_100000750430_100000210202 [2,0,0,0,0,0|1,0,0]=3 6898 B7R0.1 CCNCCCOC 2230a_100015525214_100000740836 [2,0,0,0,0,0|1,0,0]=3 6899 B7R0.1 CCNCCCOC 34a_100150723488_100000210202 [2,0,0,0,0,0|1,0,0]=3 6900 B7R0.1 CCNCCCSC 2230a_100000749238_100000210202 [2,0,0,0,0,0|1,1,0]=4 6901 B7R0.1 CCNCCOCC 2230a_100015525214_100011215890 [2,0,0,0,0,0|1,0,0]=3 6902 B7R0.1 CCNCCOCC 2230a_102516460346_100000210202 [2,0,0,0,0,0|1,0,0]=3 6903 B7R0.1 CCNCCOCC 34a_102516460346_100000210202 [2,0,0,0,0,0|1,0,0]=3 6904 B7R0.1 CCNCCSCC 2230a_100000106463_100000210202 [2,0,0,0,0,0|1,1,0]=4 6905 B7R0.1 CCNCCSCC 2230a_100015525214_100000757381 [2,0,0,0,0,0|1,1,0]=4 6906 B7R0.1 CCOCC#CCO 34a_100121572206_200000047223 [2,0,0,0,0,0|0,0,2]=4 6907 B7R0.1 CCOCCCCBr 34a_100011216708_100000210202 [2,0,0,0,0,0|1,0,0]=3 6908 B7R0.1 CCOCCCCCl 34a_100000210776_100000210202 [2,0,0,0,0,0|1,0,0]=3 6909 B7R0.1 CCOCCCCCl 7a_100000210776_100000210202 [2,0,0,0,0,0|1,0,0]=3 6910 B7R0.1 CCOCCCCF 34a_100011995726_100000210202 [2,0,0,0,0,0|1,0,0]=3 6911 B7R0.1 CCOCCCCF 34a_100121572206_100000729493 [2,0,0,0,0,0|1,0,0]=3 6912 B7R0.1 CCOCCCCF 7a_100011995726_100000210202 [2,0,0,0,0,0|1,0,0]=3 6913 B7R0.1 CCOCCCCI 34a_200012148704_100000210202 [2,0,0,0,0,0|1,0,0]=3 6914 B7R0.1 CCOCCCCN 34a_100000750430_100000210202 [2,0,0,0,0,0|1,0,0]=3 6915 B7R0.1 CCOCCCCO 34a_100121572206_100011216708 [2,0,0,0,0,0|0,0,0]=2 6916 B7R0.1 CCOCCCNC 2230a_100000210961_200000210301 [2,0,0,0,0,0|1,0,0]=3 6917 B7R0.1 CCOCCCNC 2230a_106832991635_100012232248 [2,0,0,0,0,0|1,0,0]=3 6918 B7R0.1 CCOCCCNC 34a_100000210961_200000210301 [2,0,0,0,0,0|1,0,0]=3 6919 B7R0.1 CCOCCCNC 34a_100000213112_100000210202 [2,0,0,0,0,0|1,0,0]=3 6920 B7R0.1 CCOCCCNC 34a_100102657272_100012232248 [2,0,0,0,0,0|1,0,0]=3 6921 B7R0.1 CCOCCCNC 7a_106832991635_100012232248 [2,0,0,0,0,0|1,0,0]=3 6922 B7R0.1 CCOCCCN[13CH3] 2230a_100000210961_200025704644 [2,0,0,0,0,0|1,0,0]=3 6923 B7R0.1 CCOCCCN[13CH3] 34a_100000210961_200025704644 [2,0,0,0,0,0|1,0,0]=3 6924 B7R0.1 CCOCCCOC 34a_100000740835_100000210202 [2,0,0,0,0,0|0,0,0]=2 6925 B7R0.1 CCOCCCOC 34a_100000757476_200000210301 [2,0,0,0,0,0|0,0,0]=2 6926 B7R0.1 CCOCCCOC 34a_100121572206_100000740836 [2,0,0,0,0,0|0,0,0]=2 6927 B7R0.1 CCOCCCOC 34a_100138415774_100012232248 [2,0,0,0,0,0|0,0,0]=2 6928 B7R0.1 CCOCCCOC 7a_100000757476_200000210301 [2,0,0,0,0,0|0,0,0]=2 6929 B7R0.1 CCOCCCO[13CH3] 34a_100000757476_200025704644 [2,0,0,0,0,0|0,0,0]=2 6930 B7R0.1 CCOCCCO[13CH3] 7a_100000757476_200025704644 [2,0,0,0,0,0|0,0,0]=2 6931 B7R0.1 CCOCCCSC 34a_100000690336_100000210202 [2,0,0,0,0,0|0,1,0]=3 6932 B7R0.1 CCOCCCSC 62a_100012232248_200000210301 [2,0,0,0,0,0|0,1,0]=3 6933 B7R0.1 CCOCCCSC 62a_200000210301_100012232248 [2,0,0,0,0,0|0,1,0]=3 6934 B7R0.1 CCOCCCSC 7a_100000690336_100000210202 [2,0,0,0,0,0|0,1,0]=3 6935 B7R0.1 CCOCCCS[13CH3] 62a_100012232248_200025704644 [2,0,0,0,0,0|0,1,0]=3 6936 B7R0.1 CCOCCCS[13CH3] 62a_200025704644_100012232248 [2,0,0,0,0,0|0,1,0]=3 6937 B7R0.1 CCOCCNCF 34a_102516460346_100015361967 [2,0,0,0,0,0|2,0,0]=4 6938 B7R0.1 CCOCCOCC 34a_100000210136_100000210202 [2,0,0,0,0,0|0,0,0]=2 6939 B7R0.1 CCOCCOCC 34a_100121572206_100000210147 [2,0,0,0,0,0|0,0,0]=2 6940 B7R0.1 CCOCCOCC 7a_100000210136_100000210202 [2,0,0,0,0,0|0,0,0]=2 6941 B7R0.1 CCOCCOCF 34a_100000210136_100015361967 [2,0,0,0,0,0|1,0,0]=3 6942 B7R0.1 CCOCCOCF 7a_100000210136_100015361967 [2,0,0,0,0,0|1,0,0]=3 6943 B7R0.1 CCOCCSCC 34a_100000212035_100000210202 [2,0,0,0,0,0|0,1,0]=3 6944 B7R0.1 CCOCCSCC 34a_100121572206_100000757381 [2,0,0,0,0,0|0,1,0]=3 6945 B7R0.1 CCOCCSCC 62a_100000210147_100000210202 [2,0,0,0,0,0|0,1,0]=3 6946 B7R0.1 CCOCCSCC 62a_100000210202_100011215890 [2,0,0,0,0,0|0,1,0]=3 6947 B7R0.1 CCOCCSCC 7a_100000212035_100000210202 [2,0,0,0,0,0|0,1,0]=3 6948 B7R0.1 CCOCCSCF 62a_100000210147_100015361967 [2,0,0,0,0,0|1,1,0]=4 6949 B7R0.1 CCOCCSCF 62a_100015361967_100011215890 [2,0,0,0,0,0|1,1,0]=4 6950 B7R0.1 CCOCSCCF 62a_100000739092_100011217306 [2,0,0,0,0,0|1,1,0]=4 6951 B7R0.1 CCOCSCCF 62a_100011217306_100000739092 [2,0,0,0,0,0|1,1,0]=4 6952 B7R0.1 CCOCSCCO 62a_100000211926_100000739092 [2,0,0,0,0,0|0,1,0]=3 6953 B7R0.1 CCOCSCCO 62a_100000739092_100000211926 [2,0,0,0,0,0|0,1,0]=3 6954 B7R0.1 CCOCSCOC 62a_100000739092_100000766300 [2,0,0,0,0,0|0,1,0]=3 6955 B7R0.1 CCOCSCOC 62a_100000766300_100000739092 [2,0,0,0,0,0|0,1,0]=3 6956 B7R0.1 CCOCSCSC 62a_100000739092_100011218213 [2,0,0,0,0,0|0,2,0]=4 6957 B7R0.1 CCOCSCSC 62a_100011218213_100000739092 [2,0,0,0,0,0|0,2,0]=4 6958 B7R0.1 CCSCCCCF 62a_100000210202_100000729493 [2,0,0,0,0,0|1,1,0]=4 6959 B7R0.1 CCSCCCCF 62a_100000729493_100000210202 [2,0,0,0,0,0|1,1,0]=4 6960 B7R0.1 CCSCCCCO 62a_100000210202_100000210776 [2,0,0,0,0,0|0,1,0]=3 6961 B7R0.1 CCSCCCCO 62a_100000210776_100000210202 [2,0,0,0,0,0|0,1,0]=3 6962 B7R0.1 CCSCCCOC 34a_100011216438_200000210301 [2,0,0,0,0,0|0,1,0]=3 6963 B7R0.1 CCSCCCOC 62a_100000210202_100000709357 [2,0,0,0,0,0|0,1,0]=3 6964 B7R0.1 CCSCCCOC 62a_100000709357_100000210202 [2,0,0,0,0,0|0,1,0]=3 6965 B7R0.1 CCSCCCOC 7a_100011216438_200000210301 [2,0,0,0,0,0|0,1,0]=3 6966 B7R0.1 CCSCCCO[13CH3] 34a_100011216438_200025704644 [2,0,0,0,0,0|0,1,0]=3 6967 B7R0.1 CCSCCCO[13CH3] 7a_100011216438_200025704644 [2,0,0,0,0,0|0,1,0]=3 6968 B7R0.1 CCSCCOCF 34a_100000212035_100015361967 [2,0,0,0,0,0|1,1,0]=4 6969 B7R0.1 CCSCCOCF 7a_100000212035_100015361967 [2,0,0,0,0,0|1,1,0]=4 6970 B7R0.1 CCSCCSCC 62a_100000210202_100000757381 [2,0,0,0,0,0|0,2,0]=4 6971 B7R0.1 CCSCCSCC 62a_100000757381_100000210202 [2,0,0,0,0,0|0,2,0]=4 6972 B7R0.1 CNCCCCCF 2230a_106832991635_100000729378 [2,0,0,0,0,0|2,0,0]=4 6973 B7R0.1 CNCCCCCF 34a_100102657272_100000729378 [2,0,0,0,0,0|2,0,0]=4 6974 B7R0.1 CNCCCCCF 7a_106832991635_100000729378 [2,0,0,0,0,0|2,0,0]=4 6975 B7R0.1 CNCCCCCO 2230a_100000762737_200000210301 [2,0,0,0,0,0|2,0,0]=4 6976 B7R0.1 CNCCCCCO 2230a_106832991635_100000746330 [2,0,0,0,0,0|2,0,0]=4 6977 B7R0.1 CNCCCCCO 34a_100000762737_200000210301 [2,0,0,0,0,0|2,0,0]=4 6978 B7R0.1 CNCCCCCO 34a_100102657272_100000746330 [2,0,0,0,0,0|2,0,0]=4 6979 B7R0.1 CNCCCCCO 7a_106832991635_100000746330 [2,0,0,0,0,0|2,0,0]=4 6980 B7R0.1 CNCCCCOC 2230a_106832991635_100000730899 [2,0,0,0,0,0|1,0,0]=3 6981 B7R0.1 CNCCCCOC 34a_100102657272_100000755781 [2,0,0,0,0,0|1,0,0]=3 6982 B7R0.1 CNCCCCOC 7a_106832991635_100000730899 [2,0,0,0,0,0|1,0,0]=3 6983 B7R0.1 CNCCCOCF 34a_100000213112_100015361967 [2,0,0,0,0,0|2,0,0]=4 6984 B7R0.1 CNCCOCCO 2230a_100000211614_200000210301 [2,0,0,0,0,0|1,0,0]=3 6985 B7R0.1 CNCCOCCO 2230a_106832991635_100011215305 [2,0,0,0,0,0|1,0,0]=3 6986 B7R0.1 CNCCOCCO 34a_100000211614_200000210301 [2,0,0,0,0,0|1,0,0]=3 6987 B7R0.1 CNCCOCCO 34a_100102657272_100000692535 [2,0,0,0,0,0|1,0,0]=3 6988 B7R0.1 CNCCOCCO 7a_106832991635_100011215305 [2,0,0,0,0,0|1,0,0]=3 6989 B7R0.1 CNCCSCCO 2230a_100011219999_200000210301 [2,0,0,0,0,0|1,1,0]=4 6990 B7R0.1 CNCOCCOC 2230a_106832991635_100000231047 [2,0,0,0,0,0|1,0,0]=3 6991 B7R0.1 COCCCCCBr 34a_100000746331_200000210301 [2,0,0,0,0,0|1,0,0]=3 6992 B7R0.1 COCCCCCBr 7a_100000746331_200000210301 [2,0,0,0,0,0|1,0,0]=3 6993 B7R0.1 COCCCCCCl 34a_100000746330_200000210301 [2,0,0,0,0,0|1,0,0]=3 6994 B7R0.1 COCCCCCCl 7a_100000746330_200000210301 [2,0,0,0,0,0|1,0,0]=3 6995 B7R0.1 COCCCCCF 34a_100138415774_100000729378 [2,0,0,0,0,0|1,0,0]=3 6996 B7R0.1 COCCCCCI 34a_200012148887_200000210301 [2,0,0,0,0,0|1,0,0]=3 6997 B7R0.1 COCCCCCI 7a_200012148887_200000210301 [2,0,0,0,0,0|1,0,0]=3 6998 B7R0.1 COCCCCCN 34a_100000762737_200000210301 [2,0,0,0,0,0|1,0,0]=3 6999 B7R0.1 COCCCCCO 34a_100138415774_100000746330 [2,0,0,0,0,0|1,0,0]=3 7000 B7R0.1 COCCCCOC 34a_100000740925_200000210301 [2,0,0,0,0,0|0,0,0]=2 7001 B7R0.1 COCCCCOC 34a_100138415774_100000755781 [2,0,0,0,0,0|0,0,0]=2 7002 B7R0.1 COCCCCO[13CH3] 34a_100000740925_200025704644 [2,0,0,0,0,0|0,0,0]=2 7003 B7R0.1 COCCCCSC 34a_100011217163_200000210301 [2,0,0,0,0,0|0,1,0]=3 7004 B7R0.1 COCCCCSC 62a_100000730899_200000210301 [2,0,0,0,0,0|0,1,0]=3 7005 B7R0.1 COCCCCSC 62a_200000210301_100000730899 [2,0,0,0,0,0|0,1,0]=3 7006 B7R0.1 COCCCCSC 7a_100011217163_200000210301 [2,0,0,0,0,0|0,1,0]=3 7007 B7R0.1 COCCCCS[13CH3] 62a_100000730899_200025704644 [2,0,0,0,0,0|0,1,0]=3 7008 B7R0.1 COCCCCS[13CH3] 62a_200025704644_100000730899 [2,0,0,0,0,0|0,1,0]=3 7009 B7R0.1 COCCCNCF 34a_100150723488_100015361967 [2,0,0,0,0,0|2,0,0]=4 7010 B7R0.1 COCCCOCF 34a_100000740835_100015361967 [2,0,0,0,0,0|1,0,0]=3 7011 B7R0.1 COCCCSCF 62a_100000709357_100015361967 [2,0,0,0,0,0|1,1,0]=4 7012 B7R0.1 COCCCSCF 62a_100015361967_100000709357 [2,0,0,0,0,0|1,1,0]=4 7013 B7R0.1 COCCNCCF 2230a_100000209980_100011217306 [2,0,0,0,0,0|2,0,0]=4 7014 B7R0.1 COCCNCCF 34a_100000724931_100011201679 [2,0,0,0,0,0|2,0,0]=4 7015 B7R0.1 COCCNCCO 2230a_100000209980_100000211926 [2,0,0,0,0,0|1,0,0]=3 7016 B7R0.1 COCCNCCO 2230a_100016997473_100011201679 [2,0,0,0,0,0|1,0,0]=3 7017 B7R0.1 COCCNCCO 34a_100016990907_100011201679 [2,0,0,0,0,0|1,0,0]=3 7018 B7R0.1 COCCNCOC 2230a_100000209980_100000766300 [2,0,0,0,0,0|1,0,0]=3 7019 B7R0.1 COCCNCSC 2230a_100000209980_100011218213 [2,0,0,0,0,0|1,1,0]=4 7020 B7R0.1 COCCOCC=O 34a_100000210237_200009817547 [2,0,0,0,0,0|0,0,2]=4 7021 B7R0.1 COCCOCCBr 34a_100000211926_100011201679 [2,0,0,0,0,0|1,0,0]=3 7022 B7R0.1 COCCOCCBr 34a_100000692535_200000210301 [2,0,0,0,0,0|1,0,0]=3 7023 B7R0.1 COCCOCCBr 7a_100000692535_200000210301 [2,0,0,0,0,0|1,0,0]=3 7024 B7R0.1 COCCOCCCl 34a_100011215305_200000210301 [2,0,0,0,0,0|1,0,0]=3 7025 B7R0.1 COCCOCCCl 7a_100011215305_200000210301 [2,0,0,0,0,0|1,0,0]=3 7026 B7R0.1 COCCOCCF 34a_100000210237_100011217306 [2,0,0,0,0,0|1,0,0]=3 7027 B7R0.1 COCCOCCF 34a_200015357709_200000210301 [2,0,0,0,0,0|1,0,0]=3 7028 B7R0.1 COCCOCCF 7a_200015357709_200000210301 [2,0,0,0,0,0|1,0,0]=3 7029 B7R0.1 COCCOCCI 34a_100012149058_200000210301 [2,0,0,0,0,0|1,0,0]=3 7030 B7R0.1 COCCOCCI 7a_100012149058_200000210301 [2,0,0,0,0,0|1,0,0]=3 7031 B7R0.1 COCCOCCN 34a_100000210304_100011201679 [2,0,0,0,0,0|1,0,0]=3 7032 B7R0.1 COCCOCCN 34a_100000211614_200000210301 [2,0,0,0,0,0|1,0,0]=3 7033 B7R0.1 COCCOCCO 34a_100000210237_100000211926 [2,0,0,0,0,0|0,0,0]=2 7034 B7R0.1 COCCOCCO 34a_100138415774_100000692535 [2,0,0,0,0,0|0,0,0]=2 7035 B7R0.1 COCCOCSC 34a_100000210237_100011218213 [2,0,0,0,0,0|0,1,0]=3 7036 B7R0.1 COCCOCSC 62a_100000231047_200000210301 [2,0,0,0,0,0|0,1,0]=3 7037 B7R0.1 COCCOCSC 62a_200000210301_100000231047 [2,0,0,0,0,0|0,1,0]=3 7038 B7R0.1 COCCOCS[13CH3] 62a_100000231047_200025704644 [2,0,0,0,0,0|0,1,0]=3 7039 B7R0.1 COCCOCS[13CH3] 62a_200025704644_100000231047 [2,0,0,0,0,0|0,1,0]=3 7040 B7R0.1 COCCSCCF 62a_100000233755_100011217306 [2,0,0,0,0,0|1,1,0]=4 7041 B7R0.1 COCCSCCF 62a_100011217306_100000233755 [2,0,0,0,0,0|1,1,0]=4 7042 B7R0.1 COCCSCCO 62a_100000211926_100000233755 [2,0,0,0,0,0|0,1,0]=3 7043 B7R0.1 COCCSCCO 62a_100000233755_100000211926 [2,0,0,0,0,0|0,1,0]=3 7044 B7R0.1 COCCSCOC 62a_100000233755_100000766300 [2,0,0,0,0,0|0,1,0]=3 7045 B7R0.1 COCCSCOC 62a_100000766300_100000233755 [2,0,0,0,0,0|0,1,0]=3 7046 B7R0.1 COCCSCSC 62a_100000233755_100011218213 [2,0,0,0,0,0|0,2,0]=4 7047 B7R0.1 COCCSCSC 62a_100011218213_100000233755 [2,0,0,0,0,0|0,2,0]=4 7048 B7R0.1 COCNCCCF 2230a_100015189416_100000766300 [2,0,0,0,0,0|2,0,0]=4 7049 B7R0.1 COCNCCSC 2230a_100020590264_100000766300 [2,0,0,0,0,0|1,1,0]=4 7050 B7R0.1 COCSCCCF 62a_100000766300_100011934791 [2,0,0,0,0,0|1,1,0]=4 7051 B7R0.1 COCSCCCF 62a_100011934791_100000766300 [2,0,0,0,0,0|1,1,0]=4 7052 B7R0.1 COCSCCCO 62a_100000766300_100011215043 [2,0,0,0,0,0|1,1,0]=4 7053 B7R0.1 COCSCCCO 62a_100011215043_100000766300 [2,0,0,0,0,0|1,1,0]=4 7054 B7R0.1 COCSCCSC 62a_100000212216_100000766300 [2,0,0,0,0,0|0,2,0]=4 7055 B7R0.1 COCSCCSC 62a_100000766300_100000751147 [2,0,0,0,0,0|0,2,0]=4 7056 B7R0.1 CSCCCCCF 62a_100000729378_200000210301 [2,0,0,0,0,0|1,1,0]=4 7057 B7R0.1 CSCCCCCF 62a_200000210301_100000729378 [2,0,0,0,0,0|1,1,0]=4 7058 B7R0.1 CSCCCCCO 62a_100000746330_200000210301 [2,0,0,0,0,0|1,1,0]=4 7059 B7R0.1 CSCCCCCO 62a_200000210301_100000746330 [2,0,0,0,0,0|1,1,0]=4 7060 B7R0.1 CSCCCCO[13CH3] 34a_100011217163_200025704644 [2,0,0,0,0,0|0,1,0]=3 7061 B7R0.1 CSCCCCO[13CH3] 7a_100011217163_200025704644 [2,0,0,0,0,0|0,1,0]=3 7062 B7R0.1 CSCCCOCF 34a_100000690336_100015361967 [2,0,0,0,0,0|1,1,0]=4 7063 B7R0.1 CSCCCOCF 7a_100000690336_100015361967 [2,0,0,0,0,0|1,1,0]=4 7064 B7R0.1 CSCCNCCO 2230a_100016997473_100000751147 [2,0,0,0,0,0|1,1,0]=4 7065 B7R0.1 CSCCNCCO 2230a_100020590264_100000211926 [2,0,0,0,0,0|1,1,0]=4 7066 B7R0.1 CSCCNCCO 34a_100016990907_100000212216 [2,0,0,0,0,0|1,1,0]=4 7067 B7R0.1 CSCCOCCBr 34a_100000211926_100000212216 [2,0,0,0,0,0|1,1,0]=4 7068 B7R0.1 CSCCOCCF 34a_100000230434_100011217306 [2,0,0,0,0,0|1,1,0]=4 7069 B7R0.1 CSCCOCCF 7a_100000230434_100011217306 [2,0,0,0,0,0|1,1,0]=4 7070 B7R0.1 CSCCOCCN 34a_100000210304_100000212216 [2,0,0,0,0,0|1,1,0]=4 7071 B7R0.1 CSCCOCCO 34a_100000230434_100000211926 [2,0,0,0,0,0|0,1,0]=3 7072 B7R0.1 CSCCOCCO 62a_100011215305_200000210301 [2,0,0,0,0,0|0,1,0]=3 7073 B7R0.1 CSCCOCCO 62a_200000210301_100011215305 [2,0,0,0,0,0|0,1,0]=3 7074 B7R0.1 CSCCOCCO 7a_100000230434_100000211926 [2,0,0,0,0,0|0,1,0]=3 7075 B7R0.1 CSCCOCSC 34a_100000230434_100011218213 [2,0,0,0,0,0|0,2,0]=4 7076 B7R0.1 CSCCSCCO 62a_100000211926_100000751147 [2,0,0,0,0,0|0,2,0]=4 7077 B7R0.1 CSCCSCCO 62a_100000212216_100000211926 [2,0,0,0,0,0|0,2,0]=4 7078 B7R0.1 CSCOCCCBr 34a_100011217188_100011218213 [2,0,0,0,0,0|1,1,0]=4 7079 B7R0.1 CSCOCCCCl 34a_100000230001_100011218213 [2,0,0,0,0,0|1,1,0]=4 7080 B7R0.1 CSCOCCCF 34a_100000759539_100011218213 [2,0,0,0,0,0|1,1,0]=4 7081 B7R0.1 CSCOCCCN 34a_100000182051_100011218213 [2,0,0,0,0,0|1,1,0]=4 7082 B7R0.1 CSCOCCON 34a_100000700252_100011218213 [2,0,0,0,0,0|1,1,0]=4 7083 B7R0.1 FCCCCOCF 34a_100011995726_100015361967 [2,0,0,0,0,0|2,0,0]=4 7084 B7R0.1 FCCCCOCF 7a_100011995726_100015361967 [2,0,0,0,0,0|2,0,0]=4 7085 B7R0.1 FCCCOCCBr 34a_100000211926_100011934791 [2,0,0,0,0,0|2,0,0]=4 7086 B7R0.1 FCCCOCCF 34a_100000759539_100011217306 [2,0,0,0,0,0|2,0,0]=4 7087 B7R0.1 FCCOCCCBr 34a_100011217188_100011217306 [2,0,0,0,0,0|2,0,0]=4 7088 B7R0.1 FCCOCCCCl 34a_100000230001_100011217306 [2,0,0,0,0,0|2,0,0]=4 7089 B7R0.1 FCOCCCCBr 34a_100011216708_100015361967 [2,0,0,0,0,0|2,0,0]=4 7090 B7R0.1 FCOCCCCCl 34a_100000210776_100015361967 [2,0,0,0,0,0|2,0,0]=4 7091 B7R0.1 FCOCCCCCl 7a_100000210776_100015361967 [2,0,0,0,0,0|2,0,0]=4 7092 B7R0.1 FCOCCCCI 34a_200012148704_100015361967 [2,0,0,0,0,0|2,0,0]=4 7093 B7R0.1 NCCCCOCF 34a_100000750430_100015361967 [2,0,0,0,0,0|2,0,0]=4 7094 B7R0.1 NCCCOCCF 34a_100000182051_100011217306 [2,0,0,0,0,0|2,0,0]=4 7095 B7R0.1 NCCCOCCO 34a_100000182051_100000211926 [2,0,0,0,0,0|1,0,0]=3 7096 B7R0.1 NCCOCCCF 34a_100000210304_100011934791 [2,0,0,0,0,0|2,0,0]=4 7097 B7R0.1 NCCOCCCO 34a_100000210304_100000230001 [2,0,0,0,0,0|2,0,0]=4 7098 B7R0.1 NOCCOCCF 34a_100000700252_100011217306 [2,0,0,0,0,0|2,0,0]=4 7099 B7R0.1 NOCCOCCO 34a_100000700252_100000211926 [2,0,0,0,0,0|1,0,0]=3 7100 B7R0.1 OCCCCNCF 34a_100000750430_100015361967 [2,0,0,0,0,0|2,0,0]=4 7101 B7R0.1 OCCCCSCF 62a_100000210776_100015361967 [2,0,0,0,0,0|1,1,0]=4 7102 B7R0.1 OCCCCSCF 62a_100015361967_100000210776 [2,0,0,0,0,0|1,1,0]=4 7103 B7R0.1 OCCCNCCO 2230a_100016997473_100000230001 [2,0,0,0,0,0|2,0,0]=4 7104 B7R0.1 OCCCNCCO 34a_100016990907_100000230001 [2,0,0,0,0,0|2,0,0]=4 7105 B7R0.1 OCCCOCCBr 34a_100000211926_100000230001 [2,0,0,0,0,0|2,0,0]=4 7106 B7R0.1 OCCCSCCO 62a_100000211926_100011215043 [2,0,0,0,0,0|1,1,0]=4 7107 B7R0.1 OCCCSCCO 62a_100011215043_100000211926 [2,0,0,0,0,0|1,1,0]=4 7108 B7R0.1 OCCNCCCF 2230a_100015189416_100000211926 [2,0,0,0,0,0|2,0,0]=4 7109 B7R0.1 OCCNCCCF 2230a_100016997473_100011934791 [2,0,0,0,0,0|2,0,0]=4 7110 B7R0.1 OCCNCCCF 34a_100015189416_100000211926 [2,0,0,0,0,0|2,0,0]=4 7111 B7R0.1 OCCNCCCF 34a_100016990907_100011934791 [2,0,0,0,0,0|2,0,0]=4 7112 B7R0.1 OCCOCCCBr 34a_100011217188_100000211926 [2,0,0,0,0,0|1,0,0]=3 7113 B7R0.1 OCCOCCCCl 34a_100000230001_100000211926 [2,0,0,0,0,0|1,0,0]=3 7114 B7R0.1 OCCOCCCF 34a_100000759539_100000211926 [2,0,0,0,0,0|1,0,0]=3 7115 B7R0.1 OCCSCCCF 62a_100000211926_100011934791 [2,0,0,0,0,0|1,1,0]=4 7116 B7R0.1 OCCSCCCF 62a_100011934791_100000211926 [2,0,0,0,0,0|1,1,0]=4 7117 B7R0.1 [13CH3]NCCCCCO 2230a_100000762737_200025704644 [2,0,0,0,0,0|2,0,0]=4 7118 B7R0.1 [13CH3]NCCCCCO 34a_100000762737_200025704644 [2,0,0,0,0,0|2,0,0]=4 7119 B7R0.1 [13CH3]NCCOCCO 2230a_100000211614_200025704644 [2,0,0,0,0,0|1,0,0]=3 7120 B7R0.1 [13CH3]NCCOCCO 34a_100000211614_200025704644 [2,0,0,0,0,0|1,0,0]=3 7121 B7R0.1 [13CH3]NCCSCCO 2230a_100011219999_200025704644 [2,0,0,0,0,0|1,1,0]=4 7122 B7R0.1 [13CH3]OCCCCCBr 34a_100000746331_200025704644 [2,0,0,0,0,0|1,0,0]=3 7123 B7R0.1 [13CH3]OCCCCCBr 7a_100000746331_200025704644 [2,0,0,0,0,0|1,0,0]=3 7124 B7R0.1 [13CH3]OCCCCCCl 34a_100000746330_200025704644 [2,0,0,0,0,0|1,0,0]=3 7125 B7R0.1 [13CH3]OCCCCCCl 7a_100000746330_200025704644 [2,0,0,0,0,0|1,0,0]=3 7126 B7R0.1 [13CH3]OCCCCCI 34a_200012148887_200025704644 [2,0,0,0,0,0|1,0,0]=3 7127 B7R0.1 [13CH3]OCCCCCI 7a_200012148887_200025704644 [2,0,0,0,0,0|1,0,0]=3 7128 B7R0.1 [13CH3]OCCCCCN 34a_100000762737_200025704644 [2,0,0,0,0,0|1,0,0]=3 7129 B7R0.1 [13CH3]OCCOCCBr 34a_100000692535_200025704644 [2,0,0,0,0,0|1,0,0]=3 7130 B7R0.1 [13CH3]OCCOCCBr 7a_100000692535_200025704644 [2,0,0,0,0,0|1,0,0]=3 7131 B7R0.1 [13CH3]OCCOCCCl 34a_100011215305_200025704644 [2,0,0,0,0,0|1,0,0]=3 7132 B7R0.1 [13CH3]OCCOCCCl 7a_100011215305_200025704644 [2,0,0,0,0,0|1,0,0]=3 7133 B7R0.1 [13CH3]OCCOCCF 34a_200015357709_200025704644 [2,0,0,0,0,0|1,0,0]=3 7134 B7R0.1 [13CH3]OCCOCCF 7a_200015357709_200025704644 [2,0,0,0,0,0|1,0,0]=3 7135 B7R0.1 [13CH3]OCCOCCI 34a_100012149058_200025704644 [2,0,0,0,0,0|1,0,0]=3 7136 B7R0.1 [13CH3]OCCOCCI 7a_100012149058_200025704644 [2,0,0,0,0,0|1,0,0]=3 7137 B7R0.1 [13CH3]OCCOCCN 34a_100000211614_200025704644 [2,0,0,0,0,0|1,0,0]=3 7138 B7R0.1 [13CH3]SCCCCCF 62a_100000729378_200025704644 [2,0,0,0,0,0|1,1,0]=4 7139 B7R0.1 [13CH3]SCCCCCF 62a_200025704644_100000729378 [2,0,0,0,0,0|1,1,0]=4 7140 B7R0.1 [13CH3]SCCCCCO 62a_100000746330_200025704644 [2,0,0,0,0,0|1,1,0]=4 7141 B7R0.1 [13CH3]SCCCCCO 62a_200025704644_100000746330 [2,0,0,0,0,0|1,1,0]=4 7142 B7R0.1 [13CH3]SCCOCCO 62a_100011215305_200025704644 [2,0,0,0,0,0|0,1,0]=3 7143 B7R0.1 [13CH3]SCCOCCO 62a_200025704644_100011215305 [2,0,0,0,0,0|0,1,0]=3 7144 B9R0.2 C#CCCCCOC(C)C 34a_100000212225_100010269958 [1,1,0,0,0,0|1,0,1]=4 7145 B9R0.2 C#CCCCCOC(C)C 34a_100000766709_100000210206 [1,1,0,0,0,0|1,0,1]=4 7146 B9R0.2 C#CCCCCOC(C)C 7a_100000766709_100000210206 [1,1,0,0,0,0|1,0,1]=4 7147 B9R0.2 C#CCCOCCC(C)Br 34a_100009893172_100000688953 [1,1,0,0,0,0|1,0,1]=4 7148 B9R0.2 C#CCCOCCC(C)C 34a_100000210254_100000688953 [1,1,0,0,0,0|1,0,1]=4 7149 B9R0.2 C#CCCOCCC(C)C 34a_100011215631_100000210312 [1,1,0,0,0,0|1,0,1]=4 7150 B9R0.2 C#CCCOCCC(C)C 7a_100000210254_100000688953 [1,1,0,0,0,0|1,0,1]=4 7151 B9R0.2 C#CCCOCCC(C)O 34a_100011215631_100012276601 [1,1,0,0,0,0|1,0,1]=4 7152 B9R0.2 C#CCCOCC[C@@H](C)N 34a_100000706166_100000688953 [1,1,0,0,0,0|1,0,1]=4 7153 B9R0.2 C#CCCOCOC(C)C 34a_100011215631_100000709892 [1,1,0,0,0,0|1,0,1]=4 7154 B9R0.2 C#CCOCCOC(C)C 34a_100000054580_100000210206 [1,1,0,0,0,0|0,0,2]=4 7155 B9R0.2 C#CCOCCOC(C)C 34a_100000210247_100000211751 [1,1,0,0,0,0|0,0,2]=4 7156 B9R0.2 C#CCOCCOC(C)C 34a_100000211219_100000184674 [1,1,0,0,0,0|0,0,2]=4 7157 B9R0.2 C#CCOCCOC(C)C 34a_100000212225_100010402529 [1,1,0,0,0,0|0,0,2]=4 7158 B9R0.2 C#CCOCCOC(C)C 7a_100000054580_100000210206 [1,1,0,0,0,0|0,0,2]=4 7159 B9R0.2 C#CCOCCOC(C)C 7a_100000211219_100000038162 [1,1,0,0,0,0|0,0,2]=4 7160 B9R0.2 C/C=C/CCOCC(C)C 34a_100016278192_100000210624 [1,1,0,0,0,0|1,0,1]=4 7161 B9R0.2 C/C=C/CCOCC(C)O 34a_100016278192_100011218427 [1,1,0,0,0,0|1,0,1]=4 7162 B9R0.2 C/C=C/CCOC[C@@H](C)O 34a_100016278192_100009817552 [1,1,0,0,0,0|1,0,1]=4 7163 B9R0.2 C/C=C/COCCC(C)Br 34a_100009893172_100102629194 [1,1,0,0,0,0|1,0,1]=4 7164 B9R0.2 C/C=C/COCCC(C)C 34a_100000210254_100102629194 [1,1,0,0,0,0|1,0,1]=4 7165 B9R0.2 C/C=C/COCCC(C)C 34a_100016270725_100000210312 [1,1,0,0,0,0|1,0,1]=4 7166 B9R0.2 C/C=C/COCCC(C)C 7a_100000210254_100102629194 [1,1,0,0,0,0|1,0,1]=4 7167 B9R0.2 C/C=C/COCCC(C)O 34a_100016270725_100012276601 [1,1,0,0,0,0|1,0,1]=4 7168 B9R0.2 C/C=C/COCC[C@@H](C)N 34a_100000706166_100102629194 [1,1,0,0,0,0|1,0,1]=4 7169 B9R0.2 C/C=C/COCOC(C)C 34a_100016270725_100000709892 [1,1,0,0,0,0|1,0,1]=4 7170 B9R0.2 C=C(Br)CCOCCCC 34a_100009813270_100000210210 [1,1,0,0,0,0|1,0,1]=4 7171 B9R0.2 C=C(Br)CCOCCOC 34a_100009813270_100011201679 [1,1,0,0,0,0|0,0,2]=4 7172 B9R0.2 C=C(C)CCNCCCC 2230a_100000102301_100000730704 [1,1,0,0,0,0|2,0,0]=4 7173 B9R0.2 C=C(C)CCNCCCC 7a_106832991798_100000730704 [1,1,0,0,0,0|2,0,0]=4 7174 B9R0.2 C=C(C)CCNCCOC 2230a_100000209980_100000730704 [1,1,0,0,0,0|1,0,1]=4 7175 B9R0.2 C=C(C)CCOCCCBr 34a_100011217188_100000730704 [1,1,0,0,0,0|2,0,0]=4 7176 B9R0.2 C=C(C)CCOCCCC 34a_100000210227_100000730704 [1,1,0,0,0,0|1,0,0]=3 7177 B9R0.2 C=C(C)CCOCCCC 34a_100000764851_100000210210 [1,1,0,0,0,0|1,0,0]=3 7178 B9R0.2 C=C(C)CCOCCCC 7a_100000210227_100000730704 [1,1,0,0,0,0|1,0,0]=3 7179 B9R0.2 C=C(C)CCOCCCCl 34a_100000230001_100000730704 [1,1,0,0,0,0|2,0,0]=4 7180 B9R0.2 C=C(C)CCOCCCF 34a_100000759539_100000730704 [1,1,0,0,0,0|2,0,0]=4 7181 B9R0.2 C=C(C)CCOCCCF 34a_100000764851_100011934791 [1,1,0,0,0,0|2,0,0]=4 7182 B9R0.2 C=C(C)CCOCCCN 34a_100000182051_100000730704 [1,1,0,0,0,0|2,0,0]=4 7183 B9R0.2 C=C(C)CCOCCCO 34a_100000764851_100000230001 [1,1,0,0,0,0|2,0,0]=4 7184 B9R0.2 C=C(C)CCOCCOC 34a_100000210237_100000730704 [1,1,0,0,0,0|0,0,1]=3 7185 B9R0.2 C=C(C)CCOCCOC 34a_100000764851_100011201679 [1,1,0,0,0,0|0,0,1]=3 7186 B9R0.2 C=C(C)CCOCCON 34a_100000700252_100000730704 [1,1,0,0,0,0|1,0,1]=4 7187 B9R0.2 C=C(C)CCOCCSC 34a_100000230434_100000730704 [1,1,0,0,0,0|0,1,1]=4 7188 B9R0.2 C=C(C)CCOCCSC 34a_100000764851_100000212216 [1,1,0,0,0,0|0,1,1]=4 7189 B9R0.2 C=C(C)CCOCCSC 7a_100000230434_100000730704 [1,1,0,0,0,0|0,1,1]=4 7190 B9R0.2 C=C(C)CCSCCCC 62a_100000210211_100000730704 [1,1,0,0,0,0|1,1,0]=4 7191 B9R0.2 C=C(C)CCSCCCC 62a_100000730704_100000210210 [1,1,0,0,0,0|1,1,0]=4 7192 B9R0.2 C=C(C)CCSCCOC 62a_100000233755_100000730704 [1,1,0,0,0,0|0,1,1]=4 7193 B9R0.2 C=C(C)CCSCCOC 62a_100000730704_100000233755 [1,1,0,0,0,0|0,1,1]=4 7194 B9R0.2 C=C(C)CCSCOCC 62a_100000730704_100000739092 [1,1,0,0,0,0|1,1,0]=4 7195 B9R0.2 C=C(C)CCSCOCC 62a_100000739092_100000730704 [1,1,0,0,0,0|1,1,0]=4 7196 B9R0.2 C=C(C)CNCCOCC 2230a_102516460346_100000748629 [1,1,0,0,0,0|1,0,1]=4 7197 B9R0.2 C=C(C)CNCCOCC 34a_102516460346_100000748629 [1,1,0,0,0,0|1,0,1]=4 7198 B9R0.2 C=C(C)COCCCCC 34a_100000210245_100000718602 [1,1,0,0,0,0|1,0,1]=4 7199 B9R0.2 C=C(C)COCCCCC 34a_100000210253_100000748629 [1,1,0,0,0,0|1,0,1]=4 7200 B9R0.2 C=C(C)COCCCCC 7a_100000210253_100000748629 [1,1,0,0,0,0|1,0,1]=4 7201 B9R0.2 C=C(C)COCCOCC 34a_100000210136_100000748629 [1,1,0,0,0,0|0,0,1]=3 7202 B9R0.2 C=C(C)COCCOCC 34a_100000210245_100000210147 [1,1,0,0,0,0|0,0,1]=3 7203 B9R0.2 C=C(C)COCCOCC 7a_100000210136_100000748629 [1,1,0,0,0,0|0,0,1]=3 7204 B9R0.2 C=C(C)COCCSCC 34a_100000210245_100000757381 [1,1,0,0,0,0|0,1,1]=4 7205 B9R0.2 C=C(C)COCCSCC 34a_100000212035_100000748629 [1,1,0,0,0,0|0,1,1]=4 7206 B9R0.2 C=C(C)COCCSCC 7a_100000212035_100000748629 [1,1,0,0,0,0|0,1,1]=4 7207 B9R0.2 C=C(C)CSCCOCC 62a_100000210147_100000211660 [1,1,0,0,0,0|0,1,1]=4 7208 B9R0.2 C=C(C)CSCCOCC 62a_100000748629_100011215890 [1,1,0,0,0,0|0,1,1]=4 7209 B9R0.2 C=C(F)COCCOCC 34a_100000210136_100009893438 [1,1,0,0,0,0|0,0,2]=4 7210 B9R0.2 C=C(F)COCCOCC 34a_200010262243_100000210147 [1,1,0,0,0,0|0,0,2]=4 7211 B9R0.2 C=C(F)COCCOCC 7a_100000210136_100000042424 [1,1,0,0,0,0|0,0,2]=4 7212 B9R0.2 C=CCCCCOC(C)C 34a_100000212225_100011215482 [1,1,0,0,0,0|1,0,1]=4 7213 B9R0.2 C=CCCCCOC(C)C 34a_100000766645_100000210206 [1,1,0,0,0,0|1,0,1]=4 7214 B9R0.2 C=CCCCCOC(C)C 7a_100000766645_100000210206 [1,1,0,0,0,0|1,0,1]=4 7215 B9R0.2 C=CCCOCCC(C)Br 34a_100009893172_100000754431 [1,1,0,0,0,0|1,0,1]=4 7216 B9R0.2 C=CCCOCCC(C)C 34a_100000210254_100000754431 [1,1,0,0,0,0|1,0,1]=4 7217 B9R0.2 C=CCCOCCC(C)C 34a_100011205117_100000210312 [1,1,0,0,0,0|1,0,1]=4 7218 B9R0.2 C=CCCOCCC(C)C 7a_100000210254_100000754431 [1,1,0,0,0,0|1,0,1]=4 7219 B9R0.2 C=CCCOCCC(C)O 34a_100011205117_100012276601 [1,1,0,0,0,0|1,0,1]=4 7220 B9R0.2 C=CCCOCC[C@@H](C)N 34a_100000706166_100000754431 [1,1,0,0,0,0|1,0,1]=4 7221 B9R0.2 C=CCCOCOC(C)C 34a_100011205117_100000709892 [1,1,0,0,0,0|1,0,1]=4 7222 B9R0.2 C=CCOCCOC(C)C 34a_100000037705_100000210206 [1,1,0,0,0,0|0,0,2]=4 7223 B9R0.2 C=CCOCCOC(C)C 34a_100000211219_100015514636 [1,1,0,0,0,0|0,0,2]=4 7224 B9R0.2 C=CCOCCOC(C)C 34a_200000210373_100000211751 [1,1,0,0,0,0|0,0,2]=4 7225 B9R0.2 C=CCOCCOC(C)C 7a_100000037705_100000210206 [1,1,0,0,0,0|0,0,2]=4 7226 B9R0.2 C=CCOCCOC(C)C 7a_100000211219_100015514636 [1,1,0,0,0,0|0,0,2]=4 7227 B9R0.2 C=COCCOCC(C)Br 34a_100012180447_100000039644 [1,1,0,0,0,0|0,0,2]=4 7228 B9R0.2 C=COCCOCC(C)C 34a_100000033082_100000210624 [1,1,0,0,0,0|0,0,2]=4 7229 B9R0.2 C=COCCOCC(C)C 34a_100000210257_100000039644 [1,1,0,0,0,0|0,0,2]=4 7230 B9R0.2 C=COCCOCC(C)F 34a_100015925927_100000039644 [1,1,0,0,0,0|0,0,2]=4 7231 B9R0.2 C=COCCOCC(C)O 34a_100000033082_100011218427 [1,1,0,0,0,0|0,0,2]=4 7232 B9R0.2 C=COCCOC[C@@H](C)Cl 34a_100016084084_100000039644 [1,1,0,0,0,0|0,0,2]=4 7233 B9R0.2 C=COCCOC[C@@H](C)N 34a_100000737577_100000039644 [1,1,0,0,0,0|0,0,2]=4 7234 B9R0.2 C=COCCOC[C@@H](C)O 34a_100000033082_100009817552 [1,1,0,0,0,0|0,0,2]=4 7235 B9R0.2 CC#CCCOCC(C)C 34a_100000750427_100000210624 [1,1,0,0,0,0|1,0,1]=4 7236 B9R0.2 CC#CCCOCC(C)O 34a_100000750427_100011218427 [1,1,0,0,0,0|1,0,1]=4 7237 B9R0.2 CC#CCCOC[C@@H](C)O 34a_100000750427_100009817552 [1,1,0,0,0,0|1,0,1]=4 7238 B9R0.2 CC#CCOCCC(C)Br 34a_100009893172_100000748600 [1,1,0,0,0,0|1,0,1]=4 7239 B9R0.2 CC#CCOCCC(C)C 34a_100000210254_100000748600 [1,1,0,0,0,0|1,0,1]=4 7240 B9R0.2 CC#CCOCCC(C)C 34a_100000761923_100000210312 [1,1,0,0,0,0|1,0,1]=4 7241 B9R0.2 CC#CCOCCC(C)C 7a_100000210254_100000748600 [1,1,0,0,0,0|1,0,1]=4 7242 B9R0.2 CC#CCOCCC(C)O 34a_100000761923_100012276601 [1,1,0,0,0,0|1,0,1]=4 7243 B9R0.2 CC#CCOCC[C@@H](C)N 34a_100000706166_100000748600 [1,1,0,0,0,0|1,0,1]=4 7244 B9R0.2 CC#CCOCOC(C)C 34a_100000761923_100000709892 [1,1,0,0,0,0|1,0,1]=4 7245 B9R0.2 CC(=O)CCCOCCO 34a_100000759063_100000211926 [1,1,0,0,0,0|1,0,1]=4 7246 B9R0.2 CC(=O)CCCOCCO 7a_100000759063_100000211926 [1,1,0,0,0,0|1,0,1]=4 7247 B9R0.2 CC(=O)CCOCCCF 34a_100000759926_100011934791 [1,1,0,0,0,0|2,0,0]=4 7248 B9R0.2 CC(=O)CCOCCCF 7a_100000759926_100011934791 [1,1,0,0,0,0|2,0,0]=4 7249 B9R0.2 CC(=O)CCOCCCO 34a_100000759926_100000230001 [1,1,0,0,0,0|2,0,0]=4 7250 B9R0.2 CC(=O)CCOCCCO 7a_100000759926_100011215043 [1,1,0,0,0,0|2,0,0]=4 7251 B9R0.2 CC(=O)NCCOCCO 240690a_100000211614_100015343762 [1,1,0,0,0,0|1,0,1]=4 7252 B9R0.2 CC(=O)NCCOCCO 34a_100000158858_100000211926 [1,1,0,0,0,0|1,0,1]=4 7253 B9R0.2 CC(=O)OCCCCO[13CH3] 34a_100000073216_200025704644 [1,1,0,0,0,0|0,0,1]=3 7254 B9R0.2 CC(=O)OCCCCO[13CH3] 7a_100000073216_200025704644 [1,1,0,0,0,0|0,0,1]=3 7255 B9R0.2 CC(=O)OCCCCS[13CH3] 62a_100000033659_200025704644 [1,1,0,0,0,0|0,1,1]=4 7256 B9R0.2 CC(=O)OCCCCS[13CH3] 62a_200025704644_100000033659 [1,1,0,0,0,0|0,1,1]=4 7257 B9R0.2 CC(=O)OCCNCCO 34a_100016990907_100009814007 [1,1,0,0,0,0|1,0,1]=4 7258 B9R0.2 CC(=O)OCCOCCBr 34a_100000211926_100009814007 [1,1,0,0,0,0|1,0,1]=4 7259 B9R0.2 CC(=O)OCCOCCN 34a_100000210304_100009814007 [1,1,0,0,0,0|1,0,1]=4 7260 B9R0.2 CC(=O)OCCOCS[13CH3] 62a_100000076355_200025704644 [1,1,0,0,0,0|0,1,1]=4 7261 B9R0.2 CC(=O)OCCOCS[13CH3] 62a_200025704644_100000076355 [1,1,0,0,0,0|0,1,1]=4 7262 B9R0.2 CC(=O)OCCSCCO 62a_100000211926_100009814007 [1,1,0,0,0,0|0,1,1]=4 7263 B9R0.2 CC(=O)OCCSCCO 62a_100009814007_100000211926 [1,1,0,0,0,0|0,1,1]=4 7264 B9R0.2 CC(=O)OCOCCON 34a_100000700252_100009813279 [1,1,0,0,0,0|1,0,1]=4 7265 B9R0.2 CC(Br)CCOCCCF 34a_100009893172_100011934791 [1,1,0,0,0,0|2,0,0]=4 7266 B9R0.2 CC(Br)CCOCCCO 34a_100009893172_100000230001 [1,1,0,0,0,0|2,0,0]=4 7267 B9R0.2 CC(Br)COCCCCF 34a_100012180447_100000729493 [1,1,0,0,0,0|2,0,0]=4 7268 B9R0.2 CC(Br)COCCCCO 34a_100012180447_100011216708 [1,1,0,0,0,0|2,0,0]=4 7269 B9R0.2 CC(C)CCCCCN[13CH3] 2230a_100011290863_200025704644 [1,1,0,0,0,0|2,0,0]=4 7270 B9R0.2 CC(C)CCCCCN[13CH3] 34a_100011290863_200025704644 [1,1,0,0,0,0|2,0,0]=4 7271 B9R0.2 CC(C)CCCCCO[13CH3] 34a_100011995859_200025704644 [1,1,0,0,0,0|1,0,0]=3 7272 B9R0.2 CC(C)CCCCCO[13CH3] 7a_100011995859_200025704644 [1,1,0,0,0,0|1,0,0]=3 7273 B9R0.2 CC(C)CCCCCS[13CH3] 62a_100000210682_200025704644 [1,1,0,0,0,0|1,1,0]=4 7274 B9R0.2 CC(C)CCCCCS[13CH3] 62a_200025704644_100000210682 [1,1,0,0,0,0|1,1,0]=4 7275 B9R0.2 CC(C)CCCCOCF 34a_100011214890_100015361967 [1,1,0,0,0,0|2,0,0]=4 7276 B9R0.2 CC(C)CCCCOCF 7a_100011214890_100015361967 [1,1,0,0,0,0|2,0,0]=4 7277 B9R0.2 CC(C)CCCNCCO 2230a_100016997473_100011214892 [1,1,0,0,0,0|2,0,0]=4 7278 B9R0.2 CC(C)CCCNCCO 2230a_200000737386_100000211926 [1,1,0,0,0,0|2,0,0]=4 7279 B9R0.2 CC(C)CCCNCCO 34a_100016990907_100011214892 [1,1,0,0,0,0|2,0,0]=4 7280 B9R0.2 CC(C)CCCNCCO 34a_200000737386_100000211926 [1,1,0,0,0,0|2,0,0]=4 7281 B9R0.2 CC(C)CCCOCCBr 34a_100000211926_100011214892 [1,1,0,0,0,0|2,0,0]=4 7282 B9R0.2 CC(C)CCCOCCF 34a_100000210774_100011217306 [1,1,0,0,0,0|2,0,0]=4 7283 B9R0.2 CC(C)CCCOCCF 7a_100000210774_100011217306 [1,1,0,0,0,0|2,0,0]=4 7284 B9R0.2 CC(C)CCCOCCN 34a_100000210304_100011214892 [1,1,0,0,0,0|2,0,0]=4 7285 B9R0.2 CC(C)CCCOCCO 34a_100000210774_100000211926 [1,1,0,0,0,0|1,0,0]=3 7286 B9R0.2 CC(C)CCCOCCO 7a_100000210774_100000211926 [1,1,0,0,0,0|1,0,0]=3 7287 B9R0.2 CC(C)CCCSCCO 62a_100000211926_100011214892 [1,1,0,0,0,0|1,1,0]=4 7288 B9R0.2 CC(C)CCCSCCO 62a_100011214892_100000211926 [1,1,0,0,0,0|1,1,0]=4 7289 B9R0.2 CC(C)CCOCCC#N 7a_100000210254_100000184422 [1,1,0,0,0,0|2,0,0]=4 7290 B9R0.2 CC(C)CCOCCCBr 34a_100011217188_100000210312 [1,1,0,0,0,0|2,0,0]=4 7291 B9R0.2 CC(C)CCOCCCCl 34a_100000230001_100000210312 [1,1,0,0,0,0|2,0,0]=4 7292 B9R0.2 CC(C)CCOCCCF 34a_100000210254_100011934791 [1,1,0,0,0,0|2,0,0]=4 7293 B9R0.2 CC(C)CCOCCCF 34a_100000759539_100000210312 [1,1,0,0,0,0|2,0,0]=4 7294 B9R0.2 CC(C)CCOCCCF 7a_100000210254_100011934791 [1,1,0,0,0,0|2,0,0]=4 7295 B9R0.2 CC(C)CCOCCCN 34a_100000182051_100000210312 [1,1,0,0,0,0|2,0,0]=4 7296 B9R0.2 CC(C)CCOCCCO 34a_100000210254_100000230001 [1,1,0,0,0,0|2,0,0]=4 7297 B9R0.2 CC(C)CCOCCCO 7a_100000210254_100011215043 [1,1,0,0,0,0|2,0,0]=4 7298 B9R0.2 CC(C)CCOCCON 34a_100000700252_100000210312 [1,1,0,0,0,0|1,0,0]=3 7299 B9R0.2 CC(C)CNCCOCF 34a_100015185251_100015361967 [1,1,0,0,0,0|2,0,0]=4 7300 B9R0.2 CC(C)COCCCCBr 34a_100011216708_100000210624 [1,1,0,0,0,0|2,0,0]=4 7301 B9R0.2 CC(C)COCCCCCl 34a_100000210776_100000210624 [1,1,0,0,0,0|2,0,0]=4 7302 B9R0.2 CC(C)COCCCCCl 7a_100000210776_100000210760 [1,1,0,0,0,0|2,0,0]=4 7303 B9R0.2 CC(C)COCCCCF 34a_100000210257_100000729493 [1,1,0,0,0,0|2,0,0]=4 7304 B9R0.2 CC(C)COCCCCF 34a_100011995726_100000210624 [1,1,0,0,0,0|2,0,0]=4 7305 B9R0.2 CC(C)COCCCCF 7a_100011995726_100000210760 [1,1,0,0,0,0|2,0,0]=4 7306 B9R0.2 CC(C)COCCCCI 34a_200012148704_100000210624 [1,1,0,0,0,0|2,0,0]=4 7307 B9R0.2 CC(C)COCCCCN 34a_100000750430_100000210624 [1,1,0,0,0,0|2,0,0]=4 7308 B9R0.2 CC(C)COCCCCO 34a_100000210257_100011216708 [1,1,0,0,0,0|2,0,0]=4 7309 B9R0.2 CC(C)COCCCN[13CH3] 2230a_100000205972_200025704644 [1,1,0,0,0,0|2,0,0]=4 7310 B9R0.2 CC(C)COCCCN[13CH3] 34a_100000205972_200025704644 [1,1,0,0,0,0|2,0,0]=4 7311 B9R0.2 CC(C)COCCOCF 34a_100000703358_100015361967 [1,1,0,0,0,0|1,0,0]=3 7312 B9R0.2 CC(C)COCCOCF 7a_100000703358_100015361967 [1,1,0,0,0,0|1,0,0]=3 7313 B9R0.2 CC(C)CSCCOCF 34a_200000230437_100015361967 [1,1,0,0,0,0|1,1,0]=4 7314 B9R0.2 CC(C)CSCCOCF 7a_200000230437_100015361967 [1,1,0,0,0,0|1,1,0]=4 7315 B9R0.2 CC(C)NCCCCCO 2230a_100000762737_100000210206 [1,1,0,0,0,0|2,0,0]=4 7316 B9R0.2 CC(C)NCCCCCO 2230a_100138425928_100000746330 [1,1,0,0,0,0|2,0,0]=4 7317 B9R0.2 CC(C)NCCCCCO 34a_100000762737_100000210206 [1,1,0,0,0,0|2,0,0]=4 7318 B9R0.2 CC(C)NCCCCCO 34a_100138425928_100000746330 [1,1,0,0,0,0|2,0,0]=4 7319 B9R0.2 CC(C)NCCCCO[13CH3] 34a_100011521146_200025704644 [1,1,0,0,0,0|1,0,0]=3 7320 B9R0.2 CC(C)NCCOCCF 34a_100000224655_100011217306 [1,1,0,0,0,0|2,0,0]=4 7321 B9R0.2 CC(C)NCCOCCO 2230a_100000211614_100000210206 [1,1,0,0,0,0|1,0,0]=3 7322 B9R0.2 CC(C)NCCOCCO 2230a_100138425928_100011215305 [1,1,0,0,0,0|1,0,0]=3 7323 B9R0.2 CC(C)NCCOCCO 34a_100000211614_100000210206 [1,1,0,0,0,0|1,0,0]=3 7324 B9R0.2 CC(C)NCCOCCO 34a_100000224655_100000211926 [1,1,0,0,0,0|1,0,0]=3 7325 B9R0.2 CC(C)NCCOCCO 34a_100138425928_100000692535 [1,1,0,0,0,0|1,0,0]=3 7326 B9R0.2 CC(C)NCCSCCO 2230a_100011219999_100000210206 [1,1,0,0,0,0|1,1,0]=4 7327 B9R0.2 CC(C)OCCCCCBr 34a_100000746331_100000210206 [1,1,0,0,0,0|2,0,0]=4 7328 B9R0.2 CC(C)OCCCCCBr 7a_100000746331_100000210206 [1,1,0,0,0,0|2,0,0]=4 7329 B9R0.2 CC(C)OCCCCCCl 34a_100000746330_100000210206 [1,1,0,0,0,0|2,0,0]=4 7330 B9R0.2 CC(C)OCCCCCCl 7a_100000746330_100000210206 [1,1,0,0,0,0|2,0,0]=4 7331 B9R0.2 CC(C)OCCCCCF 34a_100000212225_100000729378 [1,1,0,0,0,0|2,0,0]=4 7332 B9R0.2 CC(C)OCCCCCI 34a_200012148887_100000210206 [1,1,0,0,0,0|2,0,0]=4 7333 B9R0.2 CC(C)OCCCCCI 7a_200012148887_100000210206 [1,1,0,0,0,0|2,0,0]=4 7334 B9R0.2 CC(C)OCCCCCN 34a_100000762737_100000210206 [1,1,0,0,0,0|2,0,0]=4 7335 B9R0.2 CC(C)OCCCCCO 34a_100000212225_100000746330 [1,1,0,0,0,0|1,0,0]=3 7336 B9R0.2 CC(C)OCCNCCF 2230a_100000701111_100011217306 [1,1,0,0,0,0|2,0,0]=4 7337 B9R0.2 CC(C)OCCNCCF 34a_100000701111_100011217306 [1,1,0,0,0,0|2,0,0]=4 7338 B9R0.2 CC(C)OCCNCCF 34a_100000724931_100000211751 [1,1,0,0,0,0|2,0,0]=4 7339 B9R0.2 CC(C)OCCNCCO 2230a_100000701111_100000211926 [1,1,0,0,0,0|1,0,0]=3 7340 B9R0.2 CC(C)OCCNCCO 2230a_100016997473_100000211751 [1,1,0,0,0,0|1,0,0]=3 7341 B9R0.2 CC(C)OCCNCCO 34a_100000701111_100000211926 [1,1,0,0,0,0|1,0,0]=3 7342 B9R0.2 CC(C)OCCNCCO 34a_100016990907_100000211751 [1,1,0,0,0,0|1,0,0]=3 7343 B9R0.2 CC(C)OCCOCC#N 7a_100000211219_100011215382 [1,1,0,0,0,0|1,0,1]=4 7344 B9R0.2 CC(C)OCCOCC=O 34a_100000211219_200009817547 [1,1,0,0,0,0|0,0,2]=4 7345 B9R0.2 CC(C)OCCOCC=O 7a_100000211219_200015260668 [1,1,0,0,0,0|0,0,2]=4 7346 B9R0.2 CC(C)OCCOCCBr 34a_100000211926_100000211751 [1,1,0,0,0,0|1,0,0]=3 7347 B9R0.2 CC(C)OCCOCCBr 34a_100000692535_100000210206 [1,1,0,0,0,0|1,0,0]=3 7348 B9R0.2 CC(C)OCCOCCBr 7a_100000692535_100000210206 [1,1,0,0,0,0|1,0,0]=3 7349 B9R0.2 CC(C)OCCOCCCl 34a_100011215305_100000210206 [1,1,0,0,0,0|1,0,0]=3 7350 B9R0.2 CC(C)OCCOCCCl 7a_100011215305_100000210206 [1,1,0,0,0,0|1,0,0]=3 7351 B9R0.2 CC(C)OCCOCCF 34a_100000211219_100011217306 [1,1,0,0,0,0|1,0,0]=3 7352 B9R0.2 CC(C)OCCOCCF 34a_200015357709_100000210206 [1,1,0,0,0,0|1,0,0]=3 7353 B9R0.2 CC(C)OCCOCCF 7a_100000211219_100011217306 [1,1,0,0,0,0|1,0,0]=3 7354 B9R0.2 CC(C)OCCOCCF 7a_200015357709_100000210206 [1,1,0,0,0,0|1,0,0]=3 7355 B9R0.2 CC(C)OCCOCCI 34a_100012149058_100000210206 [1,1,0,0,0,0|1,0,0]=3 7356 B9R0.2 CC(C)OCCOCCI 7a_100012149058_100000210206 [1,1,0,0,0,0|1,0,0]=3 7357 B9R0.2 CC(C)OCCOCCN 34a_100000210304_100000211751 [1,1,0,0,0,0|1,0,0]=3 7358 B9R0.2 CC(C)OCCOCCN 34a_100000211614_100000210206 [1,1,0,0,0,0|1,0,0]=3 7359 B9R0.2 CC(C)OCCOCCO 34a_100000211219_100000211926 [1,1,0,0,0,0|0,0,0]=2 7360 B9R0.2 CC(C)OCCOCCO 34a_100000212225_100000692535 [1,1,0,0,0,0|0,0,0]=2 7361 B9R0.2 CC(C)OCCOCCO 7a_100000211219_100000211926 [1,1,0,0,0,0|0,0,0]=2 7362 B9R0.2 CC(C)OCCSCCF 62a_100000211751_100011217306 [1,1,0,0,0,0|1,1,0]=4 7363 B9R0.2 CC(C)OCCSCCF 62a_100011217306_100000211751 [1,1,0,0,0,0|1,1,0]=4 7364 B9R0.2 CC(C)OCCSCCO 62a_100000211751_100000211926 [1,1,0,0,0,0|0,1,0]=3 7365 B9R0.2 CC(C)OCCSCCO 62a_100000211926_100000211751 [1,1,0,0,0,0|0,1,0]=3 7366 B9R0.2 CC(C)OCOCCCBr 34a_100011217188_100000709892 [1,1,0,0,0,0|2,0,0]=4 7367 B9R0.2 CC(C)OCOCCCCl 34a_100000230001_100000709892 [1,1,0,0,0,0|2,0,0]=4 7368 B9R0.2 CC(C)OCOCCCF 34a_100000759539_100000709892 [1,1,0,0,0,0|2,0,0]=4 7369 B9R0.2 CC(C)OCOCCCN 34a_100000182051_100000709892 [1,1,0,0,0,0|2,0,0]=4 7370 B9R0.2 CC(C)OCOCCON 34a_100000700252_100000709892 [1,1,0,0,0,0|1,0,0]=3 7371 B9R0.2 CC(C)OCSCCCO 62a_100000709892_100011215043 [1,1,0,0,0,0|2,0,0]=4 7372 B9R0.2 CC(C)OCSCCCO 62a_100011215043_100000709892 [1,1,0,0,0,0|2,0,0]=4 7373 B9R0.2 CC(C)SCCCCCO 62a_100000210206_100000746330 [1,1,0,0,0,0|1,1,0]=4 7374 B9R0.2 CC(C)SCCCCCO 62a_100000746330_100000210206 [1,1,0,0,0,0|1,1,0]=4 7375 B9R0.2 CC(C)SCCNCCO 2230a_100000731138_100000211926 [1,1,0,0,0,0|1,1,0]=4 7376 B9R0.2 CC(C)SCCNCCO 2230a_100016997473_100000730970 [1,1,0,0,0,0|1,1,0]=4 7377 B9R0.2 CC(C)SCCNCCO 34a_100000731138_100000211926 [1,1,0,0,0,0|1,1,0]=4 7378 B9R0.2 CC(C)SCCNCCO 34a_100016990907_100000730970 [1,1,0,0,0,0|1,1,0]=4 7379 B9R0.2 CC(C)SCCOCCBr 34a_100000211926_100000730970 [1,1,0,0,0,0|1,1,0]=4 7380 B9R0.2 CC(C)SCCOCCF 34a_200011212901_100011217306 [1,1,0,0,0,0|1,1,0]=4 7381 B9R0.2 CC(C)SCCOCCF 7a_200011212901_100011217306 [1,1,0,0,0,0|1,1,0]=4 7382 B9R0.2 CC(C)SCCOCCN 34a_100000210304_100000730970 [1,1,0,0,0,0|1,1,0]=4 7383 B9R0.2 CC(C)SCCOCCO 34a_200011212901_100000211926 [1,1,0,0,0,0|0,1,0]=3 7384 B9R0.2 CC(C)SCCOCCO 62a_100000210206_100011215305 [1,1,0,0,0,0|0,1,0]=3 7385 B9R0.2 CC(C)SCCOCCO 62a_100011215305_100000210206 [1,1,0,0,0,0|0,1,0]=3 7386 B9R0.2 CC(C)SCCOCCO 7a_200011212901_100000211926 [1,1,0,0,0,0|0,1,0]=3 7387 B9R0.2 CC(C)SCCSCCO 62a_100000211926_100000730970 [1,1,0,0,0,0|0,2,0]=4 7388 B9R0.2 CC(C)SCCSCCO 62a_100000730970_100000211926 [1,1,0,0,0,0|0,2,0]=4 7389 B9R0.2 CC(F)COCCCCF 34a_100015925927_100000729493 [1,1,0,0,0,0|2,0,0]=4 7390 B9R0.2 CC(F)COCCCCO 34a_100015925927_100011216708 [1,1,0,0,0,0|2,0,0]=4 7391 B9R0.2 CC(O)CCCNCCO 2230a_100016997473_200000718107 [1,1,0,0,0,0|2,0,0]=4 7392 B9R0.2 CC(O)CCCNCCO 34a_100016990907_200000718107 [1,1,0,0,0,0|2,0,0]=4 7393 B9R0.2 CC(O)CCCOCCBr 34a_100000211926_200000718107 [1,1,0,0,0,0|2,0,0]=4 7394 B9R0.2 CC(O)CCCOCCN 34a_100000210304_200000718107 [1,1,0,0,0,0|2,0,0]=4 7395 B9R0.2 CC(O)CCCSCCO 62a_100000211926_200000718107 [1,1,0,0,0,0|1,1,0]=4 7396 B9R0.2 CC(O)CCCSCCO 62a_200000718107_100000211926 [1,1,0,0,0,0|1,1,0]=4 7397 B9R0.2 CC(O)CCOCCCBr 34a_100011217188_100012276601 [1,1,0,0,0,0|2,0,0]=4 7398 B9R0.2 CC(O)CCOCCCCl 34a_100000230001_100012276601 [1,1,0,0,0,0|2,0,0]=4 7399 B9R0.2 CC(O)CCOCCCF 34a_100000759539_100012276601 [1,1,0,0,0,0|2,0,0]=4 7400 B9R0.2 CC(O)CCOCCCN 34a_100000182051_100012276601 [1,1,0,0,0,0|2,0,0]=4 7401 B9R0.2 CC(O)CCOCCON 34a_100000700252_100012276601 [1,1,0,0,0,0|1,0,0]=3 7402 B9R0.2 CC(O)COCCCCBr 34a_100011216708_100011218427 [1,1,0,0,0,0|2,0,0]=4 7403 B9R0.2 CC(O)COCCCCCl 34a_100000210776_100011218427 [1,1,0,0,0,0|2,0,0]=4 7404 B9R0.2 CC(O)COCCCCCl 7a_100000210776_100011218427 [1,1,0,0,0,0|2,0,0]=4 7405 B9R0.2 CC(O)COCCCCF 34a_100011995726_100011218427 [1,1,0,0,0,0|2,0,0]=4 7406 B9R0.2 CC(O)COCCCCF 7a_100011995726_100011218427 [1,1,0,0,0,0|2,0,0]=4 7407 B9R0.2 CC(O)COCCCCI 34a_200012148704_100011218427 [1,1,0,0,0,0|2,0,0]=4 7408 B9R0.2 CC(O)COCCCCN 34a_100000750430_100011218427 [1,1,0,0,0,0|2,0,0]=4 7409 B9R0.2 CC/C=C\CCOC(C)C 34a_100000212225_100015370543 [1,1,0,0,0,0|1,0,1]=4 7410 B9R0.2 CC/C=C\CCOC(C)C 34a_100016288707_100000210206 [1,1,0,0,0,0|1,0,1]=4 7411 B9R0.2 CC/C=C\CCOC(C)C 7a_100016288707_100000210206 [1,1,0,0,0,0|1,0,1]=4 7412 B9R0.2 CC/C=C\COCC(C)Br 34a_100012180447_100103147603 [1,1,0,0,0,0|1,0,1]=4 7413 B9R0.2 CC/C=C\COCC(C)C 34a_100000210257_100103147603 [1,1,0,0,0,0|1,0,1]=4 7414 B9R0.2 CC/C=C\COCC(C)C 34a_100016268518_100000210624 [1,1,0,0,0,0|1,0,1]=4 7415 B9R0.2 CC/C=C\COCC(C)F 34a_100015925927_100103147603 [1,1,0,0,0,0|1,0,1]=4 7416 B9R0.2 CC/C=C\COCC(C)O 34a_100016268518_100011218427 [1,1,0,0,0,0|1,0,1]=4 7417 B9R0.2 CC/C=C\COC[C@@H](C)Cl 34a_100016084084_100103147603 [1,1,0,0,0,0|1,0,1]=4 7418 B9R0.2 CC/C=C\COC[C@@H](C)N 34a_100000737577_100103147603 [1,1,0,0,0,0|1,0,1]=4 7419 B9R0.2 CC/C=C\COC[C@@H](C)O 34a_100016268518_100009817552 [1,1,0,0,0,0|1,0,1]=4 7420 B9R0.2 CC=CCCCOC(C)C 34a_100020645299_100000210206 [1,1,0,0,0,0|1,0,1]=4 7421 B9R0.2 CC=CCOCCC(C)Br 34a_100009893172_100000070051 [1,1,0,0,0,0|1,0,1]=4 7422 B9R0.2 CC=CCOCCC(C)C 34a_100000210254_100000070051 [1,1,0,0,0,0|1,0,1]=4 7423 B9R0.2 CC=CCOCCC(C)C 7a_100000210254_100000070051 [1,1,0,0,0,0|1,0,1]=4 7424 B9R0.2 CC=CCOCC[C@@H](C)N 34a_100000706166_100000070051 [1,1,0,0,0,0|1,0,1]=4 7425 B9R0.2 CCC#CCCOC(C)C 34a_100000036655_100000210206 [1,1,0,0,0,0|1,0,1]=4 7426 B9R0.2 CCC#CCCOC(C)C 7a_100000036655_100000210206 [1,1,0,0,0,0|1,0,1]=4 7427 B9R0.2 CCC#CCOCC(C)Br 34a_100012180447_100009813939 [1,1,0,0,0,0|1,0,1]=4 7428 B9R0.2 CCC#CCOCC(C)C 34a_100000032950_100000210624 [1,1,0,0,0,0|1,0,1]=4 7429 B9R0.2 CCC#CCOCC(C)C 34a_100000210257_100009813939 [1,1,0,0,0,0|1,0,1]=4 7430 B9R0.2 CCC#CCOCC(C)F 34a_100015925927_100009813939 [1,1,0,0,0,0|1,0,1]=4 7431 B9R0.2 CCC#CCOCC(C)O 34a_100000032950_100011218427 [1,1,0,0,0,0|1,0,1]=4 7432 B9R0.2 CCC#CCOC[C@@H](C)Cl 34a_100016084084_100009813939 [1,1,0,0,0,0|1,0,1]=4 7433 B9R0.2 CCC#CCOC[C@@H](C)N 34a_100000737577_100009813939 [1,1,0,0,0,0|1,0,1]=4 7434 B9R0.2 CCC#CCOC[C@@H](C)O 34a_100000032950_100009817552 [1,1,0,0,0,0|1,0,1]=4 7435 B9R0.2 CCC/C=C/COC(C)C 34a_100016278788_100000210206 [1,1,0,0,0,0|1,0,1]=4 7436 B9R0.2 CCC/C=C/COC(C)C 7a_100016278788_100000210206 [1,1,0,0,0,0|1,0,1]=4 7437 B9R0.2 CCCC#CCOC(C)C 34a_100000034806_100000210206 [1,1,0,0,0,0|1,0,1]=4 7438 B9R0.2 CCCC#CCOC(C)C 7a_100000034806_100000210206 [1,1,0,0,0,0|1,0,1]=4 7439 B9R0.2 CCCCCCCC(=O)C 1458a_100000070787_100000210614 [1,1,0,0,0,0|2,0,0]=4 7440 B9R0.2 CCCCCCCC(=O)C 1458a_100000211969_200000210301 [1,1,0,0,0,0|2,0,0]=4 7441 B9R0.2 CCCCCCCC(=O)[13CH3] 1458a_100000211969_200025704644 [1,1,0,0,0,0|2,0,0]=4 7442 B9R0.2 CCCCCCCN(C)C 2230a_100000228206_200000210301 [1,1,0,0,0,0|2,0,0]=4 7443 B9R0.2 CCCCCCCN(C)C 2230a_100102631434_100000210681 [1,1,0,0,0,0|2,0,0]=4 7444 B9R0.2 CCCCCCCN(C)C 269982a_100000228206_200000210301 [1,1,0,0,0,0|2,0,0]=4 7445 B9R0.2 CCCCCCCN(C)C 269982a_100102631434_100000210681 [1,1,0,0,0,0|2,0,0]=4 7446 B9R0.2 CCCCCCCN(C)[13CH3] 2230a_100000228206_200025704644 [1,1,0,0,0,0|2,0,0]=4 7447 B9R0.2 CCCCCCCN(C)[13CH3] 269982a_100000228206_200025704644 [1,1,0,0,0,0|2,0,0]=4 7448 B9R0.2 CCCCCCNC(C)C 2230a_100000210581_100000210206 [1,1,0,0,0,0|2,0,0]=4 7449 B9R0.2 CCCCCCNC(C)C 2230a_100138425928_100000210314 [1,1,0,0,0,0|2,0,0]=4 7450 B9R0.2 CCCCCCNC(C)C 34a_100138425928_100000210314 [1,1,0,0,0,0|2,0,0]=4 7451 B9R0.2 CCCCCCOC(C)C 34a_100000210259_100000210206 [1,1,0,0,0,0|1,0,0]=3 7452 B9R0.2 CCCCCCOC(C)C 34a_100000212225_100000210314 [1,1,0,0,0,0|1,0,0]=3 7453 B9R0.2 CCCCCCOC(C)C 7a_100000210259_100000210206 [1,1,0,0,0,0|1,0,0]=3 7454 B9R0.2 CCCCCCSC(C)C 62a_100000210206_100000210757 [1,1,0,0,0,0|1,1,0]=4 7455 B9R0.2 CCCCCCSC(C)C 62a_100000210314_100000210206 [1,1,0,0,0,0|1,1,0]=4 7456 B9R0.2 CCCCCNCC(C)C 2230a_100000209983_100000210760 [1,1,0,0,0,0|2,0,0]=4 7457 B9R0.2 CCCCCNCC(C)C 2230a_100000210953_100000210326 [1,1,0,0,0,0|2,0,0]=4 7458 B9R0.2 CCCCCNCC(C)C 270004a_100000209983_100000210432 [1,1,0,0,0,0|2,0,0]=4 7459 B9R0.2 CCCCCNCC(C)C 34a_100000210953_100000718602 [1,1,0,0,0,0|2,0,0]=4 7460 B9R0.2 CCCCCNCC(C)O 2230a_100000209983_100011218427 [1,1,0,0,0,0|2,0,0]=4 7461 B9R0.2 CCCCCNCC(C)O 2230a_100000210904_100000210326 [1,1,0,0,0,0|2,0,0]=4 7462 B9R0.2 CCCCCNCC(C)O 34a_100000210904_100000718602 [1,1,0,0,0,0|2,0,0]=4 7463 B9R0.2 CCCCCNC[C@@H](C)O 2230a_100000209983_100009817552 [1,1,0,0,0,0|2,0,0]=4 7464 B9R0.2 CCCCCOCC(=O)C 34a_100000211253_100000718602 [1,1,0,0,0,0|1,0,1]=4 7465 B9R0.2 CCCCCOCC(C)Br 34a_100012180447_100000718602 [1,1,0,0,0,0|1,0,0]=3 7466 B9R0.2 CCCCCOCC(C)C 34a_100000210253_100000210624 [1,1,0,0,0,0|1,0,0]=3 7467 B9R0.2 CCCCCOCC(C)C 34a_100000210257_100000718602 [1,1,0,0,0,0|1,0,0]=3 7468 B9R0.2 CCCCCOCC(C)C 7a_100000210253_100000210760 [1,1,0,0,0,0|1,0,0]=3 7469 B9R0.2 CCCCCOCC(C)F 34a_100015925927_100000718602 [1,1,0,0,0,0|1,0,0]=3 7470 B9R0.2 CCCCCOCC(C)O 34a_100000210253_100011218427 [1,1,0,0,0,0|1,0,0]=3 7471 B9R0.2 CCCCCOCC(C)O 7a_100000210253_100011218427 [1,1,0,0,0,0|1,0,0]=3 7472 B9R0.2 CCCCCOCC(F)F 34a_100000210253_100011934356 [1,1,0,0,0,0|2,0,0]=4 7473 B9R0.2 CCCCCOCC(F)F 34a_100000743014_100000718602 [1,1,0,0,0,0|2,0,0]=4 7474 B9R0.2 CCCCCOCC(F)F 7a_100000210253_100011934356 [1,1,0,0,0,0|2,0,0]=4 7475 B9R0.2 CCCCCOC[C@@H](C)Cl 34a_100016084084_100000718602 [1,1,0,0,0,0|1,0,0]=3 7476 B9R0.2 CCCCCOC[C@@H](C)N 34a_100000737577_100000718602 [1,1,0,0,0,0|1,0,0]=3 7477 B9R0.2 CCCCCOC[C@@H](C)O 34a_100000210253_100009817552 [1,1,0,0,0,0|1,0,0]=3 7478 B9R0.2 CCCCCOC[C@@H](C)O 7a_100000210253_100009817552 [1,1,0,0,0,0|1,0,0]=3 7479 B9R0.2 CCCCCSCC(C)C 62a_100000210326_100000210760 [1,1,0,0,0,0|1,1,0]=4 7480 B9R0.2 CCCCCSCC(C)C 62a_100000210624_100000210326 [1,1,0,0,0,0|1,1,0]=4 7481 B9R0.2 CCCCCSCC(C)O 62a_100000210326_100011218427 [1,1,0,0,0,0|1,1,0]=4 7482 B9R0.2 CCCCCSCC(C)O 62a_100011218427_100000210326 [1,1,0,0,0,0|1,1,0]=4 7483 B9R0.2 CCCCCSC[C@@H](C)O 62a_100000210326_100009817552 [1,1,0,0,0,0|1,1,0]=4 7484 B9R0.2 CCCCCSC[C@@H](C)O 62a_100009817552_100000210326 [1,1,0,0,0,0|1,1,0]=4 7485 B9R0.2 CCCCNCCC(=O)C 7a_106832991798_100000053229 [1,1,0,0,0,0|2,0,0]=4 7486 B9R0.2 CCCCNCCC(C)C 2230a_100000102301_100000210312 [1,1,0,0,0,0|2,0,0]=4 7487 B9R0.2 CCCCNCCC(C)C 269862a_100000102301_100000185833 [1,1,0,0,0,0|2,0,0]=4 7488 B9R0.2 CCCCNCCC(C)C 7a_106832991798_100000210626 [1,1,0,0,0,0|2,0,0]=4 7489 B9R0.2 CCCCNCCC(C)O 2230a_100000102301_100012276601 [1,1,0,0,0,0|2,0,0]=4 7490 B9R0.2 CCCCNCCC(C)O 2230a_200000755665_100000210211 [1,1,0,0,0,0|2,0,0]=4 7491 B9R0.2 CCCCNCCC(C)O 7a_106832991798_100012276601 [1,1,0,0,0,0|2,0,0]=4 7492 B9R0.2 CCCCNCCN(C)C 7a_106832991798_100000755713 [1,1,0,0,0,0|2,0,0]=4 7493 B9R0.2 CCCCNCOC(C)C 2230a_100000102301_100000709892 [1,1,0,0,0,0|2,0,0]=4 7494 B9R0.2 CCCCOCC=C(C)C 34a_100000210227_100000761012 [1,1,0,0,0,0|1,0,1]=4 7495 B9R0.2 CCCCOCC=C(C)C 34a_100000753907_100000210210 [1,1,0,0,0,0|1,0,1]=4 7496 B9R0.2 CCCCOCC=C(C)C 7a_100000210227_100000761012 [1,1,0,0,0,0|1,0,1]=4 7497 B9R0.2 CCCCOCCC(=O)C 1458a_100000070787_100000743108 [1,1,0,0,0,0|1,0,0]=3 7498 B9R0.2 CCCCOCCC(=O)C 34a_100000759926_100000210210 [1,1,0,0,0,0|1,0,0]=3 7499 B9R0.2 CCCCOCCC(=O)C 7a_100000210227_100000053229 [1,1,0,0,0,0|1,0,0]=3 7500 B9R0.2 CCCCOCCC(=O)C 7a_100000759926_100000210211 [1,1,0,0,0,0|1,0,0]=3 7501 B9R0.2 CCCCOCCC(=O)N 34a_100000210227_100000731001 [1,1,0,0,0,0|2,0,0]=4 7502 B9R0.2 CCCCOCCC(=O)N 34a_100000757172_100000210210 [1,1,0,0,0,0|2,0,0]=4 7503 B9R0.2 CCCCOCCC(=O)N 7a_100000210227_100000744528 [1,1,0,0,0,0|2,0,0]=4 7504 B9R0.2 CCCCOCCC(=O)N 7a_100000757172_100000210211 [1,1,0,0,0,0|2,0,0]=4 7505 B9R0.2 CCCCOCCC(C)Br 34a_100009893172_100000210210 [1,1,0,0,0,0|1,0,0]=3 7506 B9R0.2 CCCCOCCC(C)C 34a_100000210227_100000210312 [1,1,0,0,0,0|1,0,0]=3 7507 B9R0.2 CCCCOCCC(C)C 34a_100000210254_100000210210 [1,1,0,0,0,0|1,0,0]=3 7508 B9R0.2 CCCCOCCC(C)C 7a_100000210227_100000210626 [1,1,0,0,0,0|1,0,0]=3 7509 B9R0.2 CCCCOCCC(C)C 7a_100000210254_100000210211 [1,1,0,0,0,0|1,0,0]=3 7510 B9R0.2 CCCCOCCC(C)O 34a_100000210227_100012276601 [1,1,0,0,0,0|1,0,0]=3 7511 B9R0.2 CCCCOCCC(C)O 7a_100000210227_100012276601 [1,1,0,0,0,0|1,0,0]=3 7512 B9R0.2 CCCCOCCC(F)F 34a_100103093639_100000210210 [1,1,0,0,0,0|2,0,0]=4 7513 B9R0.2 CCCCOCCN(C)C 2230a_100102631434_100000743108 [1,1,0,0,0,0|1,0,0]=3 7514 B9R0.2 CCCCOCCN(C)C 269982a_100102631434_100000743108 [1,1,0,0,0,0|1,0,0]=3 7515 B9R0.2 CCCCOCCN(C)C 7a_100000210227_100000755713 [1,1,0,0,0,0|1,0,0]=3 7516 B9R0.2 CCCCOCC[C@@H](C)N 34a_100000706166_100000210210 [1,1,0,0,0,0|1,0,0]=3 7517 B9R0.2 CCCCOCNC(C)C 2230a_100138425928_100011995733 [1,1,0,0,0,0|2,0,0]=4 7518 B9R0.2 CCCCOCNC(C)C 34a_100138425928_100011995733 [1,1,0,0,0,0|2,0,0]=4 7519 B9R0.2 CCCCOCOC(=O)C 34a_100000210227_100009813279 [1,1,0,0,0,0|1,0,1]=4 7520 B9R0.2 CCCCOCOC(C)C 34a_100000210227_100000709892 [1,1,0,0,0,0|1,0,0]=3 7521 B9R0.2 CCCCOCOC(C)C 34a_100000212225_100011995733 [1,1,0,0,0,0|1,0,0]=3 7522 B9R0.2 CCCCOCSC(C)C 62a_100000210206_100011995733 [1,1,0,0,0,0|1,1,0]=4 7523 B9R0.2 CCCCOCSC(C)C 62a_100011995733_100000210206 [1,1,0,0,0,0|1,1,0]=4 7524 B9R0.2 CCCCSCCC(=O)C 62a_100000053229_100000210210 [1,1,0,0,0,0|1,1,0]=4 7525 B9R0.2 CCCCSCCC(=O)C 62a_100000210211_100000053229 [1,1,0,0,0,0|1,1,0]=4 7526 B9R0.2 CCCCSCCC(C)C 62a_100000210211_100000210312 [1,1,0,0,0,0|1,1,0]=4 7527 B9R0.2 CCCCSCCC(C)C 62a_100000210312_100000210210 [1,1,0,0,0,0|1,1,0]=4 7528 B9R0.2 CCCCSCCC(C)O 62a_100000210211_100012276601 [1,1,0,0,0,0|1,1,0]=4 7529 B9R0.2 CCCCSCCC(C)O 62a_100012276601_100000210210 [1,1,0,0,0,0|1,1,0]=4 7530 B9R0.2 CCCCSCCN(C)C 62a_100000210211_100000755713 [1,1,0,0,0,0|1,1,0]=4 7531 B9R0.2 CCCCSCOC(C)C 62a_100000210211_100000709892 [1,1,0,0,0,0|1,1,0]=4 7532 B9R0.2 CCCCSCOC(C)C 62a_100000709892_100000210210 [1,1,0,0,0,0|1,1,0]=4 7533 B9R0.2 CCCNCCCC(C)C 2230a_200000737386_100000210303 [1,1,0,0,0,0|2,0,0]=4 7534 B9R0.2 CCCNCCCC(C)C 34a_200000737386_100000210303 [1,1,0,0,0,0|2,0,0]=4 7535 B9R0.2 CCCNCCOC(C)C 2230a_100000701111_100000210303 [1,1,0,0,0,0|1,0,0]=3 7536 B9R0.2 CCCNCCOC(C)C 34a_100000701111_100000210303 [1,1,0,0,0,0|1,0,0]=3 7537 B9R0.2 CCCNCCSC(C)C 2230a_100000731138_100000210303 [1,1,0,0,0,0|1,1,0]=4 7538 B9R0.2 CCCNCCSC(C)C 34a_100000731138_100000210303 [1,1,0,0,0,0|1,1,0]=4 7539 B9R0.2 CCCOCCC=C(C)C 34a_100000210258_100011217483 [1,1,0,0,0,0|1,0,1]=4 7540 B9R0.2 CCCOCCCC(=O)C 34a_100000210258_100000685027 [1,1,0,0,0,0|1,0,1]=4 7541 B9R0.2 CCCOCCCC(=O)C 34a_100000759063_100000210303 [1,1,0,0,0,0|1,0,1]=4 7542 B9R0.2 CCCOCCCC(=O)C 7a_100000759063_100000210303 [1,1,0,0,0,0|1,0,1]=4 7543 B9R0.2 CCCOCCCC(C)C 34a_100000210258_100011214892 [1,1,0,0,0,0|1,0,0]=3 7544 B9R0.2 CCCOCCCC(C)C 34a_100000210774_100000210303 [1,1,0,0,0,0|1,0,0]=3 7545 B9R0.2 CCCOCCCC(C)C 7a_100000210774_100000210303 [1,1,0,0,0,0|1,0,0]=3 7546 B9R0.2 CCCOCCCC(C)O 34a_100000210258_200000718107 [1,1,0,0,0,0|1,0,0]=3 7547 B9R0.2 CCCOCCNC(=O)C 1626a_100161115042_100015343762 [1,1,0,0,0,0|1,0,1]=4 7548 B9R0.2 CCCOCCNC(=O)C 240690a_100161115042_100015343762 [1,1,0,0,0,0|1,0,1]=4 7549 B9R0.2 CCCOCCNC(=O)C 34a_100000158858_100000210303 [1,1,0,0,0,0|1,0,1]=4 7550 B9R0.2 CCCOCCNC(=O)C 527a_100161115042_100103153847 [1,1,0,0,0,0|1,0,1]=4 7551 B9R0.2 CCCOCCNC(C)C 2230a_100138425928_100011215938 [1,1,0,0,0,0|1,0,0]=3 7552 B9R0.2 CCCOCCNC(C)C 2230a_100161115042_100000210206 [1,1,0,0,0,0|1,0,0]=3 7553 B9R0.2 CCCOCCNC(C)C 34a_100000224655_100000210303 [1,1,0,0,0,0|1,0,0]=3 7554 B9R0.2 CCCOCCNC(C)C 34a_100138425928_100011215938 [1,1,0,0,0,0|1,0,0]=3 7555 B9R0.2 CCCOCCNC(C)C 34a_100161115042_100000210206 [1,1,0,0,0,0|1,0,0]=3 7556 B9R0.2 CCCOCCOC(=O)C 34a_100000210258_100009814007 [1,1,0,0,0,0|0,0,1]=3 7557 B9R0.2 CCCOCCOC(=O)N 34a_100000210258_200011214921 [1,1,0,0,0,0|1,0,1]=4 7558 B9R0.2 CCCOCCOC(=O)N 7a_100000766696_100000210303 [1,1,0,0,0,0|1,0,1]=4 7559 B9R0.2 CCCOCCOC(C)C 34a_100000210258_100000211751 [1,1,0,0,0,0|0,0,0]=2 7560 B9R0.2 CCCOCCOC(C)C 34a_100000211219_100000210303 [1,1,0,0,0,0|0,0,0]=2 7561 B9R0.2 CCCOCCOC(C)C 34a_100000212225_100011215938 [1,1,0,0,0,0|0,0,0]=2 7562 B9R0.2 CCCOCCOC(C)C 34a_100000752267_100000210206 [1,1,0,0,0,0|0,0,0]=2 7563 B9R0.2 CCCOCCOC(C)C 7a_100000211219_100000210303 [1,1,0,0,0,0|0,0,0]=2 7564 B9R0.2 CCCOCCOC(C)C 7a_100000752267_100000210206 [1,1,0,0,0,0|0,0,0]=2 7565 B9R0.2 CCCOCCSC(C)C 34a_100000210258_100000730970 [1,1,0,0,0,0|0,1,0]=3 7566 B9R0.2 CCCOCCSC(C)C 34a_200011212901_100000210303 [1,1,0,0,0,0|0,1,0]=3 7567 B9R0.2 CCCOCCSC(C)C 62a_100000210206_100011215938 [1,1,0,0,0,0|0,1,0]=3 7568 B9R0.2 CCCOCCSC(C)C 62a_100011215938_100000210206 [1,1,0,0,0,0|0,1,0]=3 7569 B9R0.2 CCCOCCSC(C)C 7a_200011212901_100000210303 [1,1,0,0,0,0|0,1,0]=3 7570 B9R0.2 CCCSCCCC(C)C 62a_100000210303_100011214892 [1,1,0,0,0,0|1,1,0]=4 7571 B9R0.2 CCCSCCCC(C)C 62a_100011214892_100000210303 [1,1,0,0,0,0|1,1,0]=4 7572 B9R0.2 CCCSCCCC(C)O 62a_100000210303_200000718107 [1,1,0,0,0,0|1,1,0]=4 7573 B9R0.2 CCCSCCCC(C)O 62a_200000718107_100000210303 [1,1,0,0,0,0|1,1,0]=4 7574 B9R0.2 CCCSCCNC(C)C 2230a_100020603323_100000210206 [1,1,0,0,0,0|1,1,0]=4 7575 B9R0.2 CCCSCCOC(=O)C 62a_100000210303_100009814007 [1,1,0,0,0,0|0,1,1]=4 7576 B9R0.2 CCCSCCOC(=O)C 62a_100009814007_100000210303 [1,1,0,0,0,0|0,1,1]=4 7577 B9R0.2 CCCSCCOC(C)C 34a_200000230433_100000210206 [1,1,0,0,0,0|0,1,0]=3 7578 B9R0.2 CCCSCCOC(C)C 62a_100000210303_100000211751 [1,1,0,0,0,0|0,1,0]=3 7579 B9R0.2 CCCSCCOC(C)C 62a_100000211751_100000210303 [1,1,0,0,0,0|0,1,0]=3 7580 B9R0.2 CCCSCCOC(C)C 7a_200000230433_100000210206 [1,1,0,0,0,0|0,1,0]=3 7581 B9R0.2 CCCSCCSC(C)C 62a_100000210303_100000730970 [1,1,0,0,0,0|0,2,0]=4 7582 B9R0.2 CCCSCCSC(C)C 62a_100000730970_100000210303 [1,1,0,0,0,0|0,2,0]=4 7583 B9R0.2 CCNCCCCC(C)C 2230a_100015525214_100011216152 [1,1,0,0,0,0|2,0,0]=4 7584 B9R0.2 CCNCCCOC(C)C 2230a_100000737246_100000210202 [1,1,0,0,0,0|2,0,0]=4 7585 B9R0.2 CCNCCCOC(C)C 34a_100000737246_100000210202 [1,1,0,0,0,0|2,0,0]=4 7586 B9R0.2 CCNCCOCC(=O)O 269956a_100000700818_100000210202 [1,1,0,0,0,0|1,0,1]=4 7587 B9R0.2 CCNCCOCC(F)F 2230a_100015525214_200012177212 [1,1,0,0,0,0|2,0,0]=4 7588 B9R0.2 CCOCCCCB(O)O 34a_100121572206_200009817182 [1,1,0,0,0,0|2,0,0]=4 7589 B9R0.2 CCOCCCCC(=O)C 34a_100121572206_100009817362 [1,1,0,0,0,0|1,0,0]=3 7590 B9R0.2 CCOCCCCC(=O)N 34a_100012022536_100000210202 [1,1,0,0,0,0|2,0,0]=4 7591 B9R0.2 CCOCCCCC(=O)N 7a_100012022536_100000210202 [1,1,0,0,0,0|2,0,0]=4 7592 B9R0.2 CCOCCCCC(C)C 34a_100011214890_100000210202 [1,1,0,0,0,0|1,0,0]=3 7593 B9R0.2 CCOCCCCC(C)C 34a_100121572206_100011216152 [1,1,0,0,0,0|1,0,0]=3 7594 B9R0.2 CCOCCCCC(C)C 7a_100011214890_100000210202 [1,1,0,0,0,0|1,0,0]=3 7595 B9R0.2 CCOCCCC[N+](=O)[O-] 34a_200015379883_100000210202 [1,1,0,0,0,0|2,0,0]=4 7596 B9R0.2 CCOCCCC[N+](=O)[O-] 7a_200015379883_100000210202 [1,1,0,0,0,0|2,0,0]=4 7597 B9R0.2 CCOCCCNC(=O)C 11a_100000210961_100015343762 [1,1,0,0,0,0|2,0,0]=4 7598 B9R0.2 CCOCCCNC(=O)C 1626a_100000210961_100015343762 [1,1,0,0,0,0|2,0,0]=4 7599 B9R0.2 CCOCCCNC(=O)C 240690a_100000210961_100015343762 [1,1,0,0,0,0|2,0,0]=4 7600 B9R0.2 CCOCCCNC(=O)C 34a_100000752032_100000210202 [1,1,0,0,0,0|2,0,0]=4 7601 B9R0.2 CCOCCCNC(=O)C 527a_100000210961_100103153847 [1,1,0,0,0,0|2,0,0]=4 7602 B9R0.2 CCOCCCNC(C)C 2230a_100000210961_100000210206 [1,1,0,0,0,0|2,0,0]=4 7603 B9R0.2 CCOCCCNC(C)C 2230a_100138425928_100012232248 [1,1,0,0,0,0|2,0,0]=4 7604 B9R0.2 CCOCCCNC(C)C 34a_100000182298_100000210202 [1,1,0,0,0,0|2,0,0]=4 7605 B9R0.2 CCOCCCNC(C)C 34a_100000210961_100000210206 [1,1,0,0,0,0|2,0,0]=4 7606 B9R0.2 CCOCCCNC(C)C 34a_100138425928_100012232248 [1,1,0,0,0,0|2,0,0]=4 7607 B9R0.2 CCOCCCOC(=O)C 34a_100121572206_100000042594 [1,1,0,0,0,0|2,0,0]=4 7608 B9R0.2 CCOCCCOC(=S)C 34a_100121572206_200135323944 [1,1,0,0,0,0|2,0,0]=4 7609 B9R0.2 CCOCCCOC(C)C 34a_100000212225_100012232248 [1,1,0,0,0,0|2,0,0]=4 7610 B9R0.2 CCOCCCOC(C)C 34a_100000757476_100000210206 [1,1,0,0,0,0|2,0,0]=4 7611 B9R0.2 CCOCCCOC(C)C 7a_100000757476_100000210206 [1,1,0,0,0,0|2,0,0]=4 7612 B9R0.2 CCOCCCSC(=O)C 34a_100121572206_100000038929 [1,1,0,0,0,0|2,0,0]=4 7613 B9R0.2 CCOCCCSC(C)C 62a_100000210206_100012232248 [1,1,0,0,0,0|2,0,0]=4 7614 B9R0.2 CCOCCCSC(C)C 62a_100012232248_100000210206 [1,1,0,0,0,0|2,0,0]=4 7615 B9R0.2 CCOCCNCC(=O)O 269956a_100016091260_100000210147 [1,1,0,0,0,0|1,0,1]=4 7616 B9R0.2 CCOCCNCC(C)C 2230a_100000210953_100011215890 [1,1,0,0,0,0|1,0,0]=3 7617 B9R0.2 CCOCCNCC(C)C 2230a_102516460346_100000210760 [1,1,0,0,0,0|1,0,0]=3 7618 B9R0.2 CCOCCNCC(C)C 270004a_102516460346_100000210432 [1,1,0,0,0,0|1,0,0]=3 7619 B9R0.2 CCOCCNCC(C)C 34a_100000210953_100000210147 [1,1,0,0,0,0|1,0,0]=3 7620 B9R0.2 CCOCCNCC(C)C 34a_100015185251_100000210202 [1,1,0,0,0,0|1,0,0]=3 7621 B9R0.2 CCOCCNCC(C)C 34a_102516460346_100000210624 [1,1,0,0,0,0|1,0,0]=3 7622 B9R0.2 CCOCCNCC(C)O 2230a_100000210904_100011215890 [1,1,0,0,0,0|1,0,0]=3 7623 B9R0.2 CCOCCNCC(C)O 2230a_102516460346_100011218427 [1,1,0,0,0,0|1,0,0]=3 7624 B9R0.2 CCOCCNCC(C)O 34a_100000210904_100000210147 [1,1,0,0,0,0|1,0,0]=3 7625 B9R0.2 CCOCCNCC(C)O 34a_102516460346_100011218427 [1,1,0,0,0,0|1,0,0]=3 7626 B9R0.2 CCOCCNCC(F)F 2230a_102516460346_100011934356 [1,1,0,0,0,0|2,0,0]=4 7627 B9R0.2 CCOCCNCC(F)F 34a_100000765723_100000210147 [1,1,0,0,0,0|2,0,0]=4 7628 B9R0.2 CCOCCNCC(F)F 34a_102516460346_100011934356 [1,1,0,0,0,0|2,0,0]=4 7629 B9R0.2 CCOCCNC[C@@H](C)O 2230a_102516460346_100009817552 [1,1,0,0,0,0|1,0,0]=3 7630 B9R0.2 CCOCCNC[C@@H](C)O 34a_102516460346_100009817552 [1,1,0,0,0,0|1,0,0]=3 7631 B9R0.2 CCOCCOCC(=O)C 34a_100000211253_100000210147 [1,1,0,0,0,0|0,0,1]=3 7632 B9R0.2 CCOCCOCC(=O)N 34a_100000210136_100000187820 [1,1,0,0,0,0|0,0,2]=4 7633 B9R0.2 CCOCCOCC(=O)N 34a_100121572206_100000076697 [1,1,0,0,0,0|0,0,2]=4 7634 B9R0.2 CCOCCOCC(=O)N 7a_100000210136_100000187820 [1,1,0,0,0,0|0,0,2]=4 7635 B9R0.2 CCOCCOCC(=O)[O-] 34a_100000210136_100020667443 [1,1,0,0,0,0|0,0,2]=4 7636 B9R0.2 CCOCCOCC(C)Br 34a_100012180447_100000210147 [1,1,0,0,0,0|0,0,0]=2 7637 B9R0.2 CCOCCOCC(C)C 34a_100000210136_100000210624 [1,1,0,0,0,0|0,0,0]=2 7638 B9R0.2 CCOCCOCC(C)C 34a_100000210257_100000210147 [1,1,0,0,0,0|0,0,0]=2 7639 B9R0.2 CCOCCOCC(C)C 34a_100000703358_100000210202 [1,1,0,0,0,0|0,0,0]=2 7640 B9R0.2 CCOCCOCC(C)C 7a_100000210136_100000210760 [1,1,0,0,0,0|0,0,0]=2 7641 B9R0.2 CCOCCOCC(C)C 7a_100000703358_100000210202 [1,1,0,0,0,0|0,0,0]=2 7642 B9R0.2 CCOCCOCC(C)F 34a_100015925927_100000210147 [1,1,0,0,0,0|0,0,0]=2 7643 B9R0.2 CCOCCOCC(C)O 34a_100000210136_100011218427 [1,1,0,0,0,0|0,0,0]=2 7644 B9R0.2 CCOCCOCC(C)O 7a_100000210136_100011218427 [1,1,0,0,0,0|0,0,0]=2 7645 B9R0.2 CCOCCOCC(F)F 34a_100000210136_100011934356 [1,1,0,0,0,0|1,0,0]=3 7646 B9R0.2 CCOCCOCC(F)F 34a_100000704375_100000210202 [1,1,0,0,0,0|1,0,0]=3 7647 B9R0.2 CCOCCOCC(F)F 34a_100000743014_100000210147 [1,1,0,0,0,0|1,0,0]=3 7648 B9R0.2 CCOCCOCC(F)F 34a_100121572206_200012177212 [1,1,0,0,0,0|1,0,0]=3 7649 B9R0.2 CCOCCOCC(F)F 7a_100000210136_100011934356 [1,1,0,0,0,0|1,0,0]=3 7650 B9R0.2 CCOCCOCC(F)F 7a_100000704375_100000210202 [1,1,0,0,0,0|1,0,0]=3 7651 B9R0.2 CCOCCOC[C@@H](C)Cl 34a_100016084084_100000210147 [1,1,0,0,0,0|0,0,0]=2 7652 B9R0.2 CCOCCOC[C@@H](C)N 34a_100000737577_100000210147 [1,1,0,0,0,0|0,0,0]=2 7653 B9R0.2 CCOCCOC[C@@H](C)O 34a_100000210136_100009817552 [1,1,0,0,0,0|0,0,0]=2 7654 B9R0.2 CCOCCOC[C@@H](C)O 7a_100000210136_100009817552 [1,1,0,0,0,0|0,0,0]=2 7655 B9R0.2 CCOCCOC[N+](=O)[O-] 34a_100000210136_100000761209 [1,1,0,0,0,0|1,0,1]=4 7656 B9R0.2 CCOCCSCC(C)C 34a_200000230437_100000210202 [1,1,0,0,0,0|0,1,0]=3 7657 B9R0.2 CCOCCSCC(C)C 62a_100000210147_100000210760 [1,1,0,0,0,0|0,1,0]=3 7658 B9R0.2 CCOCCSCC(C)C 62a_100000210624_100011215890 [1,1,0,0,0,0|0,1,0]=3 7659 B9R0.2 CCOCCSCC(C)C 7a_200000230437_100000210202 [1,1,0,0,0,0|0,1,0]=3 7660 B9R0.2 CCOCCSCC(C)O 62a_100000210147_100011218427 [1,1,0,0,0,0|0,1,0]=3 7661 B9R0.2 CCOCCSCC(C)O 62a_100011218427_100011215890 [1,1,0,0,0,0|0,1,0]=3 7662 B9R0.2 CCOCCSCC(F)F 62a_100000210147_100011934356 [1,1,0,0,0,0|1,1,0]=4 7663 B9R0.2 CCOCCSCC(F)F 62a_100011934356_100011215890 [1,1,0,0,0,0|1,1,0]=4 7664 B9R0.2 CCOCCSC[C@@H](C)O 62a_100000210147_100009817552 [1,1,0,0,0,0|0,1,0]=3 7665 B9R0.2 CCOCCSC[C@@H](C)O 62a_100009817552_100011215890 [1,1,0,0,0,0|0,1,0]=3 7666 B9R0.2 CCOCNOCC(=O)O 269956a_100000106656_100000739092 [1,1,0,0,0,0|1,0,1]=4 7667 B9R0.2 CCOCSCCC(=O)C 62a_100000053229_100000739092 [1,1,0,0,0,0|1,1,0]=4 7668 B9R0.2 CCOCSCCC(=O)C 62a_100000739092_100000053229 [1,1,0,0,0,0|1,1,0]=4 7669 B9R0.2 CCOCSCCC(C)C 62a_100000210312_100000739092 [1,1,0,0,0,0|1,1,0]=4 7670 B9R0.2 CCOCSCCC(C)C 62a_100000739092_100000210312 [1,1,0,0,0,0|1,1,0]=4 7671 B9R0.2 CCOCSCCC(C)O 62a_100000739092_100012276601 [1,1,0,0,0,0|1,1,0]=4 7672 B9R0.2 CCOCSCCC(C)O 62a_100012276601_100000739092 [1,1,0,0,0,0|1,1,0]=4 7673 B9R0.2 CCOCSCCN(C)C 62a_100000739092_100000755713 [1,1,0,0,0,0|1,1,0]=4 7674 B9R0.2 CCSCCCCC(=O)C 62a_100000210202_100000735457 [1,1,0,0,0,0|1,1,0]=4 7675 B9R0.2 CCSCCCCC(=O)C 62a_100000735457_100000210202 [1,1,0,0,0,0|1,1,0]=4 7676 B9R0.2 CCSCCCCC(C)C 62a_100000210202_100011216152 [1,1,0,0,0,0|1,1,0]=4 7677 B9R0.2 CCSCCCCC(C)C 62a_100011216152_100000210202 [1,1,0,0,0,0|1,1,0]=4 7678 B9R0.2 CCSCCCCN(C)C 62a_100000210202_100000690147 [1,1,0,0,0,0|1,1,0]=4 7679 B9R0.2 CCSCCCOC(C)C 34a_100011216438_100000210206 [1,1,0,0,0,0|2,0,0]=4 7680 B9R0.2 CCSCCCOC(C)C 7a_100011216438_100000210206 [1,1,0,0,0,0|2,0,0]=4 7681 B9R0.2 CCSCCNCC(C)C 2230a_100000106463_100000210760 [1,1,0,0,0,0|1,1,0]=4 7682 B9R0.2 CCSCCNCC(C)C 2230a_100000210953_100000757381 [1,1,0,0,0,0|1,1,0]=4 7683 B9R0.2 CCSCCNCC(C)C 270004a_100000106463_100000210432 [1,1,0,0,0,0|1,1,0]=4 7684 B9R0.2 CCSCCNCC(C)C 34a_100000210953_100000757381 [1,1,0,0,0,0|1,1,0]=4 7685 B9R0.2 CCSCCNCC(C)O 2230a_100000106463_100011218427 [1,1,0,0,0,0|1,1,0]=4 7686 B9R0.2 CCSCCNCC(C)O 2230a_100000210904_100000757381 [1,1,0,0,0,0|1,1,0]=4 7687 B9R0.2 CCSCCNCC(C)O 34a_100000210904_100000757381 [1,1,0,0,0,0|1,1,0]=4 7688 B9R0.2 CCSCCNC[C@@H](C)O 2230a_100000106463_100009817552 [1,1,0,0,0,0|1,1,0]=4 7689 B9R0.2 CCSCCOCC(=O)C 34a_100000211253_100000757381 [1,1,0,0,0,0|0,1,1]=4 7690 B9R0.2 CCSCCOCC(C)Br 34a_100012180447_100000757381 [1,1,0,0,0,0|0,1,0]=3 7691 B9R0.2 CCSCCOCC(C)C 34a_100000210257_100000757381 [1,1,0,0,0,0|0,1,0]=3 7692 B9R0.2 CCSCCOCC(C)C 34a_100000212035_100000210624 [1,1,0,0,0,0|0,1,0]=3 7693 B9R0.2 CCSCCOCC(C)C 7a_100000212035_100000210760 [1,1,0,0,0,0|0,1,0]=3 7694 B9R0.2 CCSCCOCC(C)F 34a_100015925927_100000757381 [1,1,0,0,0,0|0,1,0]=3 7695 B9R0.2 CCSCCOCC(C)O 34a_100000212035_100011218427 [1,1,0,0,0,0|0,1,0]=3 7696 B9R0.2 CCSCCOCC(C)O 7a_100000212035_100011218427 [1,1,0,0,0,0|0,1,0]=3 7697 B9R0.2 CCSCCOCC(F)F 34a_100000212035_100011934356 [1,1,0,0,0,0|1,1,0]=4 7698 B9R0.2 CCSCCOCC(F)F 34a_100000743014_100000757381 [1,1,0,0,0,0|1,1,0]=4 7699 B9R0.2 CCSCCOCC(F)F 62a_100000210202_200012177212 [1,1,0,0,0,0|1,1,0]=4 7700 B9R0.2 CCSCCOCC(F)F 62a_200012177212_100000210202 [1,1,0,0,0,0|1,1,0]=4 7701 B9R0.2 CCSCCOCC(F)F 7a_100000212035_100011934356 [1,1,0,0,0,0|1,1,0]=4 7702 B9R0.2 CCSCCOC[C@@H](C)Cl 34a_100016084084_100000757381 [1,1,0,0,0,0|0,1,0]=3 7703 B9R0.2 CCSCCOC[C@@H](C)N 34a_100000737577_100000757381 [1,1,0,0,0,0|0,1,0]=3 7704 B9R0.2 CCSCCOC[C@@H](C)O 34a_100000212035_100009817552 [1,1,0,0,0,0|0,1,0]=3 7705 B9R0.2 CCSCCOC[C@@H](C)O 7a_100000212035_100009817552 [1,1,0,0,0,0|0,1,0]=3 7706 B9R0.2 CCSCCSCC(C)C 62a_100000210624_100000757381 [1,1,0,0,0,0|0,2,0]=4 7707 B9R0.2 CCSCCSCC(C)C 62a_100000757381_100000210760 [1,1,0,0,0,0|0,2,0]=4 7708 B9R0.2 CCSCCSCC(C)O 62a_100000757381_100011218427 [1,1,0,0,0,0|0,2,0]=4 7709 B9R0.2 CCSCCSCC(C)O 62a_100011218427_100000757381 [1,1,0,0,0,0|0,2,0]=4 7710 B9R0.2 CCSCCSC[C@@H](C)O 62a_100000757381_100009817552 [1,1,0,0,0,0|0,2,0]=4 7711 B9R0.2 CCSCCSC[C@@H](C)O 62a_100009817552_100000757381 [1,1,0,0,0,0|0,2,0]=4 7712 B9R0.2 CNCCCCCC(C)C 2230a_100011290863_200000210301 [1,1,0,0,0,0|2,0,0]=4 7713 B9R0.2 CNCCCCCC(C)C 2230a_106832991635_100000210682 [1,1,0,0,0,0|2,0,0]=4 7714 B9R0.2 CNCCCCCC(C)C 34a_100011290863_200000210301 [1,1,0,0,0,0|2,0,0]=4 7715 B9R0.2 CNCCCCCC(C)C 34a_100102657272_100000210682 [1,1,0,0,0,0|2,0,0]=4 7716 B9R0.2 CNCCCCCC(C)C 7a_106832991635_100000210682 [1,1,0,0,0,0|2,0,0]=4 7717 B9R0.2 CNCCCCOC(=O)C 34a_100102657272_100000033659 [1,1,0,0,0,0|1,0,1]=4 7718 B9R0.2 CNCCCCOC(=O)C 7a_106832991635_100000033659 [1,1,0,0,0,0|1,0,1]=4 7719 B9R0.2 CNCCCOCC(C)C 2230a_100000205972_200000210301 [1,1,0,0,0,0|2,0,0]=4 7720 B9R0.2 CNCCCOCC(C)C 34a_100000205972_200000210301 [1,1,0,0,0,0|2,0,0]=4 7721 B9R0.2 CNCCCOCC(C)C 34a_100000213112_100000210624 [1,1,0,0,0,0|2,0,0]=4 7722 B9R0.2 CNCCCOCC(C)O 34a_100000213112_100011218427 [1,1,0,0,0,0|2,0,0]=4 7723 B9R0.2 CNCCCOC[C@@H](C)O 34a_100000213112_100009817552 [1,1,0,0,0,0|2,0,0]=4 7724 B9R0.2 CNCOCCOC(=O)C 34a_100102657272_100000076355 [1,1,0,0,0,0|1,0,1]=4 7725 B9R0.2 COCCCCCC(=O)C 1458a_100011935119_200000210301 [1,1,0,0,0,0|1,0,1]=4 7726 B9R0.2 COCCCCCC(=O)[13CH3] 1458a_100011935119_200025704644 [1,1,0,0,0,0|1,0,1]=4 7727 B9R0.2 COCCCCCC(C)C 34a_100011995859_200000210301 [1,1,0,0,0,0|1,0,0]=3 7728 B9R0.2 COCCCCCC(C)C 34a_100138415774_100000210682 [1,1,0,0,0,0|1,0,0]=3 7729 B9R0.2 COCCCCCC(C)C 7a_100011995859_200000210301 [1,1,0,0,0,0|1,0,0]=3 7730 B9R0.2 COCCCCNC(C)C 2230a_100138425928_100000730899 [1,1,0,0,0,0|1,0,0]=3 7731 B9R0.2 COCCCCNC(C)C 34a_100011521146_200000210301 [1,1,0,0,0,0|1,0,0]=3 7732 B9R0.2 COCCCCNC(C)C 34a_100138425928_100000755781 [1,1,0,0,0,0|1,0,0]=3 7733 B9R0.2 COCCCCOC(=O)C 34a_100000073216_200000210301 [1,1,0,0,0,0|0,0,1]=3 7734 B9R0.2 COCCCCOC(=O)C 34a_100138415774_100000033659 [1,1,0,0,0,0|0,0,1]=3 7735 B9R0.2 COCCCCOC(=O)C 7a_100000073216_200000210301 [1,1,0,0,0,0|0,0,1]=3 7736 B9R0.2 COCCCCOC(C)C 34a_100000212225_100000755781 [1,1,0,0,0,0|0,0,0]=2 7737 B9R0.2 COCCCCOC(C)C 34a_100000740925_100000210206 [1,1,0,0,0,0|0,0,0]=2 7738 B9R0.2 COCCCCO[N+](=O)[O-] 34a_100138415774_100015694321 [1,1,0,0,0,0|2,0,0]=4 7739 B9R0.2 COCCCCSC(=O)C 34a_100138415774_200010402107 [1,1,0,0,0,0|0,1,1]=4 7740 B9R0.2 COCCCCSC(C)C 62a_100000210206_100000730899 [1,1,0,0,0,0|0,1,0]=3 7741 B9R0.2 COCCCCSC(C)C 62a_100000730899_100000210206 [1,1,0,0,0,0|0,1,0]=3 7742 B9R0.2 COCCCNCC(C)C 2230a_100000210953_100000740836 [1,1,0,0,0,0|2,0,0]=4 7743 B9R0.2 COCCCNCC(C)C 270004a_100150723488_100000210432 [1,1,0,0,0,0|2,0,0]=4 7744 B9R0.2 COCCCNCC(C)C 34a_100000210953_100000740836 [1,1,0,0,0,0|2,0,0]=4 7745 B9R0.2 COCCCNCC(C)C 34a_100150723488_100000210624 [1,1,0,0,0,0|2,0,0]=4 7746 B9R0.2 COCCCNCC(C)O 2230a_100000210904_100000740836 [1,1,0,0,0,0|2,0,0]=4 7747 B9R0.2 COCCCNCC(C)O 34a_100000210904_100000740836 [1,1,0,0,0,0|2,0,0]=4 7748 B9R0.2 COCCCNCC(C)O 34a_100150723488_100011218427 [1,1,0,0,0,0|2,0,0]=4 7749 B9R0.2 COCCCNC[C@@H](C)O 34a_100150723488_100009817552 [1,1,0,0,0,0|2,0,0]=4 7750 B9R0.2 COCCCOCC(C)Br 34a_100012180447_100000740836 [1,1,0,0,0,0|2,0,0]=4 7751 B9R0.2 COCCCOCC(C)C 34a_100000210257_100000740836 [1,1,0,0,0,0|2,0,0]=4 7752 B9R0.2 COCCCOCC(C)C 34a_100000740835_100000210624 [1,1,0,0,0,0|2,0,0]=4 7753 B9R0.2 COCCCOCC(C)F 34a_100015925927_100000740836 [1,1,0,0,0,0|2,0,0]=4 7754 B9R0.2 COCCCOCC(C)O 34a_100000740835_100011218427 [1,1,0,0,0,0|2,0,0]=4 7755 B9R0.2 COCCCOC[C@@H](C)Cl 34a_100016084084_100000740836 [1,1,0,0,0,0|2,0,0]=4 7756 B9R0.2 COCCCOC[C@@H](C)N 34a_100000737577_100000740836 [1,1,0,0,0,0|2,0,0]=4 7757 B9R0.2 COCCCOC[C@@H](C)O 34a_100000740835_100009817552 [1,1,0,0,0,0|2,0,0]=4 7758 B9R0.2 COCCCSCC(C)C 62a_100000210624_100000709357 [1,1,0,0,0,0|2,0,0]=4 7759 B9R0.2 COCCCSCC(C)C 62a_100000709357_100000210760 [1,1,0,0,0,0|2,0,0]=4 7760 B9R0.2 COCCCSCC(C)O 62a_100000709357_100011218427 [1,1,0,0,0,0|2,0,0]=4 7761 B9R0.2 COCCCSCC(C)O 62a_100011218427_100000709357 [1,1,0,0,0,0|2,0,0]=4 7762 B9R0.2 COCCCSC[C@@H](C)O 62a_100000709357_100009817552 [1,1,0,0,0,0|2,0,0]=4 7763 B9R0.2 COCCCSC[C@@H](C)O 62a_100009817552_100000709357 [1,1,0,0,0,0|2,0,0]=4 7764 B9R0.2 COCCNCCC(C)C 2230a_100000209980_100000210312 [1,1,0,0,0,0|1,0,0]=3 7765 B9R0.2 COCCNCCC(C)C 269862a_100000209980_100000185833 [1,1,0,0,0,0|1,0,0]=3 7766 B9R0.2 COCCNCCC(C)O 2230a_100000209980_100012276601 [1,1,0,0,0,0|1,0,0]=3 7767 B9R0.2 COCCNCCC(C)O 2230a_200000755665_100011201679 [1,1,0,0,0,0|1,0,0]=3 7768 B9R0.2 COCCNCOC(C)C 2230a_100000209980_100000709892 [1,1,0,0,0,0|1,0,0]=3 7769 B9R0.2 COCCOCC=C(C)C 34a_100000210237_100000761012 [1,1,0,0,0,0|0,0,2]=4 7770 B9R0.2 COCCOCC=C(C)C 34a_100000753907_100011201679 [1,1,0,0,0,0|0,0,2]=4 7771 B9R0.2 COCCOCCC(=O)C 1458a_100000070787_100000695917 [1,1,0,0,0,0|0,0,1]=3 7772 B9R0.2 COCCOCCC(=O)C 1458a_100000745395_200000210301 [1,1,0,0,0,0|0,0,1]=3 7773 B9R0.2 COCCOCCC(=O)C 34a_100000759926_100011201679 [1,1,0,0,0,0|0,0,1]=3 7774 B9R0.2 COCCOCCC(=O)C 7a_100000759926_100000233755 [1,1,0,0,0,0|0,0,1]=3 7775 B9R0.2 COCCOCCC(=O)N 34a_100000210237_100000731001 [1,1,0,0,0,0|1,0,1]=4 7776 B9R0.2 COCCOCCC(=O)N 34a_100000757172_100011201679 [1,1,0,0,0,0|1,0,1]=4 7777 B9R0.2 COCCOCCC(=O)N 7a_100000757172_100000233755 [1,1,0,0,0,0|1,0,1]=4 7778 B9R0.2 COCCOCCC(=O)[13CH3] 1458a_100000745395_200025704644 [1,1,0,0,0,0|0,0,1]=3 7779 B9R0.2 COCCOCCC(C)Br 34a_100009893172_100011201679 [1,1,0,0,0,0|0,0,0]=2 7780 B9R0.2 COCCOCCC(C)C 34a_100000210237_100000210312 [1,1,0,0,0,0|0,0,0]=2 7781 B9R0.2 COCCOCCC(C)C 34a_100000210254_100011201679 [1,1,0,0,0,0|0,0,0]=2 7782 B9R0.2 COCCOCCC(C)C 7a_100000210254_100000233755 [1,1,0,0,0,0|0,0,0]=2 7783 B9R0.2 COCCOCCC(C)O 34a_100000210237_100012276601 [1,1,0,0,0,0|0,0,0]=2 7784 B9R0.2 COCCOCCC(F)F 34a_100103093639_100011201679 [1,1,0,0,0,0|1,0,0]=3 7785 B9R0.2 COCCOCCN(C)C 2230a_100102631434_100000695917 [1,1,0,0,0,0|1,0,0]=3 7786 B9R0.2 COCCOCCN(C)C 269982a_100102631434_100000695917 [1,1,0,0,0,0|1,0,0]=3 7787 B9R0.2 COCCOCC[C@@H](C)N 34a_100000706166_100011201679 [1,1,0,0,0,0|0,0,0]=2 7788 B9R0.2 COCCOCNC(C)C 2230a_100138425928_100000231047 [1,1,0,0,0,0|1,0,0]=3 7789 B9R0.2 COCCOCOC(=O)C 34a_100000210237_100009813279 [1,1,0,0,0,0|0,0,1]=3 7790 B9R0.2 COCCOCOC(C)C 34a_100000210237_100000709892 [1,1,0,0,0,0|0,0,0]=2 7791 B9R0.2 COCCOCSC(C)C 62a_100000210206_100000231047 [1,1,0,0,0,0|0,1,0]=3 7792 B9R0.2 COCCOCSC(C)C 62a_100000231047_100000210206 [1,1,0,0,0,0|0,1,0]=3 7793 B9R0.2 COCCSCCC(=O)C 62a_100000053229_100000233755 [1,1,0,0,0,0|0,1,1]=4 7794 B9R0.2 COCCSCCC(=O)C 62a_100000233755_100000053229 [1,1,0,0,0,0|0,1,1]=4 7795 B9R0.2 COCCSCCC(C)C 62a_100000210312_100000233755 [1,1,0,0,0,0|0,1,0]=3 7796 B9R0.2 COCCSCCC(C)C 62a_100000233755_100000210312 [1,1,0,0,0,0|0,1,0]=3 7797 B9R0.2 COCCSCCC(C)O 62a_100000233755_100012276601 [1,1,0,0,0,0|0,1,0]=3 7798 B9R0.2 COCCSCCC(C)O 62a_100012276601_100000233755 [1,1,0,0,0,0|0,1,0]=3 7799 B9R0.2 COCCSCCN(C)C 62a_100000233755_100000755713 [1,1,0,0,0,0|1,1,0]=4 7800 B9R0.2 COCCSCOC(=O)C 62a_100000076356_100000233755 [1,1,0,0,0,0|0,1,1]=4 7801 B9R0.2 COCCSCOC(=O)C 62a_100000233755_100000076356 [1,1,0,0,0,0|0,1,1]=4 7802 B9R0.2 COCCSCOC(C)C 62a_100000233755_100000709892 [1,1,0,0,0,0|0,1,0]=3 7803 B9R0.2 COCCSCOC(C)C 62a_100000709892_100000233755 [1,1,0,0,0,0|0,1,0]=3 7804 B9R0.2 COCNCCCC(C)C 2230a_200000737386_100000766300 [1,1,0,0,0,0|2,0,0]=4 7805 B9R0.2 COCNCCOC(C)C 2230a_100000701111_100000766300 [1,1,0,0,0,0|1,0,0]=3 7806 B9R0.2 COCNCCSC(C)C 2230a_100000731138_100000766300 [1,1,0,0,0,0|1,1,0]=4 7807 B9R0.2 COCOCCOC(=O)C 34a_100138415774_100000076355 [1,1,0,0,0,0|0,0,1]=3 7808 B9R0.2 COCSCCCC(C)C 62a_100000766300_100011214892 [1,1,0,0,0,0|1,1,0]=4 7809 B9R0.2 COCSCCCC(C)C 62a_100011214892_100000766300 [1,1,0,0,0,0|1,1,0]=4 7810 B9R0.2 COCSCCCC(C)O 62a_100000766300_200000718107 [1,1,0,0,0,0|1,1,0]=4 7811 B9R0.2 COCSCCCC(C)O 62a_200000718107_100000766300 [1,1,0,0,0,0|1,1,0]=4 7812 B9R0.2 COCSCCOC(=O)C 62a_100000766300_100009814007 [1,1,0,0,0,0|0,1,1]=4 7813 B9R0.2 COCSCCOC(=O)C 62a_100009814007_100000766300 [1,1,0,0,0,0|0,1,1]=4 7814 B9R0.2 COCSCCOC(C)C 62a_100000211751_100000766300 [1,1,0,0,0,0|0,1,0]=3 7815 B9R0.2 COCSCCOC(C)C 62a_100000766300_100000211751 [1,1,0,0,0,0|0,1,0]=3 7816 B9R0.2 COCSCCSC(C)C 62a_100000730970_100000766300 [1,1,0,0,0,0|0,2,0]=4 7817 B9R0.2 COCSCCSC(C)C 62a_100000766300_100000730970 [1,1,0,0,0,0|0,2,0]=4 7818 B9R0.2 CSCCCCCC(C)C 62a_100000210682_200000210301 [1,1,0,0,0,0|1,1,0]=4 7819 B9R0.2 CSCCCCCC(C)C 62a_200000210301_100000210682 [1,1,0,0,0,0|1,1,0]=4 7820 B9R0.2 CSCCCCOC(=O)C 62a_100000033659_200000210301 [1,1,0,0,0,0|0,1,1]=4 7821 B9R0.2 CSCCCCOC(=O)C 62a_200000210301_100000033659 [1,1,0,0,0,0|0,1,1]=4 7822 B9R0.2 CSCCCCOC(C)C 34a_100011217163_100000210206 [1,1,0,0,0,0|0,1,0]=3 7823 B9R0.2 CSCCCCOC(C)C 7a_100011217163_100000210206 [1,1,0,0,0,0|0,1,0]=3 7824 B9R0.2 CSCCCOCC(C)C 34a_100000690336_100000210624 [1,1,0,0,0,0|2,0,0]=4 7825 B9R0.2 CSCCCOCC(C)C 7a_100000690336_100000210760 [1,1,0,0,0,0|2,0,0]=4 7826 B9R0.2 CSCCCOCC(C)O 34a_100000690336_100011218427 [1,1,0,0,0,0|2,0,0]=4 7827 B9R0.2 CSCCCOCC(C)O 7a_100000690336_100011218427 [1,1,0,0,0,0|2,0,0]=4 7828 B9R0.2 CSCCCOC[C@@H](C)O 34a_100000690336_100009817552 [1,1,0,0,0,0|2,0,0]=4 7829 B9R0.2 CSCCCOC[C@@H](C)O 7a_100000690336_100009817552 [1,1,0,0,0,0|2,0,0]=4 7830 B9R0.2 CSCCNCCC(C)C 2230a_100020590264_100000210312 [1,1,0,0,0,0|1,1,0]=4 7831 B9R0.2 CSCCNCCC(C)C 269862a_100020590264_100000185833 [1,1,0,0,0,0|1,1,0]=4 7832 B9R0.2 CSCCNCCC(C)O 2230a_100020590264_100012276601 [1,1,0,0,0,0|1,1,0]=4 7833 B9R0.2 CSCCNCCC(C)O 2230a_200000755665_100000751147 [1,1,0,0,0,0|1,1,0]=4 7834 B9R0.2 CSCCNCOC(C)C 2230a_100020590264_100000709892 [1,1,0,0,0,0|1,1,0]=4 7835 B9R0.2 CSCCOCCC(=O)C 34a_100000759926_100000212216 [1,1,0,0,0,0|0,1,1]=4 7836 B9R0.2 CSCCOCCC(=O)C 7a_100000230434_100000053229 [1,1,0,0,0,0|0,1,1]=4 7837 B9R0.2 CSCCOCCC(=O)C 7a_100000759926_100000212216 [1,1,0,0,0,0|0,1,1]=4 7838 B9R0.2 CSCCOCCC(C)Br 34a_100009893172_100000212216 [1,1,0,0,0,0|0,1,0]=3 7839 B9R0.2 CSCCOCCC(C)C 34a_100000210254_100000212216 [1,1,0,0,0,0|0,1,0]=3 7840 B9R0.2 CSCCOCCC(C)C 34a_100000230434_100000210312 [1,1,0,0,0,0|0,1,0]=3 7841 B9R0.2 CSCCOCCC(C)C 7a_100000210254_100000212216 [1,1,0,0,0,0|0,1,0]=3 7842 B9R0.2 CSCCOCCC(C)C 7a_100000230434_100000210626 [1,1,0,0,0,0|0,1,0]=3 7843 B9R0.2 CSCCOCCC(C)O 34a_100000230434_100012276601 [1,1,0,0,0,0|0,1,0]=3 7844 B9R0.2 CSCCOCCC(C)O 7a_100000230434_100012276601 [1,1,0,0,0,0|0,1,0]=3 7845 B9R0.2 CSCCOCCC(F)F 34a_100103093639_100000212216 [1,1,0,0,0,0|1,1,0]=4 7846 B9R0.2 CSCCOCCN(C)C 7a_100000230434_100000755713 [1,1,0,0,0,0|1,1,0]=4 7847 B9R0.2 CSCCOCC[C@@H](C)N 34a_100000706166_100000212216 [1,1,0,0,0,0|0,1,0]=3 7848 B9R0.2 CSCCOCOC(=O)C 34a_100000230434_100009813279 [1,1,0,0,0,0|0,1,1]=4 7849 B9R0.2 CSCCOCOC(C)C 34a_100000230434_100000709892 [1,1,0,0,0,0|0,1,0]=3 7850 B9R0.2 CSCCSCCC(C)C 62a_100000210312_100000751147 [1,1,0,0,0,0|0,2,0]=4 7851 B9R0.2 CSCCSCCC(C)C 62a_100000212216_100000210312 [1,1,0,0,0,0|0,2,0]=4 7852 B9R0.2 CSCCSCCC(C)O 62a_100000212216_100012276601 [1,1,0,0,0,0|0,2,0]=4 7853 B9R0.2 CSCCSCCC(C)O 62a_100012276601_100000751147 [1,1,0,0,0,0|0,2,0]=4 7854 B9R0.2 CSCCSCOC(C)C 62a_100000212216_100000709892 [1,1,0,0,0,0|0,2,0]=4 7855 B9R0.2 CSCCSCOC(C)C 62a_100000709892_100000751147 [1,1,0,0,0,0|0,2,0]=4 7856 B9R0.2 CSCNCCOC(C)C 2230a_100000701111_100011218213 [1,1,0,0,0,0|1,1,0]=4 7857 B9R0.2 CSCNCCOC(C)C 34a_100000701111_100011218213 [1,1,0,0,0,0|1,1,0]=4 7858 B9R0.2 CSCOCCCC(C)C 34a_100000210774_100011218213 [1,1,0,0,0,0|1,1,0]=4 7859 B9R0.2 CSCOCCNC(C)C 34a_100000224655_100011218213 [1,1,0,0,0,0|1,1,0]=4 7860 B9R0.2 CSCOCCOC(=O)C 62a_100000076355_200000210301 [1,1,0,0,0,0|0,1,1]=4 7861 B9R0.2 CSCOCCOC(=O)C 62a_200000210301_100000076355 [1,1,0,0,0,0|0,1,1]=4 7862 B9R0.2 CSCOCCOC(C)C 34a_100000211219_100011218213 [1,1,0,0,0,0|0,1,0]=3 7863 B9R0.2 CSCOCCSC(C)C 34a_200011212901_100011218213 [1,1,0,0,0,0|0,2,0]=4 7864 B9R0.2 CSCSCCOC(C)C 62a_100000211751_100011218213 [1,1,0,0,0,0|0,2,0]=4 7865 B9R0.2 CSCSCCOC(C)C 62a_100011218213_100000211751 [1,1,0,0,0,0|0,2,0]=4 7866 B9R0.2 C[C@@H](Cl)COCCCCF 34a_100016084084_100000729493 [1,1,0,0,0,0|2,0,0]=4 7867 B9R0.2 C[C@@H](Cl)COCCCCO 34a_100016084084_100011216708 [1,1,0,0,0,0|2,0,0]=4 7868 B9R0.2 C[C@@H](N)CCOCCCF 34a_100000706166_100011934791 [1,1,0,0,0,0|2,0,0]=4 7869 B9R0.2 C[C@@H](N)CCOCCCO 34a_100000706166_100000230001 [1,1,0,0,0,0|2,0,0]=4 7870 B9R0.2 C[C@@H](N)COCCCCF 34a_100000737577_100000729493 [1,1,0,0,0,0|2,0,0]=4 7871 B9R0.2 C[C@@H](N)COCCCCO 34a_100000737577_100011216708 [1,1,0,0,0,0|2,0,0]=4 7872 B9R0.2 C[C@@H](O)COCCCCBr 34a_100011216708_100009817552 [1,1,0,0,0,0|2,0,0]=4 7873 B9R0.2 C[C@@H](O)COCCCCCl 34a_100000210776_100009817552 [1,1,0,0,0,0|2,0,0]=4 7874 B9R0.2 C[C@@H](O)COCCCCCl 7a_100000210776_100009817552 [1,1,0,0,0,0|2,0,0]=4 7875 B9R0.2 C[C@@H](O)COCCCCF 34a_100011995726_100009817552 [1,1,0,0,0,0|2,0,0]=4 7876 B9R0.2 C[C@@H](O)COCCCCF 7a_100011995726_100009817552 [1,1,0,0,0,0|2,0,0]=4 7877 B9R0.2 C[C@@H](O)COCCCCI 34a_200012148704_100009817552 [1,1,0,0,0,0|2,0,0]=4 7878 B9R0.2 C[C@@H](O)COCCCCN 34a_100000750430_100009817552 [1,1,0,0,0,0|2,0,0]=4 7879 B9R0.2 FCOCCOCC(F)F 34a_100000704375_100015361967 [1,1,0,0,0,0|2,0,0]=4 7880 B9R0.2 FCOCCOCC(F)F 7a_100000704375_100015361967 [1,1,0,0,0,0|2,0,0]=4 7881 B9R0.2 NC(=O)OCCOCCO 7a_100000766696_100000211926 [1,1,0,0,0,0|1,0,1]=4 7882 B9R0.5 C#CCC(C)OCCCC 34a_100000685586_100000210210 [1,1,0,0,0,0|1,0,1]=4 7883 B9R0.5 C#CCC(C)OCCCC 7a_100000685586_100000210211 [1,1,0,0,0,0|1,0,1]=4 7884 B9R0.5 C#CCC(C)OCCOC 34a_100000685586_100011201679 [1,1,0,0,0,0|0,0,2]=4 7885 B9R0.5 C#CCC(C)OCCOC 7a_100000685586_100000233755 [1,1,0,0,0,0|0,0,2]=4 7886 B9R0.5 C#CCCOC(C)CCC 34a_100000764384_100000688953 [1,1,0,0,0,0|1,0,1]=4 7887 B9R0.5 C#CCCOC(C)CCC 34a_100011215631_100000766640 [1,1,0,0,0,0|1,0,1]=4 7888 B9R0.5 C#CCCOC(C)CCC 7a_100000764384_100000688953 [1,1,0,0,0,0|1,0,1]=4 7889 B9R0.5 C#CCCOC(C)COC 34a_100011215631_100000765312 [1,1,0,0,0,0|0,0,2]=4 7890 B9R0.5 C#CCCO[C@H](C)COC 34a_100011934205_100000688953 [1,1,0,0,0,0|0,0,2]=4 7891 B9R0.5 C#CCOCC(C)OCC 34a_100011025554_100000210202 [1,1,0,0,0,0|0,0,2]=4 7892 B9R0.5 C#CCOCC(C)OCC 7a_100011025554_100000210202 [1,1,0,0,0,0|0,0,2]=4 7893 B9R0.5 C/C=C/C(C)OCCCC 34a_200102604097_100000210210 [1,1,0,0,0,0|1,0,1]=4 7894 B9R0.5 C/C=C/C(C)OCCOC 34a_200102604097_100011201679 [1,1,0,0,0,0|0,0,2]=4 7895 B9R0.5 C/C=C/COC(C)CCC 34a_100000764384_100102629194 [1,1,0,0,0,0|1,0,1]=4 7896 B9R0.5 C/C=C/COC(C)CCC 34a_100016270725_100000766640 [1,1,0,0,0,0|1,0,1]=4 7897 B9R0.5 C/C=C/COC(C)CCC 7a_100000764384_100102629194 [1,1,0,0,0,0|1,0,1]=4 7898 B9R0.5 C/C=C/COC(C)COC 34a_100016270725_100000765312 [1,1,0,0,0,0|0,0,2]=4 7899 B9R0.5 C/C=C/CO[C@H](C)COC 34a_100011934205_100102629194 [1,1,0,0,0,0|0,0,2]=4 7900 B9R0.5 C=CCCOC(C)CCC 34a_100000764384_100000754431 [1,1,0,0,0,0|1,0,1]=4 7901 B9R0.5 C=CCCOC(C)CCC 34a_100011205117_100000766640 [1,1,0,0,0,0|1,0,1]=4 7902 B9R0.5 C=CCCOC(C)CCC 7a_100000764384_100000754431 [1,1,0,0,0,0|1,0,1]=4 7903 B9R0.5 C=CCCOC(C)COC 34a_100011205117_100000765312 [1,1,0,0,0,0|0,0,2]=4 7904 B9R0.5 C=CCCO[C@H](C)COC 34a_100011934205_100000754431 [1,1,0,0,0,0|0,0,2]=4 7905 B9R0.5 C=CC[C@@H](C)OCCCC 34a_100000731007_100000210210 [1,1,0,0,0,0|1,0,1]=4 7906 B9R0.5 C=CC[C@@H](C)OCCCC 7a_100000731007_100000210211 [1,1,0,0,0,0|1,0,1]=4 7907 B9R0.5 C=CC[C@@H](C)OCCOC 34a_100000731007_100011201679 [1,1,0,0,0,0|0,0,2]=4 7908 B9R0.5 C=CC[C@@H](C)OCCOC 7a_100000731007_100000233755 [1,1,0,0,0,0|0,0,2]=4 7909 B9R0.5 CC#CC(C)OCCCC 34a_100011216543_100000210210 [1,1,0,0,0,0|1,0,1]=4 7910 B9R0.5 CC#CC(C)OCCOC 34a_100011216543_100011201679 [1,1,0,0,0,0|0,0,2]=4 7911 B9R0.5 CC#CCOC(C)CCC 34a_100000761923_100000766640 [1,1,0,0,0,0|1,0,1]=4 7912 B9R0.5 CC#CCOC(C)CCC 34a_100000764384_100000748600 [1,1,0,0,0,0|1,0,1]=4 7913 B9R0.5 CC#CCOC(C)CCC 7a_100000764384_100000748600 [1,1,0,0,0,0|1,0,1]=4 7914 B9R0.5 CC#CCOC(C)COC 34a_100000761923_100000765312 [1,1,0,0,0,0|0,0,2]=4 7915 B9R0.5 CC#CCO[C@H](C)COC 34a_100011934205_100000748600 [1,1,0,0,0,0|0,0,2]=4 7916 B9R0.5 CC(CCN)COCCO 34a_106354213184_100000211926 [1,1,0,0,0,0|2,0,0]=4 7917 B9R0.5 CC(CCO)OCCON 34a_100000700252_100009893172 [1,1,0,0,0,0|2,0,0]=4 7918 B9R0.5 CC=CCOC(C)CCC 34a_100000764384_100000070051 [1,1,0,0,0,0|1,0,1]=4 7919 B9R0.5 CC=CCOC(C)CCC 7a_100000764384_100000070051 [1,1,0,0,0,0|1,0,1]=4 7920 B9R0.5 CC=CCO[C@H](C)COC 34a_100011934205_100000070051 [1,1,0,0,0,0|0,0,2]=4 7921 B9R0.5 CCC#CCC(C)OCC 34a_200000035118_100000210202 [1,1,0,0,0,0|1,0,1]=4 7922 B9R0.5 CCC#CCC(C)OCC 7a_200000035118_100000210202 [1,1,0,0,0,0|1,0,1]=4 7923 B9R0.5 CCCC(=O)CCCOC 1458a_100000211992_100000740836 [1,1,0,0,0,0|1,0,1]=4 7924 B9R0.5 CCCC(=O)CCCOC 1458a_100000741012_100000210303 [1,1,0,0,0,0|1,0,1]=4 7925 B9R0.5 CCCC(=O)CCOCC 1458a_100000211992_100011215890 [1,1,0,0,0,0|1,0,0]=3 7926 B9R0.5 CCCC(=O)CCOCC 1458a_100000749530_100000210303 [1,1,0,0,0,0|1,0,0]=3 7927 B9R0.5 CCCC(=O)CCSCC 1458a_100000211992_100000757381 [1,1,0,0,0,0|1,1,0]=4 7928 B9R0.5 CCCC(=O)CCSCC 1458a_100000230768_100000210303 [1,1,0,0,0,0|1,1,0]=4 7929 B9R0.5 CCCC(=O)COCCO 1458a_100000708028_100000210303 [1,1,0,0,0,0|1,0,1]=4 7930 B9R0.5 CCCC(=O)NCCOC 1626a_100000209980_100000211992 [1,1,0,0,0,0|1,0,1]=4 7931 B9R0.5 CCCC(=O)NCCOC 240690a_100000209980_100000211992 [1,1,0,0,0,0|1,0,1]=4 7932 B9R0.5 CCCC(=O)NCCOC 527a_100000209980_100000211992 [1,1,0,0,0,0|1,0,1]=4 7933 B9R0.5 CCCC(=O)OCOCC 34a_100121572206_100000034017 [1,1,0,0,0,0|1,0,1]=4 7934 B9R0.5 CCCC(C)CCCOC 34a_100011713154_200000210301 [1,1,0,0,0,0|1,0,0]=3 7935 B9R0.5 CCCC(C)CCCOC 7a_100011713154_200000210301 [1,1,0,0,0,0|1,0,0]=3 7936 B9R0.5 CCCC(C)CCCO[13CH3] 34a_100011713154_200025704644 [1,1,0,0,0,0|1,0,0]=3 7937 B9R0.5 CCCC(C)CCCO[13CH3] 7a_100011713154_200025704644 [1,1,0,0,0,0|1,0,0]=3 7938 B9R0.5 CCCC(C)CCOCC 34a_100011217855_100000210202 [1,1,0,0,0,0|1,0,0]=3 7939 B9R0.5 CCCC(C)CCOCC 7a_100011217855_100000210202 [1,1,0,0,0,0|1,0,0]=3 7940 B9R0.5 CCCC(C)CCOCF 34a_100011217855_100015361967 [1,1,0,0,0,0|2,0,0]=4 7941 B9R0.5 CCCC(C)CCOCF 7a_100011217855_100015361967 [1,1,0,0,0,0|2,0,0]=4 7942 B9R0.5 CCCC(C)CNCCO 2230a_100016997473_100011216630 [1,1,0,0,0,0|2,0,0]=4 7943 B9R0.5 CCCC(C)CNCCO 270004a_100000210304_100000243154 [1,1,0,0,0,0|2,0,0]=4 7944 B9R0.5 CCCC(C)CNCCO 34a_100016990907_100011216630 [1,1,0,0,0,0|2,0,0]=4 7945 B9R0.5 CCCC(C)COCCBr 34a_100000211926_100011216630 [1,1,0,0,0,0|2,0,0]=4 7946 B9R0.5 CCCC(C)COCCF 34a_100000688023_100011217306 [1,1,0,0,0,0|2,0,0]=4 7947 B9R0.5 CCCC(C)COCCF 7a_100000688023_100011217306 [1,1,0,0,0,0|2,0,0]=4 7948 B9R0.5 CCCC(C)COCCN 34a_100000210304_100011216630 [1,1,0,0,0,0|2,0,0]=4 7949 B9R0.5 CCCC(C)COCCO 34a_100000688023_100000211926 [1,1,0,0,0,0|1,0,0]=3 7950 B9R0.5 CCCC(C)COCCO 7a_100000688023_100000211926 [1,1,0,0,0,0|1,0,0]=3 7951 B9R0.5 CCCC(C)COCSC 34a_100000688023_100011218213 [1,1,0,0,0,0|1,1,0]=4 7952 B9R0.5 CCCC(C)CSCCO 62a_100000211926_100011216630 [1,1,0,0,0,0|1,1,0]=4 7953 B9R0.5 CCCC(C)CSCCO 62a_100011216630_100000211926 [1,1,0,0,0,0|1,1,0]=4 7954 B9R0.5 CCCC(C)CSCOC 62a_100000766300_100011216630 [1,1,0,0,0,0|1,1,0]=4 7955 B9R0.5 CCCC(C)CSCOC 62a_100011216630_100000766300 [1,1,0,0,0,0|1,1,0]=4 7956 B9R0.5 CCCC(C)NCCOC 2230a_100000209980_100000766640 [1,1,0,0,0,0|1,0,0]=3 7957 B9R0.5 CCCC(C)NCCOC 2230a_100000741246_100011201679 [1,1,0,0,0,0|1,0,0]=3 7958 B9R0.5 CCCC(C)NCCOC 270004a_100000209980_100000211909 [1,1,0,0,0,0|1,0,0]=3 7959 B9R0.5 CCCC(C)NCCSC 2230a_100000741246_100000751147 [1,1,0,0,0,0|1,1,0]=4 7960 B9R0.5 CCCC(C)NCCSC 2230a_100020590264_100000766640 [1,1,0,0,0,0|1,1,0]=4 7961 B9R0.5 CCCC(C)NCCSC 270004a_100020590264_100000211909 [1,1,0,0,0,0|1,1,0]=4 7962 B9R0.5 CCCC(C)OCCC#N 7a_100000764384_100000184422 [1,1,0,0,0,0|2,0,0]=4 7963 B9R0.5 CCCC(C)OCCCBr 34a_100011217188_100000766640 [1,1,0,0,0,0|2,0,0]=4 7964 B9R0.5 CCCC(C)OCCCCl 34a_100000230001_100000766640 [1,1,0,0,0,0|2,0,0]=4 7965 B9R0.5 CCCC(C)OCCCF 34a_100000759539_100000766640 [1,1,0,0,0,0|2,0,0]=4 7966 B9R0.5 CCCC(C)OCCCF 34a_100000764384_100011934791 [1,1,0,0,0,0|2,0,0]=4 7967 B9R0.5 CCCC(C)OCCCF 7a_100000764384_100011934791 [1,1,0,0,0,0|2,0,0]=4 7968 B9R0.5 CCCC(C)OCCCN 34a_100000182051_100000766640 [1,1,0,0,0,0|2,0,0]=4 7969 B9R0.5 CCCC(C)OCCCO 34a_100000764384_100000230001 [1,1,0,0,0,0|2,0,0]=4 7970 B9R0.5 CCCC(C)OCCCO 7a_100000764384_100011215043 [1,1,0,0,0,0|2,0,0]=4 7971 B9R0.5 CCCC(C)OCCOC 34a_100000210237_100000766640 [1,1,0,0,0,0|0,0,0]=2 7972 B9R0.5 CCCC(C)OCCOC 34a_100000764384_100011201679 [1,1,0,0,0,0|0,0,0]=2 7973 B9R0.5 CCCC(C)OCCOC 7a_100000764384_100000233755 [1,1,0,0,0,0|0,0,0]=2 7974 B9R0.5 CCCC(C)OCCON 34a_100000700252_100000766640 [1,1,0,0,0,0|1,0,0]=3 7975 B9R0.5 CCCC(C)OCCSC 34a_100000230434_100000766640 [1,1,0,0,0,0|0,1,0]=3 7976 B9R0.5 CCCC(C)OCCSC 34a_100000764384_100000212216 [1,1,0,0,0,0|0,1,0]=3 7977 B9R0.5 CCCC(C)OCCSC 7a_100000230434_100000766640 [1,1,0,0,0,0|0,1,0]=3 7978 B9R0.5 CCCC(C)OCCSC 7a_100000764384_100000212216 [1,1,0,0,0,0|0,1,0]=3 7979 B9R0.5 CCCC(C)SCCOC 62a_100000233755_100000766640 [1,1,0,0,0,0|0,1,0]=3 7980 B9R0.5 CCCC(C)SCCOC 62a_100000766640_100000233755 [1,1,0,0,0,0|0,1,0]=3 7981 B9R0.5 CCCC(C)SCCSC 62a_100000212216_100000766640 [1,1,0,0,0,0|0,2,0]=4 7982 B9R0.5 CCCC(C)SCCSC 62a_100000766640_100000751147 [1,1,0,0,0,0|0,2,0]=4 7983 B9R0.5 CCCC(C)SCOCC 62a_100000739092_100000766640 [1,1,0,0,0,0|1,1,0]=4 7984 B9R0.5 CCCC(C)SCOCC 62a_100000766640_100000739092 [1,1,0,0,0,0|1,1,0]=4 7985 B9R0.5 CCCCCC(=O)CCC 1458a_100000211992_100000210326 [1,1,0,0,0,0|2,0,0]=4 7986 B9R0.5 CCCCCC(=O)CCC 1458a_100000212188_100000210303 [1,1,0,0,0,0|2,0,0]=4 7987 B9R0.5 CCCCCC(=O)CCO 1458a_100000212188_100000211926 [1,1,0,0,0,0|2,0,0]=4 7988 B9R0.5 CCCCCC(=O)CCO 1458a_100011216618_100000210326 [1,1,0,0,0,0|2,0,0]=4 7989 B9R0.5 CCCCCC(=O)COC 1458a_100000210968_100000210326 [1,1,0,0,0,0|1,0,1]=4 7990 B9R0.5 CCCCCC(=O)COC 34a_100138415774_200012276598 [1,1,0,0,0,0|1,0,1]=4 7991 B9R0.5 CCCCCC(C)NCC 2230a_100000211957_100000210202 [1,1,0,0,0,0|2,0,0]=4 7992 B9R0.5 CCCCCC(C)NCC 2230a_100015525214_200011218191 [1,1,0,0,0,0|2,0,0]=4 7993 B9R0.5 CCCCCC(C)NCC 270004a_100015525214_100000211708 [1,1,0,0,0,0|2,0,0]=4 7994 B9R0.5 CCCCCC(C)OCC 34a_100011215632_100000210202 [1,1,0,0,0,0|1,0,0]=3 7995 B9R0.5 CCCCCC(C)OCC 34a_100121572206_200011218191 [1,1,0,0,0,0|1,0,0]=3 7996 B9R0.5 CCCCCC(C)OCC 7a_100011215632_100000210202 [1,1,0,0,0,0|1,0,0]=3 7997 B9R0.5 CCCCCC(C)OCF 34a_100011215632_100015361967 [1,1,0,0,0,0|2,0,0]=4 7998 B9R0.5 CCCCCC(C)OCF 7a_100011215632_100015361967 [1,1,0,0,0,0|2,0,0]=4 7999 B9R0.5 CCCCCC(C)SCC 62a_100000210202_200011218191 [1,1,0,0,0,0|1,1,0]=4 8000 B9R0.5 CCCCCC(C)SCC 62a_200011218191_100000210202 [1,1,0,0,0,0|1,1,0]=4 8001 B9R0.5 CCCCCN(C)CCC 2230a_100000223495_100000210303 [1,1,0,0,0,0|2,0,0]=4 8002 B9R0.5 CCCCCN(C)CCC 2230a_100000747261_100000210326 [1,1,0,0,0,0|2,0,0]=4 8003 B9R0.5 CCCCCN(C)CCC 2230a_200000226819_200000210301 [1,1,0,0,0,0|2,0,0]=4 8004 B9R0.5 CCCCCN(C)CCC 269982a_100000223495_100000210303 [1,1,0,0,0,0|2,0,0]=4 8005 B9R0.5 CCCCCN(C)CCC 269982a_100000747261_100000210215 [1,1,0,0,0,0|2,0,0]=4 8006 B9R0.5 CCCCCN(C)CCC 269982a_200000226819_200000210301 [1,1,0,0,0,0|2,0,0]=4 8007 B9R0.5 CCCCCN(C)CCO 2230a_100000210263_100000210326 [1,1,0,0,0,0|2,0,0]=4 8008 B9R0.5 CCCCCN(C)CCO 2230a_100000223495_100000211926 [1,1,0,0,0,0|2,0,0]=4 8009 B9R0.5 CCCCCN(C)CCO 2230a_100000224656_200000210301 [1,1,0,0,0,0|2,0,0]=4 8010 B9R0.5 CCCCCN(C)CCO 269982a_100000210263_100000210215 [1,1,0,0,0,0|2,0,0]=4 8011 B9R0.5 CCCCCN(C)CCO 269982a_100000223495_100000211926 [1,1,0,0,0,0|2,0,0]=4 8012 B9R0.5 CCCCCN(C)CCO 269982a_100000224656_200000210301 [1,1,0,0,0,0|2,0,0]=4 8013 B9R0.5 CCCCCN(C)COC 2230a_100000223495_100000766300 [1,1,0,0,0,0|2,0,0]=4 8014 B9R0.5 CCCCCN(C)COC 269982a_100000223495_100000766300 [1,1,0,0,0,0|2,0,0]=4 8015 B9R0.5 CCCCCN([13CH3])CCC 2230a_200000226819_200025704644 [1,1,0,0,0,0|2,0,0]=4 8016 B9R0.5 CCCCCN([13CH3])CCC 269982a_200000226819_200025704644 [1,1,0,0,0,0|2,0,0]=4 8017 B9R0.5 CCCCCN([13CH3])CCO 2230a_100000224656_200025704644 [1,1,0,0,0,0|2,0,0]=4 8018 B9R0.5 CCCCCN([13CH3])CCO 269982a_100000224656_200025704644 [1,1,0,0,0,0|2,0,0]=4 8019 B9R0.5 CCCCNC(=O)COC 11a_100000102301_100000210968 [1,1,0,0,0,0|1,0,1]=4 8020 B9R0.5 CCCCNC(=O)COC 1626a_100000102301_100000210968 [1,1,0,0,0,0|1,0,1]=4 8021 B9R0.5 CCCCNC(=O)COC 240690a_100000102301_100000210968 [1,1,0,0,0,0|1,0,1]=4 8022 B9R0.5 CCCCNC(=O)COC 34a_100138415774_100000182744 [1,1,0,0,0,0|1,0,1]=4 8023 B9R0.5 CCCCNC(=O)COC 527a_100000102301_100000210968 [1,1,0,0,0,0|1,0,1]=4 8024 B9R0.5 CCCCNC(C)CCC 2230a_100000102301_100000766640 [1,1,0,0,0,0|2,0,0]=4 8025 B9R0.5 CCCCNC(C)CCC 2230a_100000741246_100000210211 [1,1,0,0,0,0|2,0,0]=4 8026 B9R0.5 CCCCNC(C)CCC 270004a_100000102301_100000211909 [1,1,0,0,0,0|2,0,0]=4 8027 B9R0.5 CCCCNC(C)CCC 7a_106832991798_100000766640 [1,1,0,0,0,0|2,0,0]=4 8028 B9R0.5 CCCCNC(C)COC 2230a_100000102301_100000765312 [1,1,0,0,0,0|1,0,0]=3 8029 B9R0.5 CCCCNC(C)COC 270004a_100000102301_100000749346 [1,1,0,0,0,0|1,0,0]=3 8030 B9R0.5 CCCCNC(C)COC 7a_106832991798_100000765312 [1,1,0,0,0,0|1,0,0]=3 8031 B9R0.5 CCCCNC(C)CSC 270004a_100000102301_100011216314 [1,1,0,0,0,0|1,1,0]=4 8032 B9R0.5 CCCCN[C@H](C)COC 2230a_100000764878_100000210211 [1,1,0,0,0,0|1,0,0]=3 8033 B9R0.5 CCCCOC(=O)CNC 2230a_106832991635_100000211628 [1,1,0,0,0,0|1,0,1]=4 8034 B9R0.5 CCCCOC(=O)CNC 34a_100102657272_100000211628 [1,1,0,0,0,0|1,0,1]=4 8035 B9R0.5 CCCCOC(=O)CNC 7a_106832991635_100000211628 [1,1,0,0,0,0|1,0,1]=4 8036 B9R0.5 CCCCOC(=O)COC 34a_100138415774_100000211628 [1,1,0,0,0,0|0,0,1]=3 8037 B9R0.5 CCCCOC(=O)CSC 62a_100000211628_200000210301 [1,1,0,0,0,0|0,1,1]=4 8038 B9R0.5 CCCCOC(=O)CSC 62a_200000210301_100000211628 [1,1,0,0,0,0|0,1,1]=4 8039 B9R0.5 CCCCOC(=O)CS[13CH3] 62a_100000211628_200025704644 [1,1,0,0,0,0|0,1,1]=4 8040 B9R0.5 CCCCOC(=O)CS[13CH3] 62a_200025704644_100000211628 [1,1,0,0,0,0|0,1,1]=4 8041 B9R0.5 CCCCOC(C)CC#N 7a_100000210227_100009813641 [1,1,0,0,0,0|2,0,0]=4 8042 B9R0.5 CCCCOC(C)CCBr 34a_100012276601_100000210210 [1,1,0,0,0,0|2,0,0]=4 8043 B9R0.5 CCCCOC(C)CCC 34a_100000210227_100000766640 [1,1,0,0,0,0|1,0,0]=3 8044 B9R0.5 CCCCOC(C)CCC 34a_100000764384_100000210210 [1,1,0,0,0,0|1,0,0]=3 8045 B9R0.5 CCCCOC(C)CCC 7a_100000210227_100000766640 [1,1,0,0,0,0|1,0,0]=3 8046 B9R0.5 CCCCOC(C)CCC 7a_100000764384_100000210211 [1,1,0,0,0,0|1,0,0]=3 8047 B9R0.5 CCCCOC(C)CCO 34a_100000210227_100009893172 [1,1,0,0,0,0|2,0,0]=4 8048 B9R0.5 CCCCOC(C)CCO 7a_100000210227_100009893172 [1,1,0,0,0,0|2,0,0]=4 8049 B9R0.5 CCCCOC(C)COC 34a_100000210227_100000765312 [1,1,0,0,0,0|0,0,0]=2 8050 B9R0.5 CCCCOC(C)COC 7a_100000210227_100000765312 [1,1,0,0,0,0|0,0,0]=2 8051 B9R0.5 CCCCO[C@H](C)COC 34a_100011934205_100000210210 [1,1,0,0,0,0|0,0,0]=2 8052 B9R0.5 CCCCSC(C)CCC 62a_100000210211_100000766640 [1,1,0,0,0,0|1,1,0]=4 8053 B9R0.5 CCCCSC(C)CCC 62a_100000766640_100000210210 [1,1,0,0,0,0|1,1,0]=4 8054 B9R0.5 CCCCSC(C)COC 62a_100000210211_100000765312 [1,1,0,0,0,0|0,1,0]=3 8055 B9R0.5 CCCCSC(C)COC 62a_100000765312_100000210210 [1,1,0,0,0,0|0,1,0]=3 8056 B9R0.5 CCCN(C)CCCOC 2230a_100000224831_100000210303 [1,1,0,0,0,0|2,0,0]=4 8057 B9R0.5 CCCN(C)CCCOC 2230a_100000747261_100000740836 [1,1,0,0,0,0|2,0,0]=4 8058 B9R0.5 CCCN(C)CCCOC 269982a_100000224831_100000210303 [1,1,0,0,0,0|2,0,0]=4 8059 B9R0.5 CCCN(C)CCCOC 269982a_100000747261_100000740836 [1,1,0,0,0,0|2,0,0]=4 8060 B9R0.5 CCCN(C)CCOCC 2230a_100000747261_100011215890 [1,1,0,0,0,0|1,0,0]=3 8061 B9R0.5 CCCN(C)CCOCC 269982a_100000747261_100011215890 [1,1,0,0,0,0|1,0,0]=3 8062 B9R0.5 CCCN(C)CCSCC 2230a_100000747261_100000757381 [1,1,0,0,0,0|1,1,0]=4 8063 B9R0.5 CCCN(C)CCSCC 269982a_100000747261_100000757381 [1,1,0,0,0,0|1,1,0]=4 8064 B9R0.5 CCCNCC(C)CCC 270004a_100020643023_100000243154 [1,1,0,0,0,0|2,0,0]=4 8065 B9R0.5 CCCNCC(O)COC 2230a_100000756049_100000210303 [1,1,0,0,0,0|2,0,0]=4 8066 B9R0.5 CCCNCC(O)COC 34a_100000756049_100000210303 [1,1,0,0,0,0|2,0,0]=4 8067 B9R0.5 CCCOCC(=O)CCC 1458a_100000745993_100000210303 [1,1,0,0,0,0|1,0,1]=4 8068 B9R0.5 CCCOCC(=O)NCC 11a_100015525214_100000745993 [1,1,0,0,0,0|1,0,1]=4 8069 B9R0.5 CCCOCC(=O)NCC 240690a_100015525214_100000745993 [1,1,0,0,0,0|1,0,1]=4 8070 B9R0.5 CCCOCC(=O)NCC 34a_100000210258_100000183381 [1,1,0,0,0,0|1,0,1]=4 8071 B9R0.5 CCCOCC(=O)NCC 527a_100015525214_100000745993 [1,1,0,0,0,0|1,0,1]=4 8072 B9R0.5 CCCOCC(=O)OCC 34a_100000210258_100000188475 [1,1,0,0,0,0|0,0,1]=3 8073 B9R0.5 CCCOCC(C)CCC 34a_100000210258_100011216630 [1,1,0,0,0,0|1,0,0]=3 8074 B9R0.5 CCCOCC(C)CCC 34a_100000688023_100000210303 [1,1,0,0,0,0|1,0,0]=3 8075 B9R0.5 CCCOCC(C)CCC 7a_100000688023_100000210303 [1,1,0,0,0,0|1,0,0]=3 8076 B9R0.5 CCCOCC(C)CCN 34a_106354213184_100000210303 [1,1,0,0,0,0|2,0,0]=4 8077 B9R0.5 CCCOCC(N)COC 34a_100000724102_100000210303 [1,1,0,0,0,0|2,0,0]=4 8078 B9R0.5 CCCOCC(O)COC 34a_100000210258_100011215053 [1,1,0,0,0,0|2,0,0]=4 8079 B9R0.5 CCCOC[C@@H](N)CCC 34a_100000732646_100000210303 [1,1,0,0,0,0|1,0,0]=3 8080 B9R0.5 CCCSCC(=O)OCC 62a_100000188475_100000210303 [1,1,0,0,0,0|0,1,1]=4 8081 B9R0.5 CCCSCC(=O)OCC 62a_100000210303_100000188475 [1,1,0,0,0,0|0,1,1]=4 8082 B9R0.5 CCCSCC(C)CCC 62a_100000210303_100011216630 [1,1,0,0,0,0|1,1,0]=4 8083 B9R0.5 CCCSCC(C)CCC 62a_100011216630_100000210303 [1,1,0,0,0,0|1,1,0]=4 8084 B9R0.5 CCCSCC(C)NCC 270004a_100015525214_100011343953 [1,1,0,0,0,0|1,1,0]=4 8085 B9R0.5 CCCSCC(O)COC 62a_100000210303_100011215053 [1,1,0,0,0,0|2,0,0]=4 8086 B9R0.5 CCCSCC(O)COC 62a_100011215053_100000210303 [1,1,0,0,0,0|2,0,0]=4 8087 B9R0.5 CCC[C@H](N)CCOCC 34a_100015193777_100000210202 [1,1,0,0,0,0|1,0,0]=3 8088 B9R0.5 CCC[C@H](N)CCOCF 34a_100015193777_100015361967 [1,1,0,0,0,0|2,0,0]=4 8089 B9R0.5 CCC[C@H](N)COCCF 34a_100000732646_100011217306 [1,1,0,0,0,0|2,0,0]=4 8090 B9R0.5 CCC[C@H](N)COCCO 34a_100000732646_100000211926 [1,1,0,0,0,0|1,0,0]=3 8091 B9R0.5 CCC[C@H](N)COCSC 34a_100000732646_100011218213 [1,1,0,0,0,0|1,1,0]=4 8092 B9R0.5 CCNC(=O)CCCOC 11a_100015525214_100000741012 [1,1,0,0,0,0|1,0,1]=4 8093 B9R0.5 CCNC(=O)CCCOC 240690a_100015525214_100000741012 [1,1,0,0,0,0|1,0,1]=4 8094 B9R0.5 CCNC(=O)CCCOC 527a_100015525214_100000741012 [1,1,0,0,0,0|1,0,1]=4 8095 B9R0.5 CCNC(=O)CCOCC 11a_100015525214_100000749530 [1,1,0,0,0,0|2,0,0]=4 8096 B9R0.5 CCNC(=O)CCOCC 240690a_100015525214_100000749530 [1,1,0,0,0,0|2,0,0]=4 8097 B9R0.5 CCNC(=O)CCOCC 527a_100015525214_100000749530 [1,1,0,0,0,0|2,0,0]=4 8098 B9R0.5 CCNC(=O)COCCO 240690a_100015525214_100000708028 [1,1,0,0,0,0|1,0,1]=4 8099 B9R0.5 CCNC(C)CCCSC 270004a_100015525214_100011399439 [1,1,0,0,0,0|1,1,0]=4 8100 B9R0.5 CCNC(C)CCOCC 270004a_100015525214_200011216536 [1,1,0,0,0,0|2,0,0]=4 8101 B9R0.5 CCOC(=O)CCCNC 2230a_106832991635_100009991533 [1,1,0,0,0,0|1,0,1]=4 8102 B9R0.5 CCOC(=O)CCCNC 34a_100102657272_100009991533 [1,1,0,0,0,0|1,0,1]=4 8103 B9R0.5 CCOC(=O)CCCNC 7a_106832991635_100011215271 [1,1,0,0,0,0|1,0,1]=4 8104 B9R0.5 CCOC(=O)CCCOC 34a_100138415774_100009991533 [1,1,0,0,0,0|0,0,1]=3 8105 B9R0.5 CCOC(=O)CCCOC 7a_100012001163_200000210301 [1,1,0,0,0,0|0,0,1]=3 8106 B9R0.5 CCOC(=O)CCCO[13CH3] 7a_100012001163_200025704644 [1,1,0,0,0,0|0,0,1]=3 8107 B9R0.5 CCOC(=O)CCCSC 62a_100009991533_200000210301 [1,1,0,0,0,0|0,1,1]=4 8108 B9R0.5 CCOC(=O)CCCSC 62a_200000210301_100009991533 [1,1,0,0,0,0|0,1,1]=4 8109 B9R0.5 CCOC(=O)CCCS[13CH3] 62a_100009991533_200025704644 [1,1,0,0,0,0|0,1,1]=4 8110 B9R0.5 CCOC(=O)CCCS[13CH3] 62a_200025704644_100009991533 [1,1,0,0,0,0|0,1,1]=4 8111 B9R0.5 CCOC(=O)CNCCO 2230a_100016997473_100000188475 [1,1,0,0,0,0|1,0,1]=4 8112 B9R0.5 CCOC(=O)CNCCO 34a_100016990907_100000188475 [1,1,0,0,0,0|1,0,1]=4 8113 B9R0.5 CCOC(=O)COCCBr 34a_100000211926_100000188475 [1,1,0,0,0,0|1,0,1]=4 8114 B9R0.5 CCOC(=O)COCCN 34a_100000210304_100000188475 [1,1,0,0,0,0|1,0,1]=4 8115 B9R0.5 CCOC(=O)CSCCO 62a_100000188475_100000211926 [1,1,0,0,0,0|0,1,1]=4 8116 B9R0.5 CCOC(=O)CSCCO 62a_100000211926_100000188475 [1,1,0,0,0,0|0,1,1]=4 8117 B9R0.5 CCOC(=O)CSCOC 62a_100000188475_100000766300 [1,1,0,0,0,0|0,1,1]=4 8118 B9R0.5 CCOC(=O)CSCOC 62a_100000766300_100000188475 [1,1,0,0,0,0|0,1,1]=4 8119 B9R0.5 CCOC(=O)NCCOC 34a_100000158857_200000210301 [1,1,0,0,0,0|1,0,1]=4 8120 B9R0.5 CCOC(=O)NCCO[13CH3] 34a_100000158857_200025704644 [1,1,0,0,0,0|1,0,1]=4 8121 B9R0.5 CCOC(C)CCCOC 34a_200011539412_100000210202 [1,1,0,0,0,0|0,0,0]=2 8122 B9R0.5 CCOC(C)CCCOC 7a_200011539412_100000210202 [1,1,0,0,0,0|0,0,0]=2 8123 B9R0.5 CCOCCC(=O)CCF 1458a_100000749530_100011217306 [1,1,0,0,0,0|2,0,0]=4 8124 B9R0.5 CCOCCC(=O)CCO 1458a_100000749530_100000211926 [1,1,0,0,0,0|1,0,0]=3 8125 B9R0.5 CCOCCC(=O)CCO 1458a_100011216618_100011215890 [1,1,0,0,0,0|1,0,0]=3 8126 B9R0.5 CCOCCC(=O)COC 1458a_100000210968_100011215890 [1,1,0,0,0,0|0,0,1]=3 8127 B9R0.5 CCOCCC(=O)CSC 1458a_100000184570_100011215890 [1,1,0,0,0,0|0,1,1]=4 8128 B9R0.5 CCOCCC(=O)OCC 34a_100121572206_100000765890 [1,1,0,0,0,0|2,0,0]=4 8129 B9R0.5 CCOCCN(C)CCO 2230a_100000210263_100011215890 [1,1,0,0,0,0|1,0,0]=3 8130 B9R0.5 CCOCCN(C)CCO 269982a_100000210263_100011215890 [1,1,0,0,0,0|1,0,0]=3 8131 B9R0.5 CCOCSC(C)CCO 62a_100000739092_100009893172 [1,1,0,0,0,0|2,0,0]=4 8132 B9R0.5 CCOCSC(C)CCO 62a_100009893172_100000739092 [1,1,0,0,0,0|2,0,0]=4 8133 B9R0.5 CCOCSC(C)COC 62a_100000739092_100000765312 [1,1,0,0,0,0|0,1,0]=3 8134 B9R0.5 CCOCSC(C)COC 62a_100000765312_100000739092 [1,1,0,0,0,0|0,1,0]=3 8135 B9R0.5 CCSCCC(=O)CCO 1458a_100000230768_100000211926 [1,1,0,0,0,0|1,1,0]=4 8136 B9R0.5 CCSCCC(=O)CCO 1458a_100011216618_100000757381 [1,1,0,0,0,0|1,1,0]=4 8137 B9R0.5 CCSCCC(=O)COC 1458a_100000210968_100000757381 [1,1,0,0,0,0|0,1,1]=4 8138 B9R0.5 CCSCCN(C)CCO 2230a_100000210263_100000757381 [1,1,0,0,0,0|1,1,0]=4 8139 B9R0.5 CCSCCN(C)CCO 269982a_100000210263_100000757381 [1,1,0,0,0,0|1,1,0]=4 8140 B9R0.5 CNCC(=O)OCCOC 2230a_106832991635_200000040189 [1,1,0,0,0,0|1,0,1]=4 8141 B9R0.5 CNCC(=O)OCCOC 34a_100102657272_200000040189 [1,1,0,0,0,0|1,0,1]=4 8142 B9R0.5 CNCC(=O)OCCOC 7a_106832991635_200000040189 [1,1,0,0,0,0|1,0,1]=4 8143 B9R0.5 COCC(C)NCCCF 2230a_100015189416_100000765312 [1,1,0,0,0,0|2,0,0]=4 8144 B9R0.5 COCC(C)NCCCF 270004a_100015189416_100000749346 [1,1,0,0,0,0|2,0,0]=4 8145 B9R0.5 COCC(C)NCCCF 34a_100015189416_100000765312 [1,1,0,0,0,0|2,0,0]=4 8146 B9R0.5 COCC(C)NCCCO 270004a_100000182051_100000749346 [1,1,0,0,0,0|2,0,0]=4 8147 B9R0.5 COCC(C)NCCSC 2230a_100020590264_100000765312 [1,1,0,0,0,0|1,1,0]=4 8148 B9R0.5 COCC(C)NCCSC 270004a_100020590264_100000749346 [1,1,0,0,0,0|1,1,0]=4 8149 B9R0.5 COCC(C)OCCCBr 34a_100011217188_100000765312 [1,1,0,0,0,0|1,0,0]=3 8150 B9R0.5 COCC(C)OCCCCl 34a_100000230001_100000765312 [1,1,0,0,0,0|1,0,0]=3 8151 B9R0.5 COCC(C)OCCCF 34a_100000759539_100000765312 [1,1,0,0,0,0|1,0,0]=3 8152 B9R0.5 COCC(C)OCCCN 34a_100000182051_100000765312 [1,1,0,0,0,0|1,0,0]=3 8153 B9R0.5 COCC(C)OCCON 34a_100000700252_100000765312 [1,1,0,0,0,0|1,0,0]=3 8154 B9R0.5 COCC(C)OCCSC 34a_100000230434_100000765312 [1,1,0,0,0,0|0,1,0]=3 8155 B9R0.5 COCC(C)OCCSC 7a_100000230434_100000765312 [1,1,0,0,0,0|0,1,0]=3 8156 B9R0.5 COCC(C)SCCCF 62a_100000765312_100011934791 [1,1,0,0,0,0|1,1,0]=4 8157 B9R0.5 COCC(C)SCCCF 62a_100011934791_100000765312 [1,1,0,0,0,0|1,1,0]=4 8158 B9R0.5 COCC(C)SCCCO 62a_100000765312_100011215043 [1,1,0,0,0,0|1,1,0]=4 8159 B9R0.5 COCC(C)SCCCO 62a_100011215043_100000765312 [1,1,0,0,0,0|1,1,0]=4 8160 B9R0.5 COCC(C)SCCSC 62a_100000212216_100000765312 [1,1,0,0,0,0|0,2,0]=4 8161 B9R0.5 COCC(C)SCCSC 62a_100000765312_100000751147 [1,1,0,0,0,0|0,2,0]=4 8162 B9R0.5 COCC(N)COCCO 34a_100000724102_100000211926 [1,1,0,0,0,0|2,0,0]=4 8163 B9R0.5 COCCCC(=O)COC 1458a_100000210968_100000740836 [1,1,0,0,0,0|1,0,1]=4 8164 B9R0.5 COCCCC(C)OCF 34a_200011539412_100015361967 [1,1,0,0,0,0|1,0,0]=3 8165 B9R0.5 COCCCC(C)OCF 7a_200011539412_100015361967 [1,1,0,0,0,0|1,0,0]=3 8166 B9R0.5 COCCCN(C)COC 2230a_100000224831_100000766300 [1,1,0,0,0,0|2,0,0]=4 8167 B9R0.5 COCCCN(C)COC 269982a_100000224831_100000766300 [1,1,0,0,0,0|2,0,0]=4 8168 B9R0.5 COCCNC(=O)COC 1626a_100000209980_100000210968 [1,1,0,0,0,0|1,0,1]=4 8169 B9R0.5 COCCNC(=O)COC 240690a_100000209980_100000210968 [1,1,0,0,0,0|1,0,1]=4 8170 B9R0.5 COCCNC(=O)COC 34a_100138415774_100000183275 [1,1,0,0,0,0|1,0,1]=4 8171 B9R0.5 COCCNC(=O)COC 527a_100000209980_100000210968 [1,1,0,0,0,0|1,0,1]=4 8172 B9R0.5 COCCNC(C)CCO 2230a_100000209980_100009893172 [1,1,0,0,0,0|2,0,0]=4 8173 B9R0.5 COCCNC(C)COC 2230a_100000209980_100000765312 [1,1,0,0,0,0|1,0,0]=3 8174 B9R0.5 COCCNC(C)COC 270004a_100000209980_100000749346 [1,1,0,0,0,0|1,0,0]=3 8175 B9R0.5 COCCNC(C)CSC 270004a_100000209980_100011216314 [1,1,0,0,0,0|1,1,0]=4 8176 B9R0.5 COCCN[C@H](C)CCO 2230a_100000706166_100011201679 [1,1,0,0,0,0|2,0,0]=4 8177 B9R0.5 COCCN[C@H](C)CCO 34a_100000706166_100011201679 [1,1,0,0,0,0|2,0,0]=4 8178 B9R0.5 COCCN[C@H](C)COC 2230a_100000764878_100011201679 [1,1,0,0,0,0|1,0,0]=3 8179 B9R0.5 COCCOC(=O)COC 34a_100138415774_200000040189 [1,1,0,0,0,0|0,0,1]=3 8180 B9R0.5 COCCOC(=O)CSC 62a_200000040189_200000210301 [1,1,0,0,0,0|0,1,1]=4 8181 B9R0.5 COCCOC(=O)CSC 62a_200000210301_200000040189 [1,1,0,0,0,0|0,1,1]=4 8182 B9R0.5 COCCOC(=O)CS[13CH3] 62a_200000040189_200025704644 [1,1,0,0,0,0|0,1,1]=4 8183 B9R0.5 COCCOC(=O)CS[13CH3] 62a_200025704644_200000040189 [1,1,0,0,0,0|0,1,1]=4 8184 B9R0.5 COCCOC(C)CCBr 34a_100012276601_100011201679 [1,1,0,0,0,0|1,0,0]=3 8185 B9R0.5 COCCOC(C)CCO 34a_100000210237_100009893172 [1,1,0,0,0,0|1,0,0]=3 8186 B9R0.5 COCCOC(C)COC 34a_100000210237_100000765312 [1,1,0,0,0,0|0,0,0]=2 8187 B9R0.5 COCCO[C@H](C)COC 34a_100011934205_100011201679 [1,1,0,0,0,0|0,0,0]=2 8188 B9R0.5 COCCSC(C)CCO 62a_100000233755_100009893172 [1,1,0,0,0,0|1,1,0]=4 8189 B9R0.5 COCCSC(C)CCO 62a_100009893172_100000233755 [1,1,0,0,0,0|1,1,0]=4 8190 B9R0.5 COCCSC(C)COC 62a_100000233755_100000765312 [1,1,0,0,0,0|0,1,0]=3 8191 B9R0.5 COCCSC(C)COC 62a_100000765312_100000233755 [1,1,0,0,0,0|0,1,0]=3 8192 B9R0.5 COCNCC(O)COC 2230a_100000756049_100000766300 [1,1,0,0,0,0|2,0,0]=4 8193 B9R0.5 COCSCC(O)COC 62a_100000766300_100011215053 [1,1,0,0,0,0|2,0,0]=4 8194 B9R0.5 COCSCC(O)COC 62a_100011215053_100000766300 [1,1,0,0,0,0|2,0,0]=4 8195 B9R0.5 COC[C@@H](C)NCCCF 2230a_100000764878_100011934791 [1,1,0,0,0,0|2,0,0]=4 8196 B9R0.5 COC[C@@H](C)NCCCO 2230a_100000764878_100000230001 [1,1,0,0,0,0|2,0,0]=4 8197 B9R0.5 COC[C@@H](C)NCCSC 2230a_100000764878_100000751147 [1,1,0,0,0,0|1,1,0]=4 8198 B9R0.5 COC[C@@H](C)OCCCF 34a_100011934205_100011934791 [1,1,0,0,0,0|1,0,0]=3 8199 B9R0.5 COC[C@@H](C)OCCCO 34a_100011934205_100000230001 [1,1,0,0,0,0|1,0,0]=3 8200 B9R0.5 COC[C@@H](C)OCCSC 34a_100011934205_100000212216 [1,1,0,0,0,0|0,1,0]=3 8201 B9R0.5 COC[C@@H](N)CCCCN 34a_100016993712_200000210301 [1,1,0,0,0,0|2,0,0]=4 8202 B9R0.5 CSCCOC(C)CCBr 34a_100012276601_100000212216 [1,1,0,0,0,0|1,1,0]=4 8203 B9R0.5 CSCCOC(C)CCO 34a_100000230434_100009893172 [1,1,0,0,0,0|1,1,0]=4 8204 B9R0.5 CSCCOC(C)CCO 7a_100000230434_100009893172 [1,1,0,0,0,0|1,1,0]=4 8205 B9R0.5 [13CH3]OC[C@@H](N)CCCCN 34a_100016993712_200025704644 [1,1,0,0,0,0|2,0,0]=4 8206 B9R0.18 C#CCOC(C)COCC 34a_100000718985_100000184674 [1,1,0,0,0,0|0,0,2]=4 8207 B9R0.18 C#CCOC(C)COCC 34a_200000093152_100000210202 [1,1,0,0,0,0|0,0,2]=4 8208 B9R0.18 C#CCOC(C)COCC 7a_100000718985_100000038162 [1,1,0,0,0,0|0,0,2]=4 8209 B9R0.18 C#CCOC(C)COCC 7a_200000093152_100000210202 [1,1,0,0,0,0|0,0,2]=4 8210 B9R0.18 C=C(COCC)OCOC 34a_100121572206_100000042856 [1,1,0,0,0,0|0,0,1]=3 8211 B9R0.18 C=C(CSCC)OCOC 62a_100000042856_100000210202 [1,1,0,0,0,0|0,1,1]=4 8212 B9R0.18 C=C(CSCC)OCOC 62a_100000210202_100000042856 [1,1,0,0,0,0|0,1,1]=4 8213 B9R0.18 C=CCOC(C)COCC 34a_100000718985_100015514636 [1,1,0,0,0,0|0,0,2]=4 8214 B9R0.18 C=CCOC(C)COCC 7a_100000718985_100015514636 [1,1,0,0,0,0|0,0,2]=4 8215 B9R0.18 CC(CCCCl)OCCO 34a_200000718107_100000211926 [1,1,0,0,0,0|2,0,0]=4 8216 B9R0.18 CC(CCCCl)OCCO 7a_200000718107_100000211926 [1,1,0,0,0,0|2,0,0]=4 8217 B9R0.18 CCC#CC(C)OCCC 34a_100000033903_100000210303 [1,1,0,0,0,0|1,0,1]=4 8218 B9R0.18 CCC#CC(C)OCCC 7a_100000033903_100000210303 [1,1,0,0,0,0|1,0,1]=4 8219 B9R0.18 CCC#CC(C)OCCO 34a_100000033903_100000211926 [1,1,0,0,0,0|1,0,1]=4 8220 B9R0.18 CCC#CC(C)OCCO 7a_100000033903_100000211926 [1,1,0,0,0,0|1,0,1]=4 8221 B9R0.18 CCCCC(=O)CCCC 1458a_100000210183_100000210211 [1,1,0,0,0,0|2,0,0]=4 8222 B9R0.18 CCCCC(=O)CCOC 1458a_100000210183_100000233755 [1,1,0,0,0,0|1,0,0]=3 8223 B9R0.18 CCCCC(=O)CCOC 1458a_100000749529_100000210211 [1,1,0,0,0,0|1,0,0]=3 8224 B9R0.18 CCCCC(=O)CCSC 1458a_100000174002_100000210211 [1,1,0,0,0,0|1,1,0]=4 8225 B9R0.18 CCCCC(=O)CCSC 1458a_100000210183_100000751147 [1,1,0,0,0,0|1,1,0]=4 8226 B9R0.18 CCCCC(=O)COCC 1458a_100000211967_100000210211 [1,1,0,0,0,0|1,0,1]=4 8227 B9R0.18 CCCCC(C)COCC 34a_100011995851_100000210202 [1,1,0,0,0,0|1,0,0]=3 8228 B9R0.18 CCCCC(C)COCC 7a_100011995851_100000210202 [1,1,0,0,0,0|1,0,0]=3 8229 B9R0.18 CCCCC(C)COCF 34a_100011995851_100015361967 [1,1,0,0,0,0|2,0,0]=4 8230 B9R0.18 CCCCC(C)COCF 7a_100011995851_100015361967 [1,1,0,0,0,0|2,0,0]=4 8231 B9R0.18 CCCCC(C)NCCC 2230a_100000126638_100000210303 [1,1,0,0,0,0|2,0,0]=4 8232 B9R0.18 CCCCC(C)NCCC 270004a_100020643023_100000210087 [1,1,0,0,0,0|2,0,0]=4 8233 B9R0.18 CCCCC(C)NCCO 2230a_100000126638_100000211926 [1,1,0,0,0,0|2,0,0]=4 8234 B9R0.18 CCCCC(C)NCCO 2230a_100016997473_200011215066 [1,1,0,0,0,0|2,0,0]=4 8235 B9R0.18 CCCCC(C)NCCO 270004a_100000210304_100000210087 [1,1,0,0,0,0|2,0,0]=4 8236 B9R0.18 CCCCC(C)NCCO 34a_100016990907_200011215066 [1,1,0,0,0,0|2,0,0]=4 8237 B9R0.18 CCCCC(C)NCOC 2230a_100000126638_100000766300 [1,1,0,0,0,0|2,0,0]=4 8238 B9R0.18 CCCCC(C)OCCBr 34a_100000211926_200011215066 [1,1,0,0,0,0|2,0,0]=4 8239 B9R0.18 CCCCC(C)OCCC 34a_100000210258_200011215066 [1,1,0,0,0,0|1,0,0]=3 8240 B9R0.18 CCCCC(C)OCCC 34a_100000687866_100000210303 [1,1,0,0,0,0|1,0,0]=3 8241 B9R0.18 CCCCC(C)OCCC 7a_100000687866_100000210303 [1,1,0,0,0,0|1,0,0]=3 8242 B9R0.18 CCCCC(C)OCCF 34a_100000687866_100011217306 [1,1,0,0,0,0|2,0,0]=4 8243 B9R0.18 CCCCC(C)OCCF 7a_100000687866_100011217306 [1,1,0,0,0,0|2,0,0]=4 8244 B9R0.18 CCCCC(C)OCCN 34a_100000210304_200011215066 [1,1,0,0,0,0|2,0,0]=4 8245 B9R0.18 CCCCC(C)OCCO 34a_100000687866_100000211926 [1,1,0,0,0,0|1,0,0]=3 8246 B9R0.18 CCCCC(C)OCCO 7a_100000687866_100000211926 [1,1,0,0,0,0|1,0,0]=3 8247 B9R0.18 CCCCC(C)OCSC 34a_100000687866_100011218213 [1,1,0,0,0,0|1,1,0]=4 8248 B9R0.18 CCCCC(C)SCCC 62a_100000210303_200011215066 [1,1,0,0,0,0|1,1,0]=4 8249 B9R0.18 CCCCC(C)SCCC 62a_200011215066_100000210303 [1,1,0,0,0,0|1,1,0]=4 8250 B9R0.18 CCCCC(C)SCCO 62a_100000211926_200011215066 [1,1,0,0,0,0|1,1,0]=4 8251 B9R0.18 CCCCC(C)SCCO 62a_200011215066_100000211926 [1,1,0,0,0,0|1,1,0]=4 8252 B9R0.18 CCCCC(C)SCOC 62a_100000766300_200011215066 [1,1,0,0,0,0|1,1,0]=4 8253 B9R0.18 CCCCC(C)SCOC 62a_200011215066_100000766300 [1,1,0,0,0,0|1,1,0]=4 8254 B9R0.18 CCCCN(C)CCCC 2230a_100000207549_100000210211 [1,1,0,0,0,0|2,0,0]=4 8255 B9R0.18 CCCCN(C)CCCC 2230a_100000684618_200000210301 [1,1,0,0,0,0|2,0,0]=4 8256 B9R0.18 CCCCN(C)CCCC 269982a_100000207549_100000210211 [1,1,0,0,0,0|2,0,0]=4 8257 B9R0.18 CCCCN(C)CCCC 269982a_100000684618_200000210301 [1,1,0,0,0,0|2,0,0]=4 8258 B9R0.18 CCCCN(C)CCOC 2230a_100000207391_200000210301 [1,1,0,0,0,0|1,0,0]=3 8259 B9R0.18 CCCCN(C)CCOC 2230a_100000207549_100011201679 [1,1,0,0,0,0|1,0,0]=3 8260 B9R0.18 CCCCN(C)CCOC 2230a_100000743101_100000210211 [1,1,0,0,0,0|1,0,0]=3 8261 B9R0.18 CCCCN(C)CCOC 269982a_100000207391_200000210301 [1,1,0,0,0,0|1,0,0]=3 8262 B9R0.18 CCCCN(C)CCOC 269982a_100000207549_100000233755 [1,1,0,0,0,0|1,0,0]=3 8263 B9R0.18 CCCCN(C)CCOC 269982a_100000743101_100000210211 [1,1,0,0,0,0|1,0,0]=3 8264 B9R0.18 CCCCN(C)CCSC 2230a_100000207549_100000751147 [1,1,0,0,0,0|1,1,0]=4 8265 B9R0.18 CCCCN(C)CCSC 2230a_100000686725_100000210211 [1,1,0,0,0,0|1,1,0]=4 8266 B9R0.18 CCCCN(C)CCSC 269982a_100000207549_100000212216 [1,1,0,0,0,0|1,1,0]=4 8267 B9R0.18 CCCCN(C)CCSC 269982a_100000686725_100000210211 [1,1,0,0,0,0|1,1,0]=4 8268 B9R0.18 CCCCN(C)COCC 269982a_100000207549_100000739092 [1,1,0,0,0,0|2,0,0]=4 8269 B9R0.18 CCCCN([13CH3])CCCC 2230a_100000684618_200025704644 [1,1,0,0,0,0|2,0,0]=4 8270 B9R0.18 CCCCN([13CH3])CCCC 269982a_100000684618_200025704644 [1,1,0,0,0,0|2,0,0]=4 8271 B9R0.18 CCCCN([13CH3])CCOC 2230a_100000207391_200025704644 [1,1,0,0,0,0|1,0,0]=3 8272 B9R0.18 CCCCN([13CH3])CCOC 269982a_100000207391_200025704644 [1,1,0,0,0,0|1,0,0]=3 8273 B9R0.18 CCCC[C@H](N)COCC 34a_100011934283_100000210202 [1,1,0,0,0,0|1,0,0]=3 8274 B9R0.18 CCCC[C@H](N)COCF 34a_100011934283_100015361967 [1,1,0,0,0,0|2,0,0]=4 8275 B9R0.18 CCCNC(=O)CCOC 11a_100020643023_100000749529 [1,1,0,0,0,0|2,0,0]=4 8276 B9R0.18 CCCNC(=O)CCOC 1626a_100020643023_100000749529 [1,1,0,0,0,0|2,0,0]=4 8277 B9R0.18 CCCNC(=O)CCOC 240690a_100020643023_100000749529 [1,1,0,0,0,0|2,0,0]=4 8278 B9R0.18 CCCNC(=O)CCOC 527a_100020643023_100000749529 [1,1,0,0,0,0|2,0,0]=4 8279 B9R0.18 CCCNC(=O)COCC 11a_100020643023_100000211967 [1,1,0,0,0,0|1,0,1]=4 8280 B9R0.18 CCCNC(=O)COCC 1626a_100020643023_100000211967 [1,1,0,0,0,0|1,0,1]=4 8281 B9R0.18 CCCNC(=O)COCC 240690a_100020643023_100000211967 [1,1,0,0,0,0|1,0,1]=4 8282 B9R0.18 CCCNC(=O)COCC 34a_100121572206_100000183358 [1,1,0,0,0,0|1,0,1]=4 8283 B9R0.18 CCCNC(=O)COCC 527a_100020643023_100000211967 [1,1,0,0,0,0|1,0,1]=4 8284 B9R0.18 CCCNC(C)CCOC 270004a_100020643023_100000742357 [1,1,0,0,0,0|2,0,0]=4 8285 B9R0.18 CCCNC(C)CSCC 270004a_100020643023_200011216171 [1,1,0,0,0,0|1,1,0]=4 8286 B9R0.18 CCCOC(=O)CNCC 2230a_100015525214_200011215008 [1,1,0,0,0,0|1,0,1]=4 8287 B9R0.18 CCCOC(=O)COCC 34a_100121572206_200011215008 [1,1,0,0,0,0|0,0,1]=3 8288 B9R0.18 CCCOC(=O)CSCC 62a_100000210202_200011215008 [1,1,0,0,0,0|0,1,1]=4 8289 B9R0.18 CCCOC(=O)CSCC 62a_200011215008_100000210202 [1,1,0,0,0,0|0,1,1]=4 8290 B9R0.18 CCCOC(C)CCCCl 34a_200000718107_100000210303 [1,1,0,0,0,0|2,0,0]=4 8291 B9R0.18 CCCOC(C)CCCCl 7a_200000718107_100000210303 [1,1,0,0,0,0|2,0,0]=4 8292 B9R0.18 CCCOC(C)CNCC 2230a_100015185124_100000210202 [1,1,0,0,0,0|1,0,0]=3 8293 B9R0.18 CCCOC(C)CNCC 34a_100015185124_100000210202 [1,1,0,0,0,0|1,0,0]=3 8294 B9R0.18 CCCOC(C)CNCF 34a_100015185124_100015361967 [1,1,0,0,0,0|2,0,0]=4 8295 B9R0.18 CCCOC(C)COCC 34a_100000718985_100000210303 [1,1,0,0,0,0|0,0,0]=2 8296 B9R0.18 CCCOC(C)COCC 7a_100000718985_100000210303 [1,1,0,0,0,0|0,0,0]=2 8297 B9R0.18 CCNCC(O)COCC 2230a_102515437182_100000210202 [1,1,0,0,0,0|2,0,0]=4 8298 B9R0.18 CCNCC(O)COCC 34a_102515437182_100000210202 [1,1,0,0,0,0|2,0,0]=4 8299 B9R0.18 CCNC[C@H](C)CCCO 2230a_100160569302_100000210202 [1,1,0,0,0,0|2,0,0]=4 8300 B9R0.18 CCNC[C@H](C)CCCO 34a_100160569302_100000210202 [1,1,0,0,0,0|2,0,0]=4 8301 B9R0.18 CCOCC(=O)CCCO 1458a_100000211967_100011215043 [1,1,0,0,0,0|1,0,1]=4 8302 B9R0.18 CCOCC(=O)CCOC 1458a_100000211967_100000233755 [1,1,0,0,0,0|0,0,1]=3 8303 B9R0.18 CCOCC(=O)CCSC 1458a_100000211967_100000751147 [1,1,0,0,0,0|0,1,1]=4 8304 B9R0.18 CCOCC(=O)NCCO 240690a_100000210304_100000211967 [1,1,0,0,0,0|1,0,1]=4 8305 B9R0.18 CCOCC(=O)NCCO 527a_100000210304_100000211967 [1,1,0,0,0,0|1,0,1]=4 8306 B9R0.18 CCOCC(C)OCC#N 7a_100000718985_100011215382 [1,1,0,0,0,0|1,0,1]=4 8307 B9R0.18 CCOCC(C)OCC=O 34a_100000718985_200009817547 [1,1,0,0,0,0|0,0,2]=4 8308 B9R0.18 CCOCC(C)OCC=O 7a_100000718985_200015260668 [1,1,0,0,0,0|0,0,2]=4 8309 B9R0.18 CCOCC(C)OCCF 34a_100000718985_100011217306 [1,1,0,0,0,0|1,0,0]=3 8310 B9R0.18 CCOCC(C)OCCF 7a_100000718985_100011217306 [1,1,0,0,0,0|1,0,0]=3 8311 B9R0.18 CCOCC(C)OCCO 34a_100000718985_100000211926 [1,1,0,0,0,0|0,0,0]=2 8312 B9R0.18 CCOCC(C)OCCO 7a_100000718985_100000211926 [1,1,0,0,0,0|0,0,0]=2 8313 B9R0.18 CCOCC(C)OCSC 34a_100000718985_100011218213 [1,1,0,0,0,0|0,1,0]=3 8314 B9R0.18 CCOCN(C)CCCO 269982a_100000213112_100000739092 [1,1,0,0,0,0|2,0,0]=4 8315 B9R0.18 CCOCN(C)CCOC 269982a_100000743101_100000739092 [1,1,0,0,0,0|1,0,0]=3 8316 B9R0.18 CCOCN(C)CCSC 269982a_100000686725_100000739092 [1,1,0,0,0,0|1,1,0]=4 8317 B9R0.18 CCOC[C@@H](C)OCOC 34a_100016172286_100000210202 [1,1,0,0,0,0|0,0,0]=2 8318 B9R0.18 CCOC[C@@H](C)OCOC 7a_100016172286_100000210202 [1,1,0,0,0,0|0,0,0]=2 8319 B9R0.18 CCOC[C@@H](N)CCSC 34a_100011827619_100000210202 [1,1,0,0,0,0|0,1,0]=3 8320 B9R0.18 CCSCC(=O)CCOC 1458a_100000230394_100000233755 [1,1,0,0,0,0|0,1,1]=4 8321 B9R0.18 CCSCC(C)NCCO 270004a_100000210304_200011216171 [1,1,0,0,0,0|1,1,0]=4 8322 B9R0.18 COCCC(=O)CCCF 1458a_100000749529_100011934791 [1,1,0,0,0,0|2,0,0]=4 8323 B9R0.18 COCCC(=O)CCCO 1458a_100000749529_100011215043 [1,1,0,0,0,0|2,0,0]=4 8324 B9R0.18 COCCC(=O)CCOC 1458a_100000749529_100000233755 [1,1,0,0,0,0|1,0,0]=3 8325 B9R0.18 COCCC(=O)CCSC 1458a_100000174002_100000233755 [1,1,0,0,0,0|1,1,0]=4 8326 B9R0.18 COCCC(=O)CCSC 1458a_100000749529_100000751147 [1,1,0,0,0,0|1,1,0]=4 8327 B9R0.18 COCCN(C)CCCF 2230a_100000743101_100011934791 [1,1,0,0,0,0|2,0,0]=4 8328 B9R0.18 COCCN(C)CCCF 269982a_100000743101_100011934791 [1,1,0,0,0,0|2,0,0]=4 8329 B9R0.18 COCCN(C)CCCO 2230a_100000213112_100011201679 [1,1,0,0,0,0|2,0,0]=4 8330 B9R0.18 COCCN(C)CCCO 2230a_100000743101_100000230001 [1,1,0,0,0,0|2,0,0]=4 8331 B9R0.18 COCCN(C)CCCO 269982a_100000213112_100000233755 [1,1,0,0,0,0|2,0,0]=4 8332 B9R0.18 COCCN(C)CCCO 269982a_100000743101_100011215043 [1,1,0,0,0,0|2,0,0]=4 8333 B9R0.18 COCCN(C)CCOC 2230a_100000210589_200000210301 [1,1,0,0,0,0|1,0,0]=3 8334 B9R0.18 COCCN(C)CCOC 2230a_100000743101_100011201679 [1,1,0,0,0,0|1,0,0]=3 8335 B9R0.18 COCCN(C)CCOC 269982a_100000210589_200000210301 [1,1,0,0,0,0|1,0,0]=3 8336 B9R0.18 COCCN(C)CCOC 269982a_100000743101_100000233755 [1,1,0,0,0,0|1,0,0]=3 8337 B9R0.18 COCCN(C)CCSC 2230a_100000686725_100011201679 [1,1,0,0,0,0|1,1,0]=4 8338 B9R0.18 COCCN(C)CCSC 2230a_100000743101_100000751147 [1,1,0,0,0,0|1,1,0]=4 8339 B9R0.18 COCCN(C)CCSC 269982a_100000686725_100000233755 [1,1,0,0,0,0|1,1,0]=4 8340 B9R0.18 COCCN(C)CCSC 269982a_100000743101_100000212216 [1,1,0,0,0,0|1,1,0]=4 8341 B9R0.18 COCCN([13CH3])CCOC 2230a_100000210589_200025704644 [1,1,0,0,0,0|1,0,0]=3 8342 B9R0.18 COCCN([13CH3])CCOC 269982a_100000210589_200025704644 [1,1,0,0,0,0|1,0,0]=3 8343 B9R0.18 COCO[C@H](C)COCF 34a_100016172286_100015361967 [1,1,0,0,0,0|1,0,0]=3 8344 B9R0.18 COCO[C@H](C)COCF 7a_100016172286_100015361967 [1,1,0,0,0,0|1,0,0]=3 8345 B9R0.18 CSCC[C@H](N)COCF 34a_100011827619_100015361967 [1,1,0,0,0,0|1,1,0]=4 8346 B9R0.46 C#CC(C)OCCOCC 34a_100000210136_200000035995 [1,1,0,0,0,0|0,0,2]=4 8347 B9R0.46 C#CCCOCC(C)CC 34a_100011215631_100000748023 [1,1,0,0,0,0|1,0,1]=4 8348 B9R0.46 C#CCCOCC(C)OC 34a_100000690652_100000688953 [1,1,0,0,0,0|0,0,2]=4 8349 B9R0.46 C#CCCOCC(O)CC 34a_100011215631_100011218378 [1,1,0,0,0,0|1,0,1]=4 8350 B9R0.46 C#CCCOC[C@@H](C)CC 34a_100011215631_100009816398 [1,1,0,0,0,0|1,0,1]=4 8351 B9R0.46 C#CCCOC[C@@H](C)CC 7a_100009816381_100000688953 [1,1,0,0,0,0|1,0,1]=4 8352 B9R0.46 C#C[C@@H](C)OCCOCC 34a_100009815206_100000210147 [1,1,0,0,0,0|0,0,2]=4 8353 B9R0.46 C#C[C@@H](C)OCCOCC 7a_100009815206_100011215890 [1,1,0,0,0,0|0,0,2]=4 8354 B9R0.46 C/C=C/CCOC(C)CC 34a_100016278192_100011215416 [1,1,0,0,0,0|1,0,1]=4 8355 B9R0.46 C/C=C/CCOC(C)CO 34a_100016278192_100012180447 [1,1,0,0,0,0|1,0,1]=4 8356 B9R0.46 C/C=C/COCC(C)CC 34a_100016270725_100000748023 [1,1,0,0,0,0|1,0,1]=4 8357 B9R0.46 C/C=C/COCC(C)OC 34a_100000690652_100102629194 [1,1,0,0,0,0|0,0,2]=4 8358 B9R0.46 C/C=C/COCC(O)CC 34a_100016270725_100011218378 [1,1,0,0,0,0|1,0,1]=4 8359 B9R0.46 C/C=C/COC[C@@H](C)CC 34a_100016270725_100009816398 [1,1,0,0,0,0|1,0,1]=4 8360 B9R0.46 C/C=C/COC[C@@H](C)CC 7a_100009816381_100102629194 [1,1,0,0,0,0|1,0,1]=4 8361 B9R0.46 C=CC(C)COCCCC 34a_100011215527_100000210210 [1,1,0,0,0,0|1,0,1]=4 8362 B9R0.46 C=CC(C)COCCCC 7a_100011215527_100000210211 [1,1,0,0,0,0|1,0,1]=4 8363 B9R0.46 C=CC(C)COCCOC 34a_100011215527_100011201679 [1,1,0,0,0,0|0,0,2]=4 8364 B9R0.46 C=CC(C)COCCOC 7a_100011215527_100000233755 [1,1,0,0,0,0|0,0,2]=4 8365 B9R0.46 C=CC(C)OCCOCC 34a_100000695699_100000210147 [1,1,0,0,0,0|0,0,2]=4 8366 B9R0.46 C=CC(O)COCCCC 34a_100000210227_100000730141 [1,1,0,0,0,0|1,0,1]=4 8367 B9R0.46 C=CC(O)COCCCC 7a_100000210227_100000730141 [1,1,0,0,0,0|1,0,1]=4 8368 B9R0.46 C=CC(O)COCCOC 34a_100000210237_100000730141 [1,1,0,0,0,0|0,0,2]=4 8369 B9R0.46 C=CCCOCC(C)CC 34a_100011205117_100000748023 [1,1,0,0,0,0|1,0,1]=4 8370 B9R0.46 C=CCCOCC(C)OC 34a_100000690652_100000754431 [1,1,0,0,0,0|0,0,2]=4 8371 B9R0.46 C=CCCOCC(O)CC 34a_100011205117_100011218378 [1,1,0,0,0,0|1,0,1]=4 8372 B9R0.46 C=CCCOC[C@@H](C)CC 34a_100011205117_100009816398 [1,1,0,0,0,0|1,0,1]=4 8373 B9R0.46 C=CCCOC[C@@H](C)CC 7a_100009816381_100000754431 [1,1,0,0,0,0|1,0,1]=4 8374 B9R0.46 C=COCCOC(C)CC 34a_100000033082_100011215416 [1,1,0,0,0,0|0,0,2]=4 8375 B9R0.46 C=COCCOC(C)CC 7a_100000210228_100000039644 [1,1,0,0,0,0|0,0,2]=4 8376 B9R0.46 C=COCCOC(C)CO 34a_100000033082_100012180447 [1,1,0,0,0,0|0,0,2]=4 8377 B9R0.46 C=C[C@H](N)COCCCC 34a_100016989147_100000210210 [1,1,0,0,0,0|1,0,1]=4 8378 B9R0.46 C=C[C@H](N)COCCOC 34a_100016989147_100011201679 [1,1,0,0,0,0|0,0,2]=4 8379 B9R0.46 CC#CCCOC(C)CC 34a_100000750427_100011215416 [1,1,0,0,0,0|1,0,1]=4 8380 B9R0.46 CC#CCCOC(C)CO 34a_100000750427_100012180447 [1,1,0,0,0,0|1,0,1]=4 8381 B9R0.46 CC#CCOCC(C)CC 34a_100000761923_100000748023 [1,1,0,0,0,0|1,0,1]=4 8382 B9R0.46 CC#CCOCC(C)OC 34a_100000690652_100000748600 [1,1,0,0,0,0|0,0,2]=4 8383 B9R0.46 CC#CCOCC(O)CC 34a_100000761923_100011218378 [1,1,0,0,0,0|1,0,1]=4 8384 B9R0.46 CC#CCOC[C@@H](C)CC 34a_100000761923_100009816398 [1,1,0,0,0,0|1,0,1]=4 8385 B9R0.46 CC#CCOC[C@@H](C)CC 7a_100009816381_100000748600 [1,1,0,0,0,0|1,0,1]=4 8386 B9R0.46 CC(CO)OCCCCBr 34a_100011216708_100012180447 [1,1,0,0,0,0|2,0,0]=4 8387 B9R0.46 CC(CO)OCCCCCl 34a_100000210776_100012180447 [1,1,0,0,0,0|2,0,0]=4 8388 B9R0.46 CC(CO)OCCCCCl 7a_100000210776_100012180447 [1,1,0,0,0,0|2,0,0]=4 8389 B9R0.46 CC(CO)OCCCCF 34a_100011995726_100012180447 [1,1,0,0,0,0|2,0,0]=4 8390 B9R0.46 CC(CO)OCCCCF 7a_100011995726_100012180447 [1,1,0,0,0,0|2,0,0]=4 8391 B9R0.46 CC(CO)OCCCCI 34a_200012148704_100012180447 [1,1,0,0,0,0|2,0,0]=4 8392 B9R0.46 CC(CO)OCCCCN 34a_100000750430_100012180447 [1,1,0,0,0,0|2,0,0]=4 8393 B9R0.46 CC/C=C\COC(C)CC 34a_100016268518_100011215416 [1,1,0,0,0,0|1,0,1]=4 8394 B9R0.46 CC/C=C\COC(C)CC 7a_100000210228_100103147603 [1,1,0,0,0,0|1,0,1]=4 8395 B9R0.46 CC/C=C\COC(C)CO 34a_100016268518_100012180447 [1,1,0,0,0,0|1,0,1]=4 8396 B9R0.46 CC=CCOCC(C)OC 34a_100000690652_100000070051 [1,1,0,0,0,0|0,0,2]=4 8397 B9R0.46 CC=CCOC[C@@H](C)CC 7a_100009816381_100000070051 [1,1,0,0,0,0|1,0,1]=4 8398 B9R0.46 CCC#CCOC(C)CC 34a_100000032950_100011215416 [1,1,0,0,0,0|1,0,1]=4 8399 B9R0.46 CCC#CCOC(C)CC 7a_100000210228_100009813939 [1,1,0,0,0,0|1,0,1]=4 8400 B9R0.46 CCC#CCOC(C)CO 34a_100000032950_100012180447 [1,1,0,0,0,0|1,0,1]=4 8401 B9R0.46 CCC(=O)CCCCCO 1458a_100000210414_100000746330 [1,1,0,0,0,0|2,0,0]=4 8402 B9R0.46 CCC(=O)CCCCCO 1458a_100102619762_100000210202 [1,1,0,0,0,0|2,0,0]=4 8403 B9R0.46 CCC(=O)CCCCOC 1458a_100000210414_100000755781 [1,1,0,0,0,0|1,0,0]=3 8404 B9R0.46 CCC(=O)CCOCCO 1458a_100000210414_100011215305 [1,1,0,0,0,0|1,0,0]=3 8405 B9R0.46 CCC(=O)CCOCCO 1458a_100011229844_100000210202 [1,1,0,0,0,0|1,0,0]=3 8406 B9R0.46 CCC(=O)COCCOC 1458a_100000211095_100000210202 [1,1,0,0,0,0|0,0,1]=3 8407 B9R0.46 CCC(=O)COCCOC 34a_100000725409_100011201679 [1,1,0,0,0,0|0,0,1]=3 8408 B9R0.46 CCC(=O)COCCSC 34a_100000725409_100000212216 [1,1,0,0,0,0|0,1,1]=4 8409 B9R0.46 CCC(=O)COCCSC 7a_100000230434_100000747405 [1,1,0,0,0,0|0,1,1]=4 8410 B9R0.46 CCC(=O)CSCCOC 62a_100000233755_100000747405 [1,1,0,0,0,0|0,1,1]=4 8411 B9R0.46 CCC(=O)CSCCOC 62a_100000747405_100000233755 [1,1,0,0,0,0|0,1,1]=4 8412 B9R0.46 CCC(=O)NCCCOC 1626a_100150723488_100000210414 [1,1,0,0,0,0|2,0,0]=4 8413 B9R0.46 CCC(=O)NCCCOC 240690a_100150723488_100000210414 [1,1,0,0,0,0|2,0,0]=4 8414 B9R0.46 CCC(=O)NCCCOC 527a_100150723488_100000210414 [1,1,0,0,0,0|2,0,0]=4 8415 B9R0.46 CCC(=O)OCCOCF 7a_200000031056_100015361967 [1,1,0,0,0,0|1,0,1]=4 8416 B9R0.46 CCC(C)CCCOCF 7a_100011216074_100015361967 [1,1,0,0,0,0|2,0,0]=4 8417 B9R0.46 CCC(C)CCNCCO 2230a_100020591266_100000211926 [1,1,0,0,0,0|2,0,0]=4 8418 B9R0.46 CCC(C)CCNCOC 2230a_100020591266_100000766300 [1,1,0,0,0,0|2,0,0]=4 8419 B9R0.46 CCC(C)CCOCCF 7a_100011215188_100011217306 [1,1,0,0,0,0|2,0,0]=4 8420 B9R0.46 CCC(C)CCOCCO 7a_100011215188_100000211926 [1,1,0,0,0,0|1,0,0]=3 8421 B9R0.46 CCC(C)CNCCOC 2230a_100000209980_100000748023 [1,1,0,0,0,0|1,0,0]=3 8422 B9R0.46 CCC(C)CNCCOC 2230a_100020588543_100011201679 [1,1,0,0,0,0|1,0,0]=3 8423 B9R0.46 CCC(C)CNCCOC 270004a_100000209980_100000243153 [1,1,0,0,0,0|1,0,0]=3 8424 B9R0.46 CCC(C)CNCCSC 2230a_100020588543_100000751147 [1,1,0,0,0,0|1,1,0]=4 8425 B9R0.46 CCC(C)CNCCSC 2230a_100020590264_100000748023 [1,1,0,0,0,0|1,1,0]=4 8426 B9R0.46 CCC(C)CNCCSC 270004a_100020590264_100000243153 [1,1,0,0,0,0|1,1,0]=4 8427 B9R0.46 CCC(C)COCCCBr 34a_100011217188_100000748023 [1,1,0,0,0,0|2,0,0]=4 8428 B9R0.46 CCC(C)COCCCCl 34a_100000230001_100000748023 [1,1,0,0,0,0|2,0,0]=4 8429 B9R0.46 CCC(C)COCCCF 34a_100000759539_100000748023 [1,1,0,0,0,0|2,0,0]=4 8430 B9R0.46 CCC(C)COCCCN 34a_100000182051_100000748023 [1,1,0,0,0,0|2,0,0]=4 8431 B9R0.46 CCC(C)COCCOC 34a_100000210237_100000748023 [1,1,0,0,0,0|0,0,0]=2 8432 B9R0.46 CCC(C)COCCON 34a_100000700252_100000748023 [1,1,0,0,0,0|1,0,0]=3 8433 B9R0.46 CCC(C)COCCSC 34a_100000230434_100000748023 [1,1,0,0,0,0|0,1,0]=3 8434 B9R0.46 CCC(C)COCCSC 7a_100000230434_100000748023 [1,1,0,0,0,0|0,1,0]=3 8435 B9R0.46 CCC(C)CSCCOC 62a_100000233755_100000748023 [1,1,0,0,0,0|0,1,0]=3 8436 B9R0.46 CCC(C)CSCCOC 62a_100000748023_100000233755 [1,1,0,0,0,0|0,1,0]=3 8437 B9R0.46 CCC(C)CSCCSC 62a_100000212216_100000748023 [1,1,0,0,0,0|0,2,0]=4 8438 B9R0.46 CCC(C)CSCCSC 62a_100000748023_100000751147 [1,1,0,0,0,0|0,2,0]=4 8439 B9R0.46 CCC(C)NCCCOC 2230a_100000209981_100000740836 [1,1,0,0,0,0|2,0,0]=4 8440 B9R0.46 CCC(C)NCCCOC 34a_100150723488_100011215416 [1,1,0,0,0,0|2,0,0]=4 8441 B9R0.46 CCC(C)OCCCCBr 34a_100011216708_100011215416 [1,1,0,0,0,0|2,0,0]=4 8442 B9R0.46 CCC(C)OCCCCCl 34a_100000210776_100011215416 [1,1,0,0,0,0|2,0,0]=4 8443 B9R0.46 CCC(C)OCCCCCl 7a_100000210776_100000758301 [1,1,0,0,0,0|2,0,0]=4 8444 B9R0.46 CCC(C)OCCCCF 34a_100011995726_100011215416 [1,1,0,0,0,0|2,0,0]=4 8445 B9R0.46 CCC(C)OCCCCF 7a_100000210228_100000729493 [1,1,0,0,0,0|2,0,0]=4 8446 B9R0.46 CCC(C)OCCCCF 7a_100011995726_100000758301 [1,1,0,0,0,0|2,0,0]=4 8447 B9R0.46 CCC(C)OCCCCI 34a_200012148704_100011215416 [1,1,0,0,0,0|2,0,0]=4 8448 B9R0.46 CCC(C)OCCCCN 34a_100000750430_100011215416 [1,1,0,0,0,0|2,0,0]=4 8449 B9R0.46 CCC(C)OCCCCO 7a_100000210228_100000210776 [1,1,0,0,0,0|2,0,0]=4 8450 B9R0.46 CCC(C)OCCCNC 34a_100000213112_100011215416 [1,1,0,0,0,0|2,0,0]=4 8451 B9R0.46 CCC(C)OCCCOC 34a_100000740835_100011215416 [1,1,0,0,0,0|2,0,0]=4 8452 B9R0.46 CCC(C)OCCCOC 7a_100000210228_100000740836 [1,1,0,0,0,0|2,0,0]=4 8453 B9R0.46 CCC(C)OCCCSC 34a_100000690336_100011215416 [1,1,0,0,0,0|2,0,0]=4 8454 B9R0.46 CCC(C)OCCCSC 7a_100000690336_100000758301 [1,1,0,0,0,0|2,0,0]=4 8455 B9R0.46 CCC(C)SCCCOC 62a_100000709357_100000758301 [1,1,0,0,0,0|2,0,0]=4 8456 B9R0.46 CCC(C)SCCCOC 62a_100000758301_100000709357 [1,1,0,0,0,0|2,0,0]=4 8457 B9R0.46 CCC(O)CNCCOC 2230a_100000209980_100011218378 [1,1,0,0,0,0|1,0,0]=3 8458 B9R0.46 CCC(O)CNCCOC 2230a_100011218483_100011201679 [1,1,0,0,0,0|1,0,0]=3 8459 B9R0.46 CCC(O)CNCCSC 2230a_100011218483_100000751147 [1,1,0,0,0,0|1,1,0]=4 8460 B9R0.46 CCC(O)CNCCSC 2230a_100020590264_100011218378 [1,1,0,0,0,0|1,1,0]=4 8461 B9R0.46 CCC(O)COCCCBr 34a_100011217188_100011218378 [1,1,0,0,0,0|2,0,0]=4 8462 B9R0.46 CCC(O)COCCCCl 34a_100000230001_100011218378 [1,1,0,0,0,0|2,0,0]=4 8463 B9R0.46 CCC(O)COCCCF 34a_100000759539_100011218378 [1,1,0,0,0,0|2,0,0]=4 8464 B9R0.46 CCC(O)COCCCN 34a_100000182051_100011218378 [1,1,0,0,0,0|2,0,0]=4 8465 B9R0.46 CCC(O)COCCOC 34a_100000210237_100011218378 [1,1,0,0,0,0|0,0,0]=2 8466 B9R0.46 CCC(O)COCCON 34a_100000700252_100011218378 [1,1,0,0,0,0|1,0,0]=3 8467 B9R0.46 CCC(O)COCCSC 34a_100000230434_100011218378 [1,1,0,0,0,0|0,1,0]=3 8468 B9R0.46 CCC(O)COCCSC 7a_100000230434_100011218378 [1,1,0,0,0,0|0,1,0]=3 8469 B9R0.46 CCC(O)CSCCOC 62a_100000233755_100011218378 [1,1,0,0,0,0|0,1,0]=3 8470 B9R0.46 CCC(O)CSCCOC 62a_100011218378_100000233755 [1,1,0,0,0,0|0,1,0]=3 8471 B9R0.46 CCC(O)CSCCSC 62a_100000212216_100011218378 [1,1,0,0,0,0|0,2,0]=4 8472 B9R0.46 CCC(O)CSCCSC 62a_100011218378_100000751147 [1,1,0,0,0,0|0,2,0]=4 8473 B9R0.46 CCCCCCC(=O)CC 1458a_100000210414_100000210757 [1,1,0,0,0,0|2,0,0]=4 8474 B9R0.46 CCCCCCC(=O)CC 1458a_100102632555_100000210202 [1,1,0,0,0,0|2,0,0]=4 8475 B9R0.46 CCCCCCC(C)NC 2230a_100000210919_200000210301 [1,1,0,0,0,0|2,0,0]=4 8476 B9R0.46 CCCCCCC(C)NC 2230a_106832991635_100011215978 [1,1,0,0,0,0|2,0,0]=4 8477 B9R0.46 CCCCCCC(C)NC 270004a_106832991635_100000210826 [1,1,0,0,0,0|2,0,0]=4 8478 B9R0.46 CCCCCCC(C)NC 34a_100000210919_200000210301 [1,1,0,0,0,0|2,0,0]=4 8479 B9R0.46 CCCCCCC(C)NC 34a_100102657272_100011215978 [1,1,0,0,0,0|2,0,0]=4 8480 B9R0.46 CCCCCCC(C)NC 7a_106832991635_100011215978 [1,1,0,0,0,0|2,0,0]=4 8481 B9R0.46 CCCCCCC(C)N[13CH3] 2230a_100000210919_200025704644 [1,1,0,0,0,0|2,0,0]=4 8482 B9R0.46 CCCCCCC(C)N[13CH3] 34a_100000210919_200025704644 [1,1,0,0,0,0|2,0,0]=4 8483 B9R0.46 CCCCCCC(C)OC 34a_100000210265_200000210301 [1,1,0,0,0,0|1,0,0]=3 8484 B9R0.46 CCCCCCC(C)OC 34a_100138415774_100011215978 [1,1,0,0,0,0|1,0,0]=3 8485 B9R0.46 CCCCCCC(C)OC 7a_100000210265_200000210301 [1,1,0,0,0,0|1,0,0]=3 8486 B9R0.46 CCCCCCC(C)O[13CH3] 34a_100000210265_200025704644 [1,1,0,0,0,0|1,0,0]=3 8487 B9R0.46 CCCCCCC(C)O[13CH3] 7a_100000210265_200025704644 [1,1,0,0,0,0|1,0,0]=3 8488 B9R0.46 CCCCCCC(C)SC 62a_100011215978_200000210301 [1,1,0,0,0,0|1,1,0]=4 8489 B9R0.46 CCCCCCC(C)SC 62a_200000210301_100011215978 [1,1,0,0,0,0|1,1,0]=4 8490 B9R0.46 CCCCCCC(C)S[13CH3] 62a_100011215978_200025704644 [1,1,0,0,0,0|1,1,0]=4 8491 B9R0.46 CCCCCCC(C)S[13CH3] 62a_200025704644_100011215978 [1,1,0,0,0,0|1,1,0]=4 8492 B9R0.46 CCCCCCN(C)CC 2230a_100000225621_100000210314 [1,1,0,0,0,0|2,0,0]=4 8493 B9R0.46 CCCCCCN(C)CC 2230a_106256046315_100000210202 [1,1,0,0,0,0|2,0,0]=4 8494 B9R0.46 CCCCCCN(C)CC 269982a_100000225621_100000210757 [1,1,0,0,0,0|2,0,0]=4 8495 B9R0.46 CCCCCCN(C)CC 269982a_106256046315_100000204670 [1,1,0,0,0,0|2,0,0]=4 8496 B9R0.46 CCCCCNC(C)CC 2230a_100000209981_100000210326 [1,1,0,0,0,0|2,0,0]=4 8497 B9R0.46 CCCCCNC(C)CC 2230a_100000209983_100000758301 [1,1,0,0,0,0|2,0,0]=4 8498 B9R0.46 CCCCCNC(C)CO 2230a_100000209983_100012180447 [1,1,0,0,0,0|2,0,0]=4 8499 B9R0.46 CCCCCN[C@H](C)CO 2230a_100000737577_100000210326 [1,1,0,0,0,0|2,0,0]=4 8500 B9R0.46 CCCCCOC(C)CC 34a_100000210253_100011215416 [1,1,0,0,0,0|1,0,0]=3 8501 B9R0.46 CCCCCOC(C)CC 7a_100000210228_100000210326 [1,1,0,0,0,0|1,0,0]=3 8502 B9R0.46 CCCCCOC(C)CC 7a_100000210253_100000758301 [1,1,0,0,0,0|1,0,0]=3 8503 B9R0.46 CCCCCOC(C)CF 34a_100016041109_100000718602 [1,1,0,0,0,0|2,0,0]=4 8504 B9R0.46 CCCCCOC(C)CF 7a_100016041109_100000210326 [1,1,0,0,0,0|2,0,0]=4 8505 B9R0.46 CCCCCOC(C)CN 34a_100000210904_100000718602 [1,1,0,0,0,0|2,0,0]=4 8506 B9R0.46 CCCCCOC(C)CO 34a_100000210253_100012180447 [1,1,0,0,0,0|1,0,0]=3 8507 B9R0.46 CCCCCOC(C)CO 7a_100000210253_100012180447 [1,1,0,0,0,0|1,0,0]=3 8508 B9R0.46 CCCCCSC(C)CC 62a_100000210326_100000758301 [1,1,0,0,0,0|1,1,0]=4 8509 B9R0.46 CCCCCSC(C)CC 62a_100000758301_100000210326 [1,1,0,0,0,0|1,1,0]=4 8510 B9R0.46 CCCCCSC(C)CO 62a_100012180447_100000210326 [1,1,0,0,0,0|1,1,0]=4 8511 B9R0.46 CCCCCSC(C)OC 62a_100000210326_100009879195 [1,1,0,0,0,0|1,1,0]=4 8512 B9R0.46 CCCCCSC(C)OC 62a_100009879195_100000210326 [1,1,0,0,0,0|1,1,0]=4 8513 B9R0.46 CCCCCS[C@H](C)CO 62a_100000210326_100016084084 [1,1,0,0,0,0|1,1,0]=4 8514 B9R0.46 CCCCCS[C@H](C)CO 62a_100016084084_100000210326 [1,1,0,0,0,0|1,1,0]=4 8515 B9R0.46 CCCCNCC(=O)OC 2230a_100000102301_100000747449 [1,1,0,0,0,0|1,0,1]=4 8516 B9R0.46 CCCCNCC(=O)OC 7a_106832991798_100000747449 [1,1,0,0,0,0|1,0,1]=4 8517 B9R0.46 CCCCNCC(C)CC 2230a_100000102301_100000748023 [1,1,0,0,0,0|2,0,0]=4 8518 B9R0.46 CCCCNCC(C)CC 2230a_100020588543_100000210211 [1,1,0,0,0,0|2,0,0]=4 8519 B9R0.46 CCCCNCC(C)CC 270004a_100000102301_100000243153 [1,1,0,0,0,0|2,0,0]=4 8520 B9R0.46 CCCCNCC(C)CC 7a_106832991798_100000748023 [1,1,0,0,0,0|2,0,0]=4 8521 B9R0.46 CCCCNCC(O)CC 2230a_100000102301_100011218378 [1,1,0,0,0,0|2,0,0]=4 8522 B9R0.46 CCCCNCC(O)CC 2230a_100011218483_100000210211 [1,1,0,0,0,0|2,0,0]=4 8523 B9R0.46 CCCCNCC(O)CC 7a_106832991798_100011218378 [1,1,0,0,0,0|2,0,0]=4 8524 B9R0.46 CCCCNC[C@@H](C)CC 2230a_100000102301_100009816398 [1,1,0,0,0,0|2,0,0]=4 8525 B9R0.46 CCCCNC[C@@H](C)CC 7a_106832991798_100009816398 [1,1,0,0,0,0|2,0,0]=4 8526 B9R0.46 CCCCNC[C@@H](C)OC 2230a_100020591295_100000210211 [1,1,0,0,0,0|1,0,0]=3 8527 B9R0.46 CCCCOCC(=O)CC 1458a_100000210414_100011995733 [1,1,0,0,0,0|1,0,1]=4 8528 B9R0.46 CCCCOCC(=O)CC 1458a_100000757543_100000210202 [1,1,0,0,0,0|1,0,1]=4 8529 B9R0.46 CCCCOCC(=O)CC 34a_100000725409_100000210210 [1,1,0,0,0,0|1,0,1]=4 8530 B9R0.46 CCCCOCC(=O)CC 7a_100000210227_100000747405 [1,1,0,0,0,0|1,0,1]=4 8531 B9R0.46 CCCCOCC(=O)NC 11a_106832991635_100000757543 [1,1,0,0,0,0|1,0,1]=4 8532 B9R0.46 CCCCOCC(=O)NC 1626a_100102657272_100000757543 [1,1,0,0,0,0|1,0,1]=4 8533 B9R0.46 CCCCOCC(=O)NC 240690a_100102657272_100000757543 [1,1,0,0,0,0|1,0,1]=4 8534 B9R0.46 CCCCOCC(=O)NC 34a_100000210227_100000183359 [1,1,0,0,0,0|1,0,1]=4 8535 B9R0.46 CCCCOCC(=O)NC 34a_100000750040_100000210210 [1,1,0,0,0,0|1,0,1]=4 8536 B9R0.46 CCCCOCC(=O)NC 527a_100102657272_100000757543 [1,1,0,0,0,0|1,0,1]=4 8537 B9R0.46 CCCCOCC(=O)NC 7a_100000210227_100000183359 [1,1,0,0,0,0|1,0,1]=4 8538 B9R0.46 CCCCOCC(=O)OC 34a_100000210227_100000747449 [1,1,0,0,0,0|0,0,1]=3 8539 B9R0.46 CCCCOCC(=O)OC 7a_100000210227_100000747449 [1,1,0,0,0,0|0,0,1]=3 8540 B9R0.46 CCCCOCC(C)CC 34a_100000210227_100000748023 [1,1,0,0,0,0|1,0,0]=3 8541 B9R0.46 CCCCOCC(C)CC 7a_100000210227_100000748023 [1,1,0,0,0,0|1,0,0]=3 8542 B9R0.46 CCCCOCC(C)CN 34a_100000744482_100000210210 [1,1,0,0,0,0|2,0,0]=4 8543 B9R0.46 CCCCOCC(C)OC 34a_100000690652_100000210210 [1,1,0,0,0,0|0,0,0]=2 8544 B9R0.46 CCCCOCC(C)OC 34a_100011217071_200000210301 [1,1,0,0,0,0|0,0,0]=2 8545 B9R0.46 CCCCOCC(C)OC 7a_100011217071_200000210301 [1,1,0,0,0,0|0,0,0]=2 8546 B9R0.46 CCCCOCC(C)O[13CH3] 34a_100011217071_200025704644 [1,1,0,0,0,0|0,0,0]=2 8547 B9R0.46 CCCCOCC(C)O[13CH3] 7a_100011217071_200025704644 [1,1,0,0,0,0|0,0,0]=2 8548 B9R0.46 CCCCOCC(Cl)CCl 34a_100000033668_100000210210 [1,1,0,0,0,0|2,0,0]=4 8549 B9R0.46 CCCCOCC(O)CC 34a_100000210227_100011218378 [1,1,0,0,0,0|1,0,0]=3 8550 B9R0.46 CCCCOCC(O)CC 7a_100000210227_100011218378 [1,1,0,0,0,0|1,0,0]=3 8551 B9R0.46 CCCCOCC(O)CO 34a_100000210227_100011219619 [1,1,0,0,0,0|2,0,0]=4 8552 B9R0.46 CCCCOCC(O)CO 7a_100000210227_100011219619 [1,1,0,0,0,0|2,0,0]=4 8553 B9R0.46 CCCCOCN(C)CC 2230a_100000225621_100011995733 [1,1,0,0,0,0|2,0,0]=4 8554 B9R0.46 CCCCOCN(C)CC 269982a_100000225621_100011995733 [1,1,0,0,0,0|2,0,0]=4 8555 B9R0.46 CCCCOC[C@@H](C)CC 34a_100000210227_100009816398 [1,1,0,0,0,0|1,0,0]=3 8556 B9R0.46 CCCCOC[C@@H](C)CC 7a_100000210227_100009816398 [1,1,0,0,0,0|1,0,0]=3 8557 B9R0.46 CCCCOC[C@@H](C)CC 7a_100009816381_100000210211 [1,1,0,0,0,0|1,0,0]=3 8558 B9R0.46 CCCCOC[C@@H](C)CO 34a_100000210227_100000059175 [1,1,0,0,0,0|2,0,0]=4 8559 B9R0.46 CCCCOC[C@@H](C)CO 7a_100000210227_100000059175 [1,1,0,0,0,0|2,0,0]=4 8560 B9R0.46 CCCCOC[C@@H](O)CF 34a_100000210227_100015614560 [1,1,0,0,0,0|2,0,0]=4 8561 B9R0.46 CCCCOC[C@@H](O)CF 7a_100000210227_100015614560 [1,1,0,0,0,0|2,0,0]=4 8562 B9R0.46 CCCCOC[C@@H](O)CO 34a_100000210227_100009815848 [1,1,0,0,0,0|2,0,0]=4 8563 B9R0.46 CCCCOC[C@@H](O)CO 7a_100000210227_100009815848 [1,1,0,0,0,0|2,0,0]=4 8564 B9R0.46 CCCCOC[C@H](F)CN 34a_100015665980_100000210210 [1,1,0,0,0,0|2,0,0]=4 8565 B9R0.46 CCCCSCC(=O)OC 62a_100000210211_100000747449 [1,1,0,0,0,0|0,1,1]=4 8566 B9R0.46 CCCCSCC(=O)OC 62a_100000747449_100000210210 [1,1,0,0,0,0|0,1,1]=4 8567 B9R0.46 CCCCSCC(C)CC 62a_100000210211_100000748023 [1,1,0,0,0,0|1,1,0]=4 8568 B9R0.46 CCCCSCC(C)CC 62a_100000748023_100000210210 [1,1,0,0,0,0|1,1,0]=4 8569 B9R0.46 CCCCSCC(O)CC 62a_100000210211_100011218378 [1,1,0,0,0,0|1,1,0]=4 8570 B9R0.46 CCCCSCC(O)CC 62a_100011218378_100000210210 [1,1,0,0,0,0|1,1,0]=4 8571 B9R0.46 CCCCSC[C@@H](C)CC 62a_100000210211_100009816398 [1,1,0,0,0,0|1,1,0]=4 8572 B9R0.46 CCCCSC[C@@H](C)CC 62a_100009816398_100000210210 [1,1,0,0,0,0|1,1,0]=4 8573 B9R0.46 CCCNCCC(C)CC 2230a_100020591266_100000210303 [1,1,0,0,0,0|2,0,0]=4 8574 B9R0.46 CCCOCCC(=O)CC 1458a_100000210414_100011215938 [1,1,0,0,0,0|1,0,0]=3 8575 B9R0.46 CCCOCCC(=O)CO 1458a_100000210174_100011215938 [1,1,0,0,0,0|2,0,0]=4 8576 B9R0.46 CCCOCCC(=O)NC 34a_100000210258_100012179268 [1,1,0,0,0,0|2,0,0]=4 8577 B9R0.46 CCCOCCC(=O)NC 34a_100000754576_100000210303 [1,1,0,0,0,0|2,0,0]=4 8578 B9R0.46 CCCOCCC(=O)OC 34a_100000210258_100000742370 [1,1,0,0,0,0|2,0,0]=4 8579 B9R0.46 CCCOCCC(C)CC 7a_100011215188_100000210303 [1,1,0,0,0,0|1,0,0]=3 8580 B9R0.46 CCCOCCC(C)OC 7a_100000764861_100000210303 [1,1,0,0,0,0|2,0,0]=4 8581 B9R0.46 CCCOCCN(C)CC 2230a_100000225621_100011215938 [1,1,0,0,0,0|1,0,0]=3 8582 B9R0.46 CCCOCCN(C)CC 269982a_100000225621_100011215938 [1,1,0,0,0,0|1,0,0]=3 8583 B9R0.46 CCN(C)CCCCCO 2230a_100000225621_100000746330 [1,1,0,0,0,0|2,0,0]=4 8584 B9R0.46 CCN(C)CCCCCO 2230a_100000722520_100000210202 [1,1,0,0,0,0|2,0,0]=4 8585 B9R0.46 CCN(C)CCCCCO 269982a_100000225621_100000746330 [1,1,0,0,0,0|2,0,0]=4 8586 B9R0.46 CCN(C)CCCCCO 269982a_100000722520_100000204670 [1,1,0,0,0,0|2,0,0]=4 8587 B9R0.46 CCN(C)CCCCOC 2230a_100000225621_100000730899 [1,1,0,0,0,0|1,0,0]=3 8588 B9R0.46 CCN(C)CCCCOC 269982a_100000225621_100000730899 [1,1,0,0,0,0|1,0,0]=3 8589 B9R0.46 CCN(C)CCOCCO 2230a_100000225621_100011215305 [1,1,0,0,0,0|1,0,0]=3 8590 B9R0.46 CCN(C)CCOCCO 2230a_100000228057_100000210202 [1,1,0,0,0,0|1,0,0]=3 8591 B9R0.46 CCN(C)CCOCCO 269982a_100000225621_100011215305 [1,1,0,0,0,0|1,0,0]=3 8592 B9R0.46 CCN(C)CCOCCO 269982a_100000228057_100000204670 [1,1,0,0,0,0|1,0,0]=3 8593 B9R0.46 CCN(C)COCCOC 2230a_100000225621_100000231047 [1,1,0,0,0,0|1,0,0]=3 8594 B9R0.46 CCN(C)COCCOC 269982a_100000225621_100000231047 [1,1,0,0,0,0|1,0,0]=3 8595 B9R0.46 CCNCCCC(=O)OC 2230a_100015525214_100011218270 [1,1,0,0,0,0|1,0,1]=4 8596 B9R0.46 CCOCCCC(=O)CC 1458a_100000210414_100012232248 [1,1,0,0,0,0|1,0,1]=4 8597 B9R0.46 CCOCCCC(=O)CO 1458a_100000210174_100012232248 [1,1,0,0,0,0|1,0,1]=4 8598 B9R0.46 CCOCCCC(=O)NC 34a_100121572206_100000741757 [1,1,0,0,0,0|1,0,1]=4 8599 B9R0.46 CCOCCCC(=O)OC 34a_100121572206_100000742333 [1,1,0,0,0,0|0,0,1]=3 8600 B9R0.46 CCOCCCC(C)CC 7a_100011216074_100000210202 [1,1,0,0,0,0|1,0,0]=3 8601 B9R0.46 CCOCCCN(C)CC 2230a_100000225621_100012232248 [1,1,0,0,0,0|2,0,0]=4 8602 B9R0.46 CCOCCCN(C)CC 269982a_100000225621_100012232248 [1,1,0,0,0,0|2,0,0]=4 8603 B9R0.46 CCOCCC[C@@H](C)CN 34a_100160569302_100000210202 [1,1,0,0,0,0|2,0,0]=4 8604 B9R0.46 CCOCCNC(=O)CC 11a_100011200944_100000210414 [1,1,0,0,0,0|1,0,1]=4 8605 B9R0.46 CCOCCNC(=O)CC 1626a_102516460346_100000210414 [1,1,0,0,0,0|1,0,1]=4 8606 B9R0.46 CCOCCNC(=O)CC 240690a_100011200944_100000210414 [1,1,0,0,0,0|1,0,1]=4 8607 B9R0.46 CCOCCNC(=O)CC 34a_200000158885_100000210202 [1,1,0,0,0,0|1,0,1]=4 8608 B9R0.46 CCOCCNC(=O)CC 527a_100011200944_100000210414 [1,1,0,0,0,0|1,0,1]=4 8609 B9R0.46 CCOCCNC(=O)CC 7a_200000158885_100000210202 [1,1,0,0,0,0|1,0,1]=4 8610 B9R0.46 CCOCCNC(=O)CO 240690a_100011200944_100000210174 [1,1,0,0,0,0|1,0,1]=4 8611 B9R0.46 CCOCCNC(=O)CO 527a_100011200944_100000210174 [1,1,0,0,0,0|1,0,1]=4 8612 B9R0.46 CCOCCNC(=O)OC 34a_100000757965_100000210202 [1,1,0,0,0,0|1,0,1]=4 8613 B9R0.46 CCOCCNC(C)CC 2230a_100000209981_100011215890 [1,1,0,0,0,0|1,0,0]=3 8614 B9R0.46 CCOCCNC(C)CC 2230a_102516460346_100000758301 [1,1,0,0,0,0|1,0,0]=3 8615 B9R0.46 CCOCCNC(C)CC 34a_102516460346_100011215416 [1,1,0,0,0,0|1,0,0]=3 8616 B9R0.46 CCOCCNC(C)CO 2230a_102516460346_100012180447 [1,1,0,0,0,0|1,0,0]=3 8617 B9R0.46 CCOCCNC(C)CO 34a_102516460346_100012180447 [1,1,0,0,0,0|1,0,0]=3 8618 B9R0.46 CCOCCN[C@H](C)CO 2230a_100000737577_100011215890 [1,1,0,0,0,0|1,0,0]=3 8619 B9R0.46 CCOCCOC(=O)CC 7a_200000031056_100000210202 [1,1,0,0,0,0|0,0,1]=3 8620 B9R0.46 CCOCCOC(=O)NC 34a_100121572206_200011997002 [1,1,0,0,0,0|1,0,1]=4 8621 B9R0.46 CCOCCOC(=O)OC 34a_100010262106_100000210202 [1,1,0,0,0,0|0,0,1]=3 8622 B9R0.46 CCOCCOC(C)C#N 34a_100011218135_100000210147 [1,1,0,0,0,0|1,0,1]=4 8623 B9R0.46 CCOCCOC(C)C#N 7a_100000210136_100000703298 [1,1,0,0,0,0|1,0,1]=4 8624 B9R0.46 CCOCCOC(C)CC 34a_100000210136_100011215416 [1,1,0,0,0,0|0,0,0]=2 8625 B9R0.46 CCOCCOC(C)CC 7a_100000210136_100000758301 [1,1,0,0,0,0|0,0,0]=2 8626 B9R0.46 CCOCCOC(C)CC 7a_100000210228_100011215890 [1,1,0,0,0,0|0,0,0]=2 8627 B9R0.46 CCOCCOC(C)CF 34a_100016041109_100000210147 [1,1,0,0,0,0|1,0,0]=3 8628 B9R0.46 CCOCCOC(C)CF 7a_100016041109_100011215890 [1,1,0,0,0,0|1,0,0]=3 8629 B9R0.46 CCOCCOC(C)CN 34a_100000210904_100000210147 [1,1,0,0,0,0|1,0,0]=3 8630 B9R0.46 CCOCCOC(C)CO 34a_100000210136_100012180447 [1,1,0,0,0,0|0,0,0]=2 8631 B9R0.46 CCOCCOC(C)CO 7a_100000210136_100012180447 [1,1,0,0,0,0|0,0,0]=2 8632 B9R0.46 CCOCCSC(C)CC 62a_100000210147_100000758301 [1,1,0,0,0,0|0,1,0]=3 8633 B9R0.46 CCOCCSC(C)CC 62a_100000758301_100011215890 [1,1,0,0,0,0|0,1,0]=3 8634 B9R0.46 CCOCCSC(C)CO 62a_100012180447_100011215890 [1,1,0,0,0,0|0,1,0]=3 8635 B9R0.46 CCOCCSC(C)OC 62a_100000210147_100009879195 [1,1,0,0,0,0|0,1,0]=3 8636 B9R0.46 CCOCCSC(C)OC 62a_100009879195_100011215890 [1,1,0,0,0,0|0,1,0]=3 8637 B9R0.46 CCOCCS[C@H](C)CO 62a_100000210147_100016084084 [1,1,0,0,0,0|0,1,0]=3 8638 B9R0.46 CCOCCS[C@H](C)CO 62a_100016084084_100011215890 [1,1,0,0,0,0|0,1,0]=3 8639 B9R0.46 CCOCSCC(=O)OC 62a_100000739092_100000747449 [1,1,0,0,0,0|0,1,1]=4 8640 B9R0.46 CCOCSCC(=O)OC 62a_100000747449_100000739092 [1,1,0,0,0,0|0,1,1]=4 8641 B9R0.46 CCOCSCC(C)CC 62a_100000739092_100000748023 [1,1,0,0,0,0|1,1,0]=4 8642 B9R0.46 CCOCSCC(C)CC 62a_100000748023_100000739092 [1,1,0,0,0,0|1,1,0]=4 8643 B9R0.46 CCOCSCC(O)CC 62a_100000739092_100011218378 [1,1,0,0,0,0|1,1,0]=4 8644 B9R0.46 CCOCSCC(O)CC 62a_100011218378_100000739092 [1,1,0,0,0,0|1,1,0]=4 8645 B9R0.46 CCOCSCC(O)CO 62a_100000739092_100011219619 [1,1,0,0,0,0|2,0,0]=4 8646 B9R0.46 CCOCSCC(O)CO 62a_100011219619_100000739092 [1,1,0,0,0,0|2,0,0]=4 8647 B9R0.46 CCOCSC[C@@H](C)CC 62a_100000739092_100009816398 [1,1,0,0,0,0|1,1,0]=4 8648 B9R0.46 CCOCSC[C@@H](C)CC 62a_100009816398_100000739092 [1,1,0,0,0,0|1,1,0]=4 8649 B9R0.46 CCOCSC[C@@H](C)CO 62a_100000059175_100000739092 [1,1,0,0,0,0|2,0,0]=4 8650 B9R0.46 CCOCSC[C@@H](C)CO 62a_100000739092_100000059175 [1,1,0,0,0,0|2,0,0]=4 8651 B9R0.46 CCOCSC[C@@H](O)CO 62a_100000739092_100009815848 [1,1,0,0,0,0|2,0,0]=4 8652 B9R0.46 CCOCSC[C@@H](O)CO 62a_100009815848_100000739092 [1,1,0,0,0,0|2,0,0]=4 8653 B9R0.46 CCSCCCC(=O)OC 62a_100000210202_100011218270 [1,1,0,0,0,0|0,1,1]=4 8654 B9R0.46 CCSCCCC(=O)OC 62a_100011218270_100000210202 [1,1,0,0,0,0|0,1,1]=4 8655 B9R0.46 CCSCCNC(C)CC 2230a_100000106463_100000758301 [1,1,0,0,0,0|1,1,0]=4 8656 B9R0.46 CCSCCNC(C)CC 2230a_100000209981_100000757381 [1,1,0,0,0,0|1,1,0]=4 8657 B9R0.46 CCSCCNC(C)CO 2230a_100000106463_100012180447 [1,1,0,0,0,0|1,1,0]=4 8658 B9R0.46 CCSCCN[C@H](C)CO 2230a_100000737577_100000757381 [1,1,0,0,0,0|1,1,0]=4 8659 B9R0.46 CCSCCOC(C)CC 34a_100000212035_100011215416 [1,1,0,0,0,0|0,1,0]=3 8660 B9R0.46 CCSCCOC(C)CC 7a_100000210228_100000757381 [1,1,0,0,0,0|0,1,0]=3 8661 B9R0.46 CCSCCOC(C)CC 7a_100000212035_100000758301 [1,1,0,0,0,0|0,1,0]=3 8662 B9R0.46 CCSCCOC(C)CF 34a_100016041109_100000757381 [1,1,0,0,0,0|1,1,0]=4 8663 B9R0.46 CCSCCOC(C)CF 7a_100016041109_100000757381 [1,1,0,0,0,0|1,1,0]=4 8664 B9R0.46 CCSCCOC(C)CN 34a_100000210904_100000757381 [1,1,0,0,0,0|1,1,0]=4 8665 B9R0.46 CCSCCOC(C)CO 34a_100000212035_100012180447 [1,1,0,0,0,0|0,1,0]=3 8666 B9R0.46 CCSCCOC(C)CO 7a_100000212035_100012180447 [1,1,0,0,0,0|0,1,0]=3 8667 B9R0.46 CCSCCSC(C)CC 62a_100000757381_100000758301 [1,1,0,0,0,0|0,2,0]=4 8668 B9R0.46 CCSCCSC(C)CC 62a_100000758301_100000757381 [1,1,0,0,0,0|0,2,0]=4 8669 B9R0.46 CCSCCSC(C)CO 62a_100012180447_100000757381 [1,1,0,0,0,0|0,2,0]=4 8670 B9R0.46 CCSCCSC(C)OC 62a_100000757381_100009879195 [1,1,0,0,0,0|0,2,0]=4 8671 B9R0.46 CCSCCSC(C)OC 62a_100009879195_100000757381 [1,1,0,0,0,0|0,2,0]=4 8672 B9R0.46 CCSCCS[C@H](C)CO 62a_100000757381_100016084084 [1,1,0,0,0,0|0,2,0]=4 8673 B9R0.46 CCSCCS[C@H](C)CO 62a_100016084084_100000757381 [1,1,0,0,0,0|0,2,0]=4 8674 B9R0.46 CC[C@H](C)CNCCOC 2230a_100000209980_100009816398 [1,1,0,0,0,0|1,0,0]=3 8675 B9R0.46 CC[C@H](C)CNCCSC 2230a_100020590264_100009816398 [1,1,0,0,0,0|1,1,0]=4 8676 B9R0.46 CC[C@H](C)COCCC#N 7a_100009816381_100000184422 [1,1,0,0,0,0|2,0,0]=4 8677 B9R0.46 CC[C@H](C)COCCCBr 34a_100011217188_100009816398 [1,1,0,0,0,0|2,0,0]=4 8678 B9R0.46 CC[C@H](C)COCCCCl 34a_100000230001_100009816398 [1,1,0,0,0,0|2,0,0]=4 8679 B9R0.46 CC[C@H](C)COCCCF 34a_100000759539_100009816398 [1,1,0,0,0,0|2,0,0]=4 8680 B9R0.46 CC[C@H](C)COCCCF 7a_100009816381_100011934791 [1,1,0,0,0,0|2,0,0]=4 8681 B9R0.46 CC[C@H](C)COCCCN 34a_100000182051_100009816398 [1,1,0,0,0,0|2,0,0]=4 8682 B9R0.46 CC[C@H](C)COCCCO 7a_100009816381_100011215043 [1,1,0,0,0,0|2,0,0]=4 8683 B9R0.46 CC[C@H](C)COCCOC 34a_100000210237_100009816398 [1,1,0,0,0,0|0,0,0]=2 8684 B9R0.46 CC[C@H](C)COCCOC 7a_100009816381_100000233755 [1,1,0,0,0,0|0,0,0]=2 8685 B9R0.46 CC[C@H](C)COCCON 34a_100000700252_100009816398 [1,1,0,0,0,0|1,0,0]=3 8686 B9R0.46 CC[C@H](C)COCCSC 34a_100000230434_100009816398 [1,1,0,0,0,0|0,1,0]=3 8687 B9R0.46 CC[C@H](C)COCCSC 7a_100000230434_100009816398 [1,1,0,0,0,0|0,1,0]=3 8688 B9R0.46 CC[C@H](C)COCCSC 7a_100009816381_100000212216 [1,1,0,0,0,0|0,1,0]=3 8689 B9R0.46 CC[C@H](C)CSCCOC 62a_100000233755_100009816398 [1,1,0,0,0,0|0,1,0]=3 8690 B9R0.46 CC[C@H](C)CSCCOC 62a_100009816398_100000233755 [1,1,0,0,0,0|0,1,0]=3 8691 B9R0.46 CC[C@H](C)CSCCSC 62a_100000212216_100009816398 [1,1,0,0,0,0|0,2,0]=4 8692 B9R0.46 CC[C@H](C)CSCCSC 62a_100009816398_100000751147 [1,1,0,0,0,0|0,2,0]=4 8693 B9R0.46 CN(CF)CCOCCO 269982a_100000228057_100015361967 [1,1,0,0,0,0|2,0,0]=4 8694 B9R0.46 CNC(=O)CCOCCO 1626a_100102657272_100011229844 [1,1,0,0,0,0|2,0,0]=4 8695 B9R0.46 CNC(=O)CCOCCO 240690a_100102657272_100011229844 [1,1,0,0,0,0|2,0,0]=4 8696 B9R0.46 CNC(=O)CCOCCO 34a_100000754576_100000211926 [1,1,0,0,0,0|2,0,0]=4 8697 B9R0.46 CNC(=O)COCCOC 11a_106832991635_100000211095 [1,1,0,0,0,0|1,0,1]=4 8698 B9R0.46 CNC(=O)COCCOC 1626a_100102657272_100000211095 [1,1,0,0,0,0|1,0,1]=4 8699 B9R0.46 CNC(=O)COCCOC 240690a_100102657272_100000211095 [1,1,0,0,0,0|1,0,1]=4 8700 B9R0.46 CNC(=O)COCCOC 34a_100000210237_100000183359 [1,1,0,0,0,0|1,0,1]=4 8701 B9R0.46 CNC(=O)COCCOC 34a_100000750040_100011201679 [1,1,0,0,0,0|1,0,1]=4 8702 B9R0.46 CNC(=O)COCCOC 527a_100102657272_100000211095 [1,1,0,0,0,0|1,0,1]=4 8703 B9R0.46 CNCCCOC(C)CO 34a_100000213112_100012180447 [1,1,0,0,0,0|2,0,0]=4 8704 B9R0.46 CNCCOCC(=O)OC 2230a_106832991635_100000090808 [1,1,0,0,0,0|1,0,1]=4 8705 B9R0.46 CNCCOCC(=O)OC 34a_100102657272_100000090808 [1,1,0,0,0,0|1,0,1]=4 8706 B9R0.46 CNCCOCC(=O)OC 7a_106832991635_100000090808 [1,1,0,0,0,0|1,0,1]=4 8707 B9R0.46 COC(=O)CCCCO[13CH3] 34a_100000059025_200025704644 [1,1,0,0,0,0|1,0,1]=4 8708 B9R0.46 COC(=O)CCCCO[13CH3] 7a_100000059025_200025704644 [1,1,0,0,0,0|1,0,1]=4 8709 B9R0.46 COC(=O)COCCCBr 34a_100011217188_100000747449 [1,1,0,0,0,0|1,0,1]=4 8710 B9R0.46 COC(=O)COCCCCl 34a_100000230001_100000747449 [1,1,0,0,0,0|1,0,1]=4 8711 B9R0.46 COC(=O)COCCCF 34a_100000759539_100000747449 [1,1,0,0,0,0|1,0,1]=4 8712 B9R0.46 COC(=O)COCCCN 34a_100000182051_100000747449 [1,1,0,0,0,0|1,0,1]=4 8713 B9R0.46 COC(=O)COCCON 34a_100000700252_100000747449 [1,1,0,0,0,0|1,0,1]=4 8714 B9R0.46 COC(=O)COCCSC 34a_100000230434_100000747449 [1,1,0,0,0,0|0,1,1]=4 8715 B9R0.46 COC(=O)COCCSC 62a_100000090808_200000210301 [1,1,0,0,0,0|0,1,1]=4 8716 B9R0.46 COC(=O)COCCSC 62a_200000210301_100000090808 [1,1,0,0,0,0|0,1,1]=4 8717 B9R0.46 COC(=O)COCCSC 7a_100000230434_100000747449 [1,1,0,0,0,0|0,1,1]=4 8718 B9R0.46 COC(=O)COCCS[13CH3] 62a_100000090808_200025704644 [1,1,0,0,0,0|0,1,1]=4 8719 B9R0.46 COC(=O)COCCS[13CH3] 62a_200025704644_100000090808 [1,1,0,0,0,0|0,1,1]=4 8720 B9R0.46 COC(=O)OCCOCF 34a_100010262106_100015361967 [1,1,0,0,0,0|1,0,1]=4 8721 B9R0.46 COC(C)CCOCCO 7a_100000764861_100000211926 [1,1,0,0,0,0|2,0,0]=4 8722 B9R0.46 COC(C)COCCCF 34a_100000690652_100011934791 [1,1,0,0,0,0|1,0,0]=3 8723 B9R0.46 COC(C)COCCCO 34a_100000690652_100000230001 [1,1,0,0,0,0|1,0,0]=3 8724 B9R0.46 COC(C)COCCSC 34a_100000690652_100000212216 [1,1,0,0,0,0|0,1,0]=3 8725 B9R0.46 COCCCCC(=O)CO 1458a_100000210174_100000755781 [1,1,0,0,0,0|2,0,0]=4 8726 B9R0.46 COCCCCC(=O)OC 34a_100000059025_200000210301 [1,1,0,0,0,0|1,0,1]=4 8727 B9R0.46 COCCCCC(=O)OC 34a_100138415774_100000204269 [1,1,0,0,0,0|1,0,1]=4 8728 B9R0.46 COCCCCC(=O)OC 7a_100000059025_200000210301 [1,1,0,0,0,0|1,0,1]=4 8729 B9R0.46 COCCCOC(C)CO 34a_100000740835_100012180447 [1,1,0,0,0,0|2,0,0]=4 8730 B9R0.46 COCCCSC(C)OC 62a_100000709357_100009879195 [1,1,0,0,0,0|2,0,0]=4 8731 B9R0.46 COCCCSC(C)OC 62a_100009879195_100000709357 [1,1,0,0,0,0|2,0,0]=4 8732 B9R0.46 COCCNCC(=O)OC 2230a_100000209980_100000747449 [1,1,0,0,0,0|1,0,1]=4 8733 B9R0.46 COCCNCC(C)CO 34a_100000744482_100011201679 [1,1,0,0,0,0|2,0,0]=4 8734 B9R0.46 COCCNCC(O)CO 2230a_100000209980_100011219619 [1,1,0,0,0,0|2,0,0]=4 8735 B9R0.46 COCCNC[C@@H](C)CO 2230a_100000209980_100000059175 [1,1,0,0,0,0|2,0,0]=4 8736 B9R0.46 COCCNC[C@@H](C)OC 2230a_100020591295_100011201679 [1,1,0,0,0,0|1,0,0]=3 8737 B9R0.46 COCCNC[C@@H](F)CO 34a_100015665980_100011201679 [1,1,0,0,0,0|2,0,0]=4 8738 B9R0.46 COCCNC[C@@H](O)CF 2230a_100000209980_100015614560 [1,1,0,0,0,0|2,0,0]=4 8739 B9R0.46 COCCNC[C@@H](O)CO 2230a_100000209980_100009815848 [1,1,0,0,0,0|2,0,0]=4 8740 B9R0.46 COCCNC[C@H](O)CO 2230a_100020644852_100011201679 [1,1,0,0,0,0|2,0,0]=4 8741 B9R0.46 COCCOCC(=O)CF 1458a_100000211095_100015361967 [1,1,0,0,0,0|1,0,1]=4 8742 B9R0.46 COCCOCC(=O)OC 34a_100000210237_100000747449 [1,1,0,0,0,0|0,0,1]=3 8743 B9R0.46 COCCOCC(=O)OC 34a_100138415774_100000090808 [1,1,0,0,0,0|0,0,1]=3 8744 B9R0.46 COCCOCC(C)CN 34a_100000744482_100011201679 [1,1,0,0,0,0|1,0,0]=3 8745 B9R0.46 COCCOCC(C)OC 34a_100000690652_100011201679 [1,1,0,0,0,0|0,0,0]=2 8746 B9R0.46 COCCOCC(Cl)CCl 34a_100000033668_100011201679 [1,1,0,0,0,0|1,0,0]=3 8747 B9R0.46 COCCOCC(O)CO 34a_100000210237_100011219619 [1,1,0,0,0,0|1,0,0]=3 8748 B9R0.46 COCCOC[C@@H](C)CO 34a_100000210237_100000059175 [1,1,0,0,0,0|1,0,0]=3 8749 B9R0.46 COCCOC[C@@H](O)CF 34a_100000210237_100015614560 [1,1,0,0,0,0|1,0,0]=3 8750 B9R0.46 COCCOC[C@@H](O)CO 34a_100000210237_100009815848 [1,1,0,0,0,0|1,0,0]=3 8751 B9R0.46 COCCOC[C@H](F)CN 34a_100015665980_100011201679 [1,1,0,0,0,0|1,0,0]=3 8752 B9R0.46 COCCSCC(=O)OC 62a_100000233755_100000747449 [1,1,0,0,0,0|0,1,1]=4 8753 B9R0.46 COCCSCC(=O)OC 62a_100000747449_100000233755 [1,1,0,0,0,0|0,1,1]=4 8754 B9R0.46 COCCSCC(O)CO 62a_100000233755_100011219619 [1,1,0,0,0,0|1,1,0]=4 8755 B9R0.46 COCCSCC(O)CO 62a_100011219619_100000233755 [1,1,0,0,0,0|1,1,0]=4 8756 B9R0.46 COCCSC[C@@H](C)CO 62a_100000059175_100000233755 [1,1,0,0,0,0|1,1,0]=4 8757 B9R0.46 COCCSC[C@@H](C)CO 62a_100000233755_100000059175 [1,1,0,0,0,0|1,1,0]=4 8758 B9R0.46 COCCSC[C@@H](O)CF 62a_100000233755_100015614560 [1,1,0,0,0,0|1,1,0]=4 8759 B9R0.46 COCCSC[C@@H](O)CF 62a_100015614560_100000233755 [1,1,0,0,0,0|1,1,0]=4 8760 B9R0.46 COCCSC[C@@H](O)CO 62a_100000233755_100009815848 [1,1,0,0,0,0|1,1,0]=4 8761 B9R0.46 COCCSC[C@@H](O)CO 62a_100009815848_100000233755 [1,1,0,0,0,0|1,1,0]=4 8762 B9R0.46 CO[C@H](C)CNCCCF 2230a_100020591295_100011934791 [1,1,0,0,0,0|2,0,0]=4 8763 B9R0.46 CO[C@H](C)CNCCCO 2230a_100020591295_100000230001 [1,1,0,0,0,0|2,0,0]=4 8764 B9R0.46 CO[C@H](C)CNCCSC 2230a_100020591295_100000751147 [1,1,0,0,0,0|1,1,0]=4 8765 B9R0.46 CSCCCOC(C)CO 34a_100000690336_100012180447 [1,1,0,0,0,0|2,0,0]=4 8766 B9R0.46 CSCCCOC(C)CO 7a_100000690336_100012180447 [1,1,0,0,0,0|2,0,0]=4 8767 B9R0.46 CSCCOCC(C)CN 34a_100000744482_100000212216 [1,1,0,0,0,0|1,1,0]=4 8768 B9R0.46 CSCCOCC(Cl)CCl 34a_100000033668_100000212216 [1,1,0,0,0,0|1,1,0]=4 8769 B9R0.46 CSCCOCC(O)CO 34a_100000230434_100011219619 [1,1,0,0,0,0|1,1,0]=4 8770 B9R0.46 CSCCOCC(O)CO 7a_100000230434_100011219619 [1,1,0,0,0,0|1,1,0]=4 8771 B9R0.46 CSCCOC[C@@H](C)CO 34a_100000230434_100000059175 [1,1,0,0,0,0|1,1,0]=4 8772 B9R0.46 CSCCOC[C@@H](C)CO 7a_100000230434_100000059175 [1,1,0,0,0,0|1,1,0]=4 8773 B9R0.46 CSCCOC[C@@H](O)CF 34a_100000230434_100015614560 [1,1,0,0,0,0|1,1,0]=4 8774 B9R0.46 CSCCOC[C@@H](O)CF 7a_100000230434_100015614560 [1,1,0,0,0,0|1,1,0]=4 8775 B9R0.46 CSCCOC[C@@H](O)CO 34a_100000230434_100009815848 [1,1,0,0,0,0|1,1,0]=4 8776 B9R0.46 CSCCOC[C@@H](O)CO 7a_100000230434_100009815848 [1,1,0,0,0,0|1,1,0]=4 8777 B9R0.46 CSCCOC[C@H](F)CN 34a_100015665980_100000212216 [1,1,0,0,0,0|1,1,0]=4 8778 B9R0.46 C[C@@H](CO)COCCON 34a_100000700252_100000059175 [1,1,0,0,0,0|2,0,0]=4 8779 B9R0.46 NOCCOCC(O)CO 34a_100000700252_100011219619 [1,1,0,0,0,0|2,0,0]=4 8780 B9R0.46 NOCCOC[C@@H](O)CF 34a_100000700252_100015614560 [1,1,0,0,0,0|2,0,0]=4 8781 B9R0.46 NOCCOC[C@@H](O)CO 34a_100000700252_100009815848 [1,1,0,0,0,0|2,0,0]=4 8782 B9R0.46 O=C(CF)CCOCCO 1458a_100011229844_100015361967 [1,1,0,0,0,0|2,0,0]=4 8783 B9R0.46 O=C(CO)CCOCCO 1458a_100000210174_100011215305 [1,1,0,0,0,0|2,0,0]=4 8784 B11R0.2 CC(C)OC(=O)COCCON 34a_100000700252_100011215430 [0,2,0,0,0,0|1,0,1]=4 8785 B11R0.2 CCCCCCC(C)OC(C)C 34a_100000210265_100000210206 [0,2,0,0,0,0|2,0,0]=4 8786 B11R0.2 CCCCCCC(C)OC(C)C 34a_100000212225_100011215978 [0,2,0,0,0,0|2,0,0]=4 8787 B11R0.2 CCCCCCC(C)OC(C)C 7a_100000210265_100000210206 [0,2,0,0,0,0|2,0,0]=4 8788 B11R0.2 CCCCCOC(C)CC(C)C 34a_100000210253_100000731052 [0,2,0,0,0,0|2,0,0]=4 8789 B11R0.2 CCCCCOC(C)CC(C)C 34a_100000211805_100000718602 [0,2,0,0,0,0|2,0,0]=4 8790 B11R0.2 CCCCCOC(C)CC(C)C 7a_100000210253_100000731052 [0,2,0,0,0,0|2,0,0]=4 8791 B11R0.2 CCCCCOC(C)CC(C)C 7a_100000211805_100000210326 [0,2,0,0,0,0|2,0,0]=4 8792 B11R0.2 CCCCOCC(=O)OC(C)C 34a_100000210227_100011215430 [0,2,0,0,0,0|1,0,1]=4 8793 B11R0.2 CCCCOCC(=O)OC(C)C 7a_100000210227_100011215430 [0,2,0,0,0,0|1,0,1]=4 8794 B11R0.2 CCCCOCC(C)OC(C)C 34a_100011217071_100000210206 [0,2,0,0,0,0|1,0,0]=3 8795 B11R0.2 CCCCOCC(C)OC(C)C 7a_100011217071_100000210206 [0,2,0,0,0,0|1,0,0]=3 8796 B11R0.2 CCCCOC[C@@H](N)CC(C)C 34a_100011830311_100000210210 [0,2,0,0,0,0|2,0,0]=4 8797 B11R0.2 CCOCCNC(C)CC(C)C 2230a_100000692259_100011215890 [0,2,0,0,0,0|2,0,0]=4 8798 B11R0.2 CCOCCNC(C)CC(C)C 2230a_102516460346_100000731052 [0,2,0,0,0,0|2,0,0]=4 8799 B11R0.2 CCOCCNC(C)CC(C)C 34a_102516460346_100000731052 [0,2,0,0,0,0|2,0,0]=4 8800 B11R0.2 CCOCCOC(=O)CC(=O)C 1458a_100000070787_200000101388 [0,2,0,0,0,0|1,0,1]=4 8801 B11R0.2 CCOCCOC(=O)CC(=O)C 34a_100121572206_100000102702 [0,2,0,0,0,0|1,0,1]=4 8802 B11R0.2 CCOCCOC(=O)CN(C)C 2230a_100102631434_200000101388 [0,2,0,0,0,0|1,0,1]=4 8803 B11R0.2 CCOCCOC(=O)CN(C)C 269982a_100102631434_200000101388 [0,2,0,0,0,0|1,0,1]=4 8804 B11R0.2 CCOCCOC(C)C=C(C)C 34a_100000717055_100000210147 [0,2,0,0,0,0|1,0,1]=4 8805 B11R0.2 CCOCCOC(C)CC(C)C 34a_100000210136_100000731052 [0,2,0,0,0,0|1,0,0]=3 8806 B11R0.2 CCOCCOC(C)CC(C)C 34a_100000211805_100000210147 [0,2,0,0,0,0|1,0,0]=3 8807 B11R0.2 CCOCCOC(C)CC(C)C 7a_100000210136_100000731052 [0,2,0,0,0,0|1,0,0]=3 8808 B11R0.2 CCOCCOC(C)CC(C)C 7a_100000211805_100011215890 [0,2,0,0,0,0|1,0,0]=3 8809 B11R0.2 CCOCCSC(C)CC(C)C 62a_100000210147_100000731052 [0,2,0,0,0,0|1,1,0]=4 8810 B11R0.2 CCOCCSC(C)CC(C)C 62a_100000731052_100011215890 [0,2,0,0,0,0|1,1,0]=4 8811 B11R0.2 CCOCCSC(C)CN(C)C 62a_100000210147_100020606517 [0,2,0,0,0,0|1,1,0]=4 8812 B11R0.2 CCOCCSC(C)CN(C)C 62a_100020606517_100011215890 [0,2,0,0,0,0|1,1,0]=4 8813 B11R0.2 CCSCCOC(C)CC(C)C 34a_100000211805_100000757381 [0,2,0,0,0,0|1,1,0]=4 8814 B11R0.2 CCSCCOC(C)CC(C)C 34a_100000212035_100000731052 [0,2,0,0,0,0|1,1,0]=4 8815 B11R0.2 CCSCCOC(C)CC(C)C 7a_100000211805_100000757381 [0,2,0,0,0,0|1,1,0]=4 8816 B11R0.2 CCSCCOC(C)CC(C)C 7a_100000212035_100000731052 [0,2,0,0,0,0|1,1,0]=4 8817 B11R0.2 COCCNCC(=O)OC(C)C 2230a_100000209980_100011215430 [0,2,0,0,0,0|1,0,1]=4 8818 B11R0.2 COCCOCC(=O)CC(C)C 1458a_100000211095_100000210624 [0,2,0,0,0,0|1,0,1]=4 8819 B11R0.2 COCCOCC(=O)CC(C)O 1458a_100000211095_100011218427 [0,2,0,0,0,0|1,0,1]=4 8820 B11R0.2 COCCOCC(=O)NC(C)C 11a_100138425928_100000211095 [0,2,0,0,0,0|1,0,1]=4 8821 B11R0.2 COCCOCC(=O)NC(C)C 1626a_100138425928_100000211095 [0,2,0,0,0,0|1,0,1]=4 8822 B11R0.2 COCCOCC(=O)NC(C)C 240690a_100138425928_100000211095 [0,2,0,0,0,0|1,0,1]=4 8823 B11R0.2 COCCOCC(=O)NC(C)C 34a_100000210237_100000183996 [0,2,0,0,0,0|1,0,1]=4 8824 B11R0.2 COCCOCC(=O)NC(C)C 527a_100138425928_100000211095 [0,2,0,0,0,0|1,0,1]=4 8825 B11R0.2 COCCOCC(=O)OC(C)C 34a_100000210237_100011215430 [0,2,0,0,0,0|0,0,1]=3 8826 B11R0.2 COCCOCN(C)CC(C)C 2230a_100000747067_100000231047 [0,2,0,0,0,0|2,0,0]=4 8827 B11R0.2 COCCOCN(C)CC(C)C 269982a_100000747067_100000231047 [0,2,0,0,0,0|2,0,0]=4 8828 B11R0.2 COCCOCN(C)CC(C)O 2230a_100000227577_100000231047 [0,2,0,0,0,0|2,0,0]=4 8829 B11R0.2 COCCOCN(C)CC(C)O 269982a_100000227577_100000231047 [0,2,0,0,0,0|2,0,0]=4 8830 B11R0.2 COCCOC[C@@H](N)CC(C)C 34a_100011830311_100011201679 [0,2,0,0,0,0|1,0,0]=3 8831 B11R0.2 COCCSCC(=O)OC(C)C 62a_100000233755_100011215430 [0,2,0,0,0,0|0,1,1]=4 8832 B11R0.2 COCCSCC(=O)OC(C)C 62a_100011215430_100000233755 [0,2,0,0,0,0|0,1,1]=4 8833 B11R0.2 CSCCOCC(=O)OC(C)C 34a_100000230434_100011215430 [0,2,0,0,0,0|0,1,1]=4 8834 B11R0.2 CSCCOCC(=O)OC(C)C 7a_100000230434_100011215430 [0,2,0,0,0,0|0,1,1]=4 8835 B11R0.2 CSCCOC[C@@H](N)CC(C)C 34a_100011830311_100000212216 [0,2,0,0,0,0|1,1,0]=4 8836 B11R0.4 C#CCC(=O)CCOCCOC 1458a_100000745395_100000184674 [0,2,0,0,0,0|1,0,1]=4 8837 B11R0.4 C#CCC(=O)CCOCCOC 1458a_100011220946_100000695917 [0,2,0,0,0,0|1,0,1]=4 8838 B11R0.4 C#CCC(C)OCCCOCC 34a_100000685586_100012232248 [0,2,0,0,0,0|1,0,1]=4 8839 B11R0.4 C#CCC(C)OCCCOCC 7a_100000685586_100012232248 [0,2,0,0,0,0|1,0,1]=4 8840 B11R0.4 C#CCC(C)OCCOCCC 34a_100000685586_100011215938 [0,2,0,0,0,0|1,0,1]=4 8841 B11R0.4 C#CCC(C)OCCOCCC 7a_100000685586_100011215938 [0,2,0,0,0,0|1,0,1]=4 8842 B11R0.4 C#CCC(C)OCCOCCO 34a_100000685586_100000692535 [0,2,0,0,0,0|1,0,1]=4 8843 B11R0.4 C#CCC(C)OCCOCCO 7a_100000685586_100011215305 [0,2,0,0,0,0|1,0,1]=4 8844 B11R0.4 C#CCCCCOC(C)COC 34a_100000766709_100000765312 [0,2,0,0,0,0|1,0,1]=4 8845 B11R0.4 C#CCCCCOC(C)COC 7a_100000766709_100000765312 [0,2,0,0,0,0|1,0,1]=4 8846 B11R0.4 C#CCCCCO[C@H](C)COC 34a_100011934205_100010269958 [0,2,0,0,0,0|1,0,1]=4 8847 B11R0.4 C#CCCOCCC(=O)OCC 34a_100011215631_100000765890 [0,2,0,0,0,0|1,0,1]=4 8848 B11R0.4 C#CCN(C)CCOCCOC 2230a_100000225692_100000695917 [0,2,0,0,0,0|1,0,1]=4 8849 B11R0.4 C#CCN(C)CCOCCOC 34a_100000225692_100000695917 [0,2,0,0,0,0|1,0,1]=4 8850 B11R0.4 C#CCOCCNC(C)COC 2230a_100000700922_100000765312 [0,2,0,0,0,0|1,0,1]=4 8851 B11R0.4 C#CCOCCNC(C)COC 34a_100000700922_100000765312 [0,2,0,0,0,0|1,0,1]=4 8852 B11R0.4 C#CCOCCN[C@H](C)COC 2230a_100000764878_100010402529 [0,2,0,0,0,0|1,0,1]=4 8853 B11R0.4 C#CCOCCOC(C)CCC 34a_100000054580_100000766640 [0,2,0,0,0,0|1,0,1]=4 8854 B11R0.4 C#CCOCCOC(C)CCC 34a_100000764384_100010402529 [0,2,0,0,0,0|1,0,1]=4 8855 B11R0.4 C#CCOCCOC(C)CCC 7a_100000054580_100000766640 [0,2,0,0,0,0|1,0,1]=4 8856 B11R0.4 C#CCOCCOC(C)CCC 7a_100000764384_100010402529 [0,2,0,0,0,0|1,0,1]=4 8857 B11R0.4 C#CCOCCOC(C)COC 34a_100000054580_100000765312 [0,2,0,0,0,0|0,0,1]=3 8858 B11R0.4 C#CCOCCOC(C)COC 7a_100000054580_100000765312 [0,2,0,0,0,0|0,0,1]=3 8859 B11R0.4 C#CCOCCO[C@H](C)COC 34a_100011934205_100010402529 [0,2,0,0,0,0|0,0,1]=3 8860 B11R0.4 C#CCOCCSC(C)COC 62a_100000765312_100010402529 [0,2,0,0,0,0|0,1,1]=4 8861 B11R0.4 C#CCOCCSC(C)COC 62a_100010402529_100000765312 [0,2,0,0,0,0|0,1,1]=4 8862 B11R0.4 C/C=C/C(C)OCCCOCC 34a_200102604097_100012232248 [0,2,0,0,0,0|1,0,1]=4 8863 B11R0.4 C/C=C/C(C)OCCOCCC 34a_200102604097_100011215938 [0,2,0,0,0,0|1,0,1]=4 8864 B11R0.4 C/C=C/C(C)OCCOCCO 34a_200102604097_100000692535 [0,2,0,0,0,0|1,0,1]=4 8865 B11R0.4 C/C=C/CCOCC(=O)OCC 34a_100016278192_100000188475 [0,2,0,0,0,0|1,0,1]=4 8866 B11R0.4 C/C=C/CCOCC(C)CCC 34a_100016278192_100011216630 [0,2,0,0,0,0|2,0,0]=4 8867 B11R0.4 C/C=C/CCOCC(O)COC 34a_100016278192_100011215053 [0,2,0,0,0,0|1,0,1]=4 8868 B11R0.4 C/C=C/COCCC(=O)OCC 34a_100016270725_100000765890 [0,2,0,0,0,0|1,0,1]=4 8869 B11R0.4 C=CCC(=O)CCOCCOC 1458a_100000210193_100000695917 [0,2,0,0,0,0|1,0,1]=4 8870 B11R0.4 C=CCC(=O)CCOCCOC 1458a_100000745395_100000210623 [0,2,0,0,0,0|1,0,1]=4 8871 B11R0.4 C=CCC(C)COCCOCC 34a_100009832082_100000210147 [0,2,0,0,0,0|1,0,1]=4 8872 B11R0.4 C=CCC(C)COCCOCC 7a_100009832082_100011215890 [0,2,0,0,0,0|1,0,1]=4 8873 B11R0.4 C=CCCCCOC(C)COC 34a_100000766645_100000765312 [0,2,0,0,0,0|1,0,1]=4 8874 B11R0.4 C=CCCCCOC(C)COC 7a_100000766645_100000765312 [0,2,0,0,0,0|1,0,1]=4 8875 B11R0.4 C=CCCCCO[C@H](C)COC 34a_100011934205_100011215482 [0,2,0,0,0,0|1,0,1]=4 8876 B11R0.4 C=CCCOCCC(=O)OCC 34a_100011205117_100000765890 [0,2,0,0,0,0|1,0,1]=4 8877 B11R0.4 C=CCN(C)CCOCCOC 2230a_100000225617_100000695917 [0,2,0,0,0,0|1,0,1]=4 8878 B11R0.4 C=CCN(C)CCOCCOC 269982a_100000225617_100000695917 [0,2,0,0,0,0|1,0,1]=4 8879 B11R0.4 C=CCOCCOC(C)CCC 34a_100000037705_100000766640 [0,2,0,0,0,0|1,0,1]=4 8880 B11R0.4 C=CCOCCOC(C)CCC 7a_100000037705_100000766640 [0,2,0,0,0,0|1,0,1]=4 8881 B11R0.4 C=CCOCCOC(C)COC 34a_100000037705_100000765312 [0,2,0,0,0,0|0,0,1]=3 8882 B11R0.4 C=CCOCCOC(C)COC 7a_100000037705_100000765312 [0,2,0,0,0,0|0,0,1]=3 8883 B11R0.4 C=CC[C@@H](C)OCCCOCC 34a_100000731007_100012232248 [0,2,0,0,0,0|1,0,1]=4 8884 B11R0.4 C=CC[C@@H](C)OCCCOCC 7a_100000731007_100012232248 [0,2,0,0,0,0|1,0,1]=4 8885 B11R0.4 C=CC[C@@H](C)OCCOCCC 34a_100000731007_100011215938 [0,2,0,0,0,0|1,0,1]=4 8886 B11R0.4 C=CC[C@@H](C)OCCOCCC 7a_100000731007_100011215938 [0,2,0,0,0,0|1,0,1]=4 8887 B11R0.4 C=CC[C@@H](C)OCCOCCO 34a_100000731007_100000692535 [0,2,0,0,0,0|1,0,1]=4 8888 B11R0.4 C=CC[C@@H](C)OCCOCCO 7a_100000731007_100011215305 [0,2,0,0,0,0|1,0,1]=4 8889 B11R0.4 C=CC[C@@H](N)COCCOCC 34a_100020615467_100000210147 [0,2,0,0,0,0|1,0,1]=4 8890 B11R0.4 C=COC(=O)COCCOCC 34a_100000210136_100000036128 [0,2,0,0,0,0|0,0,2]=4 8891 B11R0.4 C=COCCOCC(=O)OCC 34a_100000033082_100000188475 [0,2,0,0,0,0|0,0,2]=4 8892 B11R0.4 C=COCCOCC(C)CCC 34a_100000033082_100011216630 [0,2,0,0,0,0|1,0,1]=4 8893 B11R0.4 C=COCCOCC(C)CCC 34a_100000688023_100000039644 [0,2,0,0,0,0|1,0,1]=4 8894 B11R0.4 C=COCCOCC(C)CCC 7a_100000688023_100000039644 [0,2,0,0,0,0|1,0,1]=4 8895 B11R0.4 C=COCCOCC(N)COC 34a_100000724102_100000039644 [0,2,0,0,0,0|0,0,2]=4 8896 B11R0.4 C=COCCOCC(O)COC 34a_100000033082_100011215053 [0,2,0,0,0,0|0,0,2]=4 8897 B11R0.4 C=COCCOC[C@@H](N)CCC 34a_100000732646_100000039644 [0,2,0,0,0,0|1,0,1]=4 8898 B11R0.4 CC#CC(=O)CCOCCOC 1458a_100000763181_100000695917 [0,2,0,0,0,0|1,0,1]=4 8899 B11R0.4 CC#CC(C)OCCCOCC 34a_100011216543_100012232248 [0,2,0,0,0,0|1,0,1]=4 8900 B11R0.4 CC#CC(C)OCCOCCC 34a_100011216543_100011215938 [0,2,0,0,0,0|1,0,1]=4 8901 B11R0.4 CC#CC(C)OCCOCCO 34a_100011216543_100000692535 [0,2,0,0,0,0|1,0,1]=4 8902 B11R0.4 CC#CCCOCC(=O)OCC 34a_100000750427_100000188475 [0,2,0,0,0,0|1,0,1]=4 8903 B11R0.4 CC#CCCOCC(C)CCC 34a_100000750427_100011216630 [0,2,0,0,0,0|2,0,0]=4 8904 B11R0.4 CC#CCCOCC(O)COC 34a_100000750427_100011215053 [0,2,0,0,0,0|1,0,1]=4 8905 B11R0.4 CC#CCOCCC(=O)OCC 34a_100000761923_100000765890 [0,2,0,0,0,0|1,0,1]=4 8906 B11R0.4 CC(CC#N)OCCOCCBr 7a_100000692535_100009813641 [0,2,0,0,0,0|2,0,0]=4 8907 B11R0.4 CC(CC#N)OCCOCCCl 7a_100011215305_100009813641 [0,2,0,0,0,0|2,0,0]=4 8908 B11R0.4 CC(CC#N)OCCOCCF 7a_200015357709_100009813641 [0,2,0,0,0,0|2,0,0]=4 8909 B11R0.4 CC(CC#N)OCCOCCI 7a_100012149058_100009813641 [0,2,0,0,0,0|2,0,0]=4 8910 B11R0.4 CC(CCBr)OCCOCCO 34a_100012276601_100000692535 [0,2,0,0,0,0|2,0,0]=4 8911 B11R0.4 CC(CCO)OCCOCCBr 34a_100000692535_100009893172 [0,2,0,0,0,0|2,0,0]=4 8912 B11R0.4 CC(CCO)OCCOCCBr 7a_100000692535_100009893172 [0,2,0,0,0,0|2,0,0]=4 8913 B11R0.4 CC(CCO)OCCOCCCl 34a_100011215305_100009893172 [0,2,0,0,0,0|2,0,0]=4 8914 B11R0.4 CC(CCO)OCCOCCCl 7a_100011215305_100009893172 [0,2,0,0,0,0|2,0,0]=4 8915 B11R0.4 CC(CCO)OCCOCCF 34a_200015357709_100009893172 [0,2,0,0,0,0|2,0,0]=4 8916 B11R0.4 CC(CCO)OCCOCCF 7a_200015357709_100009893172 [0,2,0,0,0,0|2,0,0]=4 8917 B11R0.4 CC(CCO)OCCOCCI 34a_100012149058_100009893172 [0,2,0,0,0,0|2,0,0]=4 8918 B11R0.4 CC(CCO)OCCOCCI 7a_100012149058_100009893172 [0,2,0,0,0,0|2,0,0]=4 8919 B11R0.4 CC(CCO)OCCOCCN 34a_100000211614_100009893172 [0,2,0,0,0,0|2,0,0]=4 8920 B11R0.4 CC/C=C\CCN[C@H](C)COC 2230a_100000764878_100015370543 [0,2,0,0,0,0|2,0,0]=4 8921 B11R0.4 CC/C=C\CCOC(C)CCC 34a_100000764384_100015370543 [0,2,0,0,0,0|2,0,0]=4 8922 B11R0.4 CC/C=C\CCOC(C)CCC 34a_100016288707_100000766640 [0,2,0,0,0,0|2,0,0]=4 8923 B11R0.4 CC/C=C\CCOC(C)CCC 7a_100000764384_100015370543 [0,2,0,0,0,0|2,0,0]=4 8924 B11R0.4 CC/C=C\CCOC(C)CCC 7a_100016288707_100000766640 [0,2,0,0,0,0|2,0,0]=4 8925 B11R0.4 CC/C=C\CCOC(C)COC 34a_100016288707_100000765312 [0,2,0,0,0,0|1,0,0]=3 8926 B11R0.4 CC/C=C\CCOC(C)COC 7a_100016288707_100000765312 [0,2,0,0,0,0|1,0,0]=3 8927 B11R0.4 CC/C=C\CCO[C@H](C)COC 34a_100011934205_100015370543 [0,2,0,0,0,0|1,0,0]=3 8928 B11R0.4 CC/C=C\CCSC(C)COC 62a_100000765312_100015370543 [0,2,0,0,0,0|1,1,0]=4 8929 B11R0.4 CC/C=C\CCSC(C)COC 62a_100015370543_100000765312 [0,2,0,0,0,0|1,1,0]=4 8930 B11R0.4 CC/C=C\COCC(N)COC 34a_100000724102_100103147603 [0,2,0,0,0,0|1,0,1]=4 8931 B11R0.4 CC/C=C\COCC(O)COC 34a_100016268518_100011215053 [0,2,0,0,0,0|1,0,1]=4 8932 B11R0.4 CC=C=CCCOC(C)COC 34a_100011020354_100000765312 [0,2,0,0,0,0|1,0,1]=4 8933 B11R0.4 CC=CC(=O)CCOCCOC 1458a_100000210699_100000695917 [0,2,0,0,0,0|1,0,1]=4 8934 B11R0.4 CC=CCCCOC(C)COC 34a_100020645299_100000765312 [0,2,0,0,0,0|1,0,1]=4 8935 B11R0.4 CCC#CCCOC(C)CCC 34a_100000036655_100000766640 [0,2,0,0,0,0|2,0,0]=4 8936 B11R0.4 CCC#CCCOC(C)CCC 7a_100000036655_100000766640 [0,2,0,0,0,0|2,0,0]=4 8937 B11R0.4 CCC#CCCOC(C)COC 34a_100000036655_100000765312 [0,2,0,0,0,0|1,0,0]=3 8938 B11R0.4 CCC#CCCOC(C)COC 7a_100000036655_100000765312 [0,2,0,0,0,0|1,0,0]=3 8939 B11R0.4 CCC#CCOCC(N)COC 34a_100000724102_100009813939 [0,2,0,0,0,0|1,0,1]=4 8940 B11R0.4 CCC#CCOCC(O)COC 34a_100000032950_100011215053 [0,2,0,0,0,0|1,0,1]=4 8941 B11R0.4 CCC/C=C/COC(C)COC 34a_100016278788_100000765312 [0,2,0,0,0,0|1,0,1]=4 8942 B11R0.4 CCC/C=C/COC(C)COC 7a_100016278788_100000765312 [0,2,0,0,0,0|1,0,1]=4 8943 B11R0.4 CCCC#CCOC(C)COC 34a_100000034806_100000765312 [0,2,0,0,0,0|1,0,1]=4 8944 B11R0.4 CCCC#CCOC(C)COC 7a_100000034806_100000765312 [0,2,0,0,0,0|1,0,1]=4 8945 B11R0.4 CCCC(=O)CCCCCOC 1458a_100011935119_100000210303 [0,2,0,0,0,0|2,0,0]=4 8946 B11R0.4 CCCC(=O)CCOCCOC 1458a_100000211992_100000695917 [0,2,0,0,0,0|1,0,0]=3 8947 B11R0.4 CCCC(=O)CCOCCOC 1458a_100000745395_100000210303 [0,2,0,0,0,0|1,0,0]=3 8948 B11R0.4 CCCC(=O)CNCCOCC 2230a_102516460346_100000747444 [0,2,0,0,0,0|2,0,0]=4 8949 B11R0.4 CCCC(=O)COCCOCC 7a_100000210136_100000747444 [0,2,0,0,0,0|1,0,0]=3 8950 B11R0.4 CCCC(=O)COCCSCC 7a_100000212035_100000747444 [0,2,0,0,0,0|1,1,0]=4 8951 B11R0.4 CCCC(=O)CSCCOCC 62a_100000210147_100000747444 [0,2,0,0,0,0|1,1,0]=4 8952 B11R0.4 CCCC(=O)CSCCOCC 62a_100000747444_100011215890 [0,2,0,0,0,0|1,1,0]=4 8953 B11R0.4 CCCC(=O)OCOCCOC 34a_100000210237_100000034017 [0,2,0,0,0,0|1,0,1]=4 8954 B11R0.4 CCCC(=O)OCSCOCC 62a_100000739092_100000034017 [0,2,0,0,0,0|1,0,1]=4 8955 B11R0.4 CCCC(C)CCCOCCF 34a_100011713154_100011217306 [0,2,0,0,0,0|2,0,0]=4 8956 B11R0.4 CCCC(C)CCCOCCF 7a_100011713154_100011217306 [0,2,0,0,0,0|2,0,0]=4 8957 B11R0.4 CCCC(C)CCCOCCO 34a_100011713154_100000211926 [0,2,0,0,0,0|2,0,0]=4 8958 B11R0.4 CCCC(C)CCCOCCO 7a_100011713154_100000211926 [0,2,0,0,0,0|2,0,0]=4 8959 B11R0.4 CCCC(C)CCCOCSC 34a_100011713154_100011218213 [0,2,0,0,0,0|2,0,0]=4 8960 B11R0.4 CCCC(C)CCOCCOC 34a_100011217855_100011201679 [0,2,0,0,0,0|1,0,0]=3 8961 B11R0.4 CCCC(C)CCOCCOC 7a_100011217855_100000233755 [0,2,0,0,0,0|1,0,0]=3 8962 B11R0.4 CCCC(C)CCOCCSC 34a_100011217855_100000212216 [0,2,0,0,0,0|1,1,0]=4 8963 B11R0.4 CCCC(C)CCOCCSC 7a_100011217855_100000212216 [0,2,0,0,0,0|1,1,0]=4 8964 B11R0.4 CCCC(C)CNCCCOC 270004a_100150723488_100000243154 [0,2,0,0,0,0|2,0,0]=4 8965 B11R0.4 CCCC(C)CNCCCOC 34a_100150723488_100011216630 [0,2,0,0,0,0|2,0,0]=4 8966 B11R0.4 CCCC(C)CNCCOCC 2230a_102516460346_100011216630 [0,2,0,0,0,0|2,0,0]=4 8967 B11R0.4 CCCC(C)CNCCOCC 270004a_102516460346_100000243154 [0,2,0,0,0,0|2,0,0]=4 8968 B11R0.4 CCCC(C)CNCCOCC 34a_102516460346_100011216630 [0,2,0,0,0,0|2,0,0]=4 8969 B11R0.4 CCCC(C)COCCCCBr 34a_100011216708_100011216630 [0,2,0,0,0,0|2,0,0]=4 8970 B11R0.4 CCCC(C)COCCCCCl 34a_100000210776_100011216630 [0,2,0,0,0,0|2,0,0]=4 8971 B11R0.4 CCCC(C)COCCCCCl 7a_100000210776_100011216630 [0,2,0,0,0,0|2,0,0]=4 8972 B11R0.4 CCCC(C)COCCCCF 34a_100000688023_100000729493 [0,2,0,0,0,0|2,0,0]=4 8973 B11R0.4 CCCC(C)COCCCCF 34a_100011995726_100011216630 [0,2,0,0,0,0|2,0,0]=4 8974 B11R0.4 CCCC(C)COCCCCF 7a_100000688023_100000729493 [0,2,0,0,0,0|2,0,0]=4 8975 B11R0.4 CCCC(C)COCCCCF 7a_100011995726_100011216630 [0,2,0,0,0,0|2,0,0]=4 8976 B11R0.4 CCCC(C)COCCCCI 34a_200012148704_100011216630 [0,2,0,0,0,0|2,0,0]=4 8977 B11R0.4 CCCC(C)COCCCCN 34a_100000750430_100011216630 [0,2,0,0,0,0|2,0,0]=4 8978 B11R0.4 CCCC(C)COCCCCO 34a_100000688023_100011216708 [0,2,0,0,0,0|2,0,0]=4 8979 B11R0.4 CCCC(C)COCCCCO 7a_100000688023_100000210776 [0,2,0,0,0,0|2,0,0]=4 8980 B11R0.4 CCCC(C)COCCCNC 34a_100000213112_100011216630 [0,2,0,0,0,0|2,0,0]=4 8981 B11R0.4 CCCC(C)COCCCOC 34a_100000688023_100000740836 [0,2,0,0,0,0|1,0,0]=3 8982 B11R0.4 CCCC(C)COCCCOC 34a_100000740835_100011216630 [0,2,0,0,0,0|1,0,0]=3 8983 B11R0.4 CCCC(C)COCCCOC 7a_100000688023_100000740836 [0,2,0,0,0,0|1,0,0]=3 8984 B11R0.4 CCCC(C)COCCCSC 34a_100000690336_100011216630 [0,2,0,0,0,0|1,1,0]=4 8985 B11R0.4 CCCC(C)COCCCSC 7a_100000690336_100011216630 [0,2,0,0,0,0|1,1,0]=4 8986 B11R0.4 CCCC(C)COCCOCC 34a_100000210136_100011216630 [0,2,0,0,0,0|1,0,0]=3 8987 B11R0.4 CCCC(C)COCCOCC 34a_100000688023_100000210147 [0,2,0,0,0,0|1,0,0]=3 8988 B11R0.4 CCCC(C)COCCOCC 7a_100000210136_100011216630 [0,2,0,0,0,0|1,0,0]=3 8989 B11R0.4 CCCC(C)COCCOCC 7a_100000688023_100011215890 [0,2,0,0,0,0|1,0,0]=3 8990 B11R0.4 CCCC(C)COCCSCC 34a_100000212035_100011216630 [0,2,0,0,0,0|1,1,0]=4 8991 B11R0.4 CCCC(C)COCCSCC 34a_100000688023_100000757381 [0,2,0,0,0,0|1,1,0]=4 8992 B11R0.4 CCCC(C)COCCSCC 7a_100000212035_100011216630 [0,2,0,0,0,0|1,1,0]=4 8993 B11R0.4 CCCC(C)COCCSCC 7a_100000688023_100000757381 [0,2,0,0,0,0|1,1,0]=4 8994 B11R0.4 CCCC(C)CSCCCOC 62a_100000709357_100011216630 [0,2,0,0,0,0|1,1,0]=4 8995 B11R0.4 CCCC(C)CSCCCOC 62a_100011216630_100000709357 [0,2,0,0,0,0|1,1,0]=4 8996 B11R0.4 CCCC(C)CSCCOCC 62a_100000210147_100011216630 [0,2,0,0,0,0|1,1,0]=4 8997 B11R0.4 CCCC(C)CSCCOCC 62a_100011216630_100011215890 [0,2,0,0,0,0|1,1,0]=4 8998 B11R0.4 CCCC(C)NCCCCOC 2230a_100000741246_100000730899 [0,2,0,0,0,0|2,0,0]=4 8999 B11R0.4 CCCC(C)NCCCOCC 2230a_100000210961_100000766640 [0,2,0,0,0,0|2,0,0]=4 9000 B11R0.4 CCCC(C)NCCCOCC 2230a_100000741246_100012232248 [0,2,0,0,0,0|2,0,0]=4 9001 B11R0.4 CCCC(C)NCCCOCC 270004a_100000210961_100000211909 [0,2,0,0,0,0|2,0,0]=4 9002 B11R0.4 CCCC(C)NCCCOCC 34a_100000210961_100000766640 [0,2,0,0,0,0|2,0,0]=4 9003 B11R0.4 CCCC(C)NCCOCCO 2230a_100000211614_100000766640 [0,2,0,0,0,0|2,0,0]=4 9004 B11R0.4 CCCC(C)NCCOCCO 2230a_100000741246_100011215305 [0,2,0,0,0,0|2,0,0]=4 9005 B11R0.4 CCCC(C)NCCOCCO 270004a_100000211614_100000211909 [0,2,0,0,0,0|2,0,0]=4 9006 B11R0.4 CCCC(C)NCCOCCO 34a_100000211614_100000766640 [0,2,0,0,0,0|2,0,0]=4 9007 B11R0.4 CCCC(C)NCOCCOC 2230a_100000741246_100000231047 [0,2,0,0,0,0|1,0,0]=3 9008 B11R0.4 CCCC(C)OCCCCCBr 34a_100000746331_100000766640 [0,2,0,0,0,0|2,0,0]=4 9009 B11R0.4 CCCC(C)OCCCCCBr 7a_100000746331_100000766640 [0,2,0,0,0,0|2,0,0]=4 9010 B11R0.4 CCCC(C)OCCCCCCl 34a_100000746330_100000766640 [0,2,0,0,0,0|2,0,0]=4 9011 B11R0.4 CCCC(C)OCCCCCCl 7a_100000746330_100000766640 [0,2,0,0,0,0|2,0,0]=4 9012 B11R0.4 CCCC(C)OCCCCCF 34a_100000764384_100000729378 [0,2,0,0,0,0|2,0,0]=4 9013 B11R0.4 CCCC(C)OCCCCCF 7a_100000764384_100000729378 [0,2,0,0,0,0|2,0,0]=4 9014 B11R0.4 CCCC(C)OCCCCCI 34a_200012148887_100000766640 [0,2,0,0,0,0|2,0,0]=4 9015 B11R0.4 CCCC(C)OCCCCCI 7a_200012148887_100000766640 [0,2,0,0,0,0|2,0,0]=4 9016 B11R0.4 CCCC(C)OCCCCCN 34a_100000762737_100000766640 [0,2,0,0,0,0|2,0,0]=4 9017 B11R0.4 CCCC(C)OCCCCCO 34a_100000764384_100000746330 [0,2,0,0,0,0|2,0,0]=4 9018 B11R0.4 CCCC(C)OCCCCCO 7a_100000764384_100000746330 [0,2,0,0,0,0|2,0,0]=4 9019 B11R0.4 CCCC(C)OCCCCOC 34a_100000740925_100000766640 [0,2,0,0,0,0|2,0,0]=4 9020 B11R0.4 CCCC(C)OCCCCOC 34a_100000764384_100000755781 [0,2,0,0,0,0|2,0,0]=4 9021 B11R0.4 CCCC(C)OCCCCOC 7a_100000764384_100000730899 [0,2,0,0,0,0|2,0,0]=4 9022 B11R0.4 CCCC(C)OCCCCSC 34a_100011217163_100000766640 [0,2,0,0,0,0|2,0,0]=4 9023 B11R0.4 CCCC(C)OCCCCSC 7a_100011217163_100000766640 [0,2,0,0,0,0|2,0,0]=4 9024 B11R0.4 CCCC(C)OCCCOCC 34a_100000757476_100000766640 [0,2,0,0,0,0|1,0,0]=3 9025 B11R0.4 CCCC(C)OCCCOCC 34a_100000764384_100012232248 [0,2,0,0,0,0|1,0,0]=3 9026 B11R0.4 CCCC(C)OCCCOCC 7a_100000757476_100000766640 [0,2,0,0,0,0|1,0,0]=3 9027 B11R0.4 CCCC(C)OCCCOCC 7a_100000764384_100012232248 [0,2,0,0,0,0|1,0,0]=3 9028 B11R0.4 CCCC(C)OCCCSCC 34a_100011216438_100000766640 [0,2,0,0,0,0|1,1,0]=4 9029 B11R0.4 CCCC(C)OCCCSCC 7a_100011216438_100000766640 [0,2,0,0,0,0|1,1,0]=4 9030 B11R0.4 CCCC(C)OCCOCC#N 7a_100000764384_200000047693 [0,2,0,0,0,0|1,0,1]=4 9031 B11R0.4 CCCC(C)OCCOCCBr 34a_100000692535_100000766640 [0,2,0,0,0,0|1,0,0]=3 9032 B11R0.4 CCCC(C)OCCOCCBr 7a_100000692535_100000766640 [0,2,0,0,0,0|1,0,0]=3 9033 B11R0.4 CCCC(C)OCCOCCCl 34a_100011215305_100000766640 [0,2,0,0,0,0|1,0,0]=3 9034 B11R0.4 CCCC(C)OCCOCCCl 7a_100011215305_100000766640 [0,2,0,0,0,0|1,0,0]=3 9035 B11R0.4 CCCC(C)OCCOCCF 34a_200015357709_100000766640 [0,2,0,0,0,0|1,0,0]=3 9036 B11R0.4 CCCC(C)OCCOCCF 7a_200015357709_100000766640 [0,2,0,0,0,0|1,0,0]=3 9037 B11R0.4 CCCC(C)OCCOCCI 34a_100012149058_100000766640 [0,2,0,0,0,0|1,0,0]=3 9038 B11R0.4 CCCC(C)OCCOCCI 7a_100012149058_100000766640 [0,2,0,0,0,0|1,0,0]=3 9039 B11R0.4 CCCC(C)OCCOCCN 34a_100000211614_100000766640 [0,2,0,0,0,0|1,0,0]=3 9040 B11R0.4 CCCC(C)OCCOCCO 34a_100000764384_100000692535 [0,2,0,0,0,0|1,0,0]=3 9041 B11R0.4 CCCC(C)OCCOCCO 7a_100000764384_100011215305 [0,2,0,0,0,0|1,0,0]=3 9042 B11R0.4 CCCC(C)SCCCCOC 62a_100000730899_100000766640 [0,2,0,0,0,0|2,0,0]=4 9043 B11R0.4 CCCC(C)SCCCCOC 62a_100000766640_100000730899 [0,2,0,0,0,0|2,0,0]=4 9044 B11R0.4 CCCC(C)SCCCOCC 62a_100000766640_100012232248 [0,2,0,0,0,0|1,1,0]=4 9045 B11R0.4 CCCC(C)SCCCOCC 62a_100012232248_100000766640 [0,2,0,0,0,0|1,1,0]=4 9046 B11R0.4 CCCC(C)SCCOCCO 62a_100000766640_100011215305 [0,2,0,0,0,0|1,1,0]=4 9047 B11R0.4 CCCC(C)SCCOCCO 62a_100011215305_100000766640 [0,2,0,0,0,0|1,1,0]=4 9048 B11R0.4 CCCC(C)SCOCCOC 62a_100000231047_100000766640 [0,2,0,0,0,0|1,0,0]=3 9049 B11R0.4 CCCC(C)SCOCCOC 62a_100000766640_100000231047 [0,2,0,0,0,0|1,0,0]=3 9050 B11R0.4 CCCCCCCC(=O)COC 1458a_100000210968_100000210614 [0,2,0,0,0,0|2,0,0]=4 9051 B11R0.4 CCCCCCCC(C)OCC 34a_100121572206_200011218727 [0,2,0,0,0,0|2,0,0]=4 9052 B11R0.4 CCCCCCCC(C)OCC 34a_200011215852_100000210202 [0,2,0,0,0,0|2,0,0]=4 9053 B11R0.4 CCCCCCCC(C)OCC 7a_200011215852_100000210202 [0,2,0,0,0,0|2,0,0]=4 9054 B11R0.4 CCCCCCCC(C)OCF 34a_200011215852_100015361967 [0,2,0,0,0,0|2,0,0]=4 9055 B11R0.4 CCCCCCCC(C)OCF 7a_200011215852_100015361967 [0,2,0,0,0,0|2,0,0]=4 9056 B11R0.4 CCCCCCCN(C)COC 2230a_100000228206_100000766300 [0,2,0,0,0,0|2,0,0]=4 9057 B11R0.4 CCCCCCCN(C)COC 269982a_100000228206_100000766300 [0,2,0,0,0,0|2,0,0]=4 9058 B11R0.4 CCCCCCNC(C)COC 2230a_100000210581_100000765312 [0,2,0,0,0,0|2,0,0]=4 9059 B11R0.4 CCCCCCNC(C)COC 270004a_100000210581_100000749346 [0,2,0,0,0,0|2,0,0]=4 9060 B11R0.4 CCCCCCN[C@H](C)COC 2230a_100000764878_100000210314 [0,2,0,0,0,0|2,0,0]=4 9061 B11R0.4 CCCCCCOC(C)CCC 34a_100000210259_100000766640 [0,2,0,0,0,0|2,0,0]=4 9062 B11R0.4 CCCCCCOC(C)CCC 34a_100000764384_100000210314 [0,2,0,0,0,0|2,0,0]=4 9063 B11R0.4 CCCCCCOC(C)CCC 7a_100000210259_100000766640 [0,2,0,0,0,0|2,0,0]=4 9064 B11R0.4 CCCCCCOC(C)CCC 7a_100000764384_100000210314 [0,2,0,0,0,0|2,0,0]=4 9065 B11R0.4 CCCCCCOC(C)COC 34a_100000210259_100000765312 [0,2,0,0,0,0|1,0,0]=3 9066 B11R0.4 CCCCCCOC(C)COC 7a_100000210259_100000765312 [0,2,0,0,0,0|1,0,0]=3 9067 B11R0.4 CCCCCCO[C@H](C)COC 34a_100011934205_100000210314 [0,2,0,0,0,0|1,0,0]=3 9068 B11R0.4 CCCCCCSC(C)COC 62a_100000210314_100000765312 [0,2,0,0,0,0|1,1,0]=4 9069 B11R0.4 CCCCCCSC(C)COC 62a_100000765312_100000210757 [0,2,0,0,0,0|1,1,0]=4 9070 B11R0.4 CCCCCNCC(O)COC 2230a_100000756049_100000210326 [0,2,0,0,0,0|2,0,0]=4 9071 B11R0.4 CCCCCNCC(O)COC 34a_100000756049_100000718602 [0,2,0,0,0,0|2,0,0]=4 9072 B11R0.4 CCCCCOCC(=O)CCC 7a_100000210253_100000747444 [0,2,0,0,0,0|2,0,0]=4 9073 B11R0.4 CCCCCOCC(=O)OCC 34a_100000210253_100000188475 [0,2,0,0,0,0|1,0,1]=4 9074 B11R0.4 CCCCCOCC(=O)OCC 7a_100000210253_100000188475 [0,2,0,0,0,0|1,0,1]=4 9075 B11R0.4 CCCCCOCC(C)CCC 34a_100000210253_100011216630 [0,2,0,0,0,0|2,0,0]=4 9076 B11R0.4 CCCCCOCC(C)CCC 34a_100000688023_100000718602 [0,2,0,0,0,0|2,0,0]=4 9077 B11R0.4 CCCCCOCC(C)CCC 7a_100000210253_100011216630 [0,2,0,0,0,0|2,0,0]=4 9078 B11R0.4 CCCCCOCC(C)CCC 7a_100000688023_100000210326 [0,2,0,0,0,0|2,0,0]=4 9079 B11R0.4 CCCCCOCC(C)CCN 34a_106354213184_100000718602 [0,2,0,0,0,0|2,0,0]=4 9080 B11R0.4 CCCCCOCC(N)COC 34a_100000724102_100000718602 [0,2,0,0,0,0|1,0,0]=3 9081 B11R0.4 CCCCCOCC(O)COC 34a_100000210253_100011215053 [0,2,0,0,0,0|1,0,0]=3 9082 B11R0.4 CCCCCOCC(O)COC 7a_100000210253_100011215053 [0,2,0,0,0,0|1,0,0]=3 9083 B11R0.4 CCCCCOC[C@@H](N)CCC 34a_100000732646_100000718602 [0,2,0,0,0,0|2,0,0]=4 9084 B11R0.4 CCCCCSCC(O)COC 62a_100000210326_100011215053 [0,2,0,0,0,0|1,1,0]=4 9085 B11R0.4 CCCCCSCC(O)COC 62a_100011215053_100000210326 [0,2,0,0,0,0|1,1,0]=4 9086 B11R0.4 CCCCNCCC(=O)OCC 2230a_100000102301_100011206558 [0,2,0,0,0,0|2,0,0]=4 9087 B11R0.4 CCCCNCCC(=O)OCC 7a_106832991798_100011206558 [0,2,0,0,0,0|2,0,0]=4 9088 B11R0.4 CCCCOCCC(=O)CCC 1458a_100000211992_100000743108 [0,2,0,0,0,0|2,0,0]=4 9089 B11R0.4 CCCCOCCC(=O)CCO 1458a_100011216618_100000743108 [0,2,0,0,0,0|2,0,0]=4 9090 B11R0.4 CCCCOCCC(=O)COC 1458a_100000210968_100000743108 [0,2,0,0,0,0|2,0,0]=4 9091 B11R0.4 CCCCOCCC(=O)CSC 1458a_100000184570_100000743108 [0,2,0,0,0,0|2,0,0]=4 9092 B11R0.4 CCCCOCCC(=O)NCC 7a_100000210227_100000737597 [0,2,0,0,0,0|2,0,0]=4 9093 B11R0.4 CCCCOCCC(=O)OCC 34a_100000210227_100000765890 [0,2,0,0,0,0|1,0,0]=3 9094 B11R0.4 CCCCOCCC(=O)OCC 7a_100000210227_100011206558 [0,2,0,0,0,0|1,0,0]=3 9095 B11R0.4 CCCCOCCC(C)CCC 34a_100011217855_100000210210 [0,2,0,0,0,0|2,0,0]=4 9096 B11R0.4 CCCCOCCC(C)CCC 7a_100011217855_100000210211 [0,2,0,0,0,0|2,0,0]=4 9097 B11R0.4 CCCCOCCN(C)CCC 2230a_100000747261_100000743108 [0,2,0,0,0,0|2,0,0]=4 9098 B11R0.4 CCCCOCCN(C)CCC 269982a_100000747261_100000743108 [0,2,0,0,0,0|2,0,0]=4 9099 B11R0.4 CCCCOCCN(C)CCO 2230a_100000210263_100000743108 [0,2,0,0,0,0|2,0,0]=4 9100 B11R0.4 CCCCOCCN(C)CCO 269982a_100000210263_100000743108 [0,2,0,0,0,0|2,0,0]=4 9101 B11R0.4 CCCCOCC[C@@H](N)CCC 34a_100015193777_100000210210 [0,2,0,0,0,0|2,0,0]=4 9102 B11R0.4 CCCCOCNC(C)CCC 2230a_100000741246_100011995733 [0,2,0,0,0,0|2,0,0]=4 9103 B11R0.4 CCCCOCN[C@H](C)COC 2230a_100000764878_100011995733 [0,2,0,0,0,0|2,0,0]=4 9104 B11R0.4 CCCCOCOC(C)CCC 34a_100000764384_100011995733 [0,2,0,0,0,0|2,0,0]=4 9105 B11R0.4 CCCCOCO[C@H](C)COC 34a_100011934205_100011995733 [0,2,0,0,0,0|1,0,0]=3 9106 B11R0.4 CCCCOCSC(C)CCC 62a_100000766640_100011995733 [0,2,0,0,0,0|2,0,0]=4 9107 B11R0.4 CCCCOCSC(C)CCC 62a_100011995733_100000766640 [0,2,0,0,0,0|2,0,0]=4 9108 B11R0.4 CCCCOCSC(C)COC 62a_100000765312_100011995733 [0,2,0,0,0,0|1,1,0]=4 9109 B11R0.4 CCCCOCSC(C)COC 62a_100011995733_100000765312 [0,2,0,0,0,0|1,1,0]=4 9110 B11R0.4 CCCCSCCC(=O)OCC 62a_100000210211_100000765890 [0,2,0,0,0,0|1,1,0]=4 9111 B11R0.4 CCCCSCCC(=O)OCC 62a_100000765890_100000210210 [0,2,0,0,0,0|1,1,0]=4 9112 B11R0.4 CCCN(C)CCOCCOC 2230a_100000747261_100000695917 [0,2,0,0,0,0|1,0,0]=3 9113 B11R0.4 CCCN(C)CCOCCOC 269982a_100000747261_100000695917 [0,2,0,0,0,0|1,0,0]=3 9114 B11R0.4 CCCOCCCC(C)CCC 34a_100011713154_100000210303 [0,2,0,0,0,0|2,0,0]=4 9115 B11R0.4 CCCOCCCC(C)CCC 7a_100011713154_100000210303 [0,2,0,0,0,0|2,0,0]=4 9116 B11R0.4 CCCOCCNC(=O)COC 1626a_100161115042_100000210968 [0,2,0,0,0,0|1,0,1]=4 9117 B11R0.4 CCCOCCNC(=O)COC 240690a_100161115042_100000210968 [0,2,0,0,0,0|1,0,1]=4 9118 B11R0.4 CCCOCCNC(=O)COC 527a_100161115042_100000210968 [0,2,0,0,0,0|1,0,1]=4 9119 B11R0.4 CCCOCCNC(C)CCC 2230a_100000741246_100011215938 [0,2,0,0,0,0|2,0,0]=4 9120 B11R0.4 CCCOCCNC(C)CCC 2230a_100161115042_100000766640 [0,2,0,0,0,0|2,0,0]=4 9121 B11R0.4 CCCOCCNC(C)CCC 270004a_100161115042_100000211909 [0,2,0,0,0,0|2,0,0]=4 9122 B11R0.4 CCCOCCNC(C)CCC 34a_100161115042_100000766640 [0,2,0,0,0,0|2,0,0]=4 9123 B11R0.4 CCCOCCNC(C)COC 2230a_100161115042_100000765312 [0,2,0,0,0,0|1,0,0]=3 9124 B11R0.4 CCCOCCNC(C)COC 270004a_100161115042_100000749346 [0,2,0,0,0,0|1,0,0]=3 9125 B11R0.4 CCCOCCNC(C)COC 34a_100161115042_100000765312 [0,2,0,0,0,0|1,0,0]=3 9126 B11R0.4 CCCOCCNC(C)CSC 270004a_100161115042_100011216314 [0,2,0,0,0,0|1,1,0]=4 9127 B11R0.4 CCCOCCN[C@H](C)COC 2230a_100000764878_100011215938 [0,2,0,0,0,0|1,0,0]=3 9128 B11R0.4 CCCOCCOC(C)CC#N 7a_100000752267_100009813641 [0,2,0,0,0,0|2,0,0]=4 9129 B11R0.4 CCCOCCOC(C)CCBr 34a_100012276601_100011215938 [0,2,0,0,0,0|2,0,0]=4 9130 B11R0.4 CCCOCCOC(C)CCC 34a_100000752267_100000766640 [0,2,0,0,0,0|1,0,0]=3 9131 B11R0.4 CCCOCCOC(C)CCC 34a_100000764384_100011215938 [0,2,0,0,0,0|1,0,0]=3 9132 B11R0.4 CCCOCCOC(C)CCC 7a_100000752267_100000766640 [0,2,0,0,0,0|1,0,0]=3 9133 B11R0.4 CCCOCCOC(C)CCC 7a_100000764384_100011215938 [0,2,0,0,0,0|1,0,0]=3 9134 B11R0.4 CCCOCCOC(C)CCO 34a_100000752267_100009893172 [0,2,0,0,0,0|2,0,0]=4 9135 B11R0.4 CCCOCCOC(C)CCO 7a_100000752267_100009893172 [0,2,0,0,0,0|2,0,0]=4 9136 B11R0.4 CCCOCCOC(C)COC 34a_100000752267_100000765312 [0,2,0,0,0,0|0,0,0]=2 9137 B11R0.4 CCCOCCOC(C)COC 7a_100000752267_100000765312 [0,2,0,0,0,0|0,0,0]=2 9138 B11R0.4 CCCOCCO[C@H](C)COC 34a_100011934205_100011215938 [0,2,0,0,0,0|0,0,0]=2 9139 B11R0.4 CCCOCCSC(C)CCC 62a_100000766640_100011215938 [0,2,0,0,0,0|1,1,0]=4 9140 B11R0.4 CCCOCCSC(C)CCC 62a_100011215938_100000766640 [0,2,0,0,0,0|1,1,0]=4 9141 B11R0.4 CCCOCCSC(C)COC 62a_100000765312_100011215938 [0,2,0,0,0,0|0,1,0]=3 9142 B11R0.4 CCCOCCSC(C)COC 62a_100011215938_100000765312 [0,2,0,0,0,0|0,1,0]=3 9143 B11R0.4 CCCSCCNC(C)COC 2230a_100020603323_100000765312 [0,2,0,0,0,0|1,1,0]=4 9144 B11R0.4 CCCSCCNC(C)COC 270004a_100020603323_100000749346 [0,2,0,0,0,0|1,1,0]=4 9145 B11R0.4 CCCSCCOC(C)CCC 34a_200000230433_100000766640 [0,2,0,0,0,0|1,1,0]=4 9146 B11R0.4 CCCSCCOC(C)CCC 7a_200000230433_100000766640 [0,2,0,0,0,0|1,1,0]=4 9147 B11R0.4 CCCSCCOC(C)COC 34a_200000230433_100000765312 [0,2,0,0,0,0|0,1,0]=3 9148 B11R0.4 CCCSCCOC(C)COC 7a_200000230433_100000765312 [0,2,0,0,0,0|0,1,0]=3 9149 B11R0.4 CCC[C@H](N)CCOCCOC 34a_100015193777_100011201679 [0,2,0,0,0,0|1,0,0]=3 9150 B11R0.4 CCC[C@H](N)CCOCCSC 34a_100015193777_100000212216 [0,2,0,0,0,0|1,1,0]=4 9151 B11R0.4 CCC[C@H](N)COCCCCF 34a_100000732646_100000729493 [0,2,0,0,0,0|2,0,0]=4 9152 B11R0.4 CCC[C@H](N)COCCCCO 34a_100000732646_100011216708 [0,2,0,0,0,0|2,0,0]=4 9153 B11R0.4 CCC[C@H](N)COCCCOC 34a_100000732646_100000740836 [0,2,0,0,0,0|1,0,0]=3 9154 B11R0.4 CCC[C@H](N)COCCOCC 34a_100000732646_100000210147 [0,2,0,0,0,0|1,0,0]=3 9155 B11R0.4 CCC[C@H](N)COCCSCC 34a_100000732646_100000757381 [0,2,0,0,0,0|1,1,0]=4 9156 B11R0.4 CCNC(=O)CCCCCOC 11a_100015525214_100011935119 [0,2,0,0,0,0|2,0,0]=4 9157 B11R0.4 CCNC(=O)CCCCCOC 240690a_100015525214_100011935119 [0,2,0,0,0,0|2,0,0]=4 9158 B11R0.4 CCNC(=O)CCCCCOC 527a_100015525214_100011935119 [0,2,0,0,0,0|2,0,0]=4 9159 B11R0.4 CCNC(=O)CCNCCOC 2230a_100000209980_100000737597 [0,2,0,0,0,0|2,0,0]=4 9160 B11R0.4 CCNC(=O)CCNCCOC 34a_100025743525_100011201679 [0,2,0,0,0,0|2,0,0]=4 9161 B11R0.4 CCNC(=O)CCOCCOC 11a_100015525214_100000745395 [0,2,0,0,0,0|1,0,0]=3 9162 B11R0.4 CCNC(=O)CCOCCOC 240690a_100015525214_100000745395 [0,2,0,0,0,0|1,0,0]=3 9163 B11R0.4 CCNC(=O)CCOCCOC 527a_100015525214_100000745395 [0,2,0,0,0,0|1,0,0]=3 9164 B11R0.4 CCNC(=O)CCOCCSC 7a_100000230434_100000737597 [0,2,0,0,0,0|1,1,0]=4 9165 B11R0.4 CCNC(=O)CCSCCOC 62a_100000233755_100000737597 [0,2,0,0,0,0|1,1,0]=4 9166 B11R0.4 CCNC(=O)CCSCCOC 62a_100000737597_100000233755 [0,2,0,0,0,0|1,1,0]=4 9167 B11R0.4 CCNC(=O)COCCCOC 34a_100000740835_100000183381 [0,2,0,0,0,0|1,0,1]=4 9168 B11R0.4 CCNC(=O)COCCOCC 34a_100000210136_100000183381 [0,2,0,0,0,0|1,0,1]=4 9169 B11R0.4 CCNC(=O)COCCOCC 7a_100000210136_100000183381 [0,2,0,0,0,0|1,0,1]=4 9170 B11R0.4 CCNCCOCC(=O)OCC 2230a_100015525214_100000088970 [0,2,0,0,0,0|1,0,1]=4 9171 B11R0.4 CCOC(=O)CCCCCNC 2230a_106832991635_100000755133 [0,2,0,0,0,0|2,0,0]=4 9172 B11R0.4 CCOC(=O)CCCCCNC 34a_100102657272_100000755133 [0,2,0,0,0,0|2,0,0]=4 9173 B11R0.4 CCOC(=O)CCCCCNC 7a_106832991635_100000755133 [0,2,0,0,0,0|2,0,0]=4 9174 B11R0.4 CCOC(=O)CCCCCOC 34a_100138415774_100000755133 [0,2,0,0,0,0|1,0,0]=3 9175 B11R0.4 CCOC(=O)CCCCCOC 7a_100011214988_200000210301 [0,2,0,0,0,0|1,0,0]=3 9176 B11R0.4 CCOC(=O)CCCCCO[13CH3] 7a_100011214988_200025704644 [0,2,0,0,0,0|1,0,0]=3 9177 B11R0.4 CCOC(=O)CCCCCSC 62a_100000755133_200000210301 [0,2,0,0,0,0|1,1,0]=4 9178 B11R0.4 CCOC(=O)CCCCCSC 62a_200000210301_100000755133 [0,2,0,0,0,0|1,1,0]=4 9179 B11R0.4 CCOC(=O)CCCCCS[13CH3] 62a_100000755133_200025704644 [0,2,0,0,0,0|1,1,0]=4 9180 B11R0.4 CCOC(=O)CCCCCS[13CH3] 62a_200025704644_100000755133 [0,2,0,0,0,0|1,1,0]=4 9181 B11R0.4 CCOC(=O)CCCSCOC 62a_100000766300_100009991533 [0,2,0,0,0,0|1,0,1]=4 9182 B11R0.4 CCOC(=O)CCCSCOC 62a_100009991533_100000766300 [0,2,0,0,0,0|1,0,1]=4 9183 B11R0.4 CCOC(=O)CCNCCOC 2230a_100000209980_100011206558 [0,2,0,0,0,0|1,0,0]=3 9184 B11R0.4 CCOC(=O)CCNCCSC 2230a_100020590264_100011206558 [0,2,0,0,0,0|1,1,0]=4 9185 B11R0.4 CCOC(=O)CCOCCCBr 34a_100011217188_100000765890 [0,2,0,0,0,0|2,0,0]=4 9186 B11R0.4 CCOC(=O)CCOCCCCl 34a_100000230001_100000765890 [0,2,0,0,0,0|2,0,0]=4 9187 B11R0.4 CCOC(=O)CCOCCCF 34a_100000759539_100000765890 [0,2,0,0,0,0|2,0,0]=4 9188 B11R0.4 CCOC(=O)CCOCCCN 34a_100000182051_100000765890 [0,2,0,0,0,0|2,0,0]=4 9189 B11R0.4 CCOC(=O)CCOCCOC 34a_100000210237_100000765890 [0,2,0,0,0,0|0,0,0]=2 9190 B11R0.4 CCOC(=O)CCOCCON 34a_100000700252_100000765890 [0,2,0,0,0,0|1,0,0]=3 9191 B11R0.4 CCOC(=O)CCOCCSC 34a_100000230434_100000765890 [0,2,0,0,0,0|0,1,0]=3 9192 B11R0.4 CCOC(=O)CCOCCSC 7a_100000230434_100011206558 [0,2,0,0,0,0|0,1,0]=3 9193 B11R0.4 CCOC(=O)CCSCCOC 62a_100000233755_100000765890 [0,2,0,0,0,0|0,1,0]=3 9194 B11R0.4 CCOC(=O)CCSCCOC 62a_100000765890_100000233755 [0,2,0,0,0,0|0,1,0]=3 9195 B11R0.4 CCOC(=O)CCSCCSC 62a_100000212216_100000765890 [0,2,0,0,0,0|0,2,0]=4 9196 B11R0.4 CCOC(=O)CCSCCSC 62a_100000765890_100000751147 [0,2,0,0,0,0|0,2,0]=4 9197 B11R0.4 CCOC(=O)CNCCCOC 34a_100150723488_100000188475 [0,2,0,0,0,0|1,0,1]=4 9198 B11R0.4 CCOC(=O)COCCCCBr 34a_100011216708_100000188475 [0,2,0,0,0,0|1,0,1]=4 9199 B11R0.4 CCOC(=O)COCCCCCl 34a_100000210776_100000188475 [0,2,0,0,0,0|1,0,1]=4 9200 B11R0.4 CCOC(=O)COCCCCCl 7a_100000210776_100000188475 [0,2,0,0,0,0|1,0,1]=4 9201 B11R0.4 CCOC(=O)COCCCCF 34a_100011995726_100000188475 [0,2,0,0,0,0|1,0,1]=4 9202 B11R0.4 CCOC(=O)COCCCCF 7a_100011995726_100000188475 [0,2,0,0,0,0|1,0,1]=4 9203 B11R0.4 CCOC(=O)COCCCCI 34a_200012148704_100000188475 [0,2,0,0,0,0|1,0,1]=4 9204 B11R0.4 CCOC(=O)COCCCCN 34a_100000750430_100000188475 [0,2,0,0,0,0|1,0,1]=4 9205 B11R0.4 CCOC(=O)COCCCNC 2230a_106832991635_100009893628 [0,2,0,0,0,0|1,0,1]=4 9206 B11R0.4 CCOC(=O)COCCCNC 34a_100000213112_100000188475 [0,2,0,0,0,0|1,0,1]=4 9207 B11R0.4 CCOC(=O)COCCCNC 34a_100102657272_100009893628 [0,2,0,0,0,0|1,0,1]=4 9208 B11R0.4 CCOC(=O)COCCCNC 7a_106832991635_100009893628 [0,2,0,0,0,0|1,0,1]=4 9209 B11R0.4 CCOC(=O)COCCCOC 34a_100000740835_100000188475 [0,2,0,0,0,0|0,0,1]=3 9210 B11R0.4 CCOC(=O)COCCCOC 34a_100138415774_100009893628 [0,2,0,0,0,0|0,0,1]=3 9211 B11R0.4 CCOC(=O)COCCCSC 34a_100000690336_100000188475 [0,2,0,0,0,0|0,1,1]=4 9212 B11R0.4 CCOC(=O)COCCCSC 62a_100009893628_200000210301 [0,2,0,0,0,0|0,1,1]=4 9213 B11R0.4 CCOC(=O)COCCCSC 62a_200000210301_100009893628 [0,2,0,0,0,0|0,1,1]=4 9214 B11R0.4 CCOC(=O)COCCCSC 7a_100000690336_100000188475 [0,2,0,0,0,0|0,1,1]=4 9215 B11R0.4 CCOC(=O)COCCCS[13CH3] 62a_100009893628_200025704644 [0,2,0,0,0,0|0,1,1]=4 9216 B11R0.4 CCOC(=O)COCCCS[13CH3] 62a_200025704644_100009893628 [0,2,0,0,0,0|0,1,1]=4 9217 B11R0.4 CCOC(=O)COCCSCC 34a_100000212035_100000188475 [0,2,0,0,0,0|0,1,1]=4 9218 B11R0.4 CCOC(=O)COCCSCC 62a_100000088970_100000210202 [0,2,0,0,0,0|0,1,1]=4 9219 B11R0.4 CCOC(=O)COCCSCC 62a_100000210202_100000088970 [0,2,0,0,0,0|0,1,1]=4 9220 B11R0.4 CCOC(=O)COCCSCC 7a_100000212035_100000188475 [0,2,0,0,0,0|0,1,1]=4 9221 B11R0.4 CCOC(=O)COCCSCF 62a_100000088970_100015361967 [0,2,0,0,0,0|0,1,1]=4 9222 B11R0.4 CCOC(=O)COCCSCF 62a_100015361967_100000088970 [0,2,0,0,0,0|0,1,1]=4 9223 B11R0.4 CCOC(=O)CSCCCOC 62a_100000188475_100000709357 [0,2,0,0,0,0|0,1,1]=4 9224 B11R0.4 CCOC(=O)CSCCCOC 62a_100000709357_100000188475 [0,2,0,0,0,0|0,1,1]=4 9225 B11R0.4 CCOC(=O)CSCCOCF 7a_200000230590_100015361967 [0,2,0,0,0,0|0,1,1]=4 9226 B11R0.4 CCOC(=O)OCSCCOC 62a_100000233755_100000075025 [0,2,0,0,0,0|0,1,1]=4 9227 B11R0.4 CCOCCCCC(=O)OCC 34a_100121572206_100000750268 [0,2,0,0,0,0|1,0,1]=4 9228 B11R0.4 CCOCCCNC(=O)COC 11a_100000210961_100000210968 [0,2,0,0,0,0|1,0,1]=4 9229 B11R0.4 CCOCCCNC(=O)COC 1626a_100000210961_100000210968 [0,2,0,0,0,0|1,0,1]=4 9230 B11R0.4 CCOCCCNC(=O)COC 240690a_100000210961_100000210968 [0,2,0,0,0,0|1,0,1]=4 9231 B11R0.4 CCOCCCNC(=O)COC 527a_100000210961_100000210968 [0,2,0,0,0,0|1,0,1]=4 9232 B11R0.4 CCOCCCNC(C)COC 2230a_100000210961_100000765312 [0,2,0,0,0,0|1,0,0]=3 9233 B11R0.4 CCOCCCNC(C)COC 270004a_100000210961_100000749346 [0,2,0,0,0,0|1,0,0]=3 9234 B11R0.4 CCOCCCNC(C)COC 34a_100000210961_100000765312 [0,2,0,0,0,0|1,0,0]=3 9235 B11R0.4 CCOCCCNC(C)CSC 270004a_100000210961_100011216314 [0,2,0,0,0,0|1,1,0]=4 9236 B11R0.4 CCOCCCN[C@H](C)COC 2230a_100000764878_100012232248 [0,2,0,0,0,0|1,0,0]=3 9237 B11R0.4 CCOCCCOC(C)CC#N 7a_100000757476_100009813641 [0,2,0,0,0,0|2,0,0]=4 9238 B11R0.4 CCOCCCOC(C)CCBr 34a_100012276601_100012232248 [0,2,0,0,0,0|2,0,0]=4 9239 B11R0.4 CCOCCCOC(C)CCO 34a_100000757476_100009893172 [0,2,0,0,0,0|2,0,0]=4 9240 B11R0.4 CCOCCCOC(C)CCO 7a_100000757476_100009893172 [0,2,0,0,0,0|2,0,0]=4 9241 B11R0.4 CCOCCCOC(C)COC 34a_100000757476_100000765312 [0,2,0,0,0,0|0,0,0]=2 9242 B11R0.4 CCOCCCOC(C)COC 7a_100000757476_100000765312 [0,2,0,0,0,0|0,0,0]=2 9243 B11R0.4 CCOCCCO[C@H](C)COC 34a_100011934205_100012232248 [0,2,0,0,0,0|0,0,0]=2 9244 B11R0.4 CCOCCCSC(C)COC 62a_100000765312_100012232248 [0,2,0,0,0,0|0,1,0]=3 9245 B11R0.4 CCOCCCSC(C)COC 62a_100012232248_100000765312 [0,2,0,0,0,0|0,1,0]=3 9246 B11R0.4 CCOCCNCC(=O)OCC 2230a_102516460346_100000188475 [0,2,0,0,0,0|1,0,1]=4 9247 B11R0.4 CCOCCNCC(=O)OCC 34a_102516460346_100000188475 [0,2,0,0,0,0|1,0,1]=4 9248 B11R0.4 CCOCCNCC(O)COC 2230a_100000756049_100011215890 [0,2,0,0,0,0|1,0,0]=3 9249 B11R0.4 CCOCCNCC(O)COC 34a_100000756049_100000210147 [0,2,0,0,0,0|1,0,0]=3 9250 B11R0.4 CCOCCNCC(O)COC 34a_102516460346_100011215053 [0,2,0,0,0,0|1,0,0]=3 9251 B11R0.4 CCOCCNN=C(C)COC 4a_100000732670_100000749346 [0,2,0,0,0,0|1,0,1]=4 9252 B11R0.4 CCOCCNNC(=O)COC 22a_100000732670_100000210968 [0,2,0,0,0,0|1,0,1]=4 9253 B11R0.4 CCOCCOCC(=O)NCO 34a_100000210136_100000185155 [0,2,0,0,0,0|1,0,1]=4 9254 B11R0.4 CCOCCOCC(=O)NCO 7a_100000210136_100000185155 [0,2,0,0,0,0|1,0,1]=4 9255 B11R0.4 CCOCCOCC(=O)OCC 34a_100000210136_100000188475 [0,2,0,0,0,0|0,0,1]=3 9256 B11R0.4 CCOCCOCC(=O)OCC 34a_100121572206_100000088970 [0,2,0,0,0,0|0,0,1]=3 9257 B11R0.4 CCOCCOCC(=O)OCC 7a_100000210136_100000188475 [0,2,0,0,0,0|0,0,1]=3 9258 B11R0.4 CCOCCOCC(C)CCN 34a_106354213184_100000210147 [0,2,0,0,0,0|1,0,0]=3 9259 B11R0.4 CCOCCOCC(N)COC 34a_100000724102_100000210147 [0,2,0,0,0,0|0,0,0]=2 9260 B11R0.4 CCOCCOCC(O)COC 34a_100000210136_100011215053 [0,2,0,0,0,0|0,0,0]=2 9261 B11R0.4 CCOCCOCC(O)COC 7a_100000210136_100011215053 [0,2,0,0,0,0|0,0,0]=2 9262 B11R0.4 CCOCCOC[C@@H](O)CC#N 7a_100000210136_100000001066 [0,2,0,0,0,0|1,0,1]=4 9263 B11R0.4 CCOCCSCC(=O)OCC 62a_100000188475_100011215890 [0,2,0,0,0,0|0,1,1]=4 9264 B11R0.4 CCOCCSCC(=O)OCC 62a_100000210147_100000188475 [0,2,0,0,0,0|0,1,1]=4 9265 B11R0.4 CCOCCSCC(=O)OCC 7a_200000230590_100000210202 [0,2,0,0,0,0|0,1,1]=4 9266 B11R0.4 CCOCCSCC(O)COC 62a_100000210147_100011215053 [0,2,0,0,0,0|0,1,0]=3 9267 B11R0.4 CCOCCSCC(O)COC 62a_100011215053_100011215890 [0,2,0,0,0,0|0,1,0]=3 9268 B11R0.4 CCSCCCOC(C)COC 34a_100011216438_100000765312 [0,2,0,0,0,0|0,1,0]=3 9269 B11R0.4 CCSCCCOC(C)COC 7a_100011216438_100000765312 [0,2,0,0,0,0|0,1,0]=3 9270 B11R0.4 CCSCCNCC(O)COC 2230a_100000756049_100000757381 [0,2,0,0,0,0|1,1,0]=4 9271 B11R0.4 CCSCCNCC(O)COC 34a_100000756049_100000757381 [0,2,0,0,0,0|1,1,0]=4 9272 B11R0.4 CCSCCOCC(C)CCN 34a_106354213184_100000757381 [0,2,0,0,0,0|1,1,0]=4 9273 B11R0.4 CCSCCOCC(N)COC 34a_100000724102_100000757381 [0,2,0,0,0,0|0,1,0]=3 9274 B11R0.4 CCSCCOCC(O)COC 34a_100000212035_100011215053 [0,2,0,0,0,0|0,1,0]=3 9275 B11R0.4 CCSCCOCC(O)COC 7a_100000212035_100011215053 [0,2,0,0,0,0|0,1,0]=3 9276 B11R0.4 CCSCCSCC(O)COC 62a_100000757381_100011215053 [0,2,0,0,0,0|0,2,0]=4 9277 B11R0.4 CCSCCSCC(O)COC 62a_100011215053_100000757381 [0,2,0,0,0,0|0,2,0]=4 9278 B11R0.4 CNCCCOCC(O)COC 34a_100000213112_100011215053 [0,2,0,0,0,0|2,0,0]=4 9279 B11R0.4 CNNC(=O)CCOCCOC 22a_100016993582_100000745395 [0,2,0,0,0,0|2,0,0]=4 9280 B11R0.4 COCC(=O)NCCOCCO 240690a_100000211614_100000210968 [0,2,0,0,0,0|1,0,1]=4 9281 B11R0.4 COCC(C)NCCCCCO 2230a_100000762737_100000765312 [0,2,0,0,0,0|2,0,0]=4 9282 B11R0.4 COCC(C)NCCCCCO 270004a_100000762737_100000749346 [0,2,0,0,0,0|2,0,0]=4 9283 B11R0.4 COCC(C)NCCCCCO 34a_100000762737_100000765312 [0,2,0,0,0,0|2,0,0]=4 9284 B11R0.4 COCC(C)NCCOCCO 2230a_100000211614_100000765312 [0,2,0,0,0,0|1,0,0]=3 9285 B11R0.4 COCC(C)NCCOCCO 270004a_100000211614_100000749346 [0,2,0,0,0,0|1,0,0]=3 9286 B11R0.4 COCC(C)NCCOCCO 34a_100000211614_100000765312 [0,2,0,0,0,0|1,0,0]=3 9287 B11R0.4 COCC(C)NCCSCCO 2230a_100011219999_100000765312 [0,2,0,0,0,0|1,1,0]=4 9288 B11R0.4 COCC(C)NCCSCCO 270004a_100011219999_100000749346 [0,2,0,0,0,0|1,1,0]=4 9289 B11R0.4 COCC(C)OCCCCCBr 34a_100000746331_100000765312 [0,2,0,0,0,0|1,0,0]=3 9290 B11R0.4 COCC(C)OCCCCCBr 7a_100000746331_100000765312 [0,2,0,0,0,0|1,0,0]=3 9291 B11R0.4 COCC(C)OCCCCCCl 34a_100000746330_100000765312 [0,2,0,0,0,0|1,0,0]=3 9292 B11R0.4 COCC(C)OCCCCCCl 7a_100000746330_100000765312 [0,2,0,0,0,0|1,0,0]=3 9293 B11R0.4 COCC(C)OCCCCCI 34a_200012148887_100000765312 [0,2,0,0,0,0|1,0,0]=3 9294 B11R0.4 COCC(C)OCCCCCI 7a_200012148887_100000765312 [0,2,0,0,0,0|1,0,0]=3 9295 B11R0.4 COCC(C)OCCCCCN 34a_100000762737_100000765312 [0,2,0,0,0,0|1,0,0]=3 9296 B11R0.4 COCC(C)OCCCCSC 34a_100011217163_100000765312 [0,2,0,0,0,0|1,0,0]=3 9297 B11R0.4 COCC(C)OCCCCSC 7a_100011217163_100000765312 [0,2,0,0,0,0|1,0,0]=3 9298 B11R0.4 COCC(C)OCCOCCBr 34a_100000692535_100000765312 [0,2,0,0,0,0|0,0,0]=2 9299 B11R0.4 COCC(C)OCCOCCBr 7a_100000692535_100000765312 [0,2,0,0,0,0|0,0,0]=2 9300 B11R0.4 COCC(C)OCCOCCCl 34a_100011215305_100000765312 [0,2,0,0,0,0|0,0,0]=2 9301 B11R0.4 COCC(C)OCCOCCCl 7a_100011215305_100000765312 [0,2,0,0,0,0|0,0,0]=2 9302 B11R0.4 COCC(C)OCCOCCF 34a_200015357709_100000765312 [0,2,0,0,0,0|0,0,0]=2 9303 B11R0.4 COCC(C)OCCOCCF 7a_200015357709_100000765312 [0,2,0,0,0,0|0,0,0]=2 9304 B11R0.4 COCC(C)OCCOCCI 34a_100012149058_100000765312 [0,2,0,0,0,0|0,0,0]=2 9305 B11R0.4 COCC(C)OCCOCCI 7a_100012149058_100000765312 [0,2,0,0,0,0|0,0,0]=2 9306 B11R0.4 COCC(C)OCCOCCN 34a_100000211614_100000765312 [0,2,0,0,0,0|0,0,0]=2 9307 B11R0.4 COCC(C)SCCCCCF 62a_100000729378_100000765312 [0,2,0,0,0,0|1,1,0]=4 9308 B11R0.4 COCC(C)SCCCCCF 62a_100000765312_100000729378 [0,2,0,0,0,0|1,1,0]=4 9309 B11R0.4 COCC(C)SCCCCCO 62a_100000746330_100000765312 [0,2,0,0,0,0|1,1,0]=4 9310 B11R0.4 COCC(C)SCCCCCO 62a_100000765312_100000746330 [0,2,0,0,0,0|1,1,0]=4 9311 B11R0.4 COCC(C)SCCOCC#N 62a_100000765312_200000047693 [0,2,0,0,0,0|0,1,1]=4 9312 B11R0.4 COCC(C)SCCOCC#N 62a_200000047693_100000765312 [0,2,0,0,0,0|0,1,1]=4 9313 B11R0.4 COCC(C)SCCOCCO 62a_100000765312_100011215305 [0,2,0,0,0,0|0,1,0]=3 9314 B11R0.4 COCC(C)SCCOCCO 62a_100011215305_100000765312 [0,2,0,0,0,0|0,1,0]=3 9315 B11R0.4 COCC(N)COCCCCF 34a_100000724102_100000729493 [0,2,0,0,0,0|2,0,0]=4 9316 B11R0.4 COCC(N)COCCCCO 34a_100000724102_100011216708 [0,2,0,0,0,0|2,0,0]=4 9317 B11R0.4 COCC(O)COCCCCBr 34a_100011216708_100011215053 [0,2,0,0,0,0|2,0,0]=4 9318 B11R0.4 COCC(O)COCCCCCl 34a_100000210776_100011215053 [0,2,0,0,0,0|2,0,0]=4 9319 B11R0.4 COCC(O)COCCCCCl 7a_100000210776_100011215053 [0,2,0,0,0,0|2,0,0]=4 9320 B11R0.4 COCC(O)COCCCCF 34a_100011995726_100011215053 [0,2,0,0,0,0|2,0,0]=4 9321 B11R0.4 COCC(O)COCCCCF 7a_100011995726_100011215053 [0,2,0,0,0,0|2,0,0]=4 9322 B11R0.4 COCC(O)COCCCCI 34a_200012148704_100011215053 [0,2,0,0,0,0|2,0,0]=4 9323 B11R0.4 COCC(O)COCCCCN 34a_100000750430_100011215053 [0,2,0,0,0,0|2,0,0]=4 9324 B11R0.4 COCC(O)COCCCSC 34a_100000690336_100011215053 [0,2,0,0,0,0|2,0,0]=4 9325 B11R0.4 COCC(O)COCCCSC 7a_100000690336_100011215053 [0,2,0,0,0,0|2,0,0]=4 9326 B11R0.4 COCCCCCC(=O)CCF 1458a_100011935119_100011217306 [0,2,0,0,0,0|2,0,0]=4 9327 B11R0.4 COCCCCCC(=O)CCO 1458a_100011935119_100000211926 [0,2,0,0,0,0|2,0,0]=4 9328 B11R0.4 COCCCCN[C@H](C)COC 2230a_100000764878_100000730899 [0,2,0,0,0,0|2,0,0]=4 9329 B11R0.4 COCCCCOC(C)COC 34a_100000740925_100000765312 [0,2,0,0,0,0|1,0,0]=3 9330 B11R0.4 COCCCCO[C@H](C)COC 34a_100011934205_100000755781 [0,2,0,0,0,0|1,0,0]=3 9331 B11R0.4 COCCCCSC(C)COC 62a_100000730899_100000765312 [0,2,0,0,0,0|1,1,0]=4 9332 B11R0.4 COCCCCSC(C)COC 62a_100000765312_100000730899 [0,2,0,0,0,0|1,1,0]=4 9333 B11R0.4 COCCCOCC(C)CCN 34a_106354213184_100000740836 [0,2,0,0,0,0|2,0,0]=4 9334 B11R0.4 COCCCOCC(N)COC 34a_100000724102_100000740836 [0,2,0,0,0,0|2,0,0]=4 9335 B11R0.4 COCCCOCC(O)COC 34a_100000740835_100011215053 [0,2,0,0,0,0|2,0,0]=4 9336 B11R0.4 COCCOCCC(=O)CC#N 1458a_100000745395_100011214920 [0,2,0,0,0,0|1,0,1]=4 9337 B11R0.4 COCCOCCC(=O)CC#N 1458a_100051588842_100000695917 [0,2,0,0,0,0|1,0,1]=4 9338 B11R0.4 COCCOCCC(=O)CCF 1458a_100000745395_100011217306 [0,2,0,0,0,0|1,0,0]=3 9339 B11R0.4 COCCOCCC(=O)CCO 1458a_100000745395_100000211926 [0,2,0,0,0,0|1,0,0]=3 9340 B11R0.4 COCCOCCC(=O)CCO 1458a_100011216618_100000695917 [0,2,0,0,0,0|1,0,0]=3 9341 B11R0.4 COCCOCCC(=O)COC 1458a_100000210968_100000695917 [0,2,0,0,0,0|1,0,0]=3 9342 B11R0.4 COCCOCCC(=O)CSC 1458a_100000184570_100000695917 [0,2,0,0,0,0|1,0,0]=3 9343 B11R0.4 COCCOCCN(C)CC#N 2230a_100000748184_100000695917 [0,2,0,0,0,0|1,0,1]=4 9344 B11R0.4 COCCOCCN(C)CCO 2230a_100000210263_100000695917 [0,2,0,0,0,0|1,0,0]=3 9345 B11R0.4 COCCOCCN(C)CCO 269982a_100000210263_100000695917 [0,2,0,0,0,0|1,0,0]=3 9346 B11R0.4 COCCOCN[C@H](C)CCO 2230a_100000706166_100000231047 [0,2,0,0,0,0|2,0,0]=4 9347 B11R0.4 COCCOCN[C@H](C)COC 2230a_100000764878_100000231047 [0,2,0,0,0,0|2,0,0]=4 9348 B11R0.4 COCCOCSC(C)CCO 62a_100000231047_100009893172 [0,2,0,0,0,0|2,0,0]=4 9349 B11R0.4 COCCOCSC(C)CCO 62a_100009893172_100000231047 [0,2,0,0,0,0|2,0,0]=4 9350 B11R0.4 COCCOCSC(C)COC 62a_100000231047_100000765312 [0,2,0,0,0,0|2,0,0]=4 9351 B11R0.4 COCCOCSC(C)COC 62a_100000765312_100000231047 [0,2,0,0,0,0|2,0,0]=4 9352 B11R0.4 COC[C@@H](C)NCCCCCF 2230a_100000764878_100000729378 [0,2,0,0,0,0|2,0,0]=4 9353 B11R0.4 COC[C@@H](C)NCCCCCO 2230a_100000764878_100000746330 [0,2,0,0,0,0|2,0,0]=4 9354 B11R0.4 COC[C@@H](C)NCCOCC#N 2230a_100000764878_200000047693 [0,2,0,0,0,0|1,0,1]=4 9355 B11R0.4 COC[C@@H](C)NCCOCCO 2230a_100000764878_100011215305 [0,2,0,0,0,0|1,0,0]=3 9356 B11R0.4 COC[C@@H](C)OCCCCCF 34a_100011934205_100000729378 [0,2,0,0,0,0|1,0,0]=3 9357 B11R0.4 COC[C@@H](C)OCCCCCO 34a_100011934205_100000746330 [0,2,0,0,0,0|1,0,0]=3 9358 B11R0.4 COC[C@@H](C)OCCOCCO 34a_100011934205_100000692535 [0,2,0,0,0,0|0,0,0]=2 9359 B11R0.4 CSCC(C)NCCOCCO 270004a_100000211614_100011216314 [0,2,0,0,0,0|1,1,0]=4 9360 B11R0.5 CCC#CC(C)OC(C)COC 34a_100000033903_100000765312 [0,2,0,0,0,0|1,0,1]=4 9361 B11R0.5 CCC#CC(C)OC(C)COC 7a_100000033903_100000765312 [0,2,0,0,0,0|1,0,1]=4 9362 B11R0.5 CCCC(C)CC(=O)CCOC 1458a_100000748435_100000233755 [0,2,0,0,0,0|2,0,0]=4 9363 B11R0.5 CCCC(C)CC(=O)CCOC 1458a_100000749529_100011216630 [0,2,0,0,0,0|2,0,0]=4 9364 B11R0.5 CCCC(C)CN(C)CCOC 2230a_100000743101_100011216630 [0,2,0,0,0,0|2,0,0]=4 9365 B11R0.5 CCCC(C)CN(C)CCOC 269982a_100000743101_100011216630 [0,2,0,0,0,0|2,0,0]=4 9366 B11R0.5 CCCC(C)CN(C)CCOC 270004a_100000743101_100000243154 [0,2,0,0,0,0|2,0,0]=4 9367 B11R0.5 CCCC(C)OC(C)COCC 34a_100000718985_100000766640 [0,2,0,0,0,0|1,0,0]=3 9368 B11R0.5 CCCC(C)OC(C)COCC 7a_100000718985_100000766640 [0,2,0,0,0,0|1,0,0]=3 9369 B11R0.5 CCCCC(C)NC(C)COC 2230a_100000126638_100000765312 [0,2,0,0,0,0|2,0,0]=4 9370 B11R0.5 CCCCC(C)NC(C)COC 270004a_100000126638_100000749346 [0,2,0,0,0,0|2,0,0]=4 9371 B11R0.5 CCCCC(C)N[C@H](C)COC 2230a_100000764878_200011215066 [0,2,0,0,0,0|2,0,0]=4 9372 B11R0.5 CCCCC(C)N[C@H](C)COC 270004a_100000764878_100000210087 [0,2,0,0,0,0|2,0,0]=4 9373 B11R0.5 CCCCC(C)OC(C)CCC 34a_100000687866_100000766640 [0,2,0,0,0,0|2,0,0]=4 9374 B11R0.5 CCCCC(C)OC(C)CCC 34a_100000764384_200011215066 [0,2,0,0,0,0|2,0,0]=4 9375 B11R0.5 CCCCC(C)OC(C)CCC 7a_100000687866_100000766640 [0,2,0,0,0,0|2,0,0]=4 9376 B11R0.5 CCCCC(C)OC(C)CCC 7a_100000764384_200011215066 [0,2,0,0,0,0|2,0,0]=4 9377 B11R0.5 CCCCC(C)OC(C)COC 34a_100000687866_100000765312 [0,2,0,0,0,0|1,0,0]=3 9378 B11R0.5 CCCCC(C)OC(C)COC 7a_100000687866_100000765312 [0,2,0,0,0,0|1,0,0]=3 9379 B11R0.5 CCCCC(C)O[C@H](C)COC 34a_100011934205_200011215066 [0,2,0,0,0,0|1,0,0]=3 9380 B11R0.5 CCCCC(C)SC(C)COC 62a_100000765312_200011215066 [0,2,0,0,0,0|1,1,0]=4 9381 B11R0.5 CCCCC(C)SC(C)COC 62a_200011215066_100000765312 [0,2,0,0,0,0|1,1,0]=4 9382 B11R0.5 CCOC(=O)CC(=O)CCOC 1458a_100000243816_100000233755 [0,2,0,0,0,0|1,0,1]=4 9383 B11R0.5 CCOC(=O)CC(=O)CCOC 1458a_100000749529_100000188475 [0,2,0,0,0,0|1,0,1]=4 9384 B11R0.5 CCOC(=O)CN(C)CCOC 2230a_100000220588_100011201679 [0,2,0,0,0,0|1,0,1]=4 9385 B11R0.5 CCOC(=O)CN(C)CCOC 2230a_100000743101_100000188475 [0,2,0,0,0,0|1,0,1]=4 9386 B11R0.5 CCOC(=O)CN(C)CCOC 269982a_100000743101_100000188475 [0,2,0,0,0,0|1,0,1]=4 9387 B11R0.5 CCOCC(=O)N[C@H](C)COC 11a_100000764878_100000211967 [0,2,0,0,0,0|1,0,1]=4 9388 B11R0.5 CCOCC(=O)N[C@H](C)COC 1626a_100000764878_100000211967 [0,2,0,0,0,0|1,0,1]=4 9389 B11R0.5 CCOCC(=O)N[C@H](C)COC 240690a_100000764878_100000211967 [0,2,0,0,0,0|1,0,1]=4 9390 B11R0.5 CCOCC(=O)N[C@H](C)COC 527a_100000764878_100000211967 [0,2,0,0,0,0|1,0,1]=4 9391 B11R0.5 CCOCC(C)OC(C)CC#N 7a_100000718985_100009813641 [0,2,0,0,0,0|2,0,0]=4 9392 B11R0.5 CCOCC(C)OC(C)CCO 34a_100000718985_100009893172 [0,2,0,0,0,0|2,0,0]=4 9393 B11R0.5 CCOCC(C)OC(C)CCO 7a_100000718985_100009893172 [0,2,0,0,0,0|2,0,0]=4 9394 B11R0.5 CCOCC(C)OC(C)COC 34a_100000718985_100000765312 [0,2,0,0,0,0|0,0,0]=2 9395 B11R0.5 CCOCC(C)OC(C)COC 7a_100000718985_100000765312 [0,2,0,0,0,0|0,0,0]=2 9396 B11R0.5 CCOCN(C)CC(O)COC 269982a_100000739405_100000739092 [0,2,0,0,0,0|2,0,0]=4 9397 B11R0.5 CCOC[C@@H](C)OC(C)OCC 34a_200015424329_100000210202 [0,2,0,0,0,0|2,0,0]=4 9398 B11R0.5 CCOC[C@@H](C)OC(C)OCC 7a_200015424329_100000210202 [0,2,0,0,0,0|2,0,0]=4 9399 B11R0.5 CCSC(C)CC(=O)CCOC 1458a_200011311441_100000233755 [0,2,0,0,0,0|1,1,0]=4 9400 B11R0.5 CCSCC(C)N[C@H](C)COC 270004a_100000764878_200011216171 [0,2,0,0,0,0|1,1,0]=4 9401 B11R0.5 COCC(C)OC(C)CCCCl 34a_200000718107_100000765312 [0,2,0,0,0,0|2,0,0]=4 9402 B11R0.5 COCC(C)OC(C)CCCCl 7a_200000718107_100000765312 [0,2,0,0,0,0|2,0,0]=4 9403 B11R0.62 CCCC(C)CN[C@H](C)COC 2230a_100000764878_100011216630 [0,2,0,0,0,0|2,0,0]=4 9404 B11R0.62 CCCC(C)CN[C@H](C)COC 270004a_100000764878_100000243154 [0,2,0,0,0,0|2,0,0]=4 9405 B11R0.62 CCCC(C)COC(C)CCC 34a_100000688023_100000766640 [0,2,0,0,0,0|2,0,0]=4 9406 B11R0.62 CCCC(C)COC(C)CCC 34a_100000764384_100011216630 [0,2,0,0,0,0|2,0,0]=4 9407 B11R0.62 CCCC(C)COC(C)CCC 7a_100000688023_100000766640 [0,2,0,0,0,0|2,0,0]=4 9408 B11R0.62 CCCC(C)COC(C)CCC 7a_100000764384_100011216630 [0,2,0,0,0,0|2,0,0]=4 9409 B11R0.62 CCCC(C)COC(C)COC 34a_100000688023_100000765312 [0,2,0,0,0,0|1,0,0]=3 9410 B11R0.62 CCCC(C)COC(C)COC 7a_100000688023_100000765312 [0,2,0,0,0,0|1,0,0]=3 9411 B11R0.62 CCCC(C)CO[C@H](C)COC 34a_100011934205_100011216630 [0,2,0,0,0,0|1,0,0]=3 9412 B11R0.62 CCCC(C)CSC(C)COC 62a_100000765312_100011216630 [0,2,0,0,0,0|1,1,0]=4 9413 B11R0.62 CCCC(C)CSC(C)COC 62a_100011216630_100000765312 [0,2,0,0,0,0|1,1,0]=4 9414 B11R0.62 CCCC(C)OCC(=O)OCC 34a_100000764384_100000188475 [0,2,0,0,0,0|1,0,1]=4 9415 B11R0.62 CCCC(C)OCC(=O)OCC 7a_100000764384_100000188475 [0,2,0,0,0,0|1,0,1]=4 9416 B11R0.62 CCCC(C)OC[C@@H](N)CCC 34a_100000732646_100000766640 [0,2,0,0,0,0|2,0,0]=4 9417 B11R0.62 CCC[C@H](N)COC(C)COC 34a_100000732646_100000765312 [0,2,0,0,0,0|1,0,0]=3 9418 B11R0.62 CCNC(=O)CO[C@H](C)COC 34a_100011934205_100000183381 [0,2,0,0,0,0|1,0,1]=4 9419 B11R0.62 CCOC(=O)CN[C@H](C)COC 2230a_100000764878_100000188475 [0,2,0,0,0,0|1,0,1]=4 9420 B11R0.62 CCOC(=O)CO[C@H](C)COC 34a_100011934205_100000188475 [0,2,0,0,0,0|0,0,1]=3 9421 B11R0.62 CCOC(=O)CSC(C)COC 62a_100000188475_100000765312 [0,2,0,0,0,0|0,1,1]=4 9422 B11R0.62 CCOC(=O)CSC(C)COC 62a_100000765312_100000188475 [0,2,0,0,0,0|0,1,1]=4 9423 B11R0.62 CCOC(C)COC(C)COC 34a_200011930013_100000210202 [0,2,0,0,0,0|0,0,0]=2 9424 B11R0.62 CCOC(C)COC(C)COC 7a_200011930013_100000210202 [0,2,0,0,0,0|0,0,0]=2 9425 B11R0.62 COCC(C)OCC(C)CCN 34a_106354213184_100000765312 [0,2,0,0,0,0|2,0,0]=4 9426 B11R0.62 COCC(C)OCC(C)OCF 34a_200011930013_100015361967 [0,2,0,0,0,0|1,0,0]=3 9427 B11R0.62 COCC(C)OCC(C)OCF 7a_200011930013_100015361967 [0,2,0,0,0,0|1,0,0]=3 9428 B11R0.62 COCC(N)COC(C)COC 34a_100000724102_100000765312 [0,2,0,0,0,0|2,0,0]=4 9429 B11R0.62 COCC(O)CO[C@H](C)COC 34a_100011934205_100011215053 [0,2,0,0,0,0|2,0,0]=4 9430 B11R0.81 C#CCCCOC(C)COCC 34a_100000718985_100000695029 [0,2,0,0,0,0|1,0,1]=4 9431 B11R0.81 C#CCCCOC(C)COCC 7a_100000718985_100011215417 [0,2,0,0,0,0|1,0,1]=4 9432 B11R0.81 C#CCCOC[C@@H](C)OCOC 34a_100016172286_100000688953 [0,2,0,0,0,0|1,0,1]=4 9433 B11R0.81 C#CCCOC[C@@H](C)OCOC 7a_100016172286_100000688953 [0,2,0,0,0,0|1,0,1]=4 9434 B11R0.81 C#CCOC(C)COCCCC 34a_100011217071_100000184674 [0,2,0,0,0,0|1,0,1]=4 9435 B11R0.81 C#CCOC(C)COCCCC 34a_200000093152_100000210210 [0,2,0,0,0,0|1,0,1]=4 9436 B11R0.81 C#CCOC(C)COCCCC 7a_100011217071_100000038162 [0,2,0,0,0,0|1,0,1]=4 9437 B11R0.81 C#CCOC(C)COCCCC 7a_200000093152_100000210211 [0,2,0,0,0,0|1,0,1]=4 9438 B11R0.81 C#CCOC(C)COCCOC 34a_200000093152_100011201679 [0,2,0,0,0,0|0,0,1]=3 9439 B11R0.81 C#CCOC(C)COCCOC 7a_200000093152_100000233755 [0,2,0,0,0,0|0,0,1]=3 9440 B11R0.81 C#CCOC(C)COCCSC 34a_200000093152_100000212216 [0,2,0,0,0,0|0,1,1]=4 9441 B11R0.81 C#CCOC(C)COCCSC 7a_200000093152_100000212216 [0,2,0,0,0,0|0,1,1]=4 9442 B11R0.81 C#CCOCCC(=O)CCOC 1458a_100000693358_100000233755 [0,2,0,0,0,0|1,0,1]=4 9443 B11R0.81 C#CCOCCC(=O)CCOC 1458a_100000749529_100010402529 [0,2,0,0,0,0|1,0,1]=4 9444 B11R0.81 C#CCOCCN(C)CCOC 2230a_100000743101_100010402529 [0,2,0,0,0,0|1,0,1]=4 9445 B11R0.81 C/C=C/CC(=O)COCCOC 1458a_100000211095_100102629194 [0,2,0,0,0,0|1,0,1]=4 9446 B11R0.81 C/C=C/CCOC(C)CCCC 34a_100016278192_200011215066 [0,2,0,0,0,0|2,0,0]=4 9447 B11R0.81 C/C=C/COC[C@@H](C)OCOC 34a_100016172286_100102629194 [0,2,0,0,0,0|1,0,1]=4 9448 B11R0.81 C/C=C/COC[C@@H](C)OCOC 7a_100016172286_100102629194 [0,2,0,0,0,0|1,0,1]=4 9449 B11R0.81 C=C(COCCCC)OCOC 34a_100000210227_100000042856 [0,2,0,0,0,0|1,0,1]=4 9450 B11R0.81 C=C(COCCOC)OCOC 34a_100000210237_100000042856 [0,2,0,0,0,0|0,0,1]=3 9451 B11R0.81 C=C(COCCON)OCOC 34a_100000700252_100000042856 [0,2,0,0,0,0|1,0,1]=4 9452 B11R0.81 C=C(COCCSC)OCOC 34a_100000230434_100000042856 [0,2,0,0,0,0|0,1,1]=4 9453 B11R0.81 C=C(CSCCOC)OCOC 62a_100000042856_100000233755 [0,2,0,0,0,0|0,1,1]=4 9454 B11R0.81 C=C(CSCCOC)OCOC 62a_100000233755_100000042856 [0,2,0,0,0,0|0,1,1]=4 9455 B11R0.81 C=C(CSCOCC)OCOC 62a_100000042856_100000739092 [0,2,0,0,0,0|2,0,0]=4 9456 B11R0.81 C=C(CSCOCC)OCOC 62a_100000739092_100000042856 [0,2,0,0,0,0|2,0,0]=4 9457 B11R0.81 C=CCCC(C)OCCOCC 34a_100000765329_100000210147 [0,2,0,0,0,0|1,0,1]=4 9458 B11R0.81 C=CCCC(C)OCCOCC 7a_100000765329_100011215890 [0,2,0,0,0,0|1,0,1]=4 9459 B11R0.81 C=CCCCOC(C)COCC 34a_100000718985_100000757094 [0,2,0,0,0,0|1,0,1]=4 9460 B11R0.81 C=CCCCOC(C)COCC 7a_100000718985_100000757094 [0,2,0,0,0,0|1,0,1]=4 9461 B11R0.81 C=CCCOC[C@@H](C)OCOC 34a_100016172286_100000754431 [0,2,0,0,0,0|1,0,1]=4 9462 B11R0.81 C=CCCOC[C@@H](C)OCOC 7a_100016172286_100000754431 [0,2,0,0,0,0|1,0,1]=4 9463 B11R0.81 C=CCOC(=O)COCCOC 34a_100000210237_100000033060 [0,2,0,0,0,0|0,0,2]=4 9464 B11R0.81 C=CCOC(C)COCCCC 34a_100011217071_100015514636 [0,2,0,0,0,0|1,0,1]=4 9465 B11R0.81 C=CCOC(C)COCCCC 7a_100011217071_100015514636 [0,2,0,0,0,0|1,0,1]=4 9466 B11R0.81 C=CCOCCC(=O)CCOC 1458a_200011217002_100000233755 [0,2,0,0,0,0|1,0,1]=4 9467 B11R0.81 C=COCCOC(C)CCCC 34a_100000033082_200011215066 [0,2,0,0,0,0|1,0,1]=4 9468 B11R0.81 C=COCCOC(C)CCCC 34a_100000687866_100000039644 [0,2,0,0,0,0|1,0,1]=4 9469 B11R0.81 C=COCCOC(C)CCCC 7a_100000687866_100000039644 [0,2,0,0,0,0|1,0,1]=4 9470 B11R0.81 C=COCCOC(C)COCC 34a_100000718985_100000039644 [0,2,0,0,0,0|0,0,1]=3 9471 B11R0.81 C=COCCOC(C)COCC 7a_100000718985_100000039644 [0,2,0,0,0,0|0,0,1]=3 9472 B11R0.81 CC#CCC(=O)COCCOC 1458a_100000211095_100000748600 [0,2,0,0,0,0|1,0,1]=4 9473 B11R0.81 CC#CCCOC(C)CCCC 34a_100000750427_200011215066 [0,2,0,0,0,0|2,0,0]=4 9474 B11R0.81 CC#CCOC[C@@H](C)OCOC 34a_100016172286_100000748600 [0,2,0,0,0,0|1,0,1]=4 9475 B11R0.81 CC#CCOC[C@@H](C)OCOC 7a_100016172286_100000748600 [0,2,0,0,0,0|1,0,1]=4 9476 B11R0.81 CC/C=C\CCC(=O)CCOC 1458a_100000749529_100015370543 [0,2,0,0,0,0|2,0,0]=4 9477 B11R0.81 CC/C=C\CCN(C)CCOC 2230a_100000743101_100015370543 [0,2,0,0,0,0|2,0,0]=4 9478 B11R0.81 CC/C=C\CCN(C)CCOC 269982a_100000743101_100015370543 [0,2,0,0,0,0|2,0,0]=4 9479 B11R0.81 CC/C=C\COC(C)COCC 34a_100000718985_100103147603 [0,2,0,0,0,0|1,0,1]=4 9480 B11R0.81 CC/C=C\COC(C)COCC 7a_100000718985_100103147603 [0,2,0,0,0,0|1,0,1]=4 9481 B11R0.81 CC=CCC(=O)COCCOC 1458a_100000211095_100000070051 [0,2,0,0,0,0|1,0,1]=4 9482 B11R0.81 CC=CCOC[C@@H](C)OCOC 34a_100016172286_100000070051 [0,2,0,0,0,0|1,0,1]=4 9483 B11R0.81 CC=CCOC[C@@H](C)OCOC 7a_100016172286_100000070051 [0,2,0,0,0,0|1,0,1]=4 9484 B11R0.81 CCC#CC(C)OCCCOC 34a_100000033903_100000740836 [0,2,0,0,0,0|1,0,1]=4 9485 B11R0.81 CCC#CC(C)OCCCOC 7a_100000033903_100000740836 [0,2,0,0,0,0|1,0,1]=4 9486 B11R0.81 CCC#CC(C)OCCOCC 34a_100000033903_100000210147 [0,2,0,0,0,0|1,0,1]=4 9487 B11R0.81 CCC#CC(C)OCCOCC 7a_100000033903_100011215890 [0,2,0,0,0,0|1,0,1]=4 9488 B11R0.81 CCC#CCOC(C)COCC 34a_100000718985_100009813939 [0,2,0,0,0,0|1,0,1]=4 9489 B11R0.81 CCC#CCOC(C)COCC 7a_100000718985_100009813939 [0,2,0,0,0,0|1,0,1]=4 9490 B11R0.81 CCCCC(=O)CCCCOC 1458a_100000210183_100000755781 [0,2,0,0,0,0|2,0,0]=4 9491 B11R0.81 CCCCC(=O)CCCOCC 1458a_100000210183_100012232248 [0,2,0,0,0,0|2,0,0]=4 9492 B11R0.81 CCCCC(=O)CCOCCC 1458a_100000210183_100011215938 [0,2,0,0,0,0|2,0,0]=4 9493 B11R0.81 CCCCC(=O)CCOCCO 1458a_100000210183_100011215305 [0,2,0,0,0,0|2,0,0]=4 9494 B11R0.81 CCCCC(=O)CCOCCO 1458a_100011229844_100000210211 [0,2,0,0,0,0|2,0,0]=4 9495 B11R0.81 CCCCC(=O)COCCOC 1458a_100000211095_100000210211 [0,2,0,0,0,0|1,0,0]=3 9496 B11R0.81 CCCCC(=O)NCCOCC 11a_100011200944_100000210183 [0,2,0,0,0,0|2,0,0]=4 9497 B11R0.81 CCCCC(=O)NCCOCC 1626a_102516460346_100000210183 [0,2,0,0,0,0|2,0,0]=4 9498 B11R0.81 CCCCC(=O)NCCOCC 240690a_100011200944_100000210183 [0,2,0,0,0,0|2,0,0]=4 9499 B11R0.81 CCCCC(=O)NCCOCC 527a_100011200944_100000210183 [0,2,0,0,0,0|2,0,0]=4 9500 B11R0.81 CCCCC(C)CCCCOC 34a_200011021034_200000210301 [0,2,0,0,0,0|2,0,0]=4 9501 B11R0.81 CCCCC(C)CCCCOC 7a_200011021034_200000210301 [0,2,0,0,0,0|2,0,0]=4 9502 B11R0.81 CCCCC(C)CCCCO[13CH3] 34a_200011021034_200025704644 [0,2,0,0,0,0|2,0,0]=4 9503 B11R0.81 CCCCC(C)CCCCO[13CH3] 7a_200011021034_200025704644 [0,2,0,0,0,0|2,0,0]=4 9504 B11R0.81 CCCCC(C)COCCOC 34a_100011995851_100011201679 [0,2,0,0,0,0|1,0,0]=3 9505 B11R0.81 CCCCC(C)COCCOC 7a_100011995851_100000233755 [0,2,0,0,0,0|1,0,0]=3 9506 B11R0.81 CCCCC(C)COCCSC 34a_100011995851_100000212216 [0,2,0,0,0,0|1,1,0]=4 9507 B11R0.81 CCCCC(C)COCCSC 7a_100011995851_100000212216 [0,2,0,0,0,0|1,1,0]=4 9508 B11R0.81 CCCCC(C)NCCCOC 2230a_100000126638_100000740836 [0,2,0,0,0,0|2,0,0]=4 9509 B11R0.81 CCCCC(C)NCCCOC 270004a_100150723488_100000210087 [0,2,0,0,0,0|2,0,0]=4 9510 B11R0.81 CCCCC(C)NCCCOC 34a_100150723488_200011215066 [0,2,0,0,0,0|2,0,0]=4 9511 B11R0.81 CCCCC(C)NCCOCC 2230a_100000126638_100011215890 [0,2,0,0,0,0|2,0,0]=4 9512 B11R0.81 CCCCC(C)NCCOCC 2230a_102516460346_200011215066 [0,2,0,0,0,0|2,0,0]=4 9513 B11R0.81 CCCCC(C)NCCOCC 270004a_102516460346_100000210087 [0,2,0,0,0,0|2,0,0]=4 9514 B11R0.81 CCCCC(C)NCCOCC 34a_102516460346_200011215066 [0,2,0,0,0,0|2,0,0]=4 9515 B11R0.81 CCCCC(C)OCCCCBr 34a_100011216708_200011215066 [0,2,0,0,0,0|2,0,0]=4 9516 B11R0.81 CCCCC(C)OCCCCCl 34a_100000210776_200011215066 [0,2,0,0,0,0|2,0,0]=4 9517 B11R0.81 CCCCC(C)OCCCCCl 7a_100000210776_200011215066 [0,2,0,0,0,0|2,0,0]=4 9518 B11R0.81 CCCCC(C)OCCCCF 34a_100000687866_100000729493 [0,2,0,0,0,0|2,0,0]=4 9519 B11R0.81 CCCCC(C)OCCCCF 34a_100011995726_200011215066 [0,2,0,0,0,0|2,0,0]=4 9520 B11R0.81 CCCCC(C)OCCCCF 7a_100000687866_100000729493 [0,2,0,0,0,0|2,0,0]=4 9521 B11R0.81 CCCCC(C)OCCCCF 7a_100011995726_200011215066 [0,2,0,0,0,0|2,0,0]=4 9522 B11R0.81 CCCCC(C)OCCCCI 34a_200012148704_200011215066 [0,2,0,0,0,0|2,0,0]=4 9523 B11R0.81 CCCCC(C)OCCCCN 34a_100000750430_200011215066 [0,2,0,0,0,0|2,0,0]=4 9524 B11R0.81 CCCCC(C)OCCCCO 34a_100000687866_100011216708 [0,2,0,0,0,0|2,0,0]=4 9525 B11R0.81 CCCCC(C)OCCCCO 7a_100000687866_100000210776 [0,2,0,0,0,0|2,0,0]=4 9526 B11R0.81 CCCCC(C)OCCCNC 34a_100000213112_200011215066 [0,2,0,0,0,0|2,0,0]=4 9527 B11R0.81 CCCCC(C)OCCCOC 34a_100000687866_100000740836 [0,2,0,0,0,0|1,0,0]=3 9528 B11R0.81 CCCCC(C)OCCCOC 34a_100000740835_200011215066 [0,2,0,0,0,0|1,0,0]=3 9529 B11R0.81 CCCCC(C)OCCCOC 7a_100000687866_100000740836 [0,2,0,0,0,0|1,0,0]=3 9530 B11R0.81 CCCCC(C)OCCCSC 34a_100000690336_200011215066 [0,2,0,0,0,0|1,1,0]=4 9531 B11R0.81 CCCCC(C)OCCCSC 7a_100000690336_200011215066 [0,2,0,0,0,0|1,1,0]=4 9532 B11R0.81 CCCCC(C)OCCOCC 34a_100000210136_200011215066 [0,2,0,0,0,0|1,0,0]=3 9533 B11R0.81 CCCCC(C)OCCOCC 34a_100000687866_100000210147 [0,2,0,0,0,0|1,0,0]=3 9534 B11R0.81 CCCCC(C)OCCOCC 7a_100000210136_200011215066 [0,2,0,0,0,0|1,0,0]=3 9535 B11R0.81 CCCCC(C)OCCOCC 7a_100000687866_100011215890 [0,2,0,0,0,0|1,0,0]=3 9536 B11R0.81 CCCCC(C)OCCSCC 34a_100000212035_200011215066 [0,2,0,0,0,0|1,1,0]=4 9537 B11R0.81 CCCCC(C)OCCSCC 34a_100000687866_100000757381 [0,2,0,0,0,0|1,1,0]=4 9538 B11R0.81 CCCCC(C)OCCSCC 7a_100000212035_200011215066 [0,2,0,0,0,0|1,1,0]=4 9539 B11R0.81 CCCCC(C)OCCSCC 7a_100000687866_100000757381 [0,2,0,0,0,0|1,1,0]=4 9540 B11R0.81 CCCCC(C)SCCCOC 62a_100000709357_200011215066 [0,2,0,0,0,0|1,1,0]=4 9541 B11R0.81 CCCCC(C)SCCCOC 62a_200011215066_100000709357 [0,2,0,0,0,0|1,1,0]=4 9542 B11R0.81 CCCCC(C)SCCOCC 62a_100000210147_200011215066 [0,2,0,0,0,0|1,1,0]=4 9543 B11R0.81 CCCCC(C)SCCOCC 62a_200011215066_100011215890 [0,2,0,0,0,0|1,1,0]=4 9544 B11R0.81 CCCCCCC(=O)CCOC 1458a_100000749529_100000210757 [0,2,0,0,0,0|2,0,0]=4 9545 B11R0.81 CCCCCCC(=O)CCOC 1458a_100102632555_100000233755 [0,2,0,0,0,0|2,0,0]=4 9546 B11R0.81 CCCCCCC(=O)COCC 1458a_100000211967_100000210757 [0,2,0,0,0,0|2,0,0]=4 9547 B11R0.81 CCCCCCC(C)CCOC 34a_200011024964_200000210301 [0,2,0,0,0,0|2,0,0]=4 9548 B11R0.81 CCCCCCC(C)CCOC 7a_200011024964_200000210301 [0,2,0,0,0,0|2,0,0]=4 9549 B11R0.81 CCCCCCC(C)CCO[13CH3] 34a_200011024964_200025704644 [0,2,0,0,0,0|2,0,0]=4 9550 B11R0.81 CCCCCCC(C)CCO[13CH3] 7a_200011024964_200025704644 [0,2,0,0,0,0|2,0,0]=4 9551 B11R0.81 CCCCCCC(C)NCOC 2230a_100000210919_100000766300 [0,2,0,0,0,0|2,0,0]=4 9552 B11R0.81 CCCCCCC(C)OCCBr 34a_100000211926_100011215978 [0,2,0,0,0,0|2,0,0]=4 9553 B11R0.81 CCCCCCC(C)OCCC 34a_100000210258_100011215978 [0,2,0,0,0,0|2,0,0]=4 9554 B11R0.81 CCCCCCC(C)OCCC 34a_100000210265_100000210303 [0,2,0,0,0,0|2,0,0]=4 9555 B11R0.81 CCCCCCC(C)OCCC 7a_100000210265_100000210303 [0,2,0,0,0,0|2,0,0]=4 9556 B11R0.81 CCCCCCC(C)OCCF 34a_100000210265_100011217306 [0,2,0,0,0,0|2,0,0]=4 9557 B11R0.81 CCCCCCC(C)OCCF 7a_100000210265_100011217306 [0,2,0,0,0,0|2,0,0]=4 9558 B11R0.81 CCCCCCC(C)OCCN 34a_100000210304_100011215978 [0,2,0,0,0,0|2,0,0]=4 9559 B11R0.81 CCCCCCC(C)OCCO 34a_100000210265_100000211926 [0,2,0,0,0,0|2,0,0]=4 9560 B11R0.81 CCCCCCC(C)OCCO 7a_100000210265_100000211926 [0,2,0,0,0,0|2,0,0]=4 9561 B11R0.81 CCCCCCC(C)OCSC 34a_100000210265_100011218213 [0,2,0,0,0,0|2,0,0]=4 9562 B11R0.81 CCCCCCC(C)SCOC 62a_100000766300_100011215978 [0,2,0,0,0,0|2,0,0]=4 9563 B11R0.81 CCCCCCC(C)SCOC 62a_100011215978_100000766300 [0,2,0,0,0,0|2,0,0]=4 9564 B11R0.81 CCCCCCN(C)CCOC 2230a_100000743101_100000210314 [0,2,0,0,0,0|2,0,0]=4 9565 B11R0.81 CCCCCCN(C)CCOC 2230a_106256046315_100011201679 [0,2,0,0,0,0|2,0,0]=4 9566 B11R0.81 CCCCCCN(C)CCOC 269982a_100000743101_100000210757 [0,2,0,0,0,0|2,0,0]=4 9567 B11R0.81 CCCCCCN(C)CCOC 269982a_106256046315_100000233755 [0,2,0,0,0,0|2,0,0]=4 9568 B11R0.81 CCCCCCN(C)COCC 269982a_106256046315_100000739092 [0,2,0,0,0,0|2,0,0]=4 9569 B11R0.81 CCCCCNC(=O)CCOC 11a_100000209983_100000749529 [0,2,0,0,0,0|2,0,0]=4 9570 B11R0.81 CCCCCNC(=O)CCOC 1626a_100000209983_100000749529 [0,2,0,0,0,0|2,0,0]=4 9571 B11R0.81 CCCCCNC(=O)CCOC 240690a_100000209983_100000749529 [0,2,0,0,0,0|2,0,0]=4 9572 B11R0.81 CCCCCNC(=O)CCOC 527a_100000209983_100000749529 [0,2,0,0,0,0|2,0,0]=4 9573 B11R0.81 CCCCCNC(C)CCOC 270004a_100000209983_100000742357 [0,2,0,0,0,0|2,0,0]=4 9574 B11R0.81 CCCCCOC(C)CCCC 34a_100000210253_200011215066 [0,2,0,0,0,0|2,0,0]=4 9575 B11R0.81 CCCCCOC(C)CCCC 34a_100000687866_100000718602 [0,2,0,0,0,0|2,0,0]=4 9576 B11R0.81 CCCCCOC(C)CCCC 7a_100000210253_200011215066 [0,2,0,0,0,0|2,0,0]=4 9577 B11R0.81 CCCCCOC(C)CCCC 7a_100000687866_100000210326 [0,2,0,0,0,0|2,0,0]=4 9578 B11R0.81 CCCCCOC(C)CCCCl 34a_200000718107_100000718602 [0,2,0,0,0,0|2,0,0]=4 9579 B11R0.81 CCCCCOC(C)CCCCl 7a_200000718107_100000210326 [0,2,0,0,0,0|2,0,0]=4 9580 B11R0.81 CCCCCOC(C)COCC 34a_100000718985_100000718602 [0,2,0,0,0,0|1,0,0]=3 9581 B11R0.81 CCCCCOC(C)COCC 7a_100000718985_100000210326 [0,2,0,0,0,0|1,0,0]=3 9582 B11R0.81 CCCCN(C)CCCCOC 2230a_100000207549_100000730899 [0,2,0,0,0,0|2,0,0]=4 9583 B11R0.81 CCCCN(C)CCCCOC 269982a_100000207549_100000730899 [0,2,0,0,0,0|2,0,0]=4 9584 B11R0.81 CCCCN(C)CCCOCC 2230a_100000207549_100012232248 [0,2,0,0,0,0|2,0,0]=4 9585 B11R0.81 CCCCN(C)CCCOCC 269982a_100000207549_100012232248 [0,2,0,0,0,0|2,0,0]=4 9586 B11R0.81 CCCCN(C)CCOCCC 2230a_100000207549_100011215938 [0,2,0,0,0,0|2,0,0]=4 9587 B11R0.81 CCCCN(C)CCOCCC 269982a_100000207549_100011215938 [0,2,0,0,0,0|2,0,0]=4 9588 B11R0.81 CCCCN(C)CCOCCO 2230a_100000207549_100011215305 [0,2,0,0,0,0|2,0,0]=4 9589 B11R0.81 CCCCN(C)CCOCCO 2230a_100000228057_100000210211 [0,2,0,0,0,0|2,0,0]=4 9590 B11R0.81 CCCCN(C)CCOCCO 269982a_100000207549_100011215305 [0,2,0,0,0,0|2,0,0]=4 9591 B11R0.81 CCCCN(C)CCOCCO 269982a_100000228057_100000210211 [0,2,0,0,0,0|2,0,0]=4 9592 B11R0.81 CCCCN(C)COCCOC 2230a_100000207549_100000231047 [0,2,0,0,0,0|1,0,0]=3 9593 B11R0.81 CCCCN(C)COCCOC 269982a_100000207549_100000231047 [0,2,0,0,0,0|1,0,0]=3 9594 B11R0.81 CCCCNCC(C)OCCC 2230a_100015185124_100000210211 [0,2,0,0,0,0|2,0,0]=4 9595 B11R0.81 CCCCNCC(C)OCCC 34a_100015185124_100000210210 [0,2,0,0,0,0|2,0,0]=4 9596 B11R0.81 CCCCNCC(O)COCC 2230a_102515437182_100000210211 [0,2,0,0,0,0|2,0,0]=4 9597 B11R0.81 CCCCNCC(O)COCC 34a_102515437182_100000210210 [0,2,0,0,0,0|2,0,0]=4 9598 B11R0.81 CCCCOCC(=O)CCCC 1458a_100000210183_100011995733 [0,2,0,0,0,0|2,0,0]=4 9599 B11R0.81 CCCCOCC(=O)CCCC 1458a_100000757543_100000210211 [0,2,0,0,0,0|2,0,0]=4 9600 B11R0.81 CCCCOCC(=O)CCOC 1458a_100000749529_100011995733 [0,2,0,0,0,0|2,0,0]=4 9601 B11R0.81 CCCCOCC(=O)CCOC 1458a_100000757543_100000233755 [0,2,0,0,0,0|2,0,0]=4 9602 B11R0.81 CCCCOCC(=O)COCC 1458a_100000211967_100011995733 [0,2,0,0,0,0|1,0,0]=3 9603 B11R0.81 CCCCOCC(=O)CSCC 1458a_100000230394_100011995733 [0,2,0,0,0,0|1,1,0]=4 9604 B11R0.81 CCCCOCC(=O)OCCC 34a_100000210227_200011215008 [0,2,0,0,0,0|1,0,1]=4 9605 B11R0.81 CCCCOCC(=O)OCCC 7a_100000210227_200011215008 [0,2,0,0,0,0|1,0,1]=4 9606 B11R0.81 CCCCOCC(C)CCCC 34a_100011995851_100000210210 [0,2,0,0,0,0|2,0,0]=4 9607 B11R0.81 CCCCOCC(C)CCCC 7a_100011995851_100000210211 [0,2,0,0,0,0|2,0,0]=4 9608 B11R0.81 CCCCOCC(C)OCC#N 7a_100011217071_100011215382 [0,2,0,0,0,0|1,0,1]=4 9609 B11R0.81 CCCCOCC(C)OCC=O 34a_100011217071_200009817547 [0,2,0,0,0,0|1,0,1]=4 9610 B11R0.81 CCCCOCC(C)OCC=O 7a_100011217071_200015260668 [0,2,0,0,0,0|1,0,1]=4 9611 B11R0.81 CCCCOCC(C)OCCC 34a_100011217071_100000210303 [0,2,0,0,0,0|1,0,0]=3 9612 B11R0.81 CCCCOCC(C)OCCC 7a_100011217071_100000210303 [0,2,0,0,0,0|1,0,0]=3 9613 B11R0.81 CCCCOCC(C)OCCF 34a_100011217071_100011217306 [0,2,0,0,0,0|1,0,0]=3 9614 B11R0.81 CCCCOCC(C)OCCF 7a_100011217071_100011217306 [0,2,0,0,0,0|1,0,0]=3 9615 B11R0.81 CCCCOCC(C)OCCO 34a_100011217071_100000211926 [0,2,0,0,0,0|1,0,0]=3 9616 B11R0.81 CCCCOCC(C)OCCO 7a_100011217071_100000211926 [0,2,0,0,0,0|1,0,0]=3 9617 B11R0.81 CCCCOCC(C)OCSC 34a_100011217071_100011218213 [0,2,0,0,0,0|1,0,0]=3 9618 B11R0.81 CCCCOCN(C)CCCC 2230a_100000207549_100011995733 [0,2,0,0,0,0|2,0,0]=4 9619 B11R0.81 CCCCOCN(C)CCCC 269982a_100000207549_100011995733 [0,2,0,0,0,0|2,0,0]=4 9620 B11R0.81 CCCCOCN(C)CCOC 2230a_100000743101_100011995733 [0,2,0,0,0,0|2,0,0]=4 9621 B11R0.81 CCCCOCN(C)CCOC 269982a_100000743101_100011995733 [0,2,0,0,0,0|2,0,0]=4 9622 B11R0.81 CCCCOC[C@@H](C)OCOC 34a_100016172286_100000210210 [0,2,0,0,0,0|1,0,0]=3 9623 B11R0.81 CCCCOC[C@@H](C)OCOC 7a_100016172286_100000210211 [0,2,0,0,0,0|1,0,0]=3 9624 B11R0.81 CCCCOC[C@@H](N)CCCC 34a_100011934283_100000210210 [0,2,0,0,0,0|2,0,0]=4 9625 B11R0.81 CCCCOC[C@@H](N)CCSC 34a_100011827619_100000210210 [0,2,0,0,0,0|2,0,0]=4 9626 B11R0.81 CCCCSCC(=O)CCOC 1458a_100000191162_100000233755 [0,2,0,0,0,0|2,0,0]=4 9627 B11R0.81 CCCC[C@H](N)COCCOC 34a_100011934283_100011201679 [0,2,0,0,0,0|1,0,0]=3 9628 B11R0.81 CCCC[C@H](N)COCCSC 34a_100011934283_100000212216 [0,2,0,0,0,0|1,1,0]=4 9629 B11R0.81 CCCNC(=O)COCCOC 11a_100020643023_100000211095 [0,2,0,0,0,0|1,0,1]=4 9630 B11R0.81 CCCNC(=O)COCCOC 1626a_100020643023_100000211095 [0,2,0,0,0,0|1,0,1]=4 9631 B11R0.81 CCCNC(=O)COCCOC 240690a_100020643023_100000211095 [0,2,0,0,0,0|1,0,1]=4 9632 B11R0.81 CCCNC(=O)COCCOC 34a_100000210237_100000183358 [0,2,0,0,0,0|1,0,1]=4 9633 B11R0.81 CCCNC(=O)COCCOC 527a_100020643023_100000211095 [0,2,0,0,0,0|1,0,1]=4 9634 B11R0.81 CCCOC(=O)CNCCOC 2230a_100000209980_200011215008 [0,2,0,0,0,0|1,0,1]=4 9635 B11R0.81 CCCOC(=O)COCCOC 34a_100000210237_200011215008 [0,2,0,0,0,0|0,0,1]=3 9636 B11R0.81 CCCOC(=O)COCCON 34a_100000700252_200011215008 [0,2,0,0,0,0|1,0,1]=4 9637 B11R0.81 CCCOC(=O)COCCSC 34a_100000230434_200011215008 [0,2,0,0,0,0|0,1,1]=4 9638 B11R0.81 CCCOC(=O)COCCSC 7a_100000230434_200011215008 [0,2,0,0,0,0|0,1,1]=4 9639 B11R0.81 CCCOC(=O)CSCCOC 62a_100000233755_200011215008 [0,2,0,0,0,0|0,1,1]=4 9640 B11R0.81 CCCOC(=O)CSCCOC 62a_200011215008_100000233755 [0,2,0,0,0,0|0,1,1]=4 9641 B11R0.81 CCCOC(C)CNCCOC 2230a_100015185124_100011201679 [0,2,0,0,0,0|1,0,0]=3 9642 B11R0.81 CCCOC(C)CNCCOC 34a_100015185124_100011201679 [0,2,0,0,0,0|1,0,0]=3 9643 B11R0.81 CCCOC(C)CNCCSC 2230a_100015185124_100000751147 [0,2,0,0,0,0|1,1,0]=4 9644 B11R0.81 CCCOC(C)CNCCSC 34a_100015185124_100000212216 [0,2,0,0,0,0|1,1,0]=4 9645 B11R0.81 CCCOCCC(=O)CCOC 1458a_100000749529_100011215938 [0,2,0,0,0,0|1,0,0]=3 9646 B11R0.81 CCCOCCC(=O)CCSC 1458a_100000174002_100011215938 [0,2,0,0,0,0|1,1,0]=4 9647 B11R0.81 CCCOCCN(C)CCOC 2230a_100000743101_100011215938 [0,2,0,0,0,0|1,0,0]=3 9648 B11R0.81 CCCOCCN(C)CCOC 269982a_100000743101_100011215938 [0,2,0,0,0,0|1,0,0]=3 9649 B11R0.81 CCCOCCN(C)CCSC 2230a_100000686725_100011215938 [0,2,0,0,0,0|1,1,0]=4 9650 B11R0.81 CCCOCCN(C)CCSC 269982a_100000686725_100011215938 [0,2,0,0,0,0|1,1,0]=4 9651 B11R0.81 CCNCC(=O)OCCOCC 2230a_100015525214_200000101388 [0,2,0,0,0,0|1,0,1]=4 9652 B11R0.81 CCNNC(=O)COCCOC 22a_100000756455_100000211095 [0,2,0,0,0,0|1,0,1]=4 9653 B11R0.81 CCOCC(=O)CCCCOC 1458a_100000211967_100000755781 [0,2,0,0,0,0|1,0,0]=3 9654 B11R0.81 CCOCC(=O)NCCCOC 1626a_100150723488_100000211967 [0,2,0,0,0,0|1,0,1]=4 9655 B11R0.81 CCOCC(=O)NCCCOC 240690a_100150723488_100000211967 [0,2,0,0,0,0|1,0,1]=4 9656 B11R0.81 CCOCC(=O)NCCCOC 34a_100121572206_100000183178 [0,2,0,0,0,0|1,0,1]=4 9657 B11R0.81 CCOCC(=O)NCCCOC 527a_100150723488_100000211967 [0,2,0,0,0,0|1,0,1]=4 9658 B11R0.81 CCOCC(=O)NNCCOC 22a_100000741390_100000211967 [0,2,0,0,0,0|1,0,1]=4 9659 B11R0.81 CCOCC(C)OCC#CCO 34a_100000718985_200000047223 [0,2,0,0,0,0|1,0,1]=4 9660 B11R0.81 CCOCC(C)OCC#CCO 7a_100000718985_200000047223 [0,2,0,0,0,0|1,0,1]=4 9661 B11R0.81 CCOCC(C)OCCCC#N 7a_100000718985_100000687738 [0,2,0,0,0,0|1,0,1]=4 9662 B11R0.81 CCOCC(C)OCCCC=O 7a_100000718985_200011292268 [0,2,0,0,0,0|1,0,1]=4 9663 B11R0.81 CCOCC(C)OCCCCF 34a_100000718985_100000729493 [0,2,0,0,0,0|1,0,0]=3 9664 B11R0.81 CCOCC(C)OCCCCF 7a_100000718985_100000729493 [0,2,0,0,0,0|1,0,0]=3 9665 B11R0.81 CCOCC(C)OCCCCO 34a_100000718985_100011216708 [0,2,0,0,0,0|1,0,0]=3 9666 B11R0.81 CCOCC(C)OCCCCO 7a_100000718985_100000210776 [0,2,0,0,0,0|1,0,0]=3 9667 B11R0.81 CCOCC(C)OCCCOC 34a_100000718985_100000740836 [0,2,0,0,0,0|0,0,0]=2 9668 B11R0.81 CCOCC(C)OCCCOC 7a_100000718985_100000740836 [0,2,0,0,0,0|0,0,0]=2 9669 B11R0.81 CCOCC(C)OCCSCC 34a_100000718985_100000757381 [0,2,0,0,0,0|0,1,0]=3 9670 B11R0.81 CCOCC(C)OCCSCC 7a_100000718985_100000757381 [0,2,0,0,0,0|0,1,0]=3 9671 B11R0.81 CCOCC(O)CNCCOC 2230a_102515437182_100011201679 [0,2,0,0,0,0|1,0,0]=3 9672 B11R0.81 CCOCC(O)CNCCOC 34a_102515437182_100011201679 [0,2,0,0,0,0|1,0,0]=3 9673 B11R0.81 CCOCC(O)CNCCSC 2230a_102515437182_100000751147 [0,2,0,0,0,0|1,1,0]=4 9674 B11R0.81 CCOCC(O)CNCCSC 34a_102515437182_100000212216 [0,2,0,0,0,0|1,1,0]=4 9675 B11R0.81 CCOCCCC(=O)CCOC 1458a_100000749529_100012232248 [0,2,0,0,0,0|1,0,0]=3 9676 B11R0.81 CCOCCCC(=O)CCSC 1458a_100000174002_100012232248 [0,2,0,0,0,0|1,1,0]=4 9677 B11R0.81 CCOCCCC(=O)COCC 1458a_100000211967_100012232248 [0,2,0,0,0,0|1,0,1]=4 9678 B11R0.81 CCOCCCN(C)CCOC 2230a_100000743101_100012232248 [0,2,0,0,0,0|1,0,0]=3 9679 B11R0.81 CCOCCCN(C)CCOC 269982a_100000743101_100012232248 [0,2,0,0,0,0|1,0,0]=3 9680 B11R0.81 CCOCCCN(C)CCSC 2230a_100000686725_100012232248 [0,2,0,0,0,0|1,1,0]=4 9681 B11R0.81 CCOCCCN(C)CCSC 269982a_100000686725_100012232248 [0,2,0,0,0,0|1,1,0]=4 9682 B11R0.81 CCOCCNC(=O)CCOC 11a_100011200944_100000749529 [0,2,0,0,0,0|1,0,0]=3 9683 B11R0.81 CCOCCNC(=O)CCOC 1626a_102516460346_100000749529 [0,2,0,0,0,0|1,0,0]=3 9684 B11R0.81 CCOCCNC(=O)CCOC 240690a_100011200944_100000749529 [0,2,0,0,0,0|1,0,0]=3 9685 B11R0.81 CCOCCNC(=O)CCOC 527a_100011200944_100000749529 [0,2,0,0,0,0|1,0,0]=3 9686 B11R0.81 CCOCCNC(=O)CCSC 11a_100011200944_100000174002 [0,2,0,0,0,0|1,1,0]=4 9687 B11R0.81 CCOCCNC(=O)CCSC 1626a_102516460346_100000174002 [0,2,0,0,0,0|1,1,0]=4 9688 B11R0.81 CCOCCNC(=O)CCSC 240690a_100011200944_100000174002 [0,2,0,0,0,0|1,1,0]=4 9689 B11R0.81 CCOCCNC(=O)CCSC 527a_100011200944_100000174002 [0,2,0,0,0,0|1,1,0]=4 9690 B11R0.81 CCOCCNC(=O)COCC 11a_100011200944_100000211967 [0,2,0,0,0,0|1,0,1]=4 9691 B11R0.81 CCOCCNC(=O)COCC 1626a_102516460346_100000211967 [0,2,0,0,0,0|1,0,1]=4 9692 B11R0.81 CCOCCNC(=O)COCC 240690a_100011200944_100000211967 [0,2,0,0,0,0|1,0,1]=4 9693 B11R0.81 CCOCCNC(=O)COCC 527a_100011200944_100000211967 [0,2,0,0,0,0|1,0,1]=4 9694 B11R0.81 CCOCCNC(C)CCOC 270004a_102516460346_100000742357 [0,2,0,0,0,0|1,0,0]=3 9695 B11R0.81 CCOCCNC(C)CCSC 270004a_102516460346_100011217047 [0,2,0,0,0,0|1,1,0]=4 9696 B11R0.81 CCOCCNC(C)CSCC 270004a_102516460346_200011216171 [0,2,0,0,0,0|1,1,0]=4 9697 B11R0.81 CCOCCOC(=O)COCC 34a_100121572206_200000101388 [0,2,0,0,0,0|0,0,1]=3 9698 B11R0.81 CCOCCOC(=O)CSCC 62a_100000210202_200000101388 [0,2,0,0,0,0|0,1,1]=4 9699 B11R0.81 CCOCCOC(=O)CSCC 62a_200000101388_100000210202 [0,2,0,0,0,0|0,1,1]=4 9700 B11R0.81 CCOCCOC(=O)CSCF 62a_100015361967_200000101388 [0,2,0,0,0,0|0,1,1]=4 9701 B11R0.81 CCOCCOC(=O)CSCF 62a_200000101388_100015361967 [0,2,0,0,0,0|0,1,1]=4 9702 B11R0.81 CCOCCOC(C)CCCCl 34a_200000718107_100000210147 [0,2,0,0,0,0|1,0,0]=3 9703 B11R0.81 CCOCCOC(C)CCCCl 7a_200000718107_100011215890 [0,2,0,0,0,0|1,0,0]=3 9704 B11R0.81 CCOCCOC(C)COCC 34a_100000718985_100000210147 [0,2,0,0,0,0|0,0,0]=2 9705 B11R0.81 CCOCCOC(C)COCC 7a_100000718985_100011215890 [0,2,0,0,0,0|0,0,0]=2 9706 B11R0.81 CCSCC(=O)CCCCOC 1458a_100000230394_100000755781 [0,2,0,0,0,0|1,1,0]=4 9707 B11R0.81 CCSCC(C)NCCCOC 270004a_100150723488_200011216171 [0,2,0,0,0,0|1,1,0]=4 9708 B11R0.81 CCSCCNC(=O)CCOC 11a_100000106463_100000749529 [0,2,0,0,0,0|1,1,0]=4 9709 B11R0.81 CCSCCNC(=O)CCOC 1626a_100000106463_100000749529 [0,2,0,0,0,0|1,1,0]=4 9710 B11R0.81 CCSCCNC(=O)CCOC 240690a_100000106463_100000749529 [0,2,0,0,0,0|1,1,0]=4 9711 B11R0.81 CCSCCNC(=O)CCOC 527a_100000106463_100000749529 [0,2,0,0,0,0|1,1,0]=4 9712 B11R0.81 CCSCCNC(C)CCOC 270004a_100000106463_100000742357 [0,2,0,0,0,0|1,1,0]=4 9713 B11R0.81 CCSCCOC(C)CCCCl 34a_200000718107_100000757381 [0,2,0,0,0,0|1,1,0]=4 9714 B11R0.81 CCSCCOC(C)CCCCl 7a_200000718107_100000757381 [0,2,0,0,0,0|1,1,0]=4 9715 B11R0.81 COCCC(=O)CCCCCF 1458a_100000749529_100000729378 [0,2,0,0,0,0|2,0,0]=4 9716 B11R0.81 COCCC(=O)CCCCCO 1458a_100000749529_100000746330 [0,2,0,0,0,0|2,0,0]=4 9717 B11R0.81 COCCC(=O)CCCCCO 1458a_100102619762_100000233755 [0,2,0,0,0,0|2,0,0]=4 9718 B11R0.81 COCCC(=O)CCOCC#N 1458a_100000749529_200000047693 [0,2,0,0,0,0|1,0,1]=4 9719 B11R0.81 COCCC(=O)CCOCCO 1458a_100000749529_100011215305 [0,2,0,0,0,0|1,0,0]=3 9720 B11R0.81 COCCC(=O)CCOCCO 1458a_100011229844_100000233755 [0,2,0,0,0,0|1,0,0]=3 9721 B11R0.81 COCCCCC(=O)CCOC 1458a_100000749529_100000755781 [0,2,0,0,0,0|2,0,0]=4 9722 B11R0.81 COCCCCN(C)CCOC 2230a_100000743101_100000730899 [0,2,0,0,0,0|2,0,0]=4 9723 B11R0.81 COCCCCN(C)CCOC 269982a_100000743101_100000730899 [0,2,0,0,0,0|2,0,0]=4 9724 B11R0.81 COCCCOC(C)CCCCl 34a_200000718107_100000740836 [0,2,0,0,0,0|2,0,0]=4 9725 B11R0.81 COCCCOC(C)CCCCl 7a_200000718107_100000740836 [0,2,0,0,0,0|2,0,0]=4 9726 B11R0.81 COCCN(C)CCCCCF 2230a_100000743101_100000729378 [0,2,0,0,0,0|2,0,0]=4 9727 B11R0.81 COCCN(C)CCCCCF 269982a_100000743101_100000729378 [0,2,0,0,0,0|2,0,0]=4 9728 B11R0.81 COCCN(C)CCCCCO 2230a_100000722520_100011201679 [0,2,0,0,0,0|2,0,0]=4 9729 B11R0.81 COCCN(C)CCCCCO 2230a_100000743101_100000746330 [0,2,0,0,0,0|2,0,0]=4 9730 B11R0.81 COCCN(C)CCCCCO 269982a_100000722520_100000233755 [0,2,0,0,0,0|2,0,0]=4 9731 B11R0.81 COCCN(C)CCCCCO 269982a_100000743101_100000746330 [0,2,0,0,0,0|2,0,0]=4 9732 B11R0.81 COCCN(C)CCOCC#N 2230a_100000743101_200000047693 [0,2,0,0,0,0|1,0,1]=4 9733 B11R0.81 COCCN(C)CCOCCO 2230a_100000228057_100011201679 [0,2,0,0,0,0|1,0,0]=3 9734 B11R0.81 COCCN(C)CCOCCO 2230a_100000743101_100011215305 [0,2,0,0,0,0|1,0,0]=3 9735 B11R0.81 COCCN(C)CCOCCO 269982a_100000228057_100000233755 [0,2,0,0,0,0|1,0,0]=3 9736 B11R0.81 COCCN(C)CCOCCO 269982a_100000743101_100011215305 [0,2,0,0,0,0|1,0,0]=3 9737 B11R0.81 COCCNC[C@H](C)CCCO 2230a_100160569302_100011201679 [0,2,0,0,0,0|2,0,0]=4 9738 B11R0.81 COCCNC[C@H](C)CCCO 34a_100160569302_100011201679 [0,2,0,0,0,0|2,0,0]=4 9739 B11R0.81 COCCOCC(=O)CCCF 1458a_100000211095_100011934791 [0,2,0,0,0,0|1,0,1]=4 9740 B11R0.81 COCCOCC(=O)CCCO 1458a_100000211095_100011215043 [0,2,0,0,0,0|1,0,1]=4 9741 B11R0.81 COCCOCC(=O)CCOC 1458a_100000211095_100000233755 [0,2,0,0,0,0|1,0,1]=4 9742 B11R0.81 COCCOCC(=O)CCSC 1458a_100000211095_100000751147 [0,2,0,0,0,0|1,0,1]=4 9743 B11R0.81 COCCOCC(=O)NCCF 11a_100000724931_100000211095 [0,2,0,0,0,0|1,0,1]=4 9744 B11R0.81 COCCOCC(=O)NCCF 1626a_100000724931_100000211095 [0,2,0,0,0,0|1,0,1]=4 9745 B11R0.81 COCCOCC(=O)NCCF 240690a_100000724931_100000211095 [0,2,0,0,0,0|1,0,1]=4 9746 B11R0.81 COCCOCC(=O)NCCF 527a_100000724931_100000211095 [0,2,0,0,0,0|1,0,1]=4 9747 B11R0.81 COCCOCC(=O)NCCO 240690a_100000210304_100000211095 [0,2,0,0,0,0|1,0,1]=4 9748 B11R0.81 COCCOCC(=O)NCCO 527a_100000210304_100000211095 [0,2,0,0,0,0|1,0,1]=4 9749 B11R0.81 COCCOCN(C)CCCO 2230a_100000213112_100000231047 [0,2,0,0,0,0|2,0,0]=4 9750 B11R0.81 COCCOCN(C)CCCO 269982a_100000213112_100000231047 [0,2,0,0,0,0|2,0,0]=4 9751 B11R0.81 COCCOCN(C)CCOC 2230a_100000743101_100000231047 [0,2,0,0,0,0|2,0,0]=4 9752 B11R0.81 COCCOCN(C)CCOC 269982a_100000743101_100000231047 [0,2,0,0,0,0|2,0,0]=4 9753 B11R0.81 COCCOCN(C)CCSC 2230a_100000686725_100000231047 [0,2,0,0,0,0|2,0,0]=4 9754 B11R0.81 COCCOCN(C)CCSC 269982a_100000686725_100000231047 [0,2,0,0,0,0|2,0,0]=4 9755 B11R0.81 COCCOC[C@@H](C)OCOC 34a_100016172286_100011201679 [0,2,0,0,0,0|0,0,0]=2 9756 B11R0.81 COCCOC[C@@H](C)OCOC 7a_100016172286_100000233755 [0,2,0,0,0,0|0,0,0]=2 9757 B11R0.81 COCCOC[C@@H](N)CCSC 34a_100011827619_100011201679 [0,2,0,0,0,0|1,0,0]=3 9758 B11R0.81 COCO[C@H](C)COCCC#N 7a_100016172286_100000184422 [0,2,0,0,0,0|2,0,0]=4 9759 B11R0.81 COCO[C@H](C)COCCCF 34a_100016172286_100011934791 [0,2,0,0,0,0|2,0,0]=4 9760 B11R0.81 COCO[C@H](C)COCCCF 7a_100016172286_100011934791 [0,2,0,0,0,0|2,0,0]=4 9761 B11R0.81 COCO[C@H](C)COCCCO 34a_100016172286_100000230001 [0,2,0,0,0,0|2,0,0]=4 9762 B11R0.81 COCO[C@H](C)COCCCO 7a_100016172286_100011215043 [0,2,0,0,0,0|2,0,0]=4 9763 B11R0.81 COCO[C@H](C)COCCSC 34a_100016172286_100000212216 [0,2,0,0,0,0|0,1,0]=3 9764 B11R0.81 COCO[C@H](C)COCCSC 7a_100016172286_100000212216 [0,2,0,0,0,0|0,1,0]=3 9765 B11R0.81 CSCCC(=O)CCOCCO 1458a_100000174002_100011215305 [0,2,0,0,0,0|1,1,0]=4 9766 B11R0.81 CSCCC(=O)CCOCCO 1458a_100011229844_100000751147 [0,2,0,0,0,0|1,1,0]=4 9767 B11R0.81 CSCCN(C)CCOCCO 2230a_100000228057_100000751147 [0,2,0,0,0,0|1,1,0]=4 9768 B11R0.81 CSCCN(C)CCOCCO 2230a_100000686725_100011215305 [0,2,0,0,0,0|1,1,0]=4 9769 B11R0.81 CSCCN(C)CCOCCO 269982a_100000228057_100000212216 [0,2,0,0,0,0|1,1,0]=4 9770 B11R0.81 CSCCN(C)CCOCCO 269982a_100000686725_100011215305 [0,2,0,0,0,0|1,1,0]=4 9771 B11R0.81 CSCCOC[C@@H](N)CCSC 34a_100011827619_100000212216 [0,2,0,0,0,0|1,1,0]=4 9772 B11R0.142 C=C[C@@H](C)[C@@H](C)OCCOCC 34a_100015455354_100000210147 [0,2,0,0,0,0|1,0,1]=4 9773 B11R0.142 C=C[C@@H](C)[C@@H](C)OCCOCC 7a_100015455354_100011215890 [0,2,0,0,0,0|1,0,1]=4 9774 B11R0.142 CCC(C)C(=O)COCCOC 1458a_100000211095_100000758301 [0,2,0,0,0,0|1,0,1]=4 9775 B11R0.142 CCC(C)N(C)COCCOC 2230a_100000741768_100000231047 [0,2,0,0,0,0|2,0,0]=4 9776 B11R0.142 CCC(C)N(C)COCCOC 269982a_100000741768_100000231047 [0,2,0,0,0,0|2,0,0]=4 9777 B11R0.142 CCCCCOC(C)C(=O)OC 34a_100000210253_100000211248 [0,2,0,0,0,0|1,0,1]=4 9778 B11R0.142 CCCCCOC(C)C(=O)OC 34a_100011215400_100000718602 [0,2,0,0,0,0|1,0,1]=4 9779 B11R0.142 CCCCCOC(C)C(=O)OC 7a_100000210253_100000211248 [0,2,0,0,0,0|1,0,1]=4 9780 B11R0.142 CCCCCOC(C)C(C)CC 7a_100011215189_100000210326 [0,2,0,0,0,0|2,0,0]=4 9781 B11R0.142 CCCCOCC(C)N(C)CC 7a_100000732741_100000210211 [0,2,0,0,0,0|2,0,0]=4 9782 B11R0.142 CCN(C)C(=O)COCCOC 11a_100000225621_100000211095 [0,2,0,0,0,0|1,0,1]=4 9783 B11R0.142 CCN(C)C(=O)COCCOC 1626a_100000225621_100000211095 [0,2,0,0,0,0|1,0,1]=4 9784 B11R0.142 CCN(C)C(=O)COCCOC 240690a_100000225621_100000211095 [0,2,0,0,0,0|1,0,1]=4 9785 B11R0.142 CCN(C)C(=O)COCCOC 34a_100000210237_100000738999 [0,2,0,0,0,0|1,0,1]=4 9786 B11R0.142 CCN(C)C(=O)COCCOC 527a_100000225621_100000211095 [0,2,0,0,0,0|1,0,1]=4 9787 B11R0.142 CCN(C)C(C)COCCOC 7a_100000732741_100000233755 [0,2,0,0,0,0|1,0,0]=3 9788 B11R0.142 CCN(C)C(C)COCCSC 7a_100000732741_100000212216 [0,2,0,0,0,0|1,1,0]=4 9789 B11R0.142 CCOCCCC(=O)C(C)OC 1458a_100000743197_100012232248 [0,2,0,0,0,0|1,0,1]=4 9790 B11R0.142 CCOCCNC(=O)C(C)OC 11a_100011200944_100000743197 [0,2,0,0,0,0|1,0,1]=4 9791 B11R0.142 CCOCCNC(=O)C(C)OC 1626a_102516460346_100000743197 [0,2,0,0,0,0|1,0,1]=4 9792 B11R0.142 CCOCCNC(=O)C(C)OC 240690a_100011200944_100000743197 [0,2,0,0,0,0|1,0,1]=4 9793 B11R0.142 CCOCCNC(=O)C(C)OC 527a_100011200944_100000743197 [0,2,0,0,0,0|1,0,1]=4 9794 B11R0.142 CCOCCNC(C)C(=O)OC 2230a_102516460346_100000211248 [0,2,0,0,0,0|1,0,1]=4 9795 B11R0.142 CCOCCNC(C)C(=O)OC 34a_102516460346_100000211248 [0,2,0,0,0,0|1,0,1]=4 9796 B11R0.142 CCOCCNC(C)C(C)CC 269862a_100011200944_100000210599 [0,2,0,0,0,0|2,0,0]=4 9797 B11R0.142 CCOCCNC(C)C(C)CC 270004a_102516460346_100000210599 [0,2,0,0,0,0|2,0,0]=4 9798 B11R0.142 CCOCCOC(C)C(=O)CC 1458a_100000743585_100000210202 [0,2,0,0,0,0|1,0,1]=4 9799 B11R0.142 CCOCCOC(C)C(=O)CC 7a_100000210136_100000742827 [0,2,0,0,0,0|1,0,1]=4 9800 B11R0.142 CCOCCOC(C)C(=O)NC 11a_106832991635_100000743585 [0,2,0,0,0,0|1,0,1]=4 9801 B11R0.142 CCOCCOC(C)C(=O)NC 1626a_100102657272_100000743585 [0,2,0,0,0,0|1,0,1]=4 9802 B11R0.142 CCOCCOC(C)C(=O)NC 240690a_100102657272_100000743585 [0,2,0,0,0,0|1,0,1]=4 9803 B11R0.142 CCOCCOC(C)C(=O)NC 34a_100000210136_100000731044 [0,2,0,0,0,0|1,0,1]=4 9804 B11R0.142 CCOCCOC(C)C(=O)NC 527a_100102657272_100000743585 [0,2,0,0,0,0|1,0,1]=4 9805 B11R0.142 CCOCCOC(C)C(=O)NC 7a_100000210136_100000209862 [0,2,0,0,0,0|1,0,1]=4 9806 B11R0.142 CCOCCOC(C)C(=O)OC 34a_100000210136_100000211248 [0,2,0,0,0,0|0,0,1]=3 9807 B11R0.142 CCOCCOC(C)C(=O)OC 34a_100011215400_100000210147 [0,2,0,0,0,0|0,0,1]=3 9808 B11R0.142 CCOCCOC(C)C(=O)OC 7a_100000210136_100000211248 [0,2,0,0,0,0|0,0,1]=3 9809 B11R0.142 CCOCCOC(C)C(C)CC 7a_100011215189_100011215890 [0,2,0,0,0,0|1,0,0]=3 9810 B11R0.142 CCOCCOC(F)C(=O)NC 34a_100000210136_100009813575 [0,2,0,0,0,0|1,0,1]=4 9811 B11R0.142 CCOCCOC(F)C(=O)NC 7a_100000210136_100009813575 [0,2,0,0,0,0|1,0,1]=4 9812 B11R0.142 CCOCCSC(C)C(=O)OC 62a_100000210147_100000211248 [0,2,0,0,0,0|0,1,1]=4 9813 B11R0.142 CCOCCSC(C)C(=O)OC 62a_100000211248_100011215890 [0,2,0,0,0,0|0,1,1]=4 9814 B11R0.142 CCSCCOC(C)C(=O)OC 34a_100000212035_100000211248 [0,2,0,0,0,0|0,1,1]=4 9815 B11R0.142 CCSCCOC(C)C(=O)OC 34a_100011215400_100000757381 [0,2,0,0,0,0|0,1,1]=4 9816 B11R0.142 CCSCCOC(C)C(=O)OC 7a_100000212035_100000211248 [0,2,0,0,0,0|0,1,1]=4 9817 B11R0.142 CCSCCOC(C)C(C)CC 7a_100011215189_100000757381 [0,2,0,0,0,0|1,1,0]=4 9818 B11R0.142 COCCOCC(C)C(=O)OC 34a_100000210237_100000698445 [0,2,0,0,0,0|2,0,0]=4 9819 B11R0.142 COCCOCC(C)C(=O)OC 34a_100000749362_100011201679 [0,2,0,0,0,0|2,0,0]=4 9820 B11R0.142 COCCOCC(C)C(=O)OC 7a_100000749362_100000233755 [0,2,0,0,0,0|2,0,0]=4 9821 B11R0.142 COCCOCC(F)C(=O)OC 34a_200009849844_100011201679 [0,2,0,0,0,0|2,0,0]=4 9822 B11R0.142 COCCOC[C@@H](N)C(=O)OC 34a_100000003586_100011201679 [0,2,0,0,0,0|2,0,0]=4 9823 B11R0.155 CCCC(C)C(=O)CCOCC 1458a_100000210906_100011215890 [0,2,0,0,0,0|2,0,0]=4 9824 B11R0.155 CCCC(C)C(=O)CCOCC 1458a_100000749530_100000766640 [0,2,0,0,0,0|2,0,0]=4 9825 B11R0.155 CCCC(C)C(C)NCCOC 270004a_100000209980_100011216282 [0,2,0,0,0,0|2,0,0]=4 9826 B11R0.155 CCCC(C)C(C)OCCOC 34a_100000708338_100011201679 [0,2,0,0,0,0|1,0,0]=3 9827 B11R0.155 CCCC(C)C(C)OCCOC 7a_100000708338_100000233755 [0,2,0,0,0,0|1,0,0]=3 9828 B11R0.155 CCCC(C)C(C)OCCSC 34a_100000708338_100000212216 [0,2,0,0,0,0|1,1,0]=4 9829 B11R0.155 CCCC(C)C(C)OCCSC 7a_100000708338_100000212216 [0,2,0,0,0,0|1,1,0]=4 9830 B11R0.155 CCCCCC(=O)C(C)COC 1458a_100000212188_100000765312 [0,2,0,0,0,0|2,0,0]=4 9831 B11R0.155 CCCCCC(=O)C(C)COC 1458a_100000751857_100000210326 [0,2,0,0,0,0|2,0,0]=4 9832 B11R0.155 CCCCCN(C)C(C)COC 2230a_100000223495_100000765312 [0,2,0,0,0,0|2,0,0]=4 9833 B11R0.155 CCCCCN(C)C(C)COC 269982a_100000223495_100000765312 [0,2,0,0,0,0|2,0,0]=4 9834 B11R0.155 CCCCCN(C)C(C)COC 270004a_100000223495_100000749346 [0,2,0,0,0,0|2,0,0]=4 9835 B11R0.155 CCCCOC(=O)C(C)OCC 34a_100000038973_100000210202 [0,2,0,0,0,0|1,0,1]=4 9836 B11R0.155 CCCCOC(=O)C(C)OCC 34a_100121572206_100000759602 [0,2,0,0,0,0|1,0,1]=4 9837 B11R0.155 CCCCOC(=O)C(C)OCC 7a_100000038973_100000210202 [0,2,0,0,0,0|1,0,1]=4 9838 B11R0.155 CCCCOC(C)C(=O)OCC 34a_100000210227_100011216346 [0,2,0,0,0,0|1,0,1]=4 9839 B11R0.155 CCCCOC(C)C(=O)OCC 7a_100000210227_100011216346 [0,2,0,0,0,0|1,0,1]=4 9840 B11R0.155 CCCCOC(C)C(C)CCC 34a_100000708338_100000210210 [0,2,0,0,0,0|2,0,0]=4 9841 B11R0.155 CCCCOC(C)C(C)CCC 7a_100000708338_100000210211 [0,2,0,0,0,0|2,0,0]=4 9842 B11R0.155 CCCCOC(F)C(=O)OCC 34a_100000210227_100000760018 [0,2,0,0,0,0|1,0,1]=4 9843 B11R0.155 CCCCOC(F)C(=O)OCC 7a_100000210227_100000040065 [0,2,0,0,0,0|1,0,1]=4 9844 B11R0.155 CCCCO[C@@H](C)C(=O)OCC 7a_100000751109_100000210211 [0,2,0,0,0,0|1,0,1]=4 9845 B11R0.155 CCC[C@H](O)C(=O)CCOCC 1458a_100009822183_100011215890 [0,2,0,0,0,0|2,0,0]=4 9846 B11R0.155 CCNC(=O)C(C)OCCOC 34a_100000210237_100000230173 [0,2,0,0,0,0|1,0,1]=4 9847 B11R0.155 CCOC(=O)C(C)NCCOC 2230a_100000209980_100011215307 [0,2,0,0,0,0|1,0,1]=4 9848 B11R0.155 CCOC(=O)C(C)OCCOC 34a_100000210237_100011216346 [0,2,0,0,0,0|0,0,1]=3 9849 B11R0.155 CCOC(=O)C(C)OCCON 34a_100000700252_100011216346 [0,2,0,0,0,0|1,0,1]=4 9850 B11R0.155 CCOC(=O)C(C)OCCSC 34a_100000230434_100011216346 [0,2,0,0,0,0|0,1,1]=4 9851 B11R0.155 CCOC(=O)C(C)OCCSC 7a_100000230434_100011216346 [0,2,0,0,0,0|0,1,1]=4 9852 B11R0.155 CCOC(=O)C(C)SCCOC 62a_100000233755_100011216346 [0,2,0,0,0,0|0,1,1]=4 9853 B11R0.155 CCOC(=O)C(C)SCCOC 62a_100011216346_100000233755 [0,2,0,0,0,0|0,1,1]=4 9854 B11R0.155 CCOC(=O)C(F)NCCOC 2230a_100000209980_100000760018 [0,2,0,0,0,0|1,0,1]=4 9855 B11R0.155 CCOC(=O)C(F)OCCOC 34a_100000210237_100000760018 [0,2,0,0,0,0|0,0,1]=3 9856 B11R0.155 CCOC(=O)C(F)OCCON 34a_100000700252_100000760018 [0,2,0,0,0,0|1,0,1]=4 9857 B11R0.155 CCOC(=O)C(F)OCCSC 34a_100000230434_100000760018 [0,2,0,0,0,0|0,1,1]=4 9858 B11R0.155 CCOC(=O)C(F)OCCSC 7a_100000230434_100000040065 [0,2,0,0,0,0|0,1,1]=4 9859 B11R0.155 CCOC(=O)C(F)SCCOC 62a_100000233755_100000760018 [0,2,0,0,0,0|0,1,1]=4 9860 B11R0.155 CCOC(=O)C(F)SCCOC 62a_100000760018_100000233755 [0,2,0,0,0,0|0,1,1]=4 9861 B11R0.155 CCOC(=O)[C@H](C)OCCOC 7a_100000751109_100000233755 [0,2,0,0,0,0|0,0,1]=3 9862 B11R0.155 CCOC(=O)[C@H](C)OCCSC 7a_100000751109_100000212216 [0,2,0,0,0,0|0,1,1]=4 9863 B11R0.155 CCOC(C)C(=O)CCCOC 1458a_100000739345_100000740836 [0,2,0,0,0,0|1,0,1]=4 9864 B11R0.155 CCOC(C)C(=O)NCCOC 1626a_100000209980_100000739345 [0,2,0,0,0,0|1,0,1]=4 9865 B11R0.155 CCOC(C)C(=O)NCCOC 240690a_100000209980_100000739345 [0,2,0,0,0,0|1,0,1]=4 9866 B11R0.155 CCOC(C)C(=O)NCCOC 527a_100000209980_100000739345 [0,2,0,0,0,0|1,0,1]=4 9867 B11R0.155 CCOCCC(=O)C(C)COC 1458a_100000749530_100000765312 [0,2,0,0,0,0|1,0,0]=3 9868 B11R0.155 CCOCCC(=O)C(C)COC 1458a_100000751857_100011215890 [0,2,0,0,0,0|1,0,0]=3 9869 B11R0.155 CCOCCC(=O)C(C)CSC 1458a_100000753918_100011215890 [0,2,0,0,0,0|1,1,0]=4 9870 B11R0.155 CCSCCC(=O)C(C)COC 1458a_100000230768_100000765312 [0,2,0,0,0,0|1,1,0]=4 9871 B11R0.155 CCSCCC(=O)C(C)COC 1458a_100000751857_100000757381 [0,2,0,0,0,0|1,1,0]=4 9872 B11R0.161 C#CC(CCC)OCCCCC 34a_200011217317_100000718602 [0,2,0,0,0,0|2,0,0]=4 9873 B11R0.161 C#CC(CCC)OCCCCC 7a_200011217317_100000210326 [0,2,0,0,0,0|2,0,0]=4 9874 B11R0.161 C#CC(CCC)OCCOCC 34a_200011217317_100000210147 [0,2,0,0,0,0|1,0,0]=3 9875 B11R0.161 C#CC(CCC)OCCOCC 7a_200011217317_100011215890 [0,2,0,0,0,0|1,0,0]=3 9876 B11R0.161 C#CC(CCC)OCCSCC 34a_200011217317_100000757381 [0,2,0,0,0,0|1,1,0]=4 9877 B11R0.161 C#CC(CCC)OCCSCC 7a_200011217317_100000757381 [0,2,0,0,0,0|1,1,0]=4 9878 B11R0.161 C#CCC(CC)OCCOCC 34a_200011217983_100000210147 [0,2,0,0,0,0|1,0,1]=4 9879 B11R0.161 C#CCC(CC)OCCOCC 7a_200011217983_100011215890 [0,2,0,0,0,0|1,0,1]=4 9880 B11R0.161 C=CC(CCC)OCCCCC 34a_100011216692_100000718602 [0,2,0,0,0,0|2,0,0]=4 9881 B11R0.161 C=CC(CCC)OCCCCC 7a_100011216692_100000210326 [0,2,0,0,0,0|2,0,0]=4 9882 B11R0.161 C=CC(CCC)OCCOCC 34a_100011216692_100000210147 [0,2,0,0,0,0|1,0,0]=3 9883 B11R0.161 C=CC(CCC)OCCOCC 7a_100011216692_100011215890 [0,2,0,0,0,0|1,0,0]=3 9884 B11R0.161 C=CC(CCC)OCCSCC 34a_100011216692_100000757381 [0,2,0,0,0,0|1,1,0]=4 9885 B11R0.161 C=CC(CCC)OCCSCC 7a_100011216692_100000757381 [0,2,0,0,0,0|1,1,0]=4 9886 B11R0.161 C=CC(CCCCCC)OCC 34a_200011215977_100000210202 [0,2,0,0,0,0|2,0,0]=4 9887 B11R0.161 C=CC(CCCCCC)OCC 7a_200011215977_100000210202 [0,2,0,0,0,0|2,0,0]=4 9888 B11R0.161 C=CCC(C=C)OCCOCC 34a_100000038011_100000210147 [0,2,0,0,0,0|1,0,1]=4 9889 B11R0.161 C=CCC(C=C)OCCOCC 7a_100000038011_100011215890 [0,2,0,0,0,0|1,0,1]=4 9890 B11R0.161 C=COCCOC(CC)COC 7a_200011214946_100000039644 [0,2,0,0,0,0|0,0,2]=4 9891 B11R0.161 C=COCCOC(CCl)COC 34a_100011215053_100000039644 [0,2,0,0,0,0|0,0,2]=4 9892 B11R0.161 C=COCCOC(CN)COC 34a_100000756049_100000039644 [0,2,0,0,0,0|0,0,2]=4 9893 B11R0.161 CC#CC(CC)OCCOCC 34a_200011219922_100000210147 [0,2,0,0,0,0|1,0,1]=4 9894 B11R0.161 CC#CC(CC)OCCOCC 7a_200011219922_100011215890 [0,2,0,0,0,0|1,0,1]=4 9895 B11R0.161 CC/C=C\COC(CC)COC 7a_200011214946_100103147603 [0,2,0,0,0,0|1,0,1]=4 9896 B11R0.161 CC/C=C\COC(CCl)COC 34a_100011215053_100103147603 [0,2,0,0,0,0|1,0,1]=4 9897 B11R0.161 CC/C=C\COC(CN)COC 34a_100000756049_100103147603 [0,2,0,0,0,0|1,0,1]=4 9898 B11R0.161 CCC#CCOC(CC)COC 7a_200011214946_100009813939 [0,2,0,0,0,0|1,0,1]=4 9899 B11R0.161 CCC#CCOC(CCl)COC 34a_100011215053_100009813939 [0,2,0,0,0,0|1,0,1]=4 9900 B11R0.161 CCC#CCOC(CN)COC 34a_100000756049_100009813939 [0,2,0,0,0,0|1,0,1]=4 9901 B11R0.161 CCC(COC)OCCCCF 7a_200011214946_100000729493 [0,2,0,0,0,0|2,0,0]=4 9902 B11R0.161 CCC(COC)OCCCCO 7a_200011214946_100000210776 [0,2,0,0,0,0|2,0,0]=4 9903 B11R0.161 CCC(COC)OCCCOC 7a_200011214946_100000740836 [0,2,0,0,0,0|2,0,0]=4 9904 B11R0.161 CCCC(C#N)OCCOCC 34a_100000686963_100000210147 [0,2,0,0,0,0|1,0,0]=3 9905 B11R0.161 CCCC(C#N)OCCOCC 7a_100000686963_100011215890 [0,2,0,0,0,0|1,0,0]=3 9906 B11R0.161 CCCC(C#N)OCCSCC 34a_100000686963_100000757381 [0,2,0,0,0,0|1,1,0]=4 9907 B11R0.161 CCCC(C#N)OCCSCC 7a_100000686963_100000757381 [0,2,0,0,0,0|1,1,0]=4 9908 B11R0.161 CCCC(CC)NCCOCC 2230a_100000747048_100011215890 [0,2,0,0,0,0|2,0,0]=4 9909 B11R0.161 CCCC(CC)NCCOCC 270004a_102516460346_100000687865 [0,2,0,0,0,0|2,0,0]=4 9910 B11R0.161 CCCC(CC)OCCOCC 34a_100000687864_100000210147 [0,2,0,0,0,0|1,0,0]=3 9911 B11R0.161 CCCC(CC)OCCOCC 7a_100000210136_100011219200 [0,2,0,0,0,0|1,0,0]=3 9912 B11R0.161 CCCC(CC)OCCOCC 7a_100000687864_100011215890 [0,2,0,0,0,0|1,0,0]=3 9913 B11R0.161 CCCC(CC)OCCSCC 34a_100000687864_100000757381 [0,2,0,0,0,0|1,1,0]=4 9914 B11R0.161 CCCC(CC)OCCSCC 7a_100000212035_100011219200 [0,2,0,0,0,0|1,1,0]=4 9915 B11R0.161 CCCC(CC)OCCSCC 7a_100000687864_100000757381 [0,2,0,0,0,0|1,1,0]=4 9916 B11R0.161 CCCC(CC)SCCOCC 62a_100000210147_100011219200 [0,2,0,0,0,0|1,1,0]=4 9917 B11R0.161 CCCC(CC)SCCOCC 62a_100011219200_100011215890 [0,2,0,0,0,0|1,1,0]=4 9918 B11R0.161 CCCCCCC(CC)OCC 34a_100011215785_100000210202 [0,2,0,0,0,0|2,0,0]=4 9919 B11R0.161 CCCCCCC(CC)OCC 7a_100011215785_100000210202 [0,2,0,0,0,0|2,0,0]=4 9920 B11R0.161 CCCCCNC(CC)COC 2230a_100000757820_100000210326 [0,2,0,0,0,0|2,0,0]=4 9921 B11R0.161 CCCCCNC(CC)COC 270004a_100000209983_100000757811 [0,2,0,0,0,0|2,0,0]=4 9922 B11R0.161 CCCCCNC(CO)COC 2230a_100000724102_100000210326 [0,2,0,0,0,0|2,0,0]=4 9923 B11R0.161 CCCCCNC(CO)COC 34a_100000724102_100000718602 [0,2,0,0,0,0|2,0,0]=4 9924 B11R0.161 CCCCCOC(C#N)CCC 34a_100000686963_100000718602 [0,2,0,0,0,0|2,0,0]=4 9925 B11R0.161 CCCCCOC(C#N)CCC 7a_100000686963_100000210326 [0,2,0,0,0,0|2,0,0]=4 9926 B11R0.161 CCCCCOC(CC)CCC 34a_100000687864_100000718602 [0,2,0,0,0,0|2,0,0]=4 9927 B11R0.161 CCCCCOC(CC)CCC 7a_100000210253_100011219200 [0,2,0,0,0,0|2,0,0]=4 9928 B11R0.161 CCCCCOC(CC)CCC 7a_100000687864_100000210326 [0,2,0,0,0,0|2,0,0]=4 9929 B11R0.161 CCCCCOC(CC)COC 7a_200011214946_100000210326 [0,2,0,0,0,0|1,0,0]=3 9930 B11R0.161 CCCCCOC(CCl)COC 34a_100011215053_100000718602 [0,2,0,0,0,0|1,0,0]=3 9931 B11R0.161 CCCCCOC(CN)COC 34a_100000756049_100000718602 [0,2,0,0,0,0|1,0,0]=3 9932 B11R0.161 CCCCNCC(CC)OCC 2230a_100015183923_100000210211 [0,2,0,0,0,0|2,0,0]=4 9933 B11R0.161 CCCCNCC(CC)OCC 34a_100015183923_100000210210 [0,2,0,0,0,0|2,0,0]=4 9934 B11R0.161 CCCN(CC)COCCOC 2230a_100000226822_100000231047 [0,2,0,0,0,0|2,0,0]=4 9935 B11R0.161 CCCN(CC)COCCOC 269982a_100000226822_100000231047 [0,2,0,0,0,0|2,0,0]=4 9936 B11R0.161 CCC[C@@H](CO)NCCOCC 2230a_100000732646_100011215890 [0,2,0,0,0,0|2,0,0]=4 9937 B11R0.161 CCC[C@@H](CO)NCCOCC 34a_100000732646_100000210147 [0,2,0,0,0,0|2,0,0]=4 9938 B11R0.161 CCOC(CC)CNCCOC 2230a_100015183923_100011201679 [0,2,0,0,0,0|1,0,0]=3 9939 B11R0.161 CCOC(CC)CNCCOC 34a_100015183923_100011201679 [0,2,0,0,0,0|1,0,0]=3 9940 B11R0.161 CCOC(CC)CNCCSC 2230a_100015183923_100000751147 [0,2,0,0,0,0|1,1,0]=4 9941 B11R0.161 CCOC(CC)CNCCSC 34a_100015183923_100000212216 [0,2,0,0,0,0|1,1,0]=4 9942 B11R0.161 CCOCCNC(CC)COC 2230a_100000757820_100011215890 [0,2,0,0,0,0|1,0,0]=3 9943 B11R0.161 CCOCCNC(CC)COC 270004a_102516460346_100000757811 [0,2,0,0,0,0|1,0,0]=3 9944 B11R0.161 CCOCCNC(CO)COC 2230a_100000724102_100011215890 [0,2,0,0,0,0|1,0,0]=3 9945 B11R0.161 CCOCCNC(CO)COC 34a_100000724102_100000210147 [0,2,0,0,0,0|1,0,0]=3 9946 B11R0.161 CCOCCOC(CC)COC 7a_200011214946_100011215890 [0,2,0,0,0,0|0,0,0]=2 9947 B11R0.161 CCOCCOC(CCl)COC 34a_100011215053_100000210147 [0,2,0,0,0,0|0,0,0]=2 9948 B11R0.161 CCOCCOC(CN)COC 34a_100000756049_100000210147 [0,2,0,0,0,0|0,0,0]=2 9949 B11R0.161 CCSCCNC(CC)COC 2230a_100000757820_100000757381 [0,2,0,0,0,0|1,1,0]=4 9950 B11R0.161 CCSCCNC(CC)COC 270004a_100000106463_100000757811 [0,2,0,0,0,0|1,1,0]=4 9951 B11R0.161 CCSCCNC(CO)COC 2230a_100000724102_100000757381 [0,2,0,0,0,0|1,1,0]=4 9952 B11R0.161 CCSCCNC(CO)COC 34a_100000724102_100000757381 [0,2,0,0,0,0|1,1,0]=4 9953 B11R0.161 CCSCCOC(CC)COC 7a_200011214946_100000757381 [0,2,0,0,0,0|0,1,0]=3 9954 B11R0.161 CCSCCOC(CCl)COC 34a_100011215053_100000757381 [0,2,0,0,0,0|0,1,0]=3 9955 B11R0.161 CCSCCOC(CN)COC 34a_100000756049_100000757381 [0,2,0,0,0,0|0,1,0]=3 9956 B11R0.161 COCC(CCl)OCCCCF 34a_100011215053_100000729493 [0,2,0,0,0,0|2,0,0]=4 9957 B11R0.161 COCC(CCl)OCCCCO 34a_100011215053_100011216708 [0,2,0,0,0,0|2,0,0]=4 9958 B11R0.161 COCC(CN)OCCCCF 34a_100000756049_100000729493 [0,2,0,0,0,0|2,0,0]=4 9959 B11R0.161 COCC(CN)OCCCCO 34a_100000756049_100011216708 [0,2,0,0,0,0|2,0,0]=4 9960 B11R0.161 COCCCOC(CCl)COC 34a_100011215053_100000740836 [0,2,0,0,0,0|2,0,0]=4 9961 B11R0.161 COCCCOC(CN)COC 34a_100000756049_100000740836 [0,2,0,0,0,0|2,0,0]=4 9962 B11R0.174 CCC(C)CCNC(C)COC 2230a_100020591266_100000765312 [0,2,0,0,0,0|2,0,0]=4 9963 B11R0.174 CCC(C)CCNC(C)COC 270004a_100020591266_100000749346 [0,2,0,0,0,0|2,0,0]=4 9964 B11R0.174 CCC(C)CCOC(C)COC 7a_100011215188_100000765312 [0,2,0,0,0,0|1,0,0]=3 9965 B11R0.174 CCCC(C)CNC[C@@H](C)OC 2230a_100020591295_100011216630 [0,2,0,0,0,0|2,0,0]=4 9966 B11R0.174 CCCC(C)CNC[C@@H](C)OC 270004a_100020591295_100000243154 [0,2,0,0,0,0|2,0,0]=4 9967 B11R0.174 CCCC(C)COCC(=O)OC 34a_100000688023_100000747449 [0,2,0,0,0,0|1,0,1]=4 9968 B11R0.174 CCCC(C)COCC(=O)OC 7a_100000688023_100000747449 [0,2,0,0,0,0|1,0,1]=4 9969 B11R0.174 CCCC(C)COCC(C)CC 34a_100000688023_100000748023 [0,2,0,0,0,0|2,0,0]=4 9970 B11R0.174 CCCC(C)COCC(C)CC 7a_100000688023_100000748023 [0,2,0,0,0,0|2,0,0]=4 9971 B11R0.174 CCCC(C)COCC(C)OC 34a_100000690652_100011216630 [0,2,0,0,0,0|1,0,0]=3 9972 B11R0.174 CCCC(C)COCC(O)CC 34a_100000688023_100011218378 [0,2,0,0,0,0|2,0,0]=4 9973 B11R0.174 CCCC(C)COCC(O)CC 7a_100000688023_100011218378 [0,2,0,0,0,0|2,0,0]=4 9974 B11R0.174 CCCC(C)COC[C@@H](C)CC 34a_100000688023_100009816398 [0,2,0,0,0,0|2,0,0]=4 9975 B11R0.174 CCCC(C)COC[C@@H](C)CC 7a_100000688023_100009816398 [0,2,0,0,0,0|2,0,0]=4 9976 B11R0.174 CCCC(C)COC[C@@H](C)CC 7a_100009816381_100011216630 [0,2,0,0,0,0|2,0,0]=4 9977 B11R0.174 CCCC(C)OCCC(C)CC 7a_100011215188_100000766640 [0,2,0,0,0,0|2,0,0]=4 9978 B11R0.174 CCC[C@H](N)COCC(=O)OC 34a_100000732646_100000747449 [0,2,0,0,0,0|1,0,1]=4 9979 B11R0.174 CCC[C@H](N)COCC(C)CC 34a_100000732646_100000748023 [0,2,0,0,0,0|2,0,0]=4 9980 B11R0.174 CCC[C@H](N)COCC(O)CC 34a_100000732646_100011218378 [0,2,0,0,0,0|2,0,0]=4 9981 B11R0.174 CCC[C@H](N)COC[C@@H](C)CC 34a_100000732646_100009816398 [0,2,0,0,0,0|2,0,0]=4 9982 B11R0.174 CCNC(=O)COCC(C)OC 34a_100000690652_100000183381 [0,2,0,0,0,0|1,0,1]=4 9983 B11R0.174 CCOC(=O)CNC[C@@H](C)OC 2230a_100020591295_100000188475 [0,2,0,0,0,0|1,0,1]=4 9984 B11R0.174 CCOC(=O)COCC(C)OC 34a_100000690652_100000188475 [0,2,0,0,0,0|0,0,1]=3 9985 B11R0.174 CCOC(=O)COC[C@@H](C)CC 7a_100009816381_100000188475 [0,2,0,0,0,0|1,0,1]=4 9986 B11R0.174 CNC(=O)CCOC(C)COC 34a_100000754576_100000765312 [0,2,0,0,0,0|2,0,0]=4 9987 B11R0.174 CNC(=O)CCO[C@H](C)COC 34a_100011934205_100012179268 [0,2,0,0,0,0|2,0,0]=4 9988 B11R0.174 COCC(C)OCCC(C)OC 7a_100000764861_100000765312 [0,2,0,0,0,0|2,0,0]=4 9989 B11R0.174 COCC(O)COCC(C)OC 34a_100000690652_100011215053 [0,2,0,0,0,0|2,0,0]=4 9990 B11R0.174 COC[C@@H](C)OCCC(=O)OC 34a_100011934205_100000742370 [0,2,0,0,0,0|2,0,0]=4 9991 B11R0.176 C#CCC(C)OCCOC(C)C 34a_100000685586_100000211751 [0,2,0,0,0,0|1,0,1]=4 9992 B11R0.176 C#CCC(C)OCCOC(C)C 7a_100000685586_100000211751 [0,2,0,0,0,0|1,0,1]=4 9993 B11R0.176 C/C=C/C(C)OCCOC(C)C 34a_200102604097_100000211751 [0,2,0,0,0,0|1,0,1]=4 9994 B11R0.176 C=C(C)CCOCC(=O)OCC 34a_100000764851_100000188475 [0,2,0,0,0,0|1,0,1]=4 9995 B11R0.176 C=C(C)CCOCC(C)CCC 34a_100000688023_100000730704 [0,2,0,0,0,0|2,0,0]=4 9996 B11R0.176 C=C(C)CCOCC(C)CCC 34a_100000764851_100011216630 [0,2,0,0,0,0|2,0,0]=4 9997 B11R0.176 C=C(C)CCOCC(C)CCC 7a_100000688023_100000730704 [0,2,0,0,0,0|2,0,0]=4 9998 B11R0.176 C=C(C)CCOC[C@@H](N)CCC 34a_100000732646_100000730704 [0,2,0,0,0,0|2,0,0]=4 9999 B11R0.176 C=CC[C@@H](C)OCCOC(C)C 34a_100000731007_100000211751 [0,2,0,0,0,0|1,0,1]=4 10000 B11R0.176 C=CC[C@@H](C)OCCOC(C)C 7a_100000731007_100000211751 [0,2,0,0,0,0|1,0,1]=4 10001 B11R0.176 CC#CC(C)OCCOC(C)C 34a_100011216543_100000211751 [0,2,0,0,0,0|1,0,1]=4 10002 B11R0.176 CC(C)OCCOC(C)CC#N 7a_100000211219_100009813641 [0,2,0,0,0,0|2,0,0]=4 10003 B11R0.176 CC(C)OCCOC(C)CCBr 34a_100012276601_100000211751 [0,2,0,0,0,0|2,0,0]=4 10004 B11R0.176 CC(C)OCCOC(C)CCO 34a_100000211219_100009893172 [0,2,0,0,0,0|2,0,0]=4 10005 B11R0.176 CC(C)OCCOC(C)CCO 7a_100000211219_100009893172 [0,2,0,0,0,0|2,0,0]=4 10006 B11R0.176 CCCC(C)CCCOC(C)C 34a_100011713154_100000210206 [0,2,0,0,0,0|2,0,0]=4 10007 B11R0.176 CCCC(C)CCCOC(C)C 7a_100011713154_100000210206 [0,2,0,0,0,0|2,0,0]=4 10008 B11R0.176 CCCC(C)COCCC(=O)C 34a_100000759926_100011216630 [0,2,0,0,0,0|2,0,0]=4 10009 B11R0.176 CCCC(C)COCCC(=O)C 7a_100000688023_100000053229 [0,2,0,0,0,0|2,0,0]=4 10010 B11R0.176 CCCC(C)COCCC(=O)C 7a_100000759926_100011216630 [0,2,0,0,0,0|2,0,0]=4 10011 B11R0.176 CCCC(C)COCCC(C)Br 34a_100009893172_100011216630 [0,2,0,0,0,0|2,0,0]=4 10012 B11R0.176 CCCC(C)COCCC(C)C 34a_100000210254_100011216630 [0,2,0,0,0,0|2,0,0]=4 10013 B11R0.176 CCCC(C)COCCC(C)C 34a_100000688023_100000210312 [0,2,0,0,0,0|2,0,0]=4 10014 B11R0.176 CCCC(C)COCCC(C)C 7a_100000210254_100011216630 [0,2,0,0,0,0|2,0,0]=4 10015 B11R0.176 CCCC(C)COCCC(C)C 7a_100000688023_100000210626 [0,2,0,0,0,0|2,0,0]=4 10016 B11R0.176 CCCC(C)COCCC(C)O 34a_100000688023_100012276601 [0,2,0,0,0,0|2,0,0]=4 10017 B11R0.176 CCCC(C)COCCC(C)O 7a_100000688023_100012276601 [0,2,0,0,0,0|2,0,0]=4 10018 B11R0.176 CCCC(C)COCCN(C)C 7a_100000688023_100000755713 [0,2,0,0,0,0|2,0,0]=4 10019 B11R0.176 CCCC(C)COCC[C@@H](C)N 34a_100000706166_100011216630 [0,2,0,0,0,0|2,0,0]=4 10020 B11R0.176 CCCC(C)NCCOC(C)C 2230a_100000701111_100000766640 [0,2,0,0,0,0|2,0,0]=4 10021 B11R0.176 CCCC(C)NCCOC(C)C 2230a_100000741246_100000211751 [0,2,0,0,0,0|2,0,0]=4 10022 B11R0.176 CCCC(C)NCCOC(C)C 270004a_100000701111_100000211909 [0,2,0,0,0,0|2,0,0]=4 10023 B11R0.176 CCCC(C)NCCOC(C)C 34a_100000701111_100000766640 [0,2,0,0,0,0|2,0,0]=4 10024 B11R0.176 CCCC(C)OCCCC(C)C 34a_100000210774_100000766640 [0,2,0,0,0,0|2,0,0]=4 10025 B11R0.176 CCCC(C)OCCCC(C)C 34a_100000764384_100011214892 [0,2,0,0,0,0|2,0,0]=4 10026 B11R0.176 CCCC(C)OCCCC(C)C 7a_100000210774_100000766640 [0,2,0,0,0,0|2,0,0]=4 10027 B11R0.176 CCCC(C)OCCCC(C)C 7a_100000764384_100011214892 [0,2,0,0,0,0|2,0,0]=4 10028 B11R0.176 CCCC(C)OCCCC(C)O 34a_100000764384_200000718107 [0,2,0,0,0,0|2,0,0]=4 10029 B11R0.176 CCCC(C)OCCCC(C)O 7a_100000764384_200000718107 [0,2,0,0,0,0|2,0,0]=4 10030 B11R0.176 CCCC(C)OCCNC(C)C 34a_100000224655_100000766640 [0,2,0,0,0,0|2,0,0]=4 10031 B11R0.176 CCCC(C)OCCOC(=O)C 34a_100000764384_100009814007 [0,2,0,0,0,0|1,0,1]=4 10032 B11R0.176 CCCC(C)OCCOC(=O)C 7a_100000764384_100009814007 [0,2,0,0,0,0|1,0,1]=4 10033 B11R0.176 CCCC(C)OCCOC(C)C 34a_100000211219_100000766640 [0,2,0,0,0,0|1,0,0]=3 10034 B11R0.176 CCCC(C)OCCOC(C)C 34a_100000764384_100000211751 [0,2,0,0,0,0|1,0,0]=3 10035 B11R0.176 CCCC(C)OCCOC(C)C 7a_100000211219_100000766640 [0,2,0,0,0,0|1,0,0]=3 10036 B11R0.176 CCCC(C)OCCOC(C)C 7a_100000764384_100000211751 [0,2,0,0,0,0|1,0,0]=3 10037 B11R0.176 CCCC(C)OCCSC(C)C 34a_100000764384_100000730970 [0,2,0,0,0,0|1,1,0]=4 10038 B11R0.176 CCCC(C)OCCSC(C)C 34a_200011212901_100000766640 [0,2,0,0,0,0|1,1,0]=4 10039 B11R0.176 CCCC(C)OCCSC(C)C 7a_100000764384_100000730970 [0,2,0,0,0,0|1,1,0]=4 10040 B11R0.176 CCCC(C)OCCSC(C)C 7a_200011212901_100000766640 [0,2,0,0,0,0|1,1,0]=4 10041 B11R0.176 CCCC(C)SCCOC(C)C 62a_100000211751_100000766640 [0,2,0,0,0,0|1,1,0]=4 10042 B11R0.176 CCCC(C)SCCOC(C)C 62a_100000766640_100000211751 [0,2,0,0,0,0|1,1,0]=4 10043 B11R0.176 CCC[C@H](N)COCCC(C)C 34a_100000732646_100000210312 [0,2,0,0,0,0|2,0,0]=4 10044 B11R0.176 CCC[C@H](N)COCCC(C)O 34a_100000732646_100012276601 [0,2,0,0,0,0|2,0,0]=4 10045 B11R0.176 CCOC(=O)COCCC(=O)C 1458a_100000070787_100000088970 [0,2,0,0,0,0|1,0,1]=4 10046 B11R0.176 CCOC(=O)COCCC(=O)C 34a_100000759926_100000188475 [0,2,0,0,0,0|1,0,1]=4 10047 B11R0.176 CCOC(=O)COCCC(=O)C 7a_100000759926_100000188475 [0,2,0,0,0,0|1,0,1]=4 10048 B11R0.176 CCOC(=O)COCCC(C)Br 34a_100009893172_100000188475 [0,2,0,0,0,0|1,0,1]=4 10049 B11R0.176 CCOC(=O)COCCC(C)C 34a_100000210254_100000188475 [0,2,0,0,0,0|1,0,1]=4 10050 B11R0.176 CCOC(=O)COCCC(C)C 7a_100000210254_100000188475 [0,2,0,0,0,0|1,0,1]=4 10051 B11R0.176 CCOC(=O)COCCN(C)C 2230a_100102631434_100000088970 [0,2,0,0,0,0|1,0,1]=4 10052 B11R0.176 CCOC(=O)COCCN(C)C 269982a_100102631434_100000088970 [0,2,0,0,0,0|1,0,1]=4 10053 B11R0.176 CCOC(=O)COCC[C@@H](C)N 34a_100000706166_100000188475 [0,2,0,0,0,0|1,0,1]=4 10054 B11R0.176 COCC(=O)NCCOC(C)C 11a_100000701111_100000210968 [0,2,0,0,0,0|1,0,1]=4 10055 B11R0.176 COCC(=O)NCCOC(C)C 1626a_100000701111_100000210968 [0,2,0,0,0,0|1,0,1]=4 10056 B11R0.176 COCC(=O)NCCOC(C)C 240690a_100000701111_100000210968 [0,2,0,0,0,0|1,0,1]=4 10057 B11R0.176 COCC(=O)NCCOC(C)C 527a_100000701111_100000210968 [0,2,0,0,0,0|1,0,1]=4 10058 B11R0.176 COCC(C)NCCCC(C)C 2230a_200000737386_100000765312 [0,2,0,0,0,0|2,0,0]=4 10059 B11R0.176 COCC(C)NCCCC(C)C 270004a_200000737386_100000749346 [0,2,0,0,0,0|2,0,0]=4 10060 B11R0.176 COCC(C)NCCCC(C)C 34a_200000737386_100000765312 [0,2,0,0,0,0|2,0,0]=4 10061 B11R0.176 COCC(C)NCCOC(C)C 2230a_100000701111_100000765312 [0,2,0,0,0,0|1,0,0]=3 10062 B11R0.176 COCC(C)NCCOC(C)C 270004a_100000701111_100000749346 [0,2,0,0,0,0|1,0,0]=3 10063 B11R0.176 COCC(C)NCCOC(C)C 34a_100000701111_100000765312 [0,2,0,0,0,0|1,0,0]=3 10064 B11R0.176 COCC(C)NCCSC(C)C 2230a_100000731138_100000765312 [0,2,0,0,0,0|1,1,0]=4 10065 B11R0.176 COCC(C)NCCSC(C)C 270004a_100000731138_100000749346 [0,2,0,0,0,0|1,1,0]=4 10066 B11R0.176 COCC(C)NCCSC(C)C 34a_100000731138_100000765312 [0,2,0,0,0,0|1,1,0]=4 10067 B11R0.176 COCC(C)OCCCC(=O)C 34a_100000759063_100000765312 [0,2,0,0,0,0|1,0,1]=4 10068 B11R0.176 COCC(C)OCCCC(=O)C 7a_100000759063_100000765312 [0,2,0,0,0,0|1,0,1]=4 10069 B11R0.176 COCC(C)OCCCC(C)C 34a_100000210774_100000765312 [0,2,0,0,0,0|1,0,0]=3 10070 B11R0.176 COCC(C)OCCCC(C)C 7a_100000210774_100000765312 [0,2,0,0,0,0|1,0,0]=3 10071 B11R0.176 COCC(C)OCCNC(=O)C 34a_100000158858_100000765312 [0,2,0,0,0,0|1,0,1]=4 10072 B11R0.176 COCC(C)OCCNC(C)C 34a_100000224655_100000765312 [0,2,0,0,0,0|1,0,0]=3 10073 B11R0.176 COCC(C)OCCOC(=O)N 7a_100000766696_100000765312 [0,2,0,0,0,0|1,0,1]=4 10074 B11R0.176 COCC(C)OCCOC(C)C 34a_100000211219_100000765312 [0,2,0,0,0,0|0,0,0]=2 10075 B11R0.176 COCC(C)OCCOC(C)C 7a_100000211219_100000765312 [0,2,0,0,0,0|0,0,0]=2 10076 B11R0.176 COCC(C)OCCSC(C)C 34a_200011212901_100000765312 [0,2,0,0,0,0|0,1,0]=3 10077 B11R0.176 COCC(C)OCCSC(C)C 7a_200011212901_100000765312 [0,2,0,0,0,0|0,1,0]=3 10078 B11R0.176 COCC(C)SCCCC(C)C 62a_100000765312_100011214892 [0,2,0,0,0,0|1,1,0]=4 10079 B11R0.176 COCC(C)SCCCC(C)C 62a_100011214892_100000765312 [0,2,0,0,0,0|1,1,0]=4 10080 B11R0.176 COCC(C)SCCCC(C)O 62a_100000765312_200000718107 [0,2,0,0,0,0|1,1,0]=4 10081 B11R0.176 COCC(C)SCCCC(C)O 62a_200000718107_100000765312 [0,2,0,0,0,0|1,1,0]=4 10082 B11R0.176 COCC(C)SCCOC(=O)C 62a_100000765312_100009814007 [0,2,0,0,0,0|0,1,1]=4 10083 B11R0.176 COCC(C)SCCOC(=O)C 62a_100009814007_100000765312 [0,2,0,0,0,0|0,1,1]=4 10084 B11R0.176 COCC(C)SCCOC(C)C 62a_100000211751_100000765312 [0,2,0,0,0,0|0,1,0]=3 10085 B11R0.176 COCC(C)SCCOC(C)C 62a_100000765312_100000211751 [0,2,0,0,0,0|0,1,0]=3 10086 B11R0.176 COCC(C)SCCSC(C)C 62a_100000730970_100000765312 [0,2,0,0,0,0|0,2,0]=4 10087 B11R0.176 COCC(C)SCCSC(C)C 62a_100000765312_100000730970 [0,2,0,0,0,0|0,2,0]=4 10088 B11R0.176 COCC(N)COCOC(C)C 34a_100000724102_100000709892 [0,2,0,0,0,0|2,0,0]=4 10089 B11R0.176 COCC(O)CNCOC(C)C 2230a_100000756049_100000709892 [0,2,0,0,0,0|2,0,0]=4 10090 B11R0.176 COCC(O)CNCOC(C)C 34a_100000756049_100000709892 [0,2,0,0,0,0|2,0,0]=4 10091 B11R0.176 COCC(O)CSCOC(C)C 62a_100000709892_100011215053 [0,2,0,0,0,0|2,0,0]=4 10092 B11R0.176 COCC(O)CSCOC(C)C 62a_100011215053_100000709892 [0,2,0,0,0,0|2,0,0]=4 10093 B11R0.176 COC[C@@H](C)NCCCC(C)C 2230a_100000764878_100011214892 [0,2,0,0,0,0|2,0,0]=4 10094 B11R0.176 COC[C@@H](C)NCCCC(C)O 2230a_100000764878_200000718107 [0,2,0,0,0,0|2,0,0]=4 10095 B11R0.176 COC[C@@H](C)NCCOC(C)C 2230a_100000764878_100000211751 [0,2,0,0,0,0|1,0,0]=3 10096 B11R0.176 COC[C@@H](C)NCCSC(C)C 2230a_100000764878_100000730970 [0,2,0,0,0,0|1,1,0]=4 10097 B11R0.176 COC[C@@H](C)OCCC=C(C)C 34a_100011934205_100011217483 [0,2,0,0,0,0|1,0,1]=4 10098 B11R0.176 COC[C@@H](C)OCCCC(=O)C 34a_100011934205_100000685027 [0,2,0,0,0,0|1,0,1]=4 10099 B11R0.176 COC[C@@H](C)OCCCC(C)C 34a_100011934205_100011214892 [0,2,0,0,0,0|1,0,0]=3 10100 B11R0.176 COC[C@@H](C)OCCCC(C)O 34a_100011934205_200000718107 [0,2,0,0,0,0|1,0,0]=3 10101 B11R0.176 COC[C@@H](C)OCCOC(=O)C 34a_100011934205_100009814007 [0,2,0,0,0,0|0,0,1]=3 10102 B11R0.176 COC[C@@H](C)OCCOC(=O)N 34a_100011934205_200011214921 [0,2,0,0,0,0|1,0,1]=4 10103 B11R0.176 COC[C@@H](C)OCCOC(C)C 34a_100011934205_100000211751 [0,2,0,0,0,0|0,0,0]=2 10104 B11R0.176 COC[C@@H](C)OCCSC(C)C 34a_100011934205_100000730970 [0,2,0,0,0,0|0,1,0]=3 10105 B11R0.176 CSCC(C)NCCOC(C)C 270004a_100000701111_100011216314 [0,2,0,0,0,0|1,1,0]=4 10106 B11R0.304 C=CCC(C)(C)OCCOCC 7a_100011995686_100011215890 [0,2,0,0,0,0|1,0,1]=4 10107 B11R0.304 CCCC(C)(C)COCCOC 7a_100011995695_100000233755 [0,2,0,0,0,0|1,0,0]=3 10108 B11R0.304 CCCC(C)(C)COCCSC 7a_100011995695_100000212216 [0,2,0,0,0,0|1,1,0]=4 10109 B11R0.304 CCCC(C)(C)OCCOCC 7a_100000748436_100011215890 [0,2,0,0,0,0|1,0,0]=3 10110 B11R0.304 CCCC(C)(C)OCCSCC 7a_100000748436_100000757381 [0,2,0,0,0,0|1,1,0]=4 10111 B11R0.304 CCCCCCC(C)(C)OCC 7a_200011995690_100000210202 [0,2,0,0,0,0|2,0,0]=4 10112 B11R0.304 CCCCCNC(C)(C)COC 2230a_100000752728_100000210326 [0,2,0,0,0,0|2,0,0]=4 10113 B11R0.304 CCCCCOC(C)(C)CCC 7a_100000748436_100000210326 [0,2,0,0,0,0|2,0,0]=4 10114 B11R0.304 CCCCOCC(C)(C)CCC 7a_100011995695_100000210211 [0,2,0,0,0,0|2,0,0]=4 10115 B11R0.304 CCCCOCC(C)(C)NCC 7a_100000747347_100000210211 [0,2,0,0,0,0|2,0,0]=4 10116 B11R0.304 CCNC(C)(C)COCCOC 7a_100000747347_100000233755 [0,2,0,0,0,0|1,0,0]=3 10117 B11R0.304 CCNC(C)(C)COCCSC 7a_100000747347_100000212216 [0,2,0,0,0,0|1,1,0]=4 10118 B11R0.304 CCOC(C)(C)COCCOC 7a_100000067319_100000210202 [0,2,0,0,0,0|0,0,0]=2 10119 B11R0.304 CCOCCNC(C)(C)COC 2230a_100000752728_100011215890 [0,2,0,0,0,0|1,0,0]=3 10120 B11R0.304 CCOCCNC(C)(C)CSC 2230a_100000759623_100011215890 [0,2,0,0,0,0|1,1,0]=4 10121 B11R0.304 CCOCCNC(C)(C)CSC 7a_100000759623_100011215890 [0,2,0,0,0,0|1,1,0]=4 10122 B11R0.304 CCOCCOC(C)(C)CCBr 7a_100000702414_100011215890 [0,2,0,0,0,0|2,0,0]=4 10123 B11R0.304 CCO[Si](C)(C)CSCCOC 62a_100000233755_200000065227 [0,2,0,0,0,0|0,2,0]=4 10124 B11R0.304 CCO[Si](C)(C)CSCCOC 62a_200000065227_100000233755 [0,2,0,0,0,0|0,2,0]=4 10125 B11R0.304 CCSCCNC(C)(C)COC 2230a_100000752728_100000757381 [0,2,0,0,0,0|1,1,0]=4 10126 B11R0.304 COCCOCC(C)(C)OCF 7a_100000067319_100015361967 [0,2,0,0,0,0|1,0,0]=3 10127 B11R0.30 C=C(Br)CCOCCOC(C)C 34a_100009813270_100000211751 [0,2,0,0,0,0|1,0,1]=4 10128 B11R0.30 C=C(C)CCNCCOC(C)C 2230a_100000701111_100000730704 [0,2,0,0,0,0|2,0,0]=4 10129 B11R0.30 C=C(C)CCNCCOC(C)C 34a_100000701111_100000730704 [0,2,0,0,0,0|2,0,0]=4 10130 B11R0.30 C=C(C)CCOCCCC(C)C 34a_100000210774_100000730704 [0,2,0,0,0,0|2,0,0]=4 10131 B11R0.30 C=C(C)CCOCCCC(C)C 34a_100000764851_100011214892 [0,2,0,0,0,0|2,0,0]=4 10132 B11R0.30 C=C(C)CCOCCCC(C)C 7a_100000210774_100000730704 [0,2,0,0,0,0|2,0,0]=4 10133 B11R0.30 C=C(C)CCOCCCC(C)O 34a_100000764851_200000718107 [0,2,0,0,0,0|2,0,0]=4 10134 B11R0.30 C=C(C)CCOCCNC(C)C 34a_100000224655_100000730704 [0,2,0,0,0,0|2,0,0]=4 10135 B11R0.30 C=C(C)CCOCCOC(=O)C 34a_100000764851_100009814007 [0,2,0,0,0,0|1,0,1]=4 10136 B11R0.30 C=C(C)CCOCCOC(C)C 34a_100000211219_100000730704 [0,2,0,0,0,0|1,0,0]=3 10137 B11R0.30 C=C(C)CCOCCOC(C)C 34a_100000764851_100000211751 [0,2,0,0,0,0|1,0,0]=3 10138 B11R0.30 C=C(C)CCOCCOC(C)C 7a_100000211219_100000730704 [0,2,0,0,0,0|1,0,0]=3 10139 B11R0.30 C=C(C)CCOCCSC(C)C 34a_100000764851_100000730970 [0,2,0,0,0,0|1,1,0]=4 10140 B11R0.30 C=C(C)CCOCCSC(C)C 34a_200011212901_100000730704 [0,2,0,0,0,0|1,1,0]=4 10141 B11R0.30 C=C(C)CCOCCSC(C)C 7a_200011212901_100000730704 [0,2,0,0,0,0|1,1,0]=4 10142 B11R0.30 C=C(C)CCSCCOC(C)C 62a_100000211751_100000730704 [0,2,0,0,0,0|1,1,0]=4 10143 B11R0.30 C=C(C)CCSCCOC(C)C 62a_100000730704_100000211751 [0,2,0,0,0,0|1,1,0]=4 10144 B11R0.30 CC(=CCOCCOC(C)C)C 34a_100000211219_100000761012 [0,2,0,0,0,0|1,0,1]=4 10145 B11R0.30 CC(=CCOCCOC(C)C)C 34a_100000753907_100000211751 [0,2,0,0,0,0|1,0,1]=4 10146 B11R0.30 CC(=CCOCCOC(C)C)C 7a_100000211219_100000761012 [0,2,0,0,0,0|1,0,1]=4 10147 B11R0.30 CC(=O)CCOCCCC(C)C 34a_100000759926_100011214892 [0,2,0,0,0,0|2,0,0]=4 10148 B11R0.30 CC(=O)CCOCCCC(C)C 7a_100000210774_100000053229 [0,2,0,0,0,0|2,0,0]=4 10149 B11R0.30 CC(=O)CCOCCCC(C)C 7a_100000759926_100011214892 [0,2,0,0,0,0|2,0,0]=4 10150 B11R0.30 CC(=O)CCOCCCC(C)O 34a_100000759926_200000718107 [0,2,0,0,0,0|2,0,0]=4 10151 B11R0.30 CC(=O)CCOCCCC(C)O 7a_100000759926_200000718107 [0,2,0,0,0,0|2,0,0]=4 10152 B11R0.30 CC(=O)CCOCCOC(=O)C 1458a_100000070787_200000083610 [0,2,0,0,0,0|1,0,1]=4 10153 B11R0.30 CC(=O)CCOCCOC(=O)C 34a_100000759926_100009814007 [0,2,0,0,0,0|1,0,1]=4 10154 B11R0.30 CC(=O)CCOCCOC(=O)C 7a_100000759926_100009814007 [0,2,0,0,0,0|1,0,1]=4 10155 B11R0.30 CC(=O)CCOCCOC(C)C 34a_100000759926_100000211751 [0,2,0,0,0,0|1,0,0]=3 10156 B11R0.30 CC(=O)CCOCCOC(C)C 7a_100000211219_100000053229 [0,2,0,0,0,0|1,0,0]=3 10157 B11R0.30 CC(=O)CCOCCOC(C)C 7a_100000759926_100000211751 [0,2,0,0,0,0|1,0,0]=3 10158 B11R0.30 CC(=O)CCOCCSC(C)C 34a_100000759926_100000730970 [0,2,0,0,0,0|1,1,0]=4 10159 B11R0.30 CC(=O)CCOCCSC(C)C 7a_100000759926_100000730970 [0,2,0,0,0,0|1,1,0]=4 10160 B11R0.30 CC(=O)CCOCCSC(C)C 7a_200011212901_100000053229 [0,2,0,0,0,0|1,1,0]=4 10161 B11R0.30 CC(=O)CCSCCOC(C)C 62a_100000053229_100000211751 [0,2,0,0,0,0|1,1,0]=4 10162 B11R0.30 CC(=O)CCSCCOC(C)C 62a_100000211751_100000053229 [0,2,0,0,0,0|1,1,0]=4 10163 B11R0.30 CC(=O)OCCOCCC(C)Br 34a_100009893172_100009814007 [0,2,0,0,0,0|1,0,1]=4 10164 B11R0.30 CC(=O)OCCOCCC(C)C 34a_100000210254_100009814007 [0,2,0,0,0,0|1,0,1]=4 10165 B11R0.30 CC(=O)OCCOCCC(C)C 7a_100000210254_100009814007 [0,2,0,0,0,0|1,0,1]=4 10166 B11R0.30 CC(=O)OCCOCCN(C)C 2230a_100102631434_200000083610 [0,2,0,0,0,0|1,0,1]=4 10167 B11R0.30 CC(=O)OCCOCCN(C)C 269982a_100102631434_200000083610 [0,2,0,0,0,0|1,0,1]=4 10168 B11R0.30 CC(=O)OCCOCC[C@@H](C)N 34a_100000706166_100009814007 [0,2,0,0,0,0|1,0,1]=4 10169 B11R0.30 CC(=O)OCOCCOC(C)C 34a_100000211219_100009813279 [0,2,0,0,0,0|2,0,0]=4 10170 B11R0.30 CC(Br)CCOCCOC(C)C 34a_100009893172_100000211751 [0,2,0,0,0,0|1,0,0]=3 10171 B11R0.30 CC(Br)CCOCCSC(C)C 34a_100009893172_100000730970 [0,2,0,0,0,0|1,1,0]=4 10172 B11R0.30 CC(C)CCCCCOC(C)C 34a_100000212225_100000210682 [0,2,0,0,0,0|2,0,0]=4 10173 B11R0.30 CC(C)CCCCCOC(C)C 34a_100011995859_100000210206 [0,2,0,0,0,0|2,0,0]=4 10174 B11R0.30 CC(C)CCCCCOC(C)C 7a_100011995859_100000210206 [0,2,0,0,0,0|2,0,0]=4 10175 B11R0.30 CC(C)CCCOCCC(C)Br 34a_100009893172_100011214892 [0,2,0,0,0,0|2,0,0]=4 10176 B11R0.30 CC(C)CCCOCCC(C)C 34a_100000210254_100011214892 [0,2,0,0,0,0|2,0,0]=4 10177 B11R0.30 CC(C)CCCOCCC(C)C 34a_100000210774_100000210312 [0,2,0,0,0,0|2,0,0]=4 10178 B11R0.30 CC(C)CCCOCCC(C)C 7a_100000210254_100011214892 [0,2,0,0,0,0|2,0,0]=4 10179 B11R0.30 CC(C)CCCOCCC(C)C 7a_100000210774_100000210626 [0,2,0,0,0,0|2,0,0]=4 10180 B11R0.30 CC(C)CCCOCCC(C)O 34a_100000210774_100012276601 [0,2,0,0,0,0|2,0,0]=4 10181 B11R0.30 CC(C)CCCOCCC(C)O 7a_100000210774_100012276601 [0,2,0,0,0,0|2,0,0]=4 10182 B11R0.30 CC(C)CCCOCCN(C)C 7a_100000210774_100000755713 [0,2,0,0,0,0|2,0,0]=4 10183 B11R0.30 CC(C)CCCOCC[C@@H](C)N 34a_100000706166_100011214892 [0,2,0,0,0,0|2,0,0]=4 10184 B11R0.30 CC(C)CCNCCOC(C)C 2230a_100000701111_100000210312 [0,2,0,0,0,0|2,0,0]=4 10185 B11R0.30 CC(C)CCNCCOC(C)C 269862a_100000701111_100000185833 [0,2,0,0,0,0|2,0,0]=4 10186 B11R0.30 CC(C)CCNCCOC(C)C 34a_100000701111_100000210312 [0,2,0,0,0,0|2,0,0]=4 10187 B11R0.30 CC(C)CCOCCCC(C)O 34a_100000210254_200000718107 [0,2,0,0,0,0|2,0,0]=4 10188 B11R0.30 CC(C)CCOCCCC(C)O 7a_100000210254_200000718107 [0,2,0,0,0,0|2,0,0]=4 10189 B11R0.30 CC(C)CCOCCNC(C)C 34a_100000224655_100000210312 [0,2,0,0,0,0|2,0,0]=4 10190 B11R0.30 CC(C)CCOCCOC(C)C 34a_100000210254_100000211751 [0,2,0,0,0,0|1,0,0]=3 10191 B11R0.30 CC(C)CCOCCOC(C)C 34a_100000211219_100000210312 [0,2,0,0,0,0|1,0,0]=3 10192 B11R0.30 CC(C)CCOCCOC(C)C 7a_100000210254_100000211751 [0,2,0,0,0,0|1,0,0]=3 10193 B11R0.30 CC(C)CCOCCOC(C)C 7a_100000211219_100000210626 [0,2,0,0,0,0|1,0,0]=3 10194 B11R0.30 CC(C)CCOCCSC(C)C 34a_100000210254_100000730970 [0,2,0,0,0,0|1,1,0]=4 10195 B11R0.30 CC(C)CCOCCSC(C)C 34a_200011212901_100000210312 [0,2,0,0,0,0|1,1,0]=4 10196 B11R0.30 CC(C)CCOCCSC(C)C 7a_100000210254_100000730970 [0,2,0,0,0,0|1,1,0]=4 10197 B11R0.30 CC(C)CCOCCSC(C)C 7a_200011212901_100000210626 [0,2,0,0,0,0|1,1,0]=4 10198 B11R0.30 CC(C)CCSCCOC(C)C 62a_100000210312_100000211751 [0,2,0,0,0,0|1,1,0]=4 10199 B11R0.30 CC(C)CCSCCOC(C)C 62a_100000211751_100000210312 [0,2,0,0,0,0|1,1,0]=4 10200 B11R0.30 CC(C)OCCOCCC(=O)N 34a_100000211219_100000731001 [0,2,0,0,0,0|2,0,0]=4 10201 B11R0.30 CC(C)OCCOCCC(=O)N 34a_100000757172_100000211751 [0,2,0,0,0,0|2,0,0]=4 10202 B11R0.30 CC(C)OCCOCCC(=O)N 7a_100000211219_100000744528 [0,2,0,0,0,0|2,0,0]=4 10203 B11R0.30 CC(C)OCCOCCC(=O)N 7a_100000757172_100000211751 [0,2,0,0,0,0|2,0,0]=4 10204 B11R0.30 CC(C)OCCOCCC(F)F 34a_100103093639_100000211751 [0,2,0,0,0,0|2,0,0]=4 10205 B11R0.30 CC(C)OCCOCCN(C)C 7a_100000211219_100000755713 [0,2,0,0,0,0|1,0,0]=3 10206 B11R0.30 CC(C)OCCOCC[C@@H](C)N 34a_100000706166_100000211751 [0,2,0,0,0,0|1,0,0]=3 10207 B11R0.30 CC(C)OCCOCOC(C)C 34a_100000211219_100000709892 [0,2,0,0,0,0|2,0,0]=4 10208 B11R0.30 CC(C)OCCSCCN(C)C 62a_100000211751_100000755713 [0,2,0,0,0,0|1,1,0]=4 10209 B11R0.30 CC(C)SCCOCCN(C)C 7a_200011212901_100000755713 [0,2,0,0,0,0|1,1,0]=4 10210 B11R0.30 CC(C)SCCOCC[C@@H](C)N 34a_100000706166_100000730970 [0,2,0,0,0,0|1,1,0]=4 10211 B11R0.30 CC(O)CCCOCCC(C)Br 34a_100009893172_200000718107 [0,2,0,0,0,0|2,0,0]=4 10212 B11R0.30 CC(O)CCCOCC[C@@H](C)N 34a_100000706166_200000718107 [0,2,0,0,0,0|2,0,0]=4 10213 B11R0.30 CC(O)CCNCCOC(C)C 2230a_100000701111_100012276601 [0,2,0,0,0,0|2,0,0]=4 10214 B11R0.30 CC(O)CCNCCOC(C)C 2230a_200000755665_100000211751 [0,2,0,0,0,0|2,0,0]=4 10215 B11R0.30 CC(O)CCNCCOC(C)C 34a_100000701111_100012276601 [0,2,0,0,0,0|2,0,0]=4 10216 B11R0.30 CC(O)CCOCCNC(C)C 34a_100000224655_100012276601 [0,2,0,0,0,0|2,0,0]=4 10217 B11R0.30 CC(O)CCOCCOC(C)C 34a_100000211219_100012276601 [0,2,0,0,0,0|1,0,0]=3 10218 B11R0.30 CC(O)CCOCCOC(C)C 7a_100000211219_100012276601 [0,2,0,0,0,0|1,0,0]=3 10219 B11R0.30 CC(O)CCOCCSC(C)C 34a_200011212901_100012276601 [0,2,0,0,0,0|1,1,0]=4 10220 B11R0.30 CC(O)CCOCCSC(C)C 7a_200011212901_100012276601 [0,2,0,0,0,0|1,1,0]=4 10221 B11R0.30 CC(O)CCSCCOC(C)C 62a_100000211751_100012276601 [0,2,0,0,0,0|1,1,0]=4 10222 B11R0.30 CC(O)CCSCCOC(C)C 62a_100012276601_100000211751 [0,2,0,0,0,0|1,1,0]=4 10223 B11R0.40 C#C/C(=C\COCCOCC)/C 34a_100016990848_100000210147 [0,2,0,0,0,0|1,0,1]=4 10224 B11R0.40 C#CC(=O)CCOCCOCC 1458a_100000211873_100011211534 [0,2,0,0,0,0|1,0,1]=4 10225 B11R0.40 C#CC(C)NCCCCCOC 34a_100000747528_200000035995 [0,2,0,0,0,0|2,0,0]=4 10226 B11R0.40 C#CC(C)NCCOCCCC 2230a_100000707721_100000743108 [0,2,0,0,0,0|2,0,0]=4 10227 B11R0.40 C#CC(C)NCCOCCCC 34a_100000707721_100000743108 [0,2,0,0,0,0|2,0,0]=4 10228 B11R0.40 C#CC(C)NCCOCCOC 2230a_100000707721_100000695917 [0,2,0,0,0,0|1,0,0]=3 10229 B11R0.40 C#CC(C)NCCOCCOC 34a_100000707721_100000695917 [0,2,0,0,0,0|1,0,0]=3 10230 B11R0.40 C#CC(C)NCCOCCOC 34a_100000745349_200000035995 [0,2,0,0,0,0|1,0,0]=3 10231 B11R0.40 C#CC(C)OCCCCCCC 34a_100000210272_200000035995 [0,2,0,0,0,0|2,0,0]=4 10232 B11R0.40 C#CC(C)OCCCCCNC 34a_100000722520_200000035995 [0,2,0,0,0,0|2,0,0]=4 10233 B11R0.40 C#CC(C)OCCOCCCC 34a_100000210238_200000035995 [0,2,0,0,0,0|1,0,0]=3 10234 B11R0.40 C#CC(C)OCCOCCNC 34a_100000228057_200000035995 [0,2,0,0,0,0|1,0,0]=3 10235 B11R0.40 C#CC(C)OCCOCCOC 34a_100011215163_200000035995 [0,2,0,0,0,0|0,0,0]=2 10236 B11R0.40 C#CC(C)OCCSCCCC 34a_200000230436_200000035995 [0,2,0,0,0,0|1,1,0]=4 10237 B11R0.40 C#CC(C)SCCOCCCC 62a_200000035995_100000743108 [0,2,0,0,0,0|1,1,0]=4 10238 B11R0.40 C#CC(C)SCCOCCOC 62a_200000035995_100000695917 [0,2,0,0,0,0|0,1,0]=3 10239 B11R0.40 C#CCCCCOCC(C)OC 34a_100000690652_100010269958 [0,2,0,0,0,0|1,0,1]=4 10240 B11R0.40 C#CCCOCCOC(=O)CC 7a_200000031056_100000688953 [0,2,0,0,0,0|1,0,1]=4 10241 B11R0.40 C#CCOCCNC[C@@H](C)OC 2230a_100020591295_100010402529 [0,2,0,0,0,0|1,0,1]=4 10242 B11R0.40 C#CCOCCOCC(=O)OC 34a_100000054580_100000747449 [0,2,0,0,0,0|0,0,2]=4 10243 B11R0.40 C#CCOCCOCC(=O)OC 34a_100000210247_100000090808 [0,2,0,0,0,0|0,0,2]=4 10244 B11R0.40 C#CCOCCOCC(=O)OC 7a_100000054580_100000747449 [0,2,0,0,0,0|0,0,2]=4 10245 B11R0.40 C#CCOCCOCC(C)CC 34a_100000054580_100000748023 [0,2,0,0,0,0|1,0,1]=4 10246 B11R0.40 C#CCOCCOCC(C)CC 7a_100000054580_100000748023 [0,2,0,0,0,0|1,0,1]=4 10247 B11R0.40 C#CCOCCOCC(C)OC 34a_100000690652_100010402529 [0,2,0,0,0,0|0,0,1]=3 10248 B11R0.40 C#CCOCCOCC(O)CC 34a_100000054580_100011218378 [0,2,0,0,0,0|1,0,1]=4 10249 B11R0.40 C#CCOCCOCC(O)CC 7a_100000054580_100011218378 [0,2,0,0,0,0|1,0,1]=4 10250 B11R0.40 C#CCOCCOC[C@@H](C)CC 34a_100000054580_100009816398 [0,2,0,0,0,0|1,0,1]=4 10251 B11R0.40 C#CCOCCOC[C@@H](C)CC 7a_100000054580_100009816398 [0,2,0,0,0,0|1,0,1]=4 10252 B11R0.40 C#CCOCCOC[C@@H](C)CC 7a_100009816381_100010402529 [0,2,0,0,0,0|1,0,1]=4 10253 B11R0.40 C#C[C@@H](C)OCCCCCCC 34a_100009815206_100000210614 [0,2,0,0,0,0|2,0,0]=4 10254 B11R0.40 C#C[C@@H](C)OCCCCCCC 7a_100009815206_100000210614 [0,2,0,0,0,0|2,0,0]=4 10255 B11R0.40 C#C[C@@H](C)OCCOCCCC 34a_100009815206_100000743108 [0,2,0,0,0,0|1,0,0]=3 10256 B11R0.40 C#C[C@@H](C)OCCOCCCC 7a_100009815206_100000743108 [0,2,0,0,0,0|1,0,0]=3 10257 B11R0.40 C#C[C@@H](C)OCCOCCOC 34a_100009815206_100000695917 [0,2,0,0,0,0|0,0,0]=2 10258 B11R0.40 C#C[C@@H](C)OCCOCCOC 7a_100009815206_100000695917 [0,2,0,0,0,0|0,0,0]=2 10259 B11R0.40 C/C=C/CCOCCC(=O)OC 34a_100016278192_100000742370 [0,2,0,0,0,0|1,0,1]=4 10260 B11R0.40 C/C=C/COCCOC(=O)CC 7a_200000031056_100102629194 [0,2,0,0,0,0|1,0,1]=4 10261 B11R0.40 C=CC(=O)CCOCCOCC 1458a_100000185746_100011211534 [0,2,0,0,0,0|1,0,1]=4 10262 B11R0.40 C=CC(=O)OCCOCCOC 34a_100000210237_100009813456 [0,2,0,0,0,0|0,0,2]=4 10263 B11R0.40 C=CC(C)COCCCOCC 34a_100011215527_100012232248 [0,2,0,0,0,0|1,0,1]=4 10264 B11R0.40 C=CC(C)COCCCOCC 7a_100011215527_100012232248 [0,2,0,0,0,0|1,0,1]=4 10265 B11R0.40 C=CC(C)COCCOCCC 34a_100011215527_100011215938 [0,2,0,0,0,0|1,0,1]=4 10266 B11R0.40 C=CC(C)COCCOCCC 7a_100011215527_100011215938 [0,2,0,0,0,0|1,0,1]=4 10267 B11R0.40 C=CC(C)COCCOCCO 34a_100011215527_100000692535 [0,2,0,0,0,0|1,0,1]=4 10268 B11R0.40 C=CC(C)COCCOCCO 7a_100011215527_100011215305 [0,2,0,0,0,0|1,0,1]=4 10269 B11R0.40 C=CC(C)OCCCCCCC 34a_100000695699_100000210614 [0,2,0,0,0,0|2,0,0]=4 10270 B11R0.40 C=CC(C)OCCOCCCC 34a_100000695699_100000743108 [0,2,0,0,0,0|1,0,0]=3 10271 B11R0.40 C=CC(C)OCCOCCOC 34a_100000695699_100000695917 [0,2,0,0,0,0|0,0,0]=2 10272 B11R0.40 C=CC(C)SCCOCCCC 62a_100011215867_100000743108 [0,2,0,0,0,0|1,1,0]=4 10273 B11R0.40 C=CC(C)SCCOCCOC 62a_100011215867_100000695917 [0,2,0,0,0,0|0,1,0]=3 10274 B11R0.40 C=CC(O)COCCCOCC 34a_100000757476_100000730141 [0,2,0,0,0,0|1,0,1]=4 10275 B11R0.40 C=CC(O)COCCCOCC 7a_100000757476_100000730141 [0,2,0,0,0,0|1,0,1]=4 10276 B11R0.40 C=CC(O)COCCOCCBr 34a_100000692535_100000730141 [0,2,0,0,0,0|1,0,1]=4 10277 B11R0.40 C=CC(O)COCCOCCBr 7a_100000692535_100000730141 [0,2,0,0,0,0|1,0,1]=4 10278 B11R0.40 C=CC(O)COCCOCCC 34a_100000752267_100000730141 [0,2,0,0,0,0|1,0,1]=4 10279 B11R0.40 C=CC(O)COCCOCCC 7a_100000752267_100000730141 [0,2,0,0,0,0|1,0,1]=4 10280 B11R0.40 C=CC(O)COCCOCCCl 34a_100011215305_100000730141 [0,2,0,0,0,0|1,0,1]=4 10281 B11R0.40 C=CC(O)COCCOCCCl 7a_100011215305_100000730141 [0,2,0,0,0,0|1,0,1]=4 10282 B11R0.40 C=CC(O)COCCOCCF 34a_200015357709_100000730141 [0,2,0,0,0,0|1,0,1]=4 10283 B11R0.40 C=CC(O)COCCOCCF 7a_200015357709_100000730141 [0,2,0,0,0,0|1,0,1]=4 10284 B11R0.40 C=CC(O)COCCOCCI 34a_100012149058_100000730141 [0,2,0,0,0,0|1,0,1]=4 10285 B11R0.40 C=CC(O)COCCOCCI 7a_100012149058_100000730141 [0,2,0,0,0,0|1,0,1]=4 10286 B11R0.40 C=CC(O)COCCOCCN 34a_100000211614_100000730141 [0,2,0,0,0,0|1,0,1]=4 10287 B11R0.40 C=CCCCCOCC(C)OC 34a_100000690652_100011215482 [0,2,0,0,0,0|1,0,1]=4 10288 B11R0.40 C=CCCOCCOC(=O)CC 7a_200000031056_100000754431 [0,2,0,0,0,0|1,0,1]=4 10289 B11R0.40 C=CCOCCOCC(=O)OC 34a_100000037705_100000747449 [0,2,0,0,0,0|0,0,2]=4 10290 B11R0.40 C=CCOCCOCC(=O)OC 34a_200000210373_100000090808 [0,2,0,0,0,0|0,0,2]=4 10291 B11R0.40 C=CCOCCOCC(=O)OC 7a_100000037705_100000747449 [0,2,0,0,0,0|0,0,2]=4 10292 B11R0.40 C=CCOCCOCC(C)CC 34a_100000037705_100000748023 [0,2,0,0,0,0|1,0,1]=4 10293 B11R0.40 C=CCOCCOCC(C)CC 7a_100000037705_100000748023 [0,2,0,0,0,0|1,0,1]=4 10294 B11R0.40 C=CCOCCOCC(O)CC 34a_100000037705_100011218378 [0,2,0,0,0,0|1,0,1]=4 10295 B11R0.40 C=CCOCCOCC(O)CC 7a_100000037705_100011218378 [0,2,0,0,0,0|1,0,1]=4 10296 B11R0.40 C=CCOCCOC[C@@H](C)CC 34a_100000037705_100009816398 [0,2,0,0,0,0|1,0,1]=4 10297 B11R0.40 C=CCOCCOC[C@@H](C)CC 7a_100000037705_100009816398 [0,2,0,0,0,0|1,0,1]=4 10298 B11R0.40 C=COCCOCCC(=O)OC 34a_100000033082_100000742370 [0,2,0,0,0,0|0,0,2]=4 10299 B11R0.40 C=COCCOCCC(C)CC 7a_100011215188_100000039644 [0,2,0,0,0,0|1,0,1]=4 10300 B11R0.40 C=COCCOCCC(C)OC 7a_100000764861_100000039644 [0,2,0,0,0,0|0,0,2]=4 10301 B11R0.40 C=C[C@H](N)COCCCOCC 34a_100016989147_100012232248 [0,2,0,0,0,0|1,0,1]=4 10302 B11R0.40 C=C[C@H](N)COCCOCCC 34a_100016989147_100011215938 [0,2,0,0,0,0|1,0,1]=4 10303 B11R0.40 C=C[C@H](N)COCCOCCO 34a_100016989147_100000692535 [0,2,0,0,0,0|1,0,1]=4 10304 B11R0.40 CC#CCCOCCC(=O)OC 34a_100000750427_100000742370 [0,2,0,0,0,0|1,0,1]=4 10305 B11R0.40 CC#CCOCCOC(=O)CC 7a_200000031056_100000748600 [0,2,0,0,0,0|1,0,1]=4 10306 B11R0.40 CC(CN)COCCOCCO 34a_100000744482_100000692535 [0,2,0,0,0,0|2,0,0]=4 10307 B11R0.40 CC/C=C\CCNC[C@@H](C)OC 2230a_100020591295_100015370543 [0,2,0,0,0,0|2,0,0]=4 10308 B11R0.40 CC/C=C\CCOCC(=O)OC 34a_100016288707_100000747449 [0,2,0,0,0,0|1,0,1]=4 10309 B11R0.40 CC/C=C\CCOCC(=O)OC 7a_100016288707_100000747449 [0,2,0,0,0,0|1,0,1]=4 10310 B11R0.40 CC/C=C\CCOCC(C)CC 34a_100016288707_100000748023 [0,2,0,0,0,0|2,0,0]=4 10311 B11R0.40 CC/C=C\CCOCC(C)CC 7a_100016288707_100000748023 [0,2,0,0,0,0|2,0,0]=4 10312 B11R0.40 CC/C=C\CCOCC(C)OC 34a_100000690652_100015370543 [0,2,0,0,0,0|1,0,0]=3 10313 B11R0.40 CC/C=C\CCOCC(O)CC 34a_100016288707_100011218378 [0,2,0,0,0,0|2,0,0]=4 10314 B11R0.40 CC/C=C\CCOCC(O)CC 7a_100016288707_100011218378 [0,2,0,0,0,0|2,0,0]=4 10315 B11R0.40 CC/C=C\CCOC[C@@H](C)CC 34a_100016288707_100009816398 [0,2,0,0,0,0|2,0,0]=4 10316 B11R0.40 CC/C=C\CCOC[C@@H](C)CC 7a_100009816381_100015370543 [0,2,0,0,0,0|2,0,0]=4 10317 B11R0.40 CC/C=C\CCOC[C@@H](C)CC 7a_100016288707_100009816398 [0,2,0,0,0,0|2,0,0]=4 10318 B11R0.40 CC/C=C\COCCC(=O)OC 34a_100016268518_100000742370 [0,2,0,0,0,0|1,0,1]=4 10319 B11R0.40 CC/C=C\COCCC(C)OC 7a_100000764861_100103147603 [0,2,0,0,0,0|1,0,1]=4 10320 B11R0.40 CC=CCOCCOC(=O)CC 7a_200000031056_100000070051 [0,2,0,0,0,0|1,0,1]=4 10321 B11R0.40 CCC#CCCOCC(=O)OC 34a_100000036655_100000747449 [0,2,0,0,0,0|1,0,1]=4 10322 B11R0.40 CCC#CCCOCC(=O)OC 7a_100000036655_100000747449 [0,2,0,0,0,0|1,0,1]=4 10323 B11R0.40 CCC#CCCOCC(C)CC 34a_100000036655_100000748023 [0,2,0,0,0,0|2,0,0]=4 10324 B11R0.40 CCC#CCCOCC(C)CC 7a_100000036655_100000748023 [0,2,0,0,0,0|2,0,0]=4 10325 B11R0.40 CCC#CCCOCC(O)CC 34a_100000036655_100011218378 [0,2,0,0,0,0|2,0,0]=4 10326 B11R0.40 CCC#CCCOCC(O)CC 7a_100000036655_100011218378 [0,2,0,0,0,0|2,0,0]=4 10327 B11R0.40 CCC#CCCOC[C@@H](C)CC 34a_100000036655_100009816398 [0,2,0,0,0,0|2,0,0]=4 10328 B11R0.40 CCC#CCCOC[C@@H](C)CC 7a_100000036655_100009816398 [0,2,0,0,0,0|2,0,0]=4 10329 B11R0.40 CCC#CCOCCC(=O)OC 34a_100000032950_100000742370 [0,2,0,0,0,0|1,0,1]=4 10330 B11R0.40 CCC#CCOCCC(C)OC 7a_100000764861_100009813939 [0,2,0,0,0,0|1,0,1]=4 10331 B11R0.40 CCC(=O)CCCCCCOC 1458a_100000210414_100011998445 [0,2,0,0,0,0|2,0,0]=4 10332 B11R0.40 CCC(=O)CCCOCCOC 1458a_100000210414_100011216529 [0,2,0,0,0,0|1,0,0]=3 10333 B11R0.40 CCC(=O)COCCCCOC 34a_100000725409_100000755781 [0,2,0,0,0,0|2,0,0]=4 10334 B11R0.40 CCC(=O)COCCOCCBr 7a_100000692535_100000747405 [0,2,0,0,0,0|1,0,1]=4 10335 B11R0.40 CCC(=O)COCCOCCCl 7a_100011215305_100000747405 [0,2,0,0,0,0|1,0,1]=4 10336 B11R0.40 CCC(=O)COCCOCCF 7a_200015357709_100000747405 [0,2,0,0,0,0|1,0,1]=4 10337 B11R0.40 CCC(=O)COCCOCCI 7a_100012149058_100000747405 [0,2,0,0,0,0|1,0,1]=4 10338 B11R0.40 CCC(=O)COCCOCCO 1458a_106645077154_100000210202 [0,2,0,0,0,0|1,0,1]=4 10339 B11R0.40 CCC(=O)COCCOCCO 34a_100000725409_100000692535 [0,2,0,0,0,0|1,0,1]=4 10340 B11R0.40 CCC(=O)CSCCCCOC 62a_100000730899_100000747405 [0,2,0,0,0,0|2,0,0]=4 10341 B11R0.40 CCC(=O)CSCCCCOC 62a_100000747405_100000730899 [0,2,0,0,0,0|2,0,0]=4 10342 B11R0.40 CCC(=O)CSCOCCOC 62a_100000231047_100000747405 [0,2,0,0,0,0|1,0,0]=3 10343 B11R0.40 CCC(=O)CSCOCCOC 62a_100000747405_100000231047 [0,2,0,0,0,0|1,0,0]=3 10344 B11R0.40 CCC(=O)NCCCCCOC 11a_100000747528_100000210414 [0,2,0,0,0,0|2,0,0]=4 10345 B11R0.40 CCC(=O)NCCCCCOC 1626a_100000747528_100000210414 [0,2,0,0,0,0|2,0,0]=4 10346 B11R0.40 CCC(=O)NCCCCCOC 240690a_100000747528_100000210414 [0,2,0,0,0,0|2,0,0]=4 10347 B11R0.40 CCC(=O)NCCCCCOC 527a_100000747528_100000210414 [0,2,0,0,0,0|2,0,0]=4 10348 B11R0.40 CCC(=O)NCCNCCOC 34a_100132302217_100011201679 [0,2,0,0,0,0|2,0,0]=4 10349 B11R0.40 CCC(=O)NCCOCCOC 11a_100000745349_100000210414 [0,2,0,0,0,0|1,0,0]=3 10350 B11R0.40 CCC(=O)NCCOCCOC 1626a_100000745349_100000210414 [0,2,0,0,0,0|1,0,0]=3 10351 B11R0.40 CCC(=O)NCCOCCOC 240690a_100000745349_100000210414 [0,2,0,0,0,0|1,0,0]=3 10352 B11R0.40 CCC(=O)NCCOCCOC 34a_200000158885_100011201679 [0,2,0,0,0,0|1,0,0]=3 10353 B11R0.40 CCC(=O)NCCOCCOC 527a_100000745349_100000210414 [0,2,0,0,0,0|1,0,0]=3 10354 B11R0.40 CCC(=O)NCCOCCOC 7a_200000158885_100000233755 [0,2,0,0,0,0|1,0,0]=3 10355 B11R0.40 CCC(=O)NCCOCCSC 34a_200000158885_100000212216 [0,2,0,0,0,0|1,1,0]=4 10356 B11R0.40 CCC(=O)NCCOCCSC 7a_200000158885_100000212216 [0,2,0,0,0,0|1,1,0]=4 10357 B11R0.40 CCC(=O)OCCOCCC#N 7a_200000031056_100000184422 [0,2,0,0,0,0|2,0,0]=4 10358 B11R0.40 CCC(=O)OCCOCCCF 7a_200000031056_100011934791 [0,2,0,0,0,0|2,0,0]=4 10359 B11R0.40 CCC(=O)OCCOCCCO 7a_200000031056_100011215043 [0,2,0,0,0,0|2,0,0]=4 10360 B11R0.40 CCC(=O)OCCOCCOC 7a_200000031056_100000233755 [0,2,0,0,0,0|0,0,0]=2 10361 B11R0.40 CCC(=O)OCCOCCSC 7a_200000031056_100000212216 [0,2,0,0,0,0|0,1,0]=3 10362 B11R0.40 CCC(C)CCCCCOCF 7a_200000035636_100015361967 [0,2,0,0,0,0|2,0,0]=4 10363 B11R0.40 CCC(C)CCCOCCOC 7a_100011216074_100000233755 [0,2,0,0,0,0|1,0,0]=3 10364 B11R0.40 CCC(C)CCCOCCSC 7a_100011216074_100000212216 [0,2,0,0,0,0|1,1,0]=4 10365 B11R0.40 CCC(C)CCNCCCOC 2230a_100020591266_100000740836 [0,2,0,0,0,0|2,0,0]=4 10366 B11R0.40 CCC(C)CCOCCCCF 7a_100011215188_100000729493 [0,2,0,0,0,0|2,0,0]=4 10367 B11R0.40 CCC(C)CCOCCCCO 7a_100011215188_100000210776 [0,2,0,0,0,0|2,0,0]=4 10368 B11R0.40 CCC(C)CCOCCCOC 7a_100011215188_100000740836 [0,2,0,0,0,0|1,0,0]=3 10369 B11R0.40 CCC(C)CNCCCCOC 2230a_100020588543_100000730899 [0,2,0,0,0,0|2,0,0]=4 10370 B11R0.40 CCC(C)CNCCOCCO 2230a_100000211614_100000748023 [0,2,0,0,0,0|2,0,0]=4 10371 B11R0.40 CCC(C)CNCCOCCO 2230a_100020588543_100011215305 [0,2,0,0,0,0|2,0,0]=4 10372 B11R0.40 CCC(C)CNCCOCCO 270004a_100000211614_100000243153 [0,2,0,0,0,0|2,0,0]=4 10373 B11R0.40 CCC(C)CNCCOCCO 34a_100000211614_100000748023 [0,2,0,0,0,0|2,0,0]=4 10374 B11R0.40 CCC(C)CNCOCCOC 2230a_100020588543_100000231047 [0,2,0,0,0,0|1,0,0]=3 10375 B11R0.40 CCC(C)COCCCCCBr 34a_100000746331_100000748023 [0,2,0,0,0,0|2,0,0]=4 10376 B11R0.40 CCC(C)COCCCCCBr 7a_100000746331_100000748023 [0,2,0,0,0,0|2,0,0]=4 10377 B11R0.40 CCC(C)COCCCCCCl 34a_100000746330_100000748023 [0,2,0,0,0,0|2,0,0]=4 10378 B11R0.40 CCC(C)COCCCCCCl 7a_100000746330_100000748023 [0,2,0,0,0,0|2,0,0]=4 10379 B11R0.40 CCC(C)COCCCCCI 34a_200012148887_100000748023 [0,2,0,0,0,0|2,0,0]=4 10380 B11R0.40 CCC(C)COCCCCCI 7a_200012148887_100000748023 [0,2,0,0,0,0|2,0,0]=4 10381 B11R0.40 CCC(C)COCCCCCN 34a_100000762737_100000748023 [0,2,0,0,0,0|2,0,0]=4 10382 B11R0.40 CCC(C)COCCCCOC 34a_100000740925_100000748023 [0,2,0,0,0,0|2,0,0]=4 10383 B11R0.40 CCC(C)COCCCCSC 34a_100011217163_100000748023 [0,2,0,0,0,0|2,0,0]=4 10384 B11R0.40 CCC(C)COCCCCSC 7a_100011217163_100000748023 [0,2,0,0,0,0|2,0,0]=4 10385 B11R0.40 CCC(C)COCCOCCBr 34a_100000692535_100000748023 [0,2,0,0,0,0|1,0,0]=3 10386 B11R0.40 CCC(C)COCCOCCBr 7a_100000692535_100000748023 [0,2,0,0,0,0|1,0,0]=3 10387 B11R0.40 CCC(C)COCCOCCCl 34a_100011215305_100000748023 [0,2,0,0,0,0|1,0,0]=3 10388 B11R0.40 CCC(C)COCCOCCCl 7a_100011215305_100000748023 [0,2,0,0,0,0|1,0,0]=3 10389 B11R0.40 CCC(C)COCCOCCF 34a_200015357709_100000748023 [0,2,0,0,0,0|1,0,0]=3 10390 B11R0.40 CCC(C)COCCOCCF 7a_200015357709_100000748023 [0,2,0,0,0,0|1,0,0]=3 10391 B11R0.40 CCC(C)COCCOCCI 34a_100012149058_100000748023 [0,2,0,0,0,0|1,0,0]=3 10392 B11R0.40 CCC(C)COCCOCCI 7a_100012149058_100000748023 [0,2,0,0,0,0|1,0,0]=3 10393 B11R0.40 CCC(C)COCCOCCN 34a_100000211614_100000748023 [0,2,0,0,0,0|1,0,0]=3 10394 B11R0.40 CCC(C)CSCCCCOC 62a_100000730899_100000748023 [0,2,0,0,0,0|2,0,0]=4 10395 B11R0.40 CCC(C)CSCCCCOC 62a_100000748023_100000730899 [0,2,0,0,0,0|2,0,0]=4 10396 B11R0.40 CCC(C)CSCCOCCO 62a_100000748023_100011215305 [0,2,0,0,0,0|1,1,0]=4 10397 B11R0.40 CCC(C)CSCCOCCO 62a_100011215305_100000748023 [0,2,0,0,0,0|1,1,0]=4 10398 B11R0.40 CCC(C)CSCOCCOC 62a_100000231047_100000748023 [0,2,0,0,0,0|1,0,0]=3 10399 B11R0.40 CCC(C)CSCOCCOC 62a_100000748023_100000231047 [0,2,0,0,0,0|1,0,0]=3 10400 B11R0.40 CCC(C)NCCCCCOC 2230a_100000747528_100000758301 [0,2,0,0,0,0|2,0,0]=4 10401 B11R0.40 CCC(C)NCCCCCOC 34a_100000747528_100011215416 [0,2,0,0,0,0|2,0,0]=4 10402 B11R0.40 CCC(C)NCCOCCOC 2230a_100000209981_100000695917 [0,2,0,0,0,0|1,0,0]=3 10403 B11R0.40 CCC(C)NCCOCCOC 2230a_100000745349_100000758301 [0,2,0,0,0,0|1,0,0]=3 10404 B11R0.40 CCC(C)NCCOCCOC 34a_100000745349_100011215416 [0,2,0,0,0,0|1,0,0]=3 10405 B11R0.40 CCC(C)OCCCCCNC 34a_100000722520_100011215416 [0,2,0,0,0,0|2,0,0]=4 10406 B11R0.40 CCC(C)OCCOCCNC 34a_100000228057_100011215416 [0,2,0,0,0,0|1,0,0]=3 10407 B11R0.40 CCC(C)OCCOCCOC 34a_100011215163_100011215416 [0,2,0,0,0,0|0,0,0]=2 10408 B11R0.40 CCC(C)OCCOCCOC 7a_100000210228_100000695917 [0,2,0,0,0,0|0,0,0]=2 10409 B11R0.40 CCC(C)OCCOCCOC 7a_100011215163_100000758301 [0,2,0,0,0,0|0,0,0]=2 10410 B11R0.40 CCC(C)SCCOCCOC 62a_100000695917_100000758301 [0,2,0,0,0,0|0,1,0]=3 10411 B11R0.40 CCC(C)SCCOCCOC 62a_100000758301_100000695917 [0,2,0,0,0,0|0,1,0]=3 10412 B11R0.40 CCC(O)CNCCCCOC 2230a_100011218483_100000730899 [0,2,0,0,0,0|2,0,0]=4 10413 B11R0.40 CCC(O)CNCCOCCO 2230a_100000211614_100011218378 [0,2,0,0,0,0|2,0,0]=4 10414 B11R0.40 CCC(O)CNCCOCCO 2230a_100011218483_100011215305 [0,2,0,0,0,0|2,0,0]=4 10415 B11R0.40 CCC(O)CNCCOCCO 34a_100000211614_100011218378 [0,2,0,0,0,0|2,0,0]=4 10416 B11R0.40 CCC(O)CNCOCCOC 2230a_100011218483_100000231047 [0,2,0,0,0,0|1,0,0]=3 10417 B11R0.40 CCC(O)COCCCCCBr 34a_100000746331_100011218378 [0,2,0,0,0,0|2,0,0]=4 10418 B11R0.40 CCC(O)COCCCCCBr 7a_100000746331_100011218378 [0,2,0,0,0,0|2,0,0]=4 10419 B11R0.40 CCC(O)COCCCCCCl 34a_100000746330_100011218378 [0,2,0,0,0,0|2,0,0]=4 10420 B11R0.40 CCC(O)COCCCCCCl 7a_100000746330_100011218378 [0,2,0,0,0,0|2,0,0]=4 10421 B11R0.40 CCC(O)COCCCCCI 34a_200012148887_100011218378 [0,2,0,0,0,0|2,0,0]=4 10422 B11R0.40 CCC(O)COCCCCCI 7a_200012148887_100011218378 [0,2,0,0,0,0|2,0,0]=4 10423 B11R0.40 CCC(O)COCCCCCN 34a_100000762737_100011218378 [0,2,0,0,0,0|2,0,0]=4 10424 B11R0.40 CCC(O)COCCCCOC 34a_100000740925_100011218378 [0,2,0,0,0,0|2,0,0]=4 10425 B11R0.40 CCC(O)COCCCCSC 34a_100011217163_100011218378 [0,2,0,0,0,0|2,0,0]=4 10426 B11R0.40 CCC(O)COCCCCSC 7a_100011217163_100011218378 [0,2,0,0,0,0|2,0,0]=4 10427 B11R0.40 CCC(O)COCCOCCBr 34a_100000692535_100011218378 [0,2,0,0,0,0|1,0,0]=3 10428 B11R0.40 CCC(O)COCCOCCBr 7a_100000692535_100011218378 [0,2,0,0,0,0|1,0,0]=3 10429 B11R0.40 CCC(O)COCCOCCCl 34a_100011215305_100011218378 [0,2,0,0,0,0|1,0,0]=3 10430 B11R0.40 CCC(O)COCCOCCCl 7a_100011215305_100011218378 [0,2,0,0,0,0|1,0,0]=3 10431 B11R0.40 CCC(O)COCCOCCF 34a_200015357709_100011218378 [0,2,0,0,0,0|1,0,0]=3 10432 B11R0.40 CCC(O)COCCOCCF 7a_200015357709_100011218378 [0,2,0,0,0,0|1,0,0]=3 10433 B11R0.40 CCC(O)COCCOCCI 34a_100012149058_100011218378 [0,2,0,0,0,0|1,0,0]=3 10434 B11R0.40 CCC(O)COCCOCCI 7a_100012149058_100011218378 [0,2,0,0,0,0|1,0,0]=3 10435 B11R0.40 CCC(O)COCCOCCN 34a_100000211614_100011218378 [0,2,0,0,0,0|1,0,0]=3 10436 B11R0.40 CCC(O)CSCCCCOC 62a_100000730899_100011218378 [0,2,0,0,0,0|2,0,0]=4 10437 B11R0.40 CCC(O)CSCCCCOC 62a_100011218378_100000730899 [0,2,0,0,0,0|2,0,0]=4 10438 B11R0.40 CCC(O)CSCCOCCO 62a_100011215305_100011218378 [0,2,0,0,0,0|1,1,0]=4 10439 B11R0.40 CCC(O)CSCCOCCO 62a_100011218378_100011215305 [0,2,0,0,0,0|1,1,0]=4 10440 B11R0.40 CCC(O)CSCOCCOC 62a_100000231047_100011218378 [0,2,0,0,0,0|1,0,0]=3 10441 B11R0.40 CCC(O)CSCOCCOC 62a_100011218378_100000231047 [0,2,0,0,0,0|1,0,0]=3 10442 B11R0.40 CCCCCCCCC(C)OC 34a_100000210740_200000210301 [0,2,0,0,0,0|2,0,0]=4 10443 B11R0.40 CCCCCCCCC(C)OC 7a_100000210740_200000210301 [0,2,0,0,0,0|2,0,0]=4 10444 B11R0.40 CCCCCCCCC(C)O[13CH3] 34a_100000210740_200025704644 [0,2,0,0,0,0|2,0,0]=4 10445 B11R0.40 CCCCCCCCC(C)O[13CH3] 7a_100000210740_200025704644 [0,2,0,0,0,0|2,0,0]=4 10446 B11R0.40 CCCCCCCOC(C)C#N 34a_100011218135_100000210614 [0,2,0,0,0,0|2,0,0]=4 10447 B11R0.40 CCCCCCCOC(C)C#N 7a_100000210272_100000703298 [0,2,0,0,0,0|2,0,0]=4 10448 B11R0.40 CCCCCCCOC(C)CC 34a_100000210272_100011215416 [0,2,0,0,0,0|2,0,0]=4 10449 B11R0.40 CCCCCCCOC(C)CC 7a_100000210228_100000210614 [0,2,0,0,0,0|2,0,0]=4 10450 B11R0.40 CCCCCCCOC(C)CC 7a_100000210272_100000758301 [0,2,0,0,0,0|2,0,0]=4 10451 B11R0.40 CCCCCCCOC(C)CF 34a_100016041109_100000210614 [0,2,0,0,0,0|2,0,0]=4 10452 B11R0.40 CCCCCCCOC(C)CF 7a_100016041109_100000210614 [0,2,0,0,0,0|2,0,0]=4 10453 B11R0.40 CCCCCCCOC(C)CN 34a_100000210904_100000210614 [0,2,0,0,0,0|2,0,0]=4 10454 B11R0.40 CCCCCCCOC(C)CO 34a_100000210272_100012180447 [0,2,0,0,0,0|2,0,0]=4 10455 B11R0.40 CCCCCCCOC(C)CO 7a_100000210272_100012180447 [0,2,0,0,0,0|2,0,0]=4 10456 B11R0.40 CCCCCCCSC(C)OC 62a_100000210614_100009879195 [0,2,0,0,0,0|2,0,0]=4 10457 B11R0.40 CCCCCCCSC(C)OC 62a_100009879195_100000210316 [0,2,0,0,0,0|2,0,0]=4 10458 B11R0.40 CCCCCCNC[C@@H](C)OC 2230a_100020591295_100000210314 [0,2,0,0,0,0|2,0,0]=4 10459 B11R0.40 CCCCCCOCC(=O)OC 34a_100000210259_100000747449 [0,2,0,0,0,0|1,0,1]=4 10460 B11R0.40 CCCCCCOCC(=O)OC 7a_100000210259_100000747449 [0,2,0,0,0,0|1,0,1]=4 10461 B11R0.40 CCCCCCOCC(C)CC 34a_100000210259_100000748023 [0,2,0,0,0,0|2,0,0]=4 10462 B11R0.40 CCCCCCOCC(C)CC 7a_100000210259_100000748023 [0,2,0,0,0,0|2,0,0]=4 10463 B11R0.40 CCCCCCOCC(C)OC 34a_100000690652_100000210314 [0,2,0,0,0,0|1,0,0]=3 10464 B11R0.40 CCCCCCOCC(O)CC 34a_100000210259_100011218378 [0,2,0,0,0,0|2,0,0]=4 10465 B11R0.40 CCCCCCOCC(O)CC 7a_100000210259_100011218378 [0,2,0,0,0,0|2,0,0]=4 10466 B11R0.40 CCCCCCOC[C@@H](C)CC 34a_100000210259_100009816398 [0,2,0,0,0,0|2,0,0]=4 10467 B11R0.40 CCCCCCOC[C@@H](C)CC 7a_100000210259_100009816398 [0,2,0,0,0,0|2,0,0]=4 10468 B11R0.40 CCCCCCOC[C@@H](C)CC 7a_100009816381_100000210314 [0,2,0,0,0,0|2,0,0]=4 10469 B11R0.40 CCCCCNCCC(=O)OC 2230a_100000209983_100000204255 [0,2,0,0,0,0|2,0,0]=4 10470 B11R0.40 CCCCCOCCC(=O)NC 34a_100000210253_100012179268 [0,2,0,0,0,0|2,0,0]=4 10471 B11R0.40 CCCCCOCCC(=O)NC 34a_100000754576_100000718602 [0,2,0,0,0,0|2,0,0]=4 10472 B11R0.40 CCCCCOCCC(=O)NC 7a_100000210253_100000737683 [0,2,0,0,0,0|2,0,0]=4 10473 B11R0.40 CCCCCOCCC(=O)OC 34a_100000210253_100000742370 [0,2,0,0,0,0|1,0,0]=3 10474 B11R0.40 CCCCCOCCC(=O)OC 7a_100000210253_100000204255 [0,2,0,0,0,0|1,0,0]=3 10475 B11R0.40 CCCCCOCCC(C)CC 7a_100011215188_100000210326 [0,2,0,0,0,0|2,0,0]=4 10476 B11R0.40 CCCCCOCCC(C)OC 7a_100000764861_100000210326 [0,2,0,0,0,0|1,0,0]=3 10477 B11R0.40 CCCCCSCCC(=O)OC 62a_100000204255_100000210326 [0,2,0,0,0,0|1,1,0]=4 10478 B11R0.40 CCCCCSCCC(=O)OC 62a_100000210326_100000204255 [0,2,0,0,0,0|1,1,0]=4 10479 B11R0.40 CCCCOCCCC(C)CC 7a_100011216074_100000210211 [0,2,0,0,0,0|2,0,0]=4 10480 B11R0.40 CCCCOCCCN(C)CC 7a_100000210227_100015186262 [0,2,0,0,0,0|2,0,0]=4 10481 B11R0.40 CCCCOCCC[C@@H](C)CN 34a_100160569302_100000210210 [0,2,0,0,0,0|2,0,0]=4 10482 B11R0.40 CCCCOCCNC(=O)CC 34a_200000158885_100000210210 [0,2,0,0,0,0|2,0,0]=4 10483 B11R0.40 CCCCOCCNC(=O)CC 7a_200000158885_100000210211 [0,2,0,0,0,0|2,0,0]=4 10484 B11R0.40 CCCCOCCNC(C)C#N 2230a_100000737613_100000743108 [0,2,0,0,0,0|2,0,0]=4 10485 B11R0.40 CCCCOCCNC(C)CC 2230a_100000209981_100000743108 [0,2,0,0,0,0|2,0,0]=4 10486 B11R0.40 CCCCOCCN[C@H](C)CO 2230a_100000737577_100000743108 [0,2,0,0,0,0|2,0,0]=4 10487 B11R0.40 CCCCOCCOC(=O)CC 7a_200000031056_100000210211 [0,2,0,0,0,0|1,0,0]=3 10488 B11R0.40 CCCCOCCOC(=O)NC 34a_100000210227_200011997002 [0,2,0,0,0,0|1,0,1]=4 10489 B11R0.40 CCCCOCCOC(=O)NC 7a_100000210227_200011997002 [0,2,0,0,0,0|1,0,1]=4 10490 B11R0.40 CCCCOCCOC(=O)OC 34a_100010262106_100000210210 [0,2,0,0,0,0|1,0,1]=4 10491 B11R0.40 CCCCOCCOC(C)C#N 34a_100011218135_100000743108 [0,2,0,0,0,0|1,0,0]=3 10492 B11R0.40 CCCCOCCOC(C)C#N 7a_100000210238_100000703298 [0,2,0,0,0,0|1,0,0]=3 10493 B11R0.40 CCCCOCCOC(C)CC 34a_100000210238_100011215416 [0,2,0,0,0,0|1,0,0]=3 10494 B11R0.40 CCCCOCCOC(C)CC 7a_100000210228_100000743108 [0,2,0,0,0,0|1,0,0]=3 10495 B11R0.40 CCCCOCCOC(C)CC 7a_100000210238_100000758301 [0,2,0,0,0,0|1,0,0]=3 10496 B11R0.40 CCCCOCCOC(C)CF 34a_100016041109_100000743108 [0,2,0,0,0,0|1,0,0]=3 10497 B11R0.40 CCCCOCCOC(C)CF 7a_100016041109_100000743108 [0,2,0,0,0,0|1,0,0]=3 10498 B11R0.40 CCCCOCCOC(C)CN 34a_100000210904_100000743108 [0,2,0,0,0,0|1,0,0]=3 10499 B11R0.40 CCCCOCCOC(C)CO 34a_100000210238_100012180447 [0,2,0,0,0,0|1,0,0]=3 10500 B11R0.40 CCCCOCCOC(C)CO 7a_100000210238_100012180447 [0,2,0,0,0,0|1,0,0]=3 10501 B11R0.40 CCCCOCCSC(C)C#N 62a_100000703298_100000743108 [0,2,0,0,0,0|1,1,0]=4 10502 B11R0.40 CCCCOCCSC(C)C#N 62a_100000743108_100000703298 [0,2,0,0,0,0|1,1,0]=4 10503 B11R0.40 CCCCOCCSC(C)CC 62a_100000743108_100000758301 [0,2,0,0,0,0|1,1,0]=4 10504 B11R0.40 CCCCOCCSC(C)CC 62a_100000758301_100000743108 [0,2,0,0,0,0|1,1,0]=4 10505 B11R0.40 CCCCOCCSC(C)CO 62a_100012180447_100000743108 [0,2,0,0,0,0|1,1,0]=4 10506 B11R0.40 CCCCOCCSC(C)OC 62a_100000743108_100009879195 [0,2,0,0,0,0|1,1,0]=4 10507 B11R0.40 CCCCOCCSC(C)OC 62a_100009879195_100000743108 [0,2,0,0,0,0|1,1,0]=4 10508 B11R0.40 CCCCOCCS[C@H](C)CO 62a_100000743108_100016084084 [0,2,0,0,0,0|1,1,0]=4 10509 B11R0.40 CCCCOCCS[C@H](C)CO 62a_100016084084_100000743108 [0,2,0,0,0,0|1,1,0]=4 10510 B11R0.40 CCCCOCNCC(C)CC 2230a_100020588543_100011995733 [0,2,0,0,0,0|2,0,0]=4 10511 B11R0.40 CCCCOCNCC(O)CC 2230a_100011218483_100011995733 [0,2,0,0,0,0|2,0,0]=4 10512 B11R0.40 CCCCOCNC[C@@H](C)OC 2230a_100020591295_100011995733 [0,2,0,0,0,0|2,0,0]=4 10513 B11R0.40 CCCCOCOCC(=O)CC 34a_100000725409_100011995733 [0,2,0,0,0,0|2,0,0]=4 10514 B11R0.40 CCCCOCOCC(C)OC 34a_100000690652_100011995733 [0,2,0,0,0,0|1,0,0]=3 10515 B11R0.40 CCCCOCSCC(=O)CC 62a_100000747405_100011995733 [0,2,0,0,0,0|2,0,0]=4 10516 B11R0.40 CCCCOCSCC(=O)CC 62a_100011995733_100000747405 [0,2,0,0,0,0|2,0,0]=4 10517 B11R0.40 CCCCOCSCC(C)CC 62a_100000748023_100011995733 [0,2,0,0,0,0|2,0,0]=4 10518 B11R0.40 CCCCOCSCC(C)CC 62a_100011995733_100000748023 [0,2,0,0,0,0|2,0,0]=4 10519 B11R0.40 CCCCOCSCC(O)CC 62a_100011218378_100011995733 [0,2,0,0,0,0|2,0,0]=4 10520 B11R0.40 CCCCOCSCC(O)CC 62a_100011995733_100011218378 [0,2,0,0,0,0|2,0,0]=4 10521 B11R0.40 CCCCOCSC[C@@H](C)CC 62a_100009816398_100011995733 [0,2,0,0,0,0|2,0,0]=4 10522 B11R0.40 CCCCOCSC[C@@H](C)CC 62a_100011995733_100009816398 [0,2,0,0,0,0|2,0,0]=4 10523 B11R0.40 CCCCSCCOC(C)C#N 7a_200000230436_100000703298 [0,2,0,0,0,0|1,1,0]=4 10524 B11R0.40 CCCCSCCOC(C)CC 34a_200000230436_100011215416 [0,2,0,0,0,0|1,1,0]=4 10525 B11R0.40 CCCCSCCOC(C)CC 7a_200000230436_100000758301 [0,2,0,0,0,0|1,1,0]=4 10526 B11R0.40 CCCCSCCOC(C)CO 34a_200000230436_100012180447 [0,2,0,0,0,0|1,1,0]=4 10527 B11R0.40 CCCCSCCOC(C)CO 7a_200000230436_100012180447 [0,2,0,0,0,0|1,1,0]=4 10528 B11R0.40 CCCOCCCCC(=O)OC 34a_100000059025_100000210303 [0,2,0,0,0,0|1,0,1]=4 10529 B11R0.40 CCCOCCCCC(=O)OC 34a_100000210258_100000204269 [0,2,0,0,0,0|1,0,1]=4 10530 B11R0.40 CCCOCCCCC(=O)OC 7a_100000059025_100000210303 [0,2,0,0,0,0|1,0,1]=4 10531 B11R0.40 CCCOCCNCC(=O)OC 2230a_100161115042_100000747449 [0,2,0,0,0,0|1,0,1]=4 10532 B11R0.40 CCCOCCNCC(=O)OC 34a_100161115042_100000747449 [0,2,0,0,0,0|1,0,1]=4 10533 B11R0.40 CCCOCCNCC(C)CC 2230a_100020588543_100011215938 [0,2,0,0,0,0|2,0,0]=4 10534 B11R0.40 CCCOCCNCC(C)CC 2230a_100161115042_100000748023 [0,2,0,0,0,0|2,0,0]=4 10535 B11R0.40 CCCOCCNCC(C)CC 270004a_100161115042_100000243153 [0,2,0,0,0,0|2,0,0]=4 10536 B11R0.40 CCCOCCNCC(C)CC 34a_100161115042_100000748023 [0,2,0,0,0,0|2,0,0]=4 10537 B11R0.40 CCCOCCNCC(O)CC 2230a_100011218483_100011215938 [0,2,0,0,0,0|2,0,0]=4 10538 B11R0.40 CCCOCCNCC(O)CC 2230a_100161115042_100011218378 [0,2,0,0,0,0|2,0,0]=4 10539 B11R0.40 CCCOCCNCC(O)CC 34a_100161115042_100011218378 [0,2,0,0,0,0|2,0,0]=4 10540 B11R0.40 CCCOCCNC[C@@H](C)CC 2230a_100161115042_100009816398 [0,2,0,0,0,0|2,0,0]=4 10541 B11R0.40 CCCOCCNC[C@@H](C)CC 34a_100161115042_100009816398 [0,2,0,0,0,0|2,0,0]=4 10542 B11R0.40 CCCOCCNC[C@@H](C)OC 2230a_100020591295_100011215938 [0,2,0,0,0,0|1,0,0]=3 10543 B11R0.40 CCCOCCOCC(=O)CC 34a_100000725409_100011215938 [0,2,0,0,0,0|1,0,1]=4 10544 B11R0.40 CCCOCCOCC(=O)CC 7a_100000752267_100000747405 [0,2,0,0,0,0|1,0,1]=4 10545 B11R0.40 CCCOCCOCC(=O)NC 34a_100000750040_100011215938 [0,2,0,0,0,0|1,0,1]=4 10546 B11R0.40 CCCOCCOCC(=O)NC 34a_100000752267_100000183359 [0,2,0,0,0,0|1,0,1]=4 10547 B11R0.40 CCCOCCOCC(=O)NC 7a_100000752267_100000183359 [0,2,0,0,0,0|1,0,1]=4 10548 B11R0.40 CCCOCCOCC(=O)OC 34a_100000210258_100000090808 [0,2,0,0,0,0|0,0,1]=3 10549 B11R0.40 CCCOCCOCC(=O)OC 34a_100000752267_100000747449 [0,2,0,0,0,0|0,0,1]=3 10550 B11R0.40 CCCOCCOCC(=O)OC 7a_100000752267_100000747449 [0,2,0,0,0,0|0,0,1]=3 10551 B11R0.40 CCCOCCOCC(C)CC 34a_100000752267_100000748023 [0,2,0,0,0,0|1,0,0]=3 10552 B11R0.40 CCCOCCOCC(C)CC 7a_100000752267_100000748023 [0,2,0,0,0,0|1,0,0]=3 10553 B11R0.40 CCCOCCOCC(C)CN 34a_100000744482_100011215938 [0,2,0,0,0,0|2,0,0]=4 10554 B11R0.40 CCCOCCOCC(C)OC 34a_100000690652_100011215938 [0,2,0,0,0,0|0,0,0]=2 10555 B11R0.40 CCCOCCOCC(Cl)CCl 34a_100000033668_100011215938 [0,2,0,0,0,0|2,0,0]=4 10556 B11R0.40 CCCOCCOCC(O)CC 34a_100000752267_100011218378 [0,2,0,0,0,0|1,0,0]=3 10557 B11R0.40 CCCOCCOCC(O)CC 7a_100000752267_100011218378 [0,2,0,0,0,0|1,0,0]=3 10558 B11R0.40 CCCOCCOCC(O)CO 34a_100000752267_100011219619 [0,2,0,0,0,0|2,0,0]=4 10559 B11R0.40 CCCOCCOCC(O)CO 7a_100000752267_100011219619 [0,2,0,0,0,0|2,0,0]=4 10560 B11R0.40 CCCOCCOC[C@@H](C)CC 34a_100000752267_100009816398 [0,2,0,0,0,0|1,0,0]=3 10561 B11R0.40 CCCOCCOC[C@@H](C)CC 7a_100000752267_100009816398 [0,2,0,0,0,0|1,0,0]=3 10562 B11R0.40 CCCOCCOC[C@@H](C)CC 7a_100009816381_100011215938 [0,2,0,0,0,0|1,0,0]=3 10563 B11R0.40 CCCOCCOC[C@@H](C)CO 34a_100000752267_100000059175 [0,2,0,0,0,0|2,0,0]=4 10564 B11R0.40 CCCOCCOC[C@@H](C)CO 7a_100000752267_100000059175 [0,2,0,0,0,0|2,0,0]=4 10565 B11R0.40 CCCOCCOC[C@@H](O)CF 34a_100000752267_100015614560 [0,2,0,0,0,0|2,0,0]=4 10566 B11R0.40 CCCOCCOC[C@@H](O)CF 7a_100000752267_100015614560 [0,2,0,0,0,0|2,0,0]=4 10567 B11R0.40 CCCOCCOC[C@@H](O)CO 34a_100000752267_100009815848 [0,2,0,0,0,0|2,0,0]=4 10568 B11R0.40 CCCOCCOC[C@@H](O)CO 7a_100000752267_100009815848 [0,2,0,0,0,0|2,0,0]=4 10569 B11R0.40 CCCOCCOC[C@H](F)CN 34a_100015665980_100011215938 [0,2,0,0,0,0|2,0,0]=4 10570 B11R0.40 CCCOCCSCC(=O)OC 62a_100000747449_100011215938 [0,2,0,0,0,0|0,1,1]=4 10571 B11R0.40 CCCOCCSCC(=O)OC 62a_100011215938_100000747449 [0,2,0,0,0,0|0,1,1]=4 10572 B11R0.40 CCCOCCSCC(C)CC 62a_100000748023_100011215938 [0,2,0,0,0,0|1,1,0]=4 10573 B11R0.40 CCCOCCSCC(C)CC 62a_100011215938_100000748023 [0,2,0,0,0,0|1,1,0]=4 10574 B11R0.40 CCCOCCSCC(O)CC 62a_100011215938_100011218378 [0,2,0,0,0,0|1,1,0]=4 10575 B11R0.40 CCCOCCSCC(O)CC 62a_100011218378_100011215938 [0,2,0,0,0,0|1,1,0]=4 10576 B11R0.40 CCCOCCSC[C@@H](C)CC 62a_100009816398_100011215938 [0,2,0,0,0,0|1,1,0]=4 10577 B11R0.40 CCCOCCSC[C@@H](C)CC 62a_100011215938_100009816398 [0,2,0,0,0,0|1,1,0]=4 10578 B11R0.40 CCCSCCOCC(=O)OC 34a_200000230433_100000747449 [0,2,0,0,0,0|0,1,1]=4 10579 B11R0.40 CCCSCCOCC(=O)OC 62a_100000090808_100000210303 [0,2,0,0,0,0|0,1,1]=4 10580 B11R0.40 CCCSCCOCC(=O)OC 62a_100000210303_100000090808 [0,2,0,0,0,0|0,1,1]=4 10581 B11R0.40 CCCSCCOCC(=O)OC 7a_200000230433_100000747449 [0,2,0,0,0,0|0,1,1]=4 10582 B11R0.40 CCCSCCOCC(C)CC 34a_200000230433_100000748023 [0,2,0,0,0,0|1,1,0]=4 10583 B11R0.40 CCCSCCOCC(C)CC 7a_200000230433_100000748023 [0,2,0,0,0,0|1,1,0]=4 10584 B11R0.40 CCCSCCOCC(O)CC 34a_200000230433_100011218378 [0,2,0,0,0,0|1,1,0]=4 10585 B11R0.40 CCCSCCOCC(O)CC 7a_200000230433_100011218378 [0,2,0,0,0,0|1,1,0]=4 10586 B11R0.40 CCCSCCOC[C@@H](C)CC 34a_200000230433_100009816398 [0,2,0,0,0,0|1,1,0]=4 10587 B11R0.40 CCCSCCOC[C@@H](C)CC 7a_200000230433_100009816398 [0,2,0,0,0,0|1,1,0]=4 10588 B11R0.40 CCN(C)CCCCCCOC 2230a_100000225621_100011998445 [0,2,0,0,0,0|2,0,0]=4 10589 B11R0.40 CCN(C)CCCCCCOC 269982a_100000225621_100011998445 [0,2,0,0,0,0|2,0,0]=4 10590 B11R0.40 CCN(C)CCCNCCOC 2230a_100000209980_100015186262 [0,2,0,0,0,0|2,0,0]=4 10591 B11R0.40 CCN(C)CCCOCCOC 2230a_100000225621_100011216529 [0,2,0,0,0,0|1,0,0]=3 10592 B11R0.40 CCN(C)CCCOCCOC 269982a_100000225621_100011216529 [0,2,0,0,0,0|1,0,0]=3 10593 B11R0.40 CCN(C)CCCOCCSC 7a_100000230434_100015186262 [0,2,0,0,0,0|1,1,0]=4 10594 B11R0.40 CCN(C)CCCSCCOC 62a_100000233755_100015186262 [0,2,0,0,0,0|1,1,0]=4 10595 B11R0.40 CCNCCCCCC(=O)OC 2230a_100015525214_100009816466 [0,2,0,0,0,0|2,0,0]=4 10596 B11R0.40 CCOCCCCCC(=O)OC 34a_100000074720_100000210202 [0,2,0,0,0,0|1,0,0]=3 10597 B11R0.40 CCOCCCCCC(=O)OC 34a_100121572206_100009816466 [0,2,0,0,0,0|1,0,0]=3 10598 B11R0.40 CCOCCCCCC(=O)OC 7a_100000074720_100000210202 [0,2,0,0,0,0|1,0,0]=3 10599 B11R0.40 CCOCCCCCC(C)CC 7a_200000035636_100000210202 [0,2,0,0,0,0|2,0,0]=4 10600 B11R0.40 CCOCCCNCC(=O)OC 2230a_100000210961_100000747449 [0,2,0,0,0,0|1,0,1]=4 10601 B11R0.40 CCOCCCNCC(=O)OC 34a_100000210961_100000747449 [0,2,0,0,0,0|1,0,1]=4 10602 B11R0.40 CCOCCCNCC(C)CC 2230a_100000210961_100000748023 [0,2,0,0,0,0|2,0,0]=4 10603 B11R0.40 CCOCCCNCC(C)CC 2230a_100020588543_100012232248 [0,2,0,0,0,0|2,0,0]=4 10604 B11R0.40 CCOCCCNCC(C)CC 270004a_100000210961_100000243153 [0,2,0,0,0,0|2,0,0]=4 10605 B11R0.40 CCOCCCNCC(C)CC 34a_100000210961_100000748023 [0,2,0,0,0,0|2,0,0]=4 10606 B11R0.40 CCOCCCNCC(O)CC 2230a_100000210961_100011218378 [0,2,0,0,0,0|2,0,0]=4 10607 B11R0.40 CCOCCCNCC(O)CC 2230a_100011218483_100012232248 [0,2,0,0,0,0|2,0,0]=4 10608 B11R0.40 CCOCCCNCC(O)CC 34a_100000210961_100011218378 [0,2,0,0,0,0|2,0,0]=4 10609 B11R0.40 CCOCCCNC[C@@H](C)CC 2230a_100000210961_100009816398 [0,2,0,0,0,0|2,0,0]=4 10610 B11R0.40 CCOCCCNC[C@@H](C)CC 34a_100000210961_100009816398 [0,2,0,0,0,0|2,0,0]=4 10611 B11R0.40 CCOCCCNC[C@@H](C)OC 2230a_100020591295_100012232248 [0,2,0,0,0,0|1,0,0]=3 10612 B11R0.40 CCOCCCOCC(=O)CC 34a_100000725409_100012232248 [0,2,0,0,0,0|1,0,1]=4 10613 B11R0.40 CCOCCCOCC(=O)CC 7a_100000757476_100000747405 [0,2,0,0,0,0|1,0,1]=4 10614 B11R0.40 CCOCCCOCC(=O)NC 34a_100000750040_100012232248 [0,2,0,0,0,0|1,0,1]=4 10615 B11R0.40 CCOCCCOCC(=O)NC 34a_100000757476_100000183359 [0,2,0,0,0,0|1,0,1]=4 10616 B11R0.40 CCOCCCOCC(=O)NC 7a_100000757476_100000183359 [0,2,0,0,0,0|1,0,1]=4 10617 B11R0.40 CCOCCCOCC(=O)OC 34a_100000757476_100000747449 [0,2,0,0,0,0|0,0,1]=3 10618 B11R0.40 CCOCCCOCC(=O)OC 7a_100000757476_100000747449 [0,2,0,0,0,0|0,0,1]=3 10619 B11R0.40 CCOCCCOCC(C)CC 34a_100000757476_100000748023 [0,2,0,0,0,0|1,0,0]=3 10620 B11R0.40 CCOCCCOCC(C)CC 7a_100000757476_100000748023 [0,2,0,0,0,0|1,0,0]=3 10621 B11R0.40 CCOCCCOCC(C)CN 34a_100000744482_100012232248 [0,2,0,0,0,0|2,0,0]=4 10622 B11R0.40 CCOCCCOCC(C)OC 34a_100000690652_100012232248 [0,2,0,0,0,0|0,0,0]=2 10623 B11R0.40 CCOCCCOCC(Cl)CCl 34a_100000033668_100012232248 [0,2,0,0,0,0|2,0,0]=4 10624 B11R0.40 CCOCCCOCC(O)CC 34a_100000757476_100011218378 [0,2,0,0,0,0|1,0,0]=3 10625 B11R0.40 CCOCCCOCC(O)CC 7a_100000757476_100011218378 [0,2,0,0,0,0|1,0,0]=3 10626 B11R0.40 CCOCCCOCC(O)CO 34a_100000757476_100011219619 [0,2,0,0,0,0|2,0,0]=4 10627 B11R0.40 CCOCCCOCC(O)CO 7a_100000757476_100011219619 [0,2,0,0,0,0|2,0,0]=4 10628 B11R0.40 CCOCCCOC[C@@H](C)CC 34a_100000757476_100009816398 [0,2,0,0,0,0|1,0,0]=3 10629 B11R0.40 CCOCCCOC[C@@H](C)CC 7a_100000757476_100009816398 [0,2,0,0,0,0|1,0,0]=3 10630 B11R0.40 CCOCCCOC[C@@H](C)CC 7a_100009816381_100012232248 [0,2,0,0,0,0|1,0,0]=3 10631 B11R0.40 CCOCCCOC[C@@H](C)CO 34a_100000757476_100000059175 [0,2,0,0,0,0|2,0,0]=4 10632 B11R0.40 CCOCCCOC[C@@H](C)CO 7a_100000757476_100000059175 [0,2,0,0,0,0|2,0,0]=4 10633 B11R0.40 CCOCCCOC[C@@H](O)CF 34a_100000757476_100015614560 [0,2,0,0,0,0|2,0,0]=4 10634 B11R0.40 CCOCCCOC[C@@H](O)CF 7a_100000757476_100015614560 [0,2,0,0,0,0|2,0,0]=4 10635 B11R0.40 CCOCCCOC[C@@H](O)CO 34a_100000757476_100009815848 [0,2,0,0,0,0|2,0,0]=4 10636 B11R0.40 CCOCCCOC[C@@H](O)CO 7a_100000757476_100009815848 [0,2,0,0,0,0|2,0,0]=4 10637 B11R0.40 CCOCCCOC[C@H](F)CN 34a_100015665980_100012232248 [0,2,0,0,0,0|2,0,0]=4 10638 B11R0.40 CCOCCCSCC(=O)OC 62a_100000747449_100012232248 [0,2,0,0,0,0|0,1,1]=4 10639 B11R0.40 CCOCCCSCC(=O)OC 62a_100012232248_100000747449 [0,2,0,0,0,0|0,1,1]=4 10640 B11R0.40 CCOCCCSCC(C)CC 62a_100000748023_100012232248 [0,2,0,0,0,0|1,1,0]=4 10641 B11R0.40 CCOCCCSCC(C)CC 62a_100012232248_100000748023 [0,2,0,0,0,0|1,1,0]=4 10642 B11R0.40 CCOCCCSCC(O)CC 62a_100011218378_100012232248 [0,2,0,0,0,0|1,1,0]=4 10643 B11R0.40 CCOCCCSCC(O)CC 62a_100012232248_100011218378 [0,2,0,0,0,0|1,1,0]=4 10644 B11R0.40 CCOCCCSC[C@@H](C)CC 62a_100009816398_100012232248 [0,2,0,0,0,0|1,1,0]=4 10645 B11R0.40 CCOCCCSC[C@@H](C)CC 62a_100012232248_100009816398 [0,2,0,0,0,0|1,1,0]=4 10646 B11R0.40 CCOCCNCCC(=O)NC 2230a_100000738227_100011215890 [0,2,0,0,0,0|2,0,0]=4 10647 B11R0.40 CCOCCNCCC(=O)NC 2230a_102516460346_100000737683 [0,2,0,0,0,0|2,0,0]=4 10648 B11R0.40 CCOCCNCCC(=O)NC 34a_100000738227_100000210147 [0,2,0,0,0,0|2,0,0]=4 10649 B11R0.40 CCOCCNCCC(=O)NC 34a_102516460346_100012179268 [0,2,0,0,0,0|2,0,0]=4 10650 B11R0.40 CCOCCNCCC(=O)OC 2230a_102516460346_100000204255 [0,2,0,0,0,0|1,0,0]=3 10651 B11R0.40 CCOCCNCCC(=O)OC 34a_102516460346_100000742370 [0,2,0,0,0,0|1,0,0]=3 10652 B11R0.40 CCOCCNCCC(C)CC 2230a_100020591266_100011215890 [0,2,0,0,0,0|2,0,0]=4 10653 B11R0.40 CCOCCNCCC(C)CO 2230a_106354213184_100011215890 [0,2,0,0,0,0|2,0,0]=4 10654 B11R0.40 CCOCCNCCC(C)CO 34a_106354213184_100000210147 [0,2,0,0,0,0|2,0,0]=4 10655 B11R0.40 CCOCCOCCC(=NO)N 34a_100000749954_100000210147 [0,2,0,0,0,0|2,0,0]=4 10656 B11R0.40 CCOCCOCCC(=O)CC 1458a_100000210414_100011211534 [0,2,0,0,0,0|1,0,0]=3 10657 B11R0.40 CCOCCOCCC(=O)CO 1458a_100000210174_100011211534 [0,2,0,0,0,0|1,0,0]=3 10658 B11R0.40 CCOCCOCCC(=O)NC 34a_100000210136_100012179268 [0,2,0,0,0,0|1,0,0]=3 10659 B11R0.40 CCOCCOCCC(=O)NC 34a_100000754576_100000210147 [0,2,0,0,0,0|1,0,0]=3 10660 B11R0.40 CCOCCOCCC(=O)NC 7a_100000210136_100000737683 [0,2,0,0,0,0|1,0,0]=3 10661 B11R0.40 CCOCCOCCC(=O)OC 34a_100000210136_100000742370 [0,2,0,0,0,0|0,0,0]=2 10662 B11R0.40 CCOCCOCCC(=O)OC 7a_100000210136_100000204255 [0,2,0,0,0,0|0,0,0]=2 10663 B11R0.40 CCOCCOCCC(C)CC 7a_100011215188_100011215890 [0,2,0,0,0,0|1,0,0]=3 10664 B11R0.40 CCOCCOCCC(C)OC 7a_100000764861_100011215890 [0,2,0,0,0,0|0,0,0]=2 10665 B11R0.40 CCOCCOCCN(C)CC 2230a_100000225621_100011211534 [0,2,0,0,0,0|1,0,0]=3 10666 B11R0.40 CCOCCOCCN(C)CC 269982a_100000225621_100011211534 [0,2,0,0,0,0|1,0,0]=3 10667 B11R0.40 CCOCCSCCC(=O)NC 62a_100000210147_100000737683 [0,2,0,0,0,0|1,1,0]=4 10668 B11R0.40 CCOCCSCCC(=O)NC 62a_100000737683_100011215890 [0,2,0,0,0,0|1,1,0]=4 10669 B11R0.40 CCOCCSCCC(=O)OC 62a_100000204255_100011215890 [0,2,0,0,0,0|0,1,0]=3 10670 B11R0.40 CCOCCSCCC(=O)OC 62a_100000210147_100000204255 [0,2,0,0,0,0|0,1,0]=3 10671 B11R0.40 CCOCCSCOC(=O)OC 62a_100000210147_100000139417 [0,2,0,0,0,0|0,1,1]=4 10672 B11R0.40 CCOCSCCCC(=O)OC 62a_100000739092_100011218270 [0,2,0,0,0,0|1,0,1]=4 10673 B11R0.40 CCOCSCCCC(=O)OC 62a_100011218270_100000739092 [0,2,0,0,0,0|1,0,1]=4 10674 B11R0.40 CCSCCCCCC(=O)OC 62a_100000210202_100009816466 [0,2,0,0,0,0|1,1,0]=4 10675 B11R0.40 CCSCCCCCC(=O)OC 62a_100009816466_100000210202 [0,2,0,0,0,0|1,1,0]=4 10676 B11R0.40 CCSCCCOCC(=O)OC 34a_100011216438_100000747449 [0,2,0,0,0,0|0,1,1]=4 10677 B11R0.40 CCSCCCOCC(=O)OC 7a_100011216438_100000747449 [0,2,0,0,0,0|0,1,1]=4 10678 B11R0.40 CCSCCCOCC(C)CC 34a_100011216438_100000748023 [0,2,0,0,0,0|1,1,0]=4 10679 B11R0.40 CCSCCCOCC(C)CC 7a_100011216438_100000748023 [0,2,0,0,0,0|1,1,0]=4 10680 B11R0.40 CCSCCCOCC(O)CC 34a_100011216438_100011218378 [0,2,0,0,0,0|1,1,0]=4 10681 B11R0.40 CCSCCCOCC(O)CC 7a_100011216438_100011218378 [0,2,0,0,0,0|1,1,0]=4 10682 B11R0.40 CCSCCCOC[C@@H](C)CC 34a_100011216438_100009816398 [0,2,0,0,0,0|1,1,0]=4 10683 B11R0.40 CCSCCCOC[C@@H](C)CC 7a_100011216438_100009816398 [0,2,0,0,0,0|1,1,0]=4 10684 B11R0.40 CCSCCNCCC(=O)OC 2230a_100000106463_100000204255 [0,2,0,0,0,0|1,1,0]=4 10685 B11R0.40 CCSCCOCCC(=O)NC 34a_100000212035_100012179268 [0,2,0,0,0,0|1,1,0]=4 10686 B11R0.40 CCSCCOCCC(=O)NC 34a_100000754576_100000757381 [0,2,0,0,0,0|1,1,0]=4 10687 B11R0.40 CCSCCOCCC(=O)NC 7a_100000212035_100000737683 [0,2,0,0,0,0|1,1,0]=4 10688 B11R0.40 CCSCCOCCC(=O)OC 34a_100000212035_100000742370 [0,2,0,0,0,0|0,1,0]=3 10689 B11R0.40 CCSCCOCCC(=O)OC 7a_100000212035_100000204255 [0,2,0,0,0,0|0,1,0]=3 10690 B11R0.40 CCSCCOCCC(C)CC 7a_100011215188_100000757381 [0,2,0,0,0,0|1,1,0]=4 10691 B11R0.40 CCSCCOCCC(C)OC 7a_100000764861_100000757381 [0,2,0,0,0,0|0,1,0]=3 10692 B11R0.40 CCSCCSCCC(=O)OC 62a_100000204255_100000757381 [0,2,0,0,0,0|0,2,0]=4 10693 B11R0.40 CCSCCSCCC(=O)OC 62a_100000757381_100000204255 [0,2,0,0,0,0|0,2,0]=4 10694 B11R0.40 CC[C@H](C)CNCCOCCO 2230a_100000211614_100009816398 [0,2,0,0,0,0|2,0,0]=4 10695 B11R0.40 CC[C@H](C)CNCCOCCO 34a_100000211614_100009816398 [0,2,0,0,0,0|2,0,0]=4 10696 B11R0.40 CC[C@H](C)COCCCCCBr 34a_100000746331_100009816398 [0,2,0,0,0,0|2,0,0]=4 10697 B11R0.40 CC[C@H](C)COCCCCCBr 7a_100000746331_100009816398 [0,2,0,0,0,0|2,0,0]=4 10698 B11R0.40 CC[C@H](C)COCCCCCCl 34a_100000746330_100009816398 [0,2,0,0,0,0|2,0,0]=4 10699 B11R0.40 CC[C@H](C)COCCCCCCl 7a_100000746330_100009816398 [0,2,0,0,0,0|2,0,0]=4 10700 B11R0.40 CC[C@H](C)COCCCCCF 7a_100009816381_100000729378 [0,2,0,0,0,0|2,0,0]=4 10701 B11R0.40 CC[C@H](C)COCCCCCI 34a_200012148887_100009816398 [0,2,0,0,0,0|2,0,0]=4 10702 B11R0.40 CC[C@H](C)COCCCCCI 7a_200012148887_100009816398 [0,2,0,0,0,0|2,0,0]=4 10703 B11R0.40 CC[C@H](C)COCCCCCN 34a_100000762737_100009816398 [0,2,0,0,0,0|2,0,0]=4 10704 B11R0.40 CC[C@H](C)COCCCCCO 7a_100009816381_100000746330 [0,2,0,0,0,0|2,0,0]=4 10705 B11R0.40 CC[C@H](C)COCCCCOC 34a_100000740925_100009816398 [0,2,0,0,0,0|2,0,0]=4 10706 B11R0.40 CC[C@H](C)COCCCCOC 7a_100009816381_100000730899 [0,2,0,0,0,0|2,0,0]=4 10707 B11R0.40 CC[C@H](C)COCCCCSC 34a_100011217163_100009816398 [0,2,0,0,0,0|2,0,0]=4 10708 B11R0.40 CC[C@H](C)COCCCCSC 7a_100011217163_100009816398 [0,2,0,0,0,0|2,0,0]=4 10709 B11R0.40 CC[C@H](C)COCCOCC#N 7a_100009816381_200000047693 [0,2,0,0,0,0|1,0,1]=4 10710 B11R0.40 CC[C@H](C)COCCOCCBr 34a_100000692535_100009816398 [0,2,0,0,0,0|1,0,0]=3 10711 B11R0.40 CC[C@H](C)COCCOCCBr 7a_100000692535_100009816398 [0,2,0,0,0,0|1,0,0]=3 10712 B11R0.40 CC[C@H](C)COCCOCCCl 34a_100011215305_100009816398 [0,2,0,0,0,0|1,0,0]=3 10713 B11R0.40 CC[C@H](C)COCCOCCCl 7a_100011215305_100009816398 [0,2,0,0,0,0|1,0,0]=3 10714 B11R0.40 CC[C@H](C)COCCOCCF 34a_200015357709_100009816398 [0,2,0,0,0,0|1,0,0]=3 10715 B11R0.40 CC[C@H](C)COCCOCCF 7a_200015357709_100009816398 [0,2,0,0,0,0|1,0,0]=3 10716 B11R0.40 CC[C@H](C)COCCOCCI 34a_100012149058_100009816398 [0,2,0,0,0,0|1,0,0]=3 10717 B11R0.40 CC[C@H](C)COCCOCCI 7a_100012149058_100009816398 [0,2,0,0,0,0|1,0,0]=3 10718 B11R0.40 CC[C@H](C)COCCOCCN 34a_100000211614_100009816398 [0,2,0,0,0,0|1,0,0]=3 10719 B11R0.40 CC[C@H](C)COCCOCCO 7a_100009816381_100011215305 [0,2,0,0,0,0|1,0,0]=3 10720 B11R0.40 CC[C@H](C)CSCCCCOC 62a_100000730899_100009816398 [0,2,0,0,0,0|2,0,0]=4 10721 B11R0.40 CC[C@H](C)CSCCCCOC 62a_100009816398_100000730899 [0,2,0,0,0,0|2,0,0]=4 10722 B11R0.40 CC[C@H](C)CSCCOCCO 62a_100009816398_100011215305 [0,2,0,0,0,0|1,1,0]=4 10723 B11R0.40 CC[C@H](C)CSCCOCCO 62a_100011215305_100009816398 [0,2,0,0,0,0|1,1,0]=4 10724 B11R0.40 CC[C@H](C)CSCOCCOC 62a_100000231047_100009816398 [0,2,0,0,0,0|1,0,0]=3 10725 B11R0.40 CC[C@H](C)CSCOCCOC 62a_100009816398_100000231047 [0,2,0,0,0,0|1,0,0]=3 10726 B11R0.40 CNC(=O)CCCOCCOC 34a_100000210237_100000741757 [0,2,0,0,0,0|1,0,1]=4 10727 B11R0.40 CNC(=O)CCOCCCOC 34a_100000740835_100012179268 [0,2,0,0,0,0|2,0,0]=4 10728 B11R0.40 CNC(=O)CCOCCCOC 34a_100000754576_100000740836 [0,2,0,0,0,0|2,0,0]=4 10729 B11R0.40 CNC(=O)CNCOCCOC 2230a_100000693194_100000231047 [0,2,0,0,0,0|2,0,0]=4 10730 B11R0.40 CNC(=O)COCCOCCBr 34a_100000692535_100000183359 [0,2,0,0,0,0|1,0,1]=4 10731 B11R0.40 CNC(=O)COCCOCCBr 7a_100000692535_100000183359 [0,2,0,0,0,0|1,0,1]=4 10732 B11R0.40 CNC(=O)COCCOCCCl 34a_100011215305_100000183359 [0,2,0,0,0,0|1,0,1]=4 10733 B11R0.40 CNC(=O)COCCOCCCl 7a_100011215305_100000183359 [0,2,0,0,0,0|1,0,1]=4 10734 B11R0.40 CNC(=O)COCCOCCF 34a_200015357709_100000183359 [0,2,0,0,0,0|1,0,1]=4 10735 B11R0.40 CNC(=O)COCCOCCF 7a_200015357709_100000183359 [0,2,0,0,0,0|1,0,1]=4 10736 B11R0.40 CNC(=O)COCCOCCI 34a_100012149058_100000183359 [0,2,0,0,0,0|1,0,1]=4 10737 B11R0.40 CNC(=O)COCCOCCI 7a_100012149058_100000183359 [0,2,0,0,0,0|1,0,1]=4 10738 B11R0.40 CNC(=O)COCCOCCN 34a_100000211614_100000183359 [0,2,0,0,0,0|1,0,1]=4 10739 B11R0.40 CNC(=O)COCCOCCO 1626a_100102657272_106645077154 [0,2,0,0,0,0|1,0,1]=4 10740 B11R0.40 CNC(=O)COCCOCCO 240690a_100102657272_106645077154 [0,2,0,0,0,0|1,0,1]=4 10741 B11R0.40 CNC(=O)COCCOCCO 34a_100000750040_100000692535 [0,2,0,0,0,0|1,0,1]=4 10742 B11R0.40 CNC(=O)CSCOCCOC 62a_100000183359_100000231047 [0,2,0,0,0,0|2,0,0]=4 10743 B11R0.40 CNC(=O)CSCOCCOC 62a_100000231047_100000183359 [0,2,0,0,0,0|2,0,0]=4 10744 B11R0.40 CNC(=O)NCCOCCOC 2708a_100000745349_106832991635 [0,2,0,0,0,0|1,0,1]=4 10745 B11R0.40 CNC(=O)NCCOCCOC 2708a_100102657272_100000745349 [0,2,0,0,0,0|1,0,1]=4 10746 B11R0.40 CNC(=O)NCCOCCOC 273464a_100000745349_100102657272 [0,2,0,0,0,0|1,0,1]=4 10747 B11R0.40 CNC(=O)NCCOCCOC 273464a_100102657272_100000745349 [0,2,0,0,0,0|1,0,1]=4 10748 B11R0.40 CNC(=O)NCCOCCOC 512a_100000745349_100102657272 [0,2,0,0,0,0|1,0,1]=4 10749 B11R0.40 CNC(=O)OCCOCCOC 34a_100000210237_200011997002 [0,2,0,0,0,0|0,0,1]=3 10750 B11R0.40 CNC(=O)OCCOCCON 34a_100000700252_200011997002 [0,2,0,0,0,0|1,0,1]=4 10751 B11R0.40 CNC(=O)OCCOCCSC 34a_100000230434_200011997002 [0,2,0,0,0,0|0,1,1]=4 10752 B11R0.40 CNC(=O)OCCOCCSC 7a_100000230434_200011997002 [0,2,0,0,0,0|0,1,1]=4 10753 B11R0.40 CNC(=O)OCCSCCOC 62a_100000233755_200011997002 [0,2,0,0,0,0|0,1,1]=4 10754 B11R0.40 CNC(=O)OCCSCCOC 62a_200011997002_100000233755 [0,2,0,0,0,0|0,1,1]=4 10755 B11R0.40 CNCCCCCOC(C)CO 34a_100000722520_100012180447 [0,2,0,0,0,0|2,0,0]=4 10756 B11R0.40 CNCCCOCCC(=O)OC 34a_100000213112_100000742370 [0,2,0,0,0,0|2,0,0]=4 10757 B11R0.40 CNCCOCCOC(C)CO 34a_100000228057_100012180447 [0,2,0,0,0,0|1,0,0]=3 10758 B11R0.40 COC(=O)CCCCCOCF 34a_100000074720_100015361967 [0,2,0,0,0,0|2,0,0]=4 10759 B11R0.40 COC(=O)CCCCCOCF 7a_100000074720_100015361967 [0,2,0,0,0,0|2,0,0]=4 10760 B11R0.40 COC(=O)CCCCOCCBr 34a_100000211926_100000204269 [0,2,0,0,0,0|1,0,1]=4 10761 B11R0.40 COC(=O)CCCCOCCF 34a_100000059025_100011217306 [0,2,0,0,0,0|1,0,1]=4 10762 B11R0.40 COC(=O)CCCCOCCF 7a_100000059025_100011217306 [0,2,0,0,0,0|1,0,1]=4 10763 B11R0.40 COC(=O)CCCCOCCN 34a_100000210304_100000204269 [0,2,0,0,0,0|1,0,1]=4 10764 B11R0.40 COC(=O)CCCCOCCO 34a_100000059025_100000211926 [0,2,0,0,0,0|1,0,1]=4 10765 B11R0.40 COC(=O)CCCCOCCO 7a_100000059025_100000211926 [0,2,0,0,0,0|1,0,1]=4 10766 B11R0.40 COC(=O)CCCCOCSC 34a_100000059025_100011218213 [0,2,0,0,0,0|1,0,1]=4 10767 B11R0.40 COC(=O)CCOCCCCBr 34a_100011216708_100000742370 [0,2,0,0,0,0|2,0,0]=4 10768 B11R0.40 COC(=O)CCOCCCCCl 34a_100000210776_100000742370 [0,2,0,0,0,0|2,0,0]=4 10769 B11R0.40 COC(=O)CCOCCCCCl 7a_100000210776_100000204255 [0,2,0,0,0,0|2,0,0]=4 10770 B11R0.40 COC(=O)CCOCCCCF 34a_100011995726_100000742370 [0,2,0,0,0,0|2,0,0]=4 10771 B11R0.40 COC(=O)CCOCCCCF 7a_100011995726_100000204255 [0,2,0,0,0,0|2,0,0]=4 10772 B11R0.40 COC(=O)CCOCCCCI 34a_200012148704_100000742370 [0,2,0,0,0,0|2,0,0]=4 10773 B11R0.40 COC(=O)CCOCCCCN 34a_100000750430_100000742370 [0,2,0,0,0,0|2,0,0]=4 10774 B11R0.40 COC(=O)CCOCCCSC 34a_100000690336_100000742370 [0,2,0,0,0,0|2,0,0]=4 10775 B11R0.40 COC(=O)CCOCCCSC 7a_100000690336_100000204255 [0,2,0,0,0,0|2,0,0]=4 10776 B11R0.40 COC(=O)CNCCOCCO 2230a_100000211614_100000747449 [0,2,0,0,0,0|1,0,1]=4 10777 B11R0.40 COC(=O)CNCCOCCO 34a_100000211614_100000747449 [0,2,0,0,0,0|1,0,1]=4 10778 B11R0.40 COC(=O)COCCCCCBr 34a_100000746331_100000747449 [0,2,0,0,0,0|1,0,1]=4 10779 B11R0.40 COC(=O)COCCCCCBr 7a_100000746331_100000747449 [0,2,0,0,0,0|1,0,1]=4 10780 B11R0.40 COC(=O)COCCCCCCl 34a_100000746330_100000747449 [0,2,0,0,0,0|1,0,1]=4 10781 B11R0.40 COC(=O)COCCCCCCl 7a_100000746330_100000747449 [0,2,0,0,0,0|1,0,1]=4 10782 B11R0.40 COC(=O)COCCCCCI 34a_200012148887_100000747449 [0,2,0,0,0,0|1,0,1]=4 10783 B11R0.40 COC(=O)COCCCCCI 7a_200012148887_100000747449 [0,2,0,0,0,0|1,0,1]=4 10784 B11R0.40 COC(=O)COCCCCCN 34a_100000762737_100000747449 [0,2,0,0,0,0|1,0,1]=4 10785 B11R0.40 COC(=O)COCCCCSC 34a_100011217163_100000747449 [0,2,0,0,0,0|1,0,1]=4 10786 B11R0.40 COC(=O)COCCCCSC 7a_100011217163_100000747449 [0,2,0,0,0,0|1,0,1]=4 10787 B11R0.40 COC(=O)COCCNCCF 34a_100000724931_100000090808 [0,2,0,0,0,0|1,0,1]=4 10788 B11R0.40 COC(=O)COCCNCCO 2230a_100016997473_100000090808 [0,2,0,0,0,0|1,0,1]=4 10789 B11R0.40 COC(=O)COCCNCCO 34a_100016990907_100000090808 [0,2,0,0,0,0|1,0,1]=4 10790 B11R0.40 COC(=O)COCCOCCBr 34a_100000211926_100000090808 [0,2,0,0,0,0|0,0,1]=3 10791 B11R0.40 COC(=O)COCCOCCBr 34a_100000692535_100000747449 [0,2,0,0,0,0|0,0,1]=3 10792 B11R0.40 COC(=O)COCCOCCBr 7a_100000692535_100000747449 [0,2,0,0,0,0|0,0,1]=3 10793 B11R0.40 COC(=O)COCCOCCCl 34a_100011215305_100000747449 [0,2,0,0,0,0|0,0,1]=3 10794 B11R0.40 COC(=O)COCCOCCCl 7a_100011215305_100000747449 [0,2,0,0,0,0|0,0,1]=3 10795 B11R0.40 COC(=O)COCCOCCF 34a_200015357709_100000747449 [0,2,0,0,0,0|0,0,1]=3 10796 B11R0.40 COC(=O)COCCOCCF 7a_200015357709_100000747449 [0,2,0,0,0,0|0,0,1]=3 10797 B11R0.40 COC(=O)COCCOCCI 34a_100012149058_100000747449 [0,2,0,0,0,0|0,0,1]=3 10798 B11R0.40 COC(=O)COCCOCCI 7a_100012149058_100000747449 [0,2,0,0,0,0|0,0,1]=3 10799 B11R0.40 COC(=O)COCCOCCN 34a_100000210304_100000090808 [0,2,0,0,0,0|0,0,1]=3 10800 B11R0.40 COC(=O)COCCOCCN 34a_100000211614_100000747449 [0,2,0,0,0,0|0,0,1]=3 10801 B11R0.40 COC(=O)COCCSCCF 62a_100000090808_100011217306 [0,2,0,0,0,0|0,1,1]=4 10802 B11R0.40 COC(=O)COCCSCCF 62a_100011217306_100000090808 [0,2,0,0,0,0|0,1,1]=4 10803 B11R0.40 COC(=O)COCCSCCO 62a_100000090808_100000211926 [0,2,0,0,0,0|0,1,1]=4 10804 B11R0.40 COC(=O)COCCSCCO 62a_100000211926_100000090808 [0,2,0,0,0,0|0,1,1]=4 10805 B11R0.40 COC(=O)COCCSCSC 62a_100000090808_100011218213 [0,2,0,0,0,0|0,1,1]=4 10806 B11R0.40 COC(=O)COCCSCSC 62a_100011218213_100000090808 [0,2,0,0,0,0|0,1,1]=4 10807 B11R0.40 COC(=O)CSCCOCCO 62a_100000747449_100011215305 [0,2,0,0,0,0|0,1,1]=4 10808 B11R0.40 COC(=O)CSCCOCCO 62a_100011215305_100000747449 [0,2,0,0,0,0|0,1,1]=4 10809 B11R0.40 COC(=O)OCCOCCSC 34a_100010262106_100000212216 [0,2,0,0,0,0|0,1,1]=4 10810 B11R0.40 COC(C)CCOCCCCF 7a_100000764861_100000729493 [0,2,0,0,0,0|2,0,0]=4 10811 B11R0.40 COC(C)CCOCCCCO 7a_100000764861_100000210776 [0,2,0,0,0,0|2,0,0]=4 10812 B11R0.40 COC(C)COCCCCCF 34a_100000690652_100000729378 [0,2,0,0,0,0|1,0,0]=3 10813 B11R0.40 COC(C)COCCCCCO 34a_100000690652_100000746330 [0,2,0,0,0,0|1,0,0]=3 10814 B11R0.40 COC(C)COCCOCCO 34a_100000690652_100000692535 [0,2,0,0,0,0|0,0,0]=2 10815 B11R0.40 COCCCCCNC(C)C#N 2230a_100000747528_100000184139 [0,2,0,0,0,0|2,0,0]=4 10816 B11R0.40 COCCCCCNC(C)CO 2230a_100000747528_100012180447 [0,2,0,0,0,0|2,0,0]=4 10817 B11R0.40 COCCCCCNC(C)CO 34a_100000747528_100012180447 [0,2,0,0,0,0|2,0,0]=4 10818 B11R0.40 COCCCCNC[C@@H](C)OC 2230a_100020591295_100000730899 [0,2,0,0,0,0|2,0,0]=4 10819 B11R0.40 COCCCCOCC(=O)OC 34a_100000740925_100000747449 [0,2,0,0,0,0|1,0,1]=4 10820 B11R0.40 COCCCCOCC(C)OC 34a_100000690652_100000755781 [0,2,0,0,0,0|1,0,0]=3 10821 B11R0.40 COCCCOCCC(=O)OC 34a_100000740835_100000742370 [0,2,0,0,0,0|2,0,0]=4 10822 B11R0.40 COCCCOCCC(C)OC 7a_100000764861_100000740836 [0,2,0,0,0,0|2,0,0]=4 10823 B11R0.40 COCCOCCCC(=O)CO 1458a_100000210174_100011216529 [0,2,0,0,0,0|1,0,1]=4 10824 B11R0.40 COCCOCCCC(=O)OC 34a_100000210237_100000742333 [0,2,0,0,0,0|1,0,1]=4 10825 B11R0.40 COCCOCCC[C@@H](C)CN 34a_100160569302_100011201679 [0,2,0,0,0,0|1,0,0]=3 10826 B11R0.40 COCCOCCNC(=O)CO 240690a_100000745349_100000210174 [0,2,0,0,0,0|1,0,1]=4 10827 B11R0.40 COCCOCCNC(=O)CO 527a_100000745349_100000210174 [0,2,0,0,0,0|1,0,1]=4 10828 B11R0.40 COCCOCCNC(=O)OC 34a_100000757965_100011201679 [0,2,0,0,0,0|1,0,1]=4 10829 B11R0.40 COCCOCCNC(C)C#N 2230a_100000737613_100000695917 [0,2,0,0,0,0|1,0,0]=3 10830 B11R0.40 COCCOCCNC(C)C#N 2230a_100000745349_100000184139 [0,2,0,0,0,0|1,0,0]=3 10831 B11R0.40 COCCOCCNC(C)CO 2230a_100000745349_100012180447 [0,2,0,0,0,0|1,0,0]=3 10832 B11R0.40 COCCOCCNC(C)CO 34a_100000745349_100012180447 [0,2,0,0,0,0|1,0,0]=3 10833 B11R0.40 COCCOCCN[C@H](C)CO 2230a_100000737577_100000695917 [0,2,0,0,0,0|1,0,0]=3 10834 B11R0.40 COCCOCCOC(=O)OC 34a_100010262106_100011201679 [0,2,0,0,0,0|0,0,1]=3 10835 B11R0.40 COCCOCCOC(C)C#N 34a_100011218135_100000695917 [0,2,0,0,0,0|0,0,0]=2 10836 B11R0.40 COCCOCCOC(C)C#N 7a_100011215163_100000703298 [0,2,0,0,0,0|0,0,0]=2 10837 B11R0.40 COCCOCCOC(C)CF 34a_100016041109_100000695917 [0,2,0,0,0,0|0,0,0]=2 10838 B11R0.40 COCCOCCOC(C)CF 7a_100016041109_100000695917 [0,2,0,0,0,0|0,0,0]=2 10839 B11R0.40 COCCOCCOC(C)CN 34a_100000210904_100000695917 [0,2,0,0,0,0|0,0,0]=2 10840 B11R0.40 COCCOCCOC(C)CO 34a_100011215163_100012180447 [0,2,0,0,0,0|0,0,0]=2 10841 B11R0.40 COCCOCCOC(C)CO 7a_100011215163_100012180447 [0,2,0,0,0,0|0,0,0]=2 10842 B11R0.40 COCCOCCSC(C)C#N 62a_100000695917_100000703298 [0,2,0,0,0,0|0,1,0]=3 10843 B11R0.40 COCCOCCSC(C)C#N 62a_100000703298_100000695917 [0,2,0,0,0,0|0,1,0]=3 10844 B11R0.40 COCCOCCSC(C)CO 62a_100012180447_100000695917 [0,2,0,0,0,0|0,1,0]=3 10845 B11R0.40 COCCOCCSC(C)OC 62a_100000695917_100009879195 [0,2,0,0,0,0|0,1,0]=3 10846 B11R0.40 COCCOCCSC(C)OC 62a_100009879195_100000695917 [0,2,0,0,0,0|0,1,0]=3 10847 B11R0.40 COCCOCCSC(F)C#N 62a_100000695917_200000117898 [0,2,0,0,0,0|0,1,1]=4 10848 B11R0.40 COCCOCCSC(F)C#N 62a_200000117898_100000695917 [0,2,0,0,0,0|0,1,1]=4 10849 B11R0.40 COCCOCCS[C@H](C)CO 62a_100000695917_100016084084 [0,2,0,0,0,0|0,1,0]=3 10850 B11R0.40 COCCOCCS[C@H](C)CO 62a_100016084084_100000695917 [0,2,0,0,0,0|0,1,0]=3 10851 B11R0.40 COCCOCNC[C@@H](C)OC 2230a_100020591295_100000231047 [0,2,0,0,0,0|2,0,0]=4 10852 B11R0.40 COCCOCNC[C@H](O)CO 2230a_100020644852_100000231047 [0,2,0,0,0,0|2,0,0]=4 10853 B11R0.40 COCCOCSCC(=O)OC 62a_100000231047_100000747449 [0,2,0,0,0,0|2,0,0]=4 10854 B11R0.40 COCCOCSCC(=O)OC 62a_100000747449_100000231047 [0,2,0,0,0,0|2,0,0]=4 10855 B11R0.40 COCCOCSCC(O)CO 62a_100000231047_100011219619 [0,2,0,0,0,0|2,0,0]=4 10856 B11R0.40 COCCOCSCC(O)CO 62a_100011219619_100000231047 [0,2,0,0,0,0|2,0,0]=4 10857 B11R0.40 COCCOCSC[C@@H](C)CO 62a_100000059175_100000231047 [0,2,0,0,0,0|2,0,0]=4 10858 B11R0.40 COCCOCSC[C@@H](C)CO 62a_100000231047_100000059175 [0,2,0,0,0,0|2,0,0]=4 10859 B11R0.40 COCCOCSC[C@@H](O)CF 62a_100000231047_100015614560 [0,2,0,0,0,0|2,0,0]=4 10860 B11R0.40 COCCOCSC[C@@H](O)CF 62a_100015614560_100000231047 [0,2,0,0,0,0|2,0,0]=4 10861 B11R0.40 COCCOCSC[C@@H](O)CO 62a_100000231047_100009815848 [0,2,0,0,0,0|2,0,0]=4 10862 B11R0.40 COCCOCSC[C@@H](O)CO 62a_100009815848_100000231047 [0,2,0,0,0,0|2,0,0]=4 10863 B11R0.40 COCSCCOCC(=O)OC 62a_100000090808_100000766300 [0,2,0,0,0,0|0,1,1]=4 10864 B11R0.40 COCSCCOCC(=O)OC 62a_100000766300_100000090808 [0,2,0,0,0,0|0,1,1]=4 10865 B11R0.40 CO[C@H](C)CNCCCCCF 2230a_100020591295_100000729378 [0,2,0,0,0,0|2,0,0]=4 10866 B11R0.40 CO[C@H](C)CNCCCCCO 2230a_100020591295_100000746330 [0,2,0,0,0,0|2,0,0]=4 10867 B11R0.40 CO[C@H](C)CNCCOCC#N 2230a_100020591295_200000047693 [0,2,0,0,0,0|1,0,1]=4 10868 B11R0.40 CO[C@H](C)CNCCOCCO 2230a_100020591295_100011215305 [0,2,0,0,0,0|1,0,0]=3 10869 B11R0.40 CSCCOCCC[C@@H](C)CN 34a_100160569302_100000212216 [0,2,0,0,0,0|1,1,0]=4 10870 B11R0.40 C[C@@H](CO)COCCOCCBr 34a_100000692535_100000059175 [0,2,0,0,0,0|2,0,0]=4 10871 B11R0.40 C[C@@H](CO)COCCOCCBr 7a_100000692535_100000059175 [0,2,0,0,0,0|2,0,0]=4 10872 B11R0.40 C[C@@H](CO)COCCOCCCl 34a_100011215305_100000059175 [0,2,0,0,0,0|2,0,0]=4 10873 B11R0.40 C[C@@H](CO)COCCOCCCl 7a_100011215305_100000059175 [0,2,0,0,0,0|2,0,0]=4 10874 B11R0.40 C[C@@H](CO)COCCOCCF 34a_200015357709_100000059175 [0,2,0,0,0,0|2,0,0]=4 10875 B11R0.40 C[C@@H](CO)COCCOCCF 7a_200015357709_100000059175 [0,2,0,0,0,0|2,0,0]=4 10876 B11R0.40 C[C@@H](CO)COCCOCCI 34a_100012149058_100000059175 [0,2,0,0,0,0|2,0,0]=4 10877 B11R0.40 C[C@@H](CO)COCCOCCI 7a_100012149058_100000059175 [0,2,0,0,0,0|2,0,0]=4 10878 B11R0.40 C[C@@H](CO)COCCOCCN 34a_100000211614_100000059175 [0,2,0,0,0,0|2,0,0]=4 10879 B11R0.40 NCCOCCOCC(O)CO 34a_100000211614_100011219619 [0,2,0,0,0,0|2,0,0]=4 10880 B11R0.40 NCCOCCOC[C@@H](O)CF 34a_100000211614_100015614560 [0,2,0,0,0,0|2,0,0]=4 10881 B11R0.40 NCCOCCOC[C@@H](O)CO 34a_100000211614_100009815848 [0,2,0,0,0,0|2,0,0]=4 10882 B11R0.40 NC[C@@H](F)COCCOCCO 34a_100015665980_100000692535 [0,2,0,0,0,0|2,0,0]=4 10883 B11R0.40 OCC(O)COCCOCCBr 34a_100000692535_100011219619 [0,2,0,0,0,0|2,0,0]=4 10884 B11R0.40 OCC(O)COCCOCCBr 7a_100000692535_100011219619 [0,2,0,0,0,0|2,0,0]=4 10885 B11R0.40 OCC(O)COCCOCCCl 34a_100011215305_100011219619 [0,2,0,0,0,0|2,0,0]=4 10886 B11R0.40 OCC(O)COCCOCCCl 7a_100011215305_100011219619 [0,2,0,0,0,0|2,0,0]=4 10887 B11R0.40 OCC(O)COCCOCCF 34a_200015357709_100011219619 [0,2,0,0,0,0|2,0,0]=4 10888 B11R0.40 OCC(O)COCCOCCF 7a_200015357709_100011219619 [0,2,0,0,0,0|2,0,0]=4 10889 B11R0.40 OCC(O)COCCOCCI 34a_100012149058_100011219619 [0,2,0,0,0,0|2,0,0]=4 10890 B11R0.40 OCC(O)COCCOCCI 7a_100012149058_100011219619 [0,2,0,0,0,0|2,0,0]=4 10891 B11R0.40 OCCOCCOCC(Cl)CCl 34a_100000033668_100000692535 [0,2,0,0,0,0|2,0,0]=4 10892 B11R0.40 OC[C@H](O)COCCOCCBr 34a_100000692535_100009815848 [0,2,0,0,0,0|2,0,0]=4 10893 B11R0.40 OC[C@H](O)COCCOCCBr 7a_100000692535_100009815848 [0,2,0,0,0,0|2,0,0]=4 10894 B11R0.40 OC[C@H](O)COCCOCCCl 34a_100011215305_100009815848 [0,2,0,0,0,0|2,0,0]=4 10895 B11R0.40 OC[C@H](O)COCCOCCCl 7a_100011215305_100009815848 [0,2,0,0,0,0|2,0,0]=4 10896 B11R0.40 OC[C@H](O)COCCOCCF 34a_200015357709_100009815848 [0,2,0,0,0,0|2,0,0]=4 10897 B11R0.40 OC[C@H](O)COCCOCCF 7a_200015357709_100009815848 [0,2,0,0,0,0|2,0,0]=4 10898 B11R0.40 OC[C@H](O)COCCOCCI 34a_100012149058_100009815848 [0,2,0,0,0,0|2,0,0]=4 10899 B11R0.40 OC[C@H](O)COCCOCCI 7a_100012149058_100009815848 [0,2,0,0,0,0|2,0,0]=4 10900 B11R0.40 O[C@@H](CF)COCCOCCBr 34a_100000692535_100015614560 [0,2,0,0,0,0|2,0,0]=4 10901 B11R0.40 O[C@@H](CF)COCCOCCBr 7a_100000692535_100015614560 [0,2,0,0,0,0|2,0,0]=4 10902 B11R0.40 O[C@@H](CF)COCCOCCCl 34a_100011215305_100015614560 [0,2,0,0,0,0|2,0,0]=4 10903 B11R0.40 O[C@@H](CF)COCCOCCCl 7a_100011215305_100015614560 [0,2,0,0,0,0|2,0,0]=4 10904 B11R0.40 O[C@@H](CF)COCCOCCF 34a_200015357709_100015614560 [0,2,0,0,0,0|2,0,0]=4 10905 B11R0.40 O[C@@H](CF)COCCOCCF 7a_200015357709_100015614560 [0,2,0,0,0,0|2,0,0]=4 10906 B11R0.40 O[C@@H](CF)COCCOCCI 34a_100012149058_100015614560 [0,2,0,0,0,0|2,0,0]=4 10907 B11R0.40 O[C@@H](CF)COCCOCCI 7a_100012149058_100015614560 [0,2,0,0,0,0|2,0,0]=4 10908 B11R0.42 C=C(C)C(=O)CCOCCOC 1458a_100000185857_100000695917 [0,2,0,0,0,0|1,0,1]=4 10909 B11R0.42 CCCCCOCC(C)C(=O)C 34a_100000032740_100000718602 [0,2,0,0,0,0|2,0,0]=4 10910 B11R0.42 CCCCCOCC(C)C(=O)C 7a_100000032740_100000210326 [0,2,0,0,0,0|2,0,0]=4 10911 B11R0.42 CCCCCOC[C@H](N)C(C)C 34a_100011830312_100000718602 [0,2,0,0,0,0|2,0,0]=4 10912 B11R0.42 CCCCOCCC(=O)C(C)C 1458a_100000210198_100000743108 [0,2,0,0,0,0|2,0,0]=4 10913 B11R0.42 CCCCOCCC(=O)C(C)F 1458a_100000062450_100000743108 [0,2,0,0,0,0|2,0,0]=4 10914 B11R0.42 CCCCOCCC(=O)[C@@H](C)O 1458a_100000717761_100000743108 [0,2,0,0,0,0|2,0,0]=4 10915 B11R0.42 CCCCOCCC(=O)[C@H](C)O 1458a_217856618621_100000743108 [0,2,0,0,0,0|2,0,0]=4 10916 B11R0.42 CCCCOCCC(N)C(C)C 34a_100161115045_100000210210 [0,2,0,0,0,0|2,0,0]=4 10917 B11R0.42 CCCCOCCN(C)C(C)C 269982a_200000211004_100000743108 [0,2,0,0,0,0|2,0,0]=4 10918 B11R0.42 CCOCCNCC(O)C(C)C 2230a_100000759067_100011215890 [0,2,0,0,0,0|2,0,0]=4 10919 B11R0.42 CCOCCNCC(O)C(C)C 34a_100000759067_100000210147 [0,2,0,0,0,0|2,0,0]=4 10920 B11R0.42 CCOCCOCC(=O)C(=O)C 34a_100000210136_100011261029 [0,2,0,0,0,0|1,0,1]=4 10921 B11R0.42 CCOCCOCC(=O)C(C)C 34a_100000210136_100000753385 [0,2,0,0,0,0|1,0,1]=4 10922 B11R0.42 CCOCCOCC(=O)C(C)C 7a_100000210136_100000753385 [0,2,0,0,0,0|1,0,1]=4 10923 B11R0.42 CCOCCOCC(=O)N(C)C 34a_100000210136_100000692301 [0,2,0,0,0,0|1,0,1]=4 10924 B11R0.42 CCOCCOCC(=O)N(C)C 7a_100000210136_100000692301 [0,2,0,0,0,0|1,0,1]=4 10925 B11R0.42 CCOCCOCC(C)C(=O)C 34a_100000032740_100000210147 [0,2,0,0,0,0|1,0,0]=3 10926 B11R0.42 CCOCCOCC(C)C(=O)C 7a_100000032740_100011215890 [0,2,0,0,0,0|1,0,0]=3 10927 B11R0.42 CCOCCOCC(C)[N+](=O)[O-] 34a_100000039676_100000210147 [0,2,0,0,0,0|2,0,0]=4 10928 B11R0.42 CCOCCOCC(C)[N+](=O)[O-] 7a_100000039676_100011215890 [0,2,0,0,0,0|2,0,0]=4 10929 B11R0.42 CCOCCOC[C@H](N)C(=O)N 34a_100000729942_100000210147 [0,2,0,0,0,0|2,0,0]=4 10930 B11R0.42 CCOCCOC[C@H](N)C(C)C 34a_100011830312_100000210147 [0,2,0,0,0,0|1,0,0]=3 10931 B11R0.42 CCSCCOCC(C)C(=O)C 34a_100000032740_100000757381 [0,2,0,0,0,0|1,1,0]=4 10932 B11R0.42 CCSCCOCC(C)C(=O)C 7a_100000032740_100000757381 [0,2,0,0,0,0|1,1,0]=4 10933 B11R0.42 CCSCCOC[C@H](N)C(C)C 34a_100011830312_100000757381 [0,2,0,0,0,0|1,1,0]=4 10934 B11R0.42 COCCCCCC(=O)C(C)C 1458a_100011935119_100000210206 [0,2,0,0,0,0|2,0,0]=4 10935 B11R0.42 COCCOCCC(=O)C(C)C 1458a_100000210198_100000695917 [0,2,0,0,0,0|1,0,0]=3 10936 B11R0.42 COCCOCCC(=O)C(C)C 1458a_100000745395_100000210206 [0,2,0,0,0,0|1,0,0]=3 10937 B11R0.42 COCCOCCC(=O)C(C)F 1458a_100000062450_100000695917 [0,2,0,0,0,0|1,0,0]=3 10938 B11R0.42 COCCOCCC(=O)C(O)O 1458a_100000233687_100000695917 [0,2,0,0,0,0|2,0,0]=4 10939 B11R0.42 COCCOCCC(=O)N(C)C 11a_100102631434_100000745395 [0,2,0,0,0,0|2,0,0]=4 10940 B11R0.42 COCCOCCC(=O)N(C)C 1626a_100102631434_100000745395 [0,2,0,0,0,0|2,0,0]=4 10941 B11R0.42 COCCOCCC(=O)N(C)C 240690a_100102631434_100000745395 [0,2,0,0,0,0|2,0,0]=4 10942 B11R0.42 COCCOCCC(=O)N(C)C 34a_200000747469_100011201679 [0,2,0,0,0,0|2,0,0]=4 10943 B11R0.42 COCCOCCC(=O)N(C)C 527a_100102631434_100000745395 [0,2,0,0,0,0|2,0,0]=4 10944 B11R0.42 COCCOCCC(=O)[C@@H](C)O 1458a_100000717761_100000695917 [0,2,0,0,0,0|1,0,0]=3 10945 B11R0.42 COCCOCCC(=O)[C@H](C)O 1458a_217856618621_100000695917 [0,2,0,0,0,0|1,0,0]=3 10946 B11R0.42 COCCOCCC(N)C(C)C 34a_100161115045_100011201679 [0,2,0,0,0,0|1,0,0]=3 10947 B11R0.42 COCCOCCN(C)C(C)C 269982a_200000211004_100000695917 [0,2,0,0,0,0|1,0,0]=3 10948 B11R0.42 COCCOCNC(C)C(C)C 2230a_100000211541_100000231047 [0,2,0,0,0,0|2,0,0]=4 10949 B11R0.42 CSCCOCCC(N)C(C)C 34a_100161115045_100000212216 [0,2,0,0,0,0|1,1,0]=4 10950 B11R0.46 C=C(C)CCC(=O)CCOCC 1458a_100000749530_100000730704 [0,2,0,0,0,0|2,0,0]=4 10951 B11R0.46 C=C(C)CCC(=O)CCOCC 1458a_200000688413_100011215890 [0,2,0,0,0,0|2,0,0]=4 10952 B11R0.46 CC(C)CCC(C)OCCON 34a_100000700252_100011261404 [0,2,0,0,0,0|2,0,0]=4 10953 B11R0.46 CCCCOC(=O)COC(C)C 34a_100000212225_100000211628 [0,2,0,0,0,0|1,0,1]=4 10954 B11R0.46 CCCCOC(C)CCC(C)C 34a_100000210227_100011261404 [0,2,0,0,0,0|2,0,0]=4 10955 B11R0.46 CCCCOC(C)CCC(C)C 34a_100011215350_100000210210 [0,2,0,0,0,0|2,0,0]=4 10956 B11R0.46 CCCCOC(C)CCC(C)C 7a_100011215350_100000210211 [0,2,0,0,0,0|2,0,0]=4 10957 B11R0.46 CCOCCC(=O)CCC(C)C 1458a_100000181311_100011215890 [0,2,0,0,0,0|2,0,0]=4 10958 B11R0.46 CCOCCC(=O)CCC(C)C 1458a_100000749530_100000210312 [0,2,0,0,0,0|2,0,0]=4 10959 B11R0.46 CCOCCC(=O)CCC(C)O 1458a_100000749530_100012276601 [0,2,0,0,0,0|2,0,0]=4 10960 B11R0.46 CCOCCC(=O)CC[S+](C)C 1458a_100009452791_100011215890 [0,2,0,0,0,0|1,1,0]=4 10961 B11R0.46 CCOCCN(C)CCC(C)C 2230a_100000742789_100011215890 [0,2,0,0,0,0|2,0,0]=4 10962 B11R0.46 CCOCCN(C)CCC(C)C 269982a_100000742789_100011215890 [0,2,0,0,0,0|2,0,0]=4 10963 B11R0.46 CCOCCN(C)CCN(C)C 269982a_100000225618_100011215890 [0,2,0,0,0,0|2,0,0]=4 10964 B11R0.46 COCCCC(=O)COC(C)C 1458a_100000745533_100000740836 [0,2,0,0,0,0|1,0,1]=4 10965 B11R0.46 COCCCN(C)COC(C)C 2230a_100000224831_100000709892 [0,2,0,0,0,0|2,0,0]=4 10966 B11R0.46 COCCCN(C)COC(C)C 269982a_100000224831_100000709892 [0,2,0,0,0,0|2,0,0]=4 10967 B11R0.46 COCCNC(=O)COC(C)C 1626a_100000209980_100000745533 [0,2,0,0,0,0|1,0,1]=4 10968 B11R0.46 COCCNC(=O)COC(C)C 240690a_100000209980_100000745533 [0,2,0,0,0,0|1,0,1]=4 10969 B11R0.46 COCCNC(=O)COC(C)C 34a_100000212225_100000183275 [0,2,0,0,0,0|1,0,1]=4 10970 B11R0.46 COCCNC(=O)COC(C)C 527a_100000209980_100000745533 [0,2,0,0,0,0|1,0,1]=4 10971 B11R0.46 COCCNC(C)CCC(C)C 2230a_100000209980_100011261404 [0,2,0,0,0,0|2,0,0]=4 10972 B11R0.46 COCCNC(C)CCC(C)C 2230a_100138410893_100011201679 [0,2,0,0,0,0|2,0,0]=4 10973 B11R0.46 COCCNC(C)CCC(C)C 270004a_100000209980_100000210476 [0,2,0,0,0,0|2,0,0]=4 10974 B11R0.46 COCCNC(C)COC(=O)C 270004a_100000209980_100000000629 [0,2,0,0,0,0|1,0,1]=4 10975 B11R0.46 COCCOC(=O)CNC(C)C 2230a_100138425928_200000040189 [0,2,0,0,0,0|1,0,1]=4 10976 B11R0.46 COCCOC(=O)CNC(C)C 34a_100138425928_200000040189 [0,2,0,0,0,0|1,0,1]=4 10977 B11R0.46 COCCOC(=O)COC(C)C 34a_100000212225_200000040189 [0,2,0,0,0,0|0,0,1]=3 10978 B11R0.46 COCCOC(=O)CSC(C)C 62a_100000210206_200000040189 [0,2,0,0,0,0|0,1,1]=4 10979 B11R0.46 COCCOC(=O)CSC(C)C 62a_200000040189_100000210206 [0,2,0,0,0,0|0,1,1]=4 10980 B11R0.46 COCCOC(C)CCC(C)C 34a_100000210237_100011261404 [0,2,0,0,0,0|1,0,0]=3 10981 B11R0.46 COCCOC(C)CCC(C)C 34a_100011215350_100011201679 [0,2,0,0,0,0|1,0,0]=3 10982 B11R0.46 COCCOC(C)CCC(C)C 7a_100011215350_100000233755 [0,2,0,0,0,0|1,0,0]=3 10983 B11R0.46 COCCSC(C)CCC(C)C 62a_100000233755_100011261404 [0,2,0,0,0,0|1,1,0]=4 10984 B11R0.46 COCCSC(C)CCC(C)C 62a_100011261404_100000233755 [0,2,0,0,0,0|1,1,0]=4 10985 B11R0.46 CSCCOC(C)CCC(C)C 34a_100000230434_100011261404 [0,2,0,0,0,0|1,1,0]=4 10986 B11R0.46 CSCCOC(C)CCC(C)C 34a_100011215350_100000212216 [0,2,0,0,0,0|1,1,0]=4 10987 B11R0.46 CSCCOC(C)CCC(C)C 7a_100011215350_100000212216 [0,2,0,0,0,0|1,1,0]=4 10988 B11R0.111 C=C(C)CCOCCC(C)CC 7a_100011215188_100000730704 [0,2,0,0,0,0|2,0,0]=4 10989 B11R0.111 C=CC(C)COCCOC(C)C 34a_100011215527_100000211751 [0,2,0,0,0,0|1,0,1]=4 10990 B11R0.111 C=CC(C)COCCOC(C)C 7a_100011215527_100000211751 [0,2,0,0,0,0|1,0,1]=4 10991 B11R0.111 C=CC(O)COCCOC(C)C 34a_100000211219_100000730141 [0,2,0,0,0,0|1,0,1]=4 10992 B11R0.111 C=CC(O)COCCOC(C)C 7a_100000211219_100000730141 [0,2,0,0,0,0|1,0,1]=4 10993 B11R0.111 C=C[C@H](N)COCCOC(C)C 34a_100016989147_100000211751 [0,2,0,0,0,0|1,0,1]=4 10994 B11R0.111 CC(C)OCCOCC(Cl)CCl 34a_100000033668_100000211751 [0,2,0,0,0,0|2,0,0]=4 10995 B11R0.111 CC(C)OCCOCC(O)CO 34a_100000211219_100011219619 [0,2,0,0,0,0|2,0,0]=4 10996 B11R0.111 CC(C)OCCOCC(O)CO 7a_100000211219_100011219619 [0,2,0,0,0,0|2,0,0]=4 10997 B11R0.111 CC(C)OCCOC[C@@H](C)CO 34a_100000211219_100000059175 [0,2,0,0,0,0|2,0,0]=4 10998 B11R0.111 CC(C)OCCOC[C@@H](C)CO 7a_100000211219_100000059175 [0,2,0,0,0,0|2,0,0]=4 10999 B11R0.111 CC(C)OCCOC[C@@H](O)CF 34a_100000211219_100015614560 [0,2,0,0,0,0|2,0,0]=4 11000 B11R0.111 CC(C)OCCOC[C@@H](O)CF 7a_100000211219_100015614560 [0,2,0,0,0,0|2,0,0]=4 11001 B11R0.111 CC(C)OCCOC[C@@H](O)CO 34a_100000211219_100009815848 [0,2,0,0,0,0|2,0,0]=4 11002 B11R0.111 CC(C)OCCOC[C@@H](O)CO 7a_100000211219_100009815848 [0,2,0,0,0,0|2,0,0]=4 11003 B11R0.111 CC(C)OCCOC[C@H](F)CN 34a_100015665980_100000211751 [0,2,0,0,0,0|2,0,0]=4 11004 B11R0.111 CC(CN)COCCOC(C)C 34a_100000744482_100000211751 [0,2,0,0,0,0|2,0,0]=4 11005 B11R0.111 CCC(=O)COCCOC(C)C 34a_100000725409_100000211751 [0,2,0,0,0,0|1,0,1]=4 11006 B11R0.111 CCC(=O)COCCOC(C)C 7a_100000211219_100000747405 [0,2,0,0,0,0|1,0,1]=4 11007 B11R0.111 CCC(C)CCOCCC(=O)C 7a_100011215188_100000053229 [0,2,0,0,0,0|2,0,0]=4 11008 B11R0.111 CCC(C)CCOCCC(C)C 7a_100011215188_100000210626 [0,2,0,0,0,0|2,0,0]=4 11009 B11R0.111 CCC(C)CCOCCC(C)O 7a_100011215188_100012276601 [0,2,0,0,0,0|2,0,0]=4 11010 B11R0.111 CCC(C)CCOCCN(C)C 7a_100011215188_100000755713 [0,2,0,0,0,0|2,0,0]=4 11011 B11R0.111 CCC(C)CNCCOC(C)C 2230a_100000701111_100000748023 [0,2,0,0,0,0|2,0,0]=4 11012 B11R0.111 CCC(C)CNCCOC(C)C 2230a_100020588543_100000211751 [0,2,0,0,0,0|2,0,0]=4 11013 B11R0.111 CCC(C)CNCCOC(C)C 270004a_100000701111_100000243153 [0,2,0,0,0,0|2,0,0]=4 11014 B11R0.111 CCC(C)CNCCOC(C)C 34a_100000701111_100000748023 [0,2,0,0,0,0|2,0,0]=4 11015 B11R0.111 CCC(C)COCCCC(C)C 34a_100000210774_100000748023 [0,2,0,0,0,0|2,0,0]=4 11016 B11R0.111 CCC(C)COCCCC(C)C 7a_100000210774_100000748023 [0,2,0,0,0,0|2,0,0]=4 11017 B11R0.111 CCC(C)COCCNC(C)C 34a_100000224655_100000748023 [0,2,0,0,0,0|2,0,0]=4 11018 B11R0.111 CCC(C)COCCOC(C)C 34a_100000211219_100000748023 [0,2,0,0,0,0|1,0,0]=3 11019 B11R0.111 CCC(C)COCCOC(C)C 7a_100000211219_100000748023 [0,2,0,0,0,0|1,0,0]=3 11020 B11R0.111 CCC(C)COCCSC(C)C 34a_200011212901_100000748023 [0,2,0,0,0,0|1,1,0]=4 11021 B11R0.111 CCC(C)COCCSC(C)C 7a_200011212901_100000748023 [0,2,0,0,0,0|1,1,0]=4 11022 B11R0.111 CCC(C)CSCCOC(C)C 62a_100000211751_100000748023 [0,2,0,0,0,0|1,1,0]=4 11023 B11R0.111 CCC(C)CSCCOC(C)C 62a_100000748023_100000211751 [0,2,0,0,0,0|1,1,0]=4 11024 B11R0.111 CCC(O)CNCCOC(C)C 2230a_100000701111_100011218378 [0,2,0,0,0,0|2,0,0]=4 11025 B11R0.111 CCC(O)CNCCOC(C)C 2230a_100011218483_100000211751 [0,2,0,0,0,0|2,0,0]=4 11026 B11R0.111 CCC(O)CNCCOC(C)C 34a_100000701111_100011218378 [0,2,0,0,0,0|2,0,0]=4 11027 B11R0.111 CCC(O)COCCCC(C)C 34a_100000210774_100011218378 [0,2,0,0,0,0|2,0,0]=4 11028 B11R0.111 CCC(O)COCCCC(C)C 7a_100000210774_100011218378 [0,2,0,0,0,0|2,0,0]=4 11029 B11R0.111 CCC(O)COCCNC(C)C 34a_100000224655_100011218378 [0,2,0,0,0,0|2,0,0]=4 11030 B11R0.111 CCC(O)COCCOC(C)C 34a_100000211219_100011218378 [0,2,0,0,0,0|1,0,0]=3 11031 B11R0.111 CCC(O)COCCOC(C)C 7a_100000211219_100011218378 [0,2,0,0,0,0|1,0,0]=3 11032 B11R0.111 CCC(O)COCCSC(C)C 34a_200011212901_100011218378 [0,2,0,0,0,0|1,1,0]=4 11033 B11R0.111 CCC(O)COCCSC(C)C 7a_200011212901_100011218378 [0,2,0,0,0,0|1,1,0]=4 11034 B11R0.111 CCC(O)CSCCOC(C)C 62a_100000211751_100011218378 [0,2,0,0,0,0|1,1,0]=4 11035 B11R0.111 CCC(O)CSCCOC(C)C 62a_100011218378_100000211751 [0,2,0,0,0,0|1,1,0]=4 11036 B11R0.111 CC[C@H](C)CNCCOC(C)C 2230a_100000701111_100009816398 [0,2,0,0,0,0|2,0,0]=4 11037 B11R0.111 CC[C@H](C)CNCCOC(C)C 34a_100000701111_100009816398 [0,2,0,0,0,0|2,0,0]=4 11038 B11R0.111 CC[C@H](C)COCCCC(C)C 34a_100000210774_100009816398 [0,2,0,0,0,0|2,0,0]=4 11039 B11R0.111 CC[C@H](C)COCCCC(C)C 7a_100000210774_100009816398 [0,2,0,0,0,0|2,0,0]=4 11040 B11R0.111 CC[C@H](C)COCCCC(C)C 7a_100009816381_100011214892 [0,2,0,0,0,0|2,0,0]=4 11041 B11R0.111 CC[C@H](C)COCCCC(C)O 7a_100009816381_200000718107 [0,2,0,0,0,0|2,0,0]=4 11042 B11R0.111 CC[C@H](C)COCCNC(C)C 34a_100000224655_100009816398 [0,2,0,0,0,0|2,0,0]=4 11043 B11R0.111 CC[C@H](C)COCCOC(=O)C 7a_100009816381_100009814007 [0,2,0,0,0,0|1,0,1]=4 11044 B11R0.111 CC[C@H](C)COCCOC(C)C 34a_100000211219_100009816398 [0,2,0,0,0,0|1,0,0]=3 11045 B11R0.111 CC[C@H](C)COCCOC(C)C 7a_100000211219_100009816398 [0,2,0,0,0,0|1,0,0]=3 11046 B11R0.111 CC[C@H](C)COCCOC(C)C 7a_100009816381_100000211751 [0,2,0,0,0,0|1,0,0]=3 11047 B11R0.111 CC[C@H](C)COCCSC(C)C 34a_200011212901_100009816398 [0,2,0,0,0,0|1,1,0]=4 11048 B11R0.111 CC[C@H](C)COCCSC(C)C 7a_100009816381_100000730970 [0,2,0,0,0,0|1,1,0]=4 11049 B11R0.111 CC[C@H](C)COCCSC(C)C 7a_200011212901_100009816398 [0,2,0,0,0,0|1,1,0]=4 11050 B11R0.111 CC[C@H](C)CSCCOC(C)C 62a_100000211751_100009816398 [0,2,0,0,0,0|1,1,0]=4 11051 B11R0.111 CC[C@H](C)CSCCOC(C)C 62a_100009816398_100000211751 [0,2,0,0,0,0|1,1,0]=4 11052 B11R0.111 CNC(=O)COCCOC(C)C 34a_100000211219_100000183359 [0,2,0,0,0,0|1,0,1]=4 11053 B11R0.111 CNC(=O)COCCOC(C)C 34a_100000750040_100000211751 [0,2,0,0,0,0|1,0,1]=4 11054 B11R0.111 CNC(=O)COCCOC(C)C 7a_100000211219_100000183359 [0,2,0,0,0,0|1,0,1]=4 11055 B11R0.111 COC(=O)CCCCOC(C)C 34a_100000059025_100000210206 [0,2,0,0,0,0|1,0,1]=4 11056 B11R0.111 COC(=O)CCCCOC(C)C 34a_100000212225_100000204269 [0,2,0,0,0,0|1,0,1]=4 11057 B11R0.111 COC(=O)CCCCOC(C)C 7a_100000059025_100000210206 [0,2,0,0,0,0|1,0,1]=4 11058 B11R0.111 COC(=O)CNCCOC(C)C 2230a_100000701111_100000747449 [0,2,0,0,0,0|1,0,1]=4 11059 B11R0.111 COC(=O)CNCCOC(C)C 34a_100000701111_100000747449 [0,2,0,0,0,0|1,0,1]=4 11060 B11R0.111 COC(=O)COCCCC(C)C 34a_100000210774_100000747449 [0,2,0,0,0,0|1,0,1]=4 11061 B11R0.111 COC(=O)COCCCC(C)C 7a_100000210774_100000747449 [0,2,0,0,0,0|1,0,1]=4 11062 B11R0.111 COC(=O)COCCNC(C)C 2230a_100138425928_100000090808 [0,2,0,0,0,0|1,0,1]=4 11063 B11R0.111 COC(=O)COCCNC(C)C 34a_100000224655_100000747449 [0,2,0,0,0,0|1,0,1]=4 11064 B11R0.111 COC(=O)COCCNC(C)C 34a_100138425928_100000090808 [0,2,0,0,0,0|1,0,1]=4 11065 B11R0.111 COC(=O)COCCOC(C)C 34a_100000211219_100000747449 [0,2,0,0,0,0|0,0,1]=3 11066 B11R0.111 COC(=O)COCCOC(C)C 34a_100000212225_100000090808 [0,2,0,0,0,0|0,0,1]=3 11067 B11R0.111 COC(=O)COCCOC(C)C 7a_100000211219_100000747449 [0,2,0,0,0,0|0,0,1]=3 11068 B11R0.111 COC(=O)COCCSC(C)C 34a_200011212901_100000747449 [0,2,0,0,0,0|0,1,1]=4 11069 B11R0.111 COC(=O)COCCSC(C)C 62a_100000090808_100000210206 [0,2,0,0,0,0|0,1,1]=4 11070 B11R0.111 COC(=O)COCCSC(C)C 62a_100000210206_100000090808 [0,2,0,0,0,0|0,1,1]=4 11071 B11R0.111 COC(=O)COCCSC(C)C 7a_200011212901_100000747449 [0,2,0,0,0,0|0,1,1]=4 11072 B11R0.111 COC(=O)CSCCOC(C)C 62a_100000211751_100000747449 [0,2,0,0,0,0|0,1,1]=4 11073 B11R0.111 COC(=O)CSCCOC(C)C 62a_100000747449_100000211751 [0,2,0,0,0,0|0,1,1]=4 11074 B11R0.111 COC(C)COCCC=C(C)C 34a_100000690652_100011217483 [0,2,0,0,0,0|1,0,1]=4 11075 B11R0.111 COC(C)COCCCC(=O)C 34a_100000690652_100000685027 [0,2,0,0,0,0|1,0,1]=4 11076 B11R0.111 COC(C)COCCCC(C)C 34a_100000690652_100011214892 [0,2,0,0,0,0|1,0,0]=3 11077 B11R0.111 COC(C)COCCCC(C)O 34a_100000690652_200000718107 [0,2,0,0,0,0|1,0,0]=3 11078 B11R0.111 COC(C)COCCOC(=O)C 34a_100000690652_100009814007 [0,2,0,0,0,0|0,0,1]=3 11079 B11R0.111 COC(C)COCCOC(=O)N 34a_100000690652_200011214921 [0,2,0,0,0,0|1,0,1]=4 11080 B11R0.111 COC(C)COCCOC(C)C 34a_100000690652_100000211751 [0,2,0,0,0,0|0,0,0]=2 11081 B11R0.111 COC(C)COCCSC(C)C 34a_100000690652_100000730970 [0,2,0,0,0,0|0,1,0]=3 11082 B11R0.111 CO[C@H](C)CNCCCC(C)C 2230a_100020591295_100011214892 [0,2,0,0,0,0|2,0,0]=4 11083 B11R0.111 CO[C@H](C)CNCCCC(C)O 2230a_100020591295_200000718107 [0,2,0,0,0,0|2,0,0]=4 11084 B11R0.111 CO[C@H](C)CNCCOC(C)C 2230a_100020591295_100000211751 [0,2,0,0,0,0|1,0,0]=3 11085 B11R0.111 CO[C@H](C)CNCCSC(C)C 2230a_100020591295_100000730970 [0,2,0,0,0,0|1,1,0]=4 11086 B11R0.147 C=C(C)CCOC(C)CCCC 34a_100000687866_100000730704 [0,2,0,0,0,0|2,0,0]=4 11087 B11R0.147 C=C(C)CCOC(C)CCCC 34a_100000764851_200011215066 [0,2,0,0,0,0|2,0,0]=4 11088 B11R0.147 C=C(C)CCOC(C)CCCC 7a_100000687866_100000730704 [0,2,0,0,0,0|2,0,0]=4 11089 B11R0.147 C=C(C)CCOC(C)COCC 34a_100000718985_100000730704 [0,2,0,0,0,0|1,0,0]=3 11090 B11R0.147 C=C(C)CCOC(C)COCC 7a_100000718985_100000730704 [0,2,0,0,0,0|1,0,0]=3 11091 B11R0.147 CC(C)CCCC(C)CCO[13CH3] 34a_100000015991_200025704644 [0,2,0,0,0,0|2,0,0]=4 11092 B11R0.147 CC(C)CCCC(C)CCO[13CH3] 7a_100000015991_200025704644 [0,2,0,0,0,0|2,0,0]=4 11093 B11R0.147 CCCCC(=O)CCOC(C)C 1458a_100000210183_100000211751 [0,2,0,0,0,0|2,0,0]=4 11094 B11R0.147 CCCCC(C)OCCC(=O)C 34a_100000759926_200011215066 [0,2,0,0,0,0|2,0,0]=4 11095 B11R0.147 CCCCC(C)OCCC(=O)C 7a_100000687866_100000053229 [0,2,0,0,0,0|2,0,0]=4 11096 B11R0.147 CCCCC(C)OCCC(=O)C 7a_100000759926_200011215066 [0,2,0,0,0,0|2,0,0]=4 11097 B11R0.147 CCCCC(C)OCCC(C)Br 34a_100009893172_200011215066 [0,2,0,0,0,0|2,0,0]=4 11098 B11R0.147 CCCCC(C)OCCC(C)C 34a_100000210254_200011215066 [0,2,0,0,0,0|2,0,0]=4 11099 B11R0.147 CCCCC(C)OCCC(C)C 34a_100000687866_100000210312 [0,2,0,0,0,0|2,0,0]=4 11100 B11R0.147 CCCCC(C)OCCC(C)C 7a_100000210254_200011215066 [0,2,0,0,0,0|2,0,0]=4 11101 B11R0.147 CCCCC(C)OCCC(C)C 7a_100000687866_100000210626 [0,2,0,0,0,0|2,0,0]=4 11102 B11R0.147 CCCCC(C)OCCC(C)O 34a_100000687866_100012276601 [0,2,0,0,0,0|2,0,0]=4 11103 B11R0.147 CCCCC(C)OCCC(C)O 7a_100000687866_100012276601 [0,2,0,0,0,0|2,0,0]=4 11104 B11R0.147 CCCCC(C)OCCN(C)C 7a_100000687866_100000755713 [0,2,0,0,0,0|2,0,0]=4 11105 B11R0.147 CCCCC(C)OCC[C@@H](C)N 34a_100000706166_200011215066 [0,2,0,0,0,0|2,0,0]=4 11106 B11R0.147 CCCCN(C)CCOC(C)C 2230a_100000207549_100000211751 [0,2,0,0,0,0|2,0,0]=4 11107 B11R0.147 CCCCN(C)CCOC(C)C 269982a_100000207549_100000211751 [0,2,0,0,0,0|2,0,0]=4 11108 B11R0.147 CCOCC(C)OCC=C(C)C 34a_100000718985_100000761012 [0,2,0,0,0,0|1,0,1]=4 11109 B11R0.147 CCOCC(C)OCC=C(C)C 7a_100000718985_100000761012 [0,2,0,0,0,0|1,0,1]=4 11110 B11R0.147 CCOCC(C)OCCC(=O)C 7a_100000718985_100000053229 [0,2,0,0,0,0|1,0,0]=3 11111 B11R0.147 CCOCC(C)OCCC(=O)N 34a_100000718985_100000731001 [0,2,0,0,0,0|2,0,0]=4 11112 B11R0.147 CCOCC(C)OCCC(=O)N 7a_100000718985_100000744528 [0,2,0,0,0,0|2,0,0]=4 11113 B11R0.147 CCOCC(C)OCCC(C)C 34a_100000718985_100000210312 [0,2,0,0,0,0|1,0,0]=3 11114 B11R0.147 CCOCC(C)OCCC(C)C 7a_100000718985_100000210626 [0,2,0,0,0,0|1,0,0]=3 11115 B11R0.147 CCOCC(C)OCCC(C)O 34a_100000718985_100012276601 [0,2,0,0,0,0|1,0,0]=3 11116 B11R0.147 CCOCC(C)OCCC(C)O 7a_100000718985_100012276601 [0,2,0,0,0,0|1,0,0]=3 11117 B11R0.147 CCOCC(C)OCCN(C)C 7a_100000718985_100000755713 [0,2,0,0,0,0|1,0,0]=3 11118 B11R0.147 CCOCC(C)OCOC(=O)C 34a_100000718985_100009813279 [0,2,0,0,0,0|2,0,0]=4 11119 B11R0.147 CCOCC(C)OCOC(C)C 34a_100000718985_100000709892 [0,2,0,0,0,0|2,0,0]=4 11120 B11R0.147 COCCC(=O)CCCC(C)C 1458a_100000749529_100011214892 [0,2,0,0,0,0|2,0,0]=4 11121 B11R0.147 COCCC(=O)CCCC(C)C 1458a_100011216857_100000233755 [0,2,0,0,0,0|2,0,0]=4 11122 B11R0.147 COCCC(=O)CCCC(C)O 1458a_100000749529_200000718107 [0,2,0,0,0,0|2,0,0]=4 11123 B11R0.147 COCCC(=O)CCOC(=O)C 1458a_100000749529_100009814007 [0,2,0,0,0,0|1,0,1]=4 11124 B11R0.147 COCCC(=O)CCOC(C)C 1458a_100000749529_100000211751 [0,2,0,0,0,0|1,0,0]=3 11125 B11R0.147 COCCC(=O)CCSC(C)C 1458a_100000749529_100000730970 [0,2,0,0,0,0|1,1,0]=4 11126 B11R0.147 COCCC(C)CCCC(C)C 34a_100000015991_200000210301 [0,2,0,0,0,0|2,0,0]=4 11127 B11R0.147 COCCC(C)CCCC(C)C 34a_100138415774_100009816328 [0,2,0,0,0,0|2,0,0]=4 11128 B11R0.147 COCCC(C)CCCC(C)C 7a_100000015991_200000210301 [0,2,0,0,0,0|2,0,0]=4 11129 B11R0.147 COCCN(C)CCCC(C)C 2230a_100000743101_100011214892 [0,2,0,0,0,0|2,0,0]=4 11130 B11R0.147 COCCN(C)CCCC(C)C 269982a_100000743101_100011214892 [0,2,0,0,0,0|2,0,0]=4 11131 B11R0.147 COCCN(C)CCCC(C)O 2230a_100000743101_200000718107 [0,2,0,0,0,0|2,0,0]=4 11132 B11R0.147 COCCN(C)CCCC(C)O 269982a_100000743101_200000718107 [0,2,0,0,0,0|2,0,0]=4 11133 B11R0.147 COCCN(C)CCOC(=O)C 269982a_100000743101_100009814007 [0,2,0,0,0,0|1,0,1]=4 11134 B11R0.147 COCCN(C)CCOC(C)C 2230a_100000743101_100000211751 [0,2,0,0,0,0|1,0,0]=3 11135 B11R0.147 COCCN(C)CCOC(C)C 269982a_100000743101_100000211751 [0,2,0,0,0,0|1,0,0]=3 11136 B11R0.147 COCCN(C)CCSC(C)C 2230a_100000743101_100000730970 [0,2,0,0,0,0|1,1,0]=4 11137 B11R0.147 COCCN(C)CCSC(C)C 269982a_100000743101_100000730970 [0,2,0,0,0,0|1,1,0]=4 11138 B11R0.147 CSCCC(=O)CCOC(C)C 1458a_100000174002_100000211751 [0,2,0,0,0,0|1,1,0]=4 11139 B11R0.147 CSCCN(C)CCOC(C)C 2230a_100000686725_100000211751 [0,2,0,0,0,0|1,1,0]=4 11140 B11R0.147 CSCCN(C)CCOC(C)C 269982a_100000686725_100000211751 [0,2,0,0,0,0|1,1,0]=4 11141 B11R0.148 C#CCCCOCCOC(C)C 34a_100000211219_100000695029 [0,2,0,0,0,0|1,0,1]=4 11142 B11R0.148 C#CCCCOCCOC(C)C 34a_100000215630_100000211751 [0,2,0,0,0,0|1,0,1]=4 11143 B11R0.148 C#CCCCOCCOC(C)C 7a_100000211219_100011215417 [0,2,0,0,0,0|1,0,1]=4 11144 B11R0.148 C#CCCCOCCOC(C)C 7a_100000215630_100000211751 [0,2,0,0,0,0|1,0,1]=4 11145 B11R0.148 C#CCCOCCOCC(C)C 34a_100000703358_100000688953 [0,2,0,0,0,0|1,0,1]=4 11146 B11R0.148 C#CCCOCCOCC(C)C 7a_100000703358_100000688953 [0,2,0,0,0,0|1,0,1]=4 11147 B11R0.148 C#CCCOCCOCC(F)F 34a_100000704375_100000688953 [0,2,0,0,0,0|1,0,1]=4 11148 B11R0.148 C#CCCOCCOCC(F)F 34a_100011215631_200012177212 [0,2,0,0,0,0|1,0,1]=4 11149 B11R0.148 C#CCCOCCOCC(F)F 7a_100000704375_100000688953 [0,2,0,0,0,0|1,0,1]=4 11150 B11R0.148 C#CCOCCOCCC(=C)C 34a_100000054580_100000730704 [0,2,0,0,0,0|1,0,1]=4 11151 B11R0.148 C#CCOCCOCCC(=C)C 34a_100000764851_100010402529 [0,2,0,0,0,0|1,0,1]=4 11152 B11R0.148 C#CCOCCOCCC(=C)C 7a_100000054580_100000730704 [0,2,0,0,0,0|1,0,1]=4 11153 B11R0.148 C#CCOCCOCCC(=O)C 1458a_100000070787_100010408581 [0,2,0,0,0,0|1,0,1]=4 11154 B11R0.148 C#CCOCCOCCC(=O)C 1458a_100019993476_200000210301 [0,2,0,0,0,0|1,0,1]=4 11155 B11R0.148 C#CCOCCOCCC(=O)C 34a_100000759926_100010402529 [0,2,0,0,0,0|1,0,1]=4 11156 B11R0.148 C#CCOCCOCCC(=O)C 7a_100000054580_100000053229 [0,2,0,0,0,0|1,0,1]=4 11157 B11R0.148 C#CCOCCOCCC(=O)C 7a_100000759926_100010402529 [0,2,0,0,0,0|1,0,1]=4 11158 B11R0.148 C#CCOCCOCCC(=O)[13CH3] 1458a_100019993476_200025704644 [0,2,0,0,0,0|1,0,1]=4 11159 B11R0.148 C#CCOCCOCCC(C)Br 34a_100009893172_100010402529 [0,2,0,0,0,0|1,0,1]=4 11160 B11R0.148 C#CCOCCOCCC(C)C 34a_100000054580_100000210312 [0,2,0,0,0,0|1,0,1]=4 11161 B11R0.148 C#CCOCCOCCC(C)C 34a_100000210254_100010402529 [0,2,0,0,0,0|1,0,1]=4 11162 B11R0.148 C#CCOCCOCCC(C)C 7a_100000054580_100000210626 [0,2,0,0,0,0|1,0,1]=4 11163 B11R0.148 C#CCOCCOCCC(C)C 7a_100000210254_100010402529 [0,2,0,0,0,0|1,0,1]=4 11164 B11R0.148 C#CCOCCOCCC(C)O 34a_100000054580_100012276601 [0,2,0,0,0,0|1,0,1]=4 11165 B11R0.148 C#CCOCCOCCC(C)O 7a_100000054580_100012276601 [0,2,0,0,0,0|1,0,1]=4 11166 B11R0.148 C#CCOCCOCCN(C)C 2230a_100102631434_100010408581 [0,2,0,0,0,0|1,0,1]=4 11167 B11R0.148 C#CCOCCOCCN(C)C 7a_100000054580_100000755713 [0,2,0,0,0,0|1,0,1]=4 11168 B11R0.148 C#CCOCCOCC[C@@H](C)N 34a_100000706166_100010402529 [0,2,0,0,0,0|1,0,1]=4 11169 B11R0.148 C/C=C/CCOCCCC(C)C 34a_100016278192_100011214892 [0,2,0,0,0,0|2,0,0]=4 11170 B11R0.148 C/C=C/CCOCCCC(C)O 34a_100016278192_200000718107 [0,2,0,0,0,0|2,0,0]=4 11171 B11R0.148 C/C=C/CCOCCOC(=O)C 34a_100016278192_100009814007 [0,2,0,0,0,0|1,0,1]=4 11172 B11R0.148 C/C=C/CCOCCOC(C)C 34a_100016278192_100000211751 [0,2,0,0,0,0|1,0,0]=3 11173 B11R0.148 C/C=C/CCOCCSC(C)C 34a_100016278192_100000730970 [0,2,0,0,0,0|1,1,0]=4 11174 B11R0.148 C/C=C/COCCOCC(C)C 34a_100000703358_100102629194 [0,2,0,0,0,0|1,0,1]=4 11175 B11R0.148 C/C=C/COCCOCC(C)C 7a_100000703358_100102629194 [0,2,0,0,0,0|1,0,1]=4 11176 B11R0.148 C/C=C/COCCOCC(F)F 34a_100000704375_100102629194 [0,2,0,0,0,0|1,0,1]=4 11177 B11R0.148 C/C=C/COCCOCC(F)F 34a_100016270725_200012177212 [0,2,0,0,0,0|1,0,1]=4 11178 B11R0.148 C/C=C/COCCOCC(F)F 7a_100000704375_100102629194 [0,2,0,0,0,0|1,0,1]=4 11179 B11R0.148 C=C(Br)CCOCCCOCC 34a_100009813270_100012232248 [0,2,0,0,0,0|1,0,1]=4 11180 B11R0.148 C=C(Br)CCOCCOCCC 34a_100009813270_100011215938 [0,2,0,0,0,0|1,0,1]=4 11181 B11R0.148 C=C(Br)CCOCCOCCO 34a_100009813270_100000692535 [0,2,0,0,0,0|1,0,1]=4 11182 B11R0.148 C=C(C)CCNCCCOCC 2230a_100000210961_100000730704 [0,2,0,0,0,0|2,0,0]=4 11183 B11R0.148 C=C(C)CCNCCCOCC 34a_100000210961_100000730704 [0,2,0,0,0,0|2,0,0]=4 11184 B11R0.148 C=C(C)CCNCCOCCC 2230a_100161115042_100000730704 [0,2,0,0,0,0|2,0,0]=4 11185 B11R0.148 C=C(C)CCNCCOCCC 34a_100161115042_100000730704 [0,2,0,0,0,0|2,0,0]=4 11186 B11R0.148 C=C(C)CCNCCOCCO 2230a_100000211614_100000730704 [0,2,0,0,0,0|2,0,0]=4 11187 B11R0.148 C=C(C)CCNCCOCCO 34a_100000211614_100000730704 [0,2,0,0,0,0|2,0,0]=4 11188 B11R0.148 C=C(C)CCOCC/C=C\CC 34a_100000764851_100015370543 [0,2,0,0,0,0|2,0,0]=4 11189 B11R0.148 C=C(C)CCOCC/C=C\CC 34a_100016288707_100000730704 [0,2,0,0,0,0|2,0,0]=4 11190 B11R0.148 C=C(C)CCOCC/C=C\CC 7a_100016288707_100000730704 [0,2,0,0,0,0|2,0,0]=4 11191 B11R0.148 C=C(C)CCOCCC#CCC 34a_100000036655_100000730704 [0,2,0,0,0,0|2,0,0]=4 11192 B11R0.148 C=C(C)CCOCCC#CCC 7a_100000036655_100000730704 [0,2,0,0,0,0|2,0,0]=4 11193 B11R0.148 C=C(C)CCOCCCCCBr 34a_100000746331_100000730704 [0,2,0,0,0,0|2,0,0]=4 11194 B11R0.148 C=C(C)CCOCCCCCBr 7a_100000746331_100000730704 [0,2,0,0,0,0|2,0,0]=4 11195 B11R0.148 C=C(C)CCOCCCCCC 34a_100000210259_100000730704 [0,2,0,0,0,0|2,0,0]=4 11196 B11R0.148 C=C(C)CCOCCCCCC 34a_100000764851_100000210314 [0,2,0,0,0,0|2,0,0]=4 11197 B11R0.148 C=C(C)CCOCCCCCC 7a_100000210259_100000730704 [0,2,0,0,0,0|2,0,0]=4 11198 B11R0.148 C=C(C)CCOCCCCCCl 34a_100000746330_100000730704 [0,2,0,0,0,0|2,0,0]=4 11199 B11R0.148 C=C(C)CCOCCCCCCl 7a_100000746330_100000730704 [0,2,0,0,0,0|2,0,0]=4 11200 B11R0.148 C=C(C)CCOCCCCCF 34a_100000764851_100000729378 [0,2,0,0,0,0|2,0,0]=4 11201 B11R0.148 C=C(C)CCOCCCCCI 34a_200012148887_100000730704 [0,2,0,0,0,0|2,0,0]=4 11202 B11R0.148 C=C(C)CCOCCCCCI 7a_200012148887_100000730704 [0,2,0,0,0,0|2,0,0]=4 11203 B11R0.148 C=C(C)CCOCCCCCN 34a_100000762737_100000730704 [0,2,0,0,0,0|2,0,0]=4 11204 B11R0.148 C=C(C)CCOCCCCCO 34a_100000764851_100000746330 [0,2,0,0,0,0|2,0,0]=4 11205 B11R0.148 C=C(C)CCOCCCCOC 34a_100000740925_100000730704 [0,2,0,0,0,0|2,0,0]=4 11206 B11R0.148 C=C(C)CCOCCCCOC 34a_100000764851_100000755781 [0,2,0,0,0,0|2,0,0]=4 11207 B11R0.148 C=C(C)CCOCCCCSC 34a_100011217163_100000730704 [0,2,0,0,0,0|2,0,0]=4 11208 B11R0.148 C=C(C)CCOCCCCSC 7a_100011217163_100000730704 [0,2,0,0,0,0|2,0,0]=4 11209 B11R0.148 C=C(C)CCOCCCOCC 34a_100000757476_100000730704 [0,2,0,0,0,0|1,0,0]=3 11210 B11R0.148 C=C(C)CCOCCCOCC 34a_100000764851_100012232248 [0,2,0,0,0,0|1,0,0]=3 11211 B11R0.148 C=C(C)CCOCCCOCC 7a_100000757476_100000730704 [0,2,0,0,0,0|1,0,0]=3 11212 B11R0.148 C=C(C)CCOCCCSCC 34a_100011216438_100000730704 [0,2,0,0,0,0|1,1,0]=4 11213 B11R0.148 C=C(C)CCOCCCSCC 7a_100011216438_100000730704 [0,2,0,0,0,0|1,1,0]=4 11214 B11R0.148 C=C(C)CCOCCOCCBr 34a_100000692535_100000730704 [0,2,0,0,0,0|1,0,0]=3 11215 B11R0.148 C=C(C)CCOCCOCCBr 7a_100000692535_100000730704 [0,2,0,0,0,0|1,0,0]=3 11216 B11R0.148 C=C(C)CCOCCOCCC 34a_100000752267_100000730704 [0,2,0,0,0,0|1,0,0]=3 11217 B11R0.148 C=C(C)CCOCCOCCC 34a_100000764851_100011215938 [0,2,0,0,0,0|1,0,0]=3 11218 B11R0.148 C=C(C)CCOCCOCCC 7a_100000752267_100000730704 [0,2,0,0,0,0|1,0,0]=3 11219 B11R0.148 C=C(C)CCOCCOCCCl 34a_100011215305_100000730704 [0,2,0,0,0,0|1,0,0]=3 11220 B11R0.148 C=C(C)CCOCCOCCCl 7a_100011215305_100000730704 [0,2,0,0,0,0|1,0,0]=3 11221 B11R0.148 C=C(C)CCOCCOCCF 34a_200015357709_100000730704 [0,2,0,0,0,0|1,0,0]=3 11222 B11R0.148 C=C(C)CCOCCOCCF 7a_200015357709_100000730704 [0,2,0,0,0,0|1,0,0]=3 11223 B11R0.148 C=C(C)CCOCCOCCI 34a_100012149058_100000730704 [0,2,0,0,0,0|1,0,0]=3 11224 B11R0.148 C=C(C)CCOCCOCCI 7a_100012149058_100000730704 [0,2,0,0,0,0|1,0,0]=3 11225 B11R0.148 C=C(C)CCOCCOCCN 34a_100000211614_100000730704 [0,2,0,0,0,0|1,0,0]=3 11226 B11R0.148 C=C(C)CCOCCOCCO 34a_100000764851_100000692535 [0,2,0,0,0,0|1,0,0]=3 11227 B11R0.148 C=C(C)CCOCCSCCC 34a_200000230433_100000730704 [0,2,0,0,0,0|1,1,0]=4 11228 B11R0.148 C=C(C)CCOCCSCCC 7a_200000230433_100000730704 [0,2,0,0,0,0|1,1,0]=4 11229 B11R0.148 C=C(C)CCOCOCCCC 34a_100000764851_100011995733 [0,2,0,0,0,0|2,0,0]=4 11230 B11R0.148 C=C(C)CCSCCCOCC 62a_100000730704_100012232248 [0,2,0,0,0,0|1,1,0]=4 11231 B11R0.148 C=C(C)CCSCCCOCC 62a_100012232248_100000730704 [0,2,0,0,0,0|1,1,0]=4 11232 B11R0.148 C=C(C)CCSCCOCCC 62a_100000730704_100011215938 [0,2,0,0,0,0|1,1,0]=4 11233 B11R0.148 C=C(C)CCSCCOCCC 62a_100011215938_100000730704 [0,2,0,0,0,0|1,1,0]=4 11234 B11R0.148 C=C(C)CCSCCOCCO 62a_100000730704_100011215305 [0,2,0,0,0,0|1,1,0]=4 11235 B11R0.148 C=C(C)CCSCCOCCO 62a_100011215305_100000730704 [0,2,0,0,0,0|1,1,0]=4 11236 B11R0.148 C=C(C)CCSCOCCOC 62a_100000231047_100000730704 [0,2,0,0,0,0|1,0,1]=4 11237 B11R0.148 C=C(C)CCSCOCCOC 62a_100000730704_100000231047 [0,2,0,0,0,0|1,0,1]=4 11238 B11R0.148 C=C(C)CNCCCCCOC 2230a_100000747528_100000748629 [0,2,0,0,0,0|2,0,0]=4 11239 B11R0.148 C=C(C)CNCCCCCOC 34a_100000747528_100000748629 [0,2,0,0,0,0|2,0,0]=4 11240 B11R0.148 C=C(C)CNCCOCCOC 2230a_100000745349_100000748629 [0,2,0,0,0,0|1,0,0]=3 11241 B11R0.148 C=C(C)CNCCOCCOC 34a_100000745349_100000748629 [0,2,0,0,0,0|1,0,0]=3 11242 B11R0.148 C=C(C)COCCCCCCC 34a_100000210245_100000210614 [0,2,0,0,0,0|2,0,0]=4 11243 B11R0.148 C=C(C)COCCCCCCC 34a_100000210272_100000748629 [0,2,0,0,0,0|2,0,0]=4 11244 B11R0.148 C=C(C)COCCCCCCC 7a_100000210272_100000748629 [0,2,0,0,0,0|2,0,0]=4 11245 B11R0.148 C=C(C)COCCCCCNC 34a_100000722520_100000748629 [0,2,0,0,0,0|2,0,0]=4 11246 B11R0.148 C=C(C)COCCOCCCC 34a_100000210238_100000748629 [0,2,0,0,0,0|1,0,0]=3 11247 B11R0.148 C=C(C)COCCOCCCC 34a_100000210245_100000743108 [0,2,0,0,0,0|1,0,0]=3 11248 B11R0.148 C=C(C)COCCOCCCC 7a_100000210238_100000748629 [0,2,0,0,0,0|1,0,0]=3 11249 B11R0.148 C=C(C)COCCOCCNC 34a_100000228057_100000748629 [0,2,0,0,0,0|1,0,0]=3 11250 B11R0.148 C=C(C)COCCOCCOC 34a_100000210245_100000695917 [0,2,0,0,0,0|0,0,0]=2 11251 B11R0.148 C=C(C)COCCOCCOC 34a_100011215163_100000748629 [0,2,0,0,0,0|0,0,0]=2 11252 B11R0.148 C=C(C)COCCOCCOC 7a_100011215163_100000748629 [0,2,0,0,0,0|0,0,0]=2 11253 B11R0.148 C=C(C)COCCSCCCC 34a_200000230436_100000748629 [0,2,0,0,0,0|1,1,0]=4 11254 B11R0.148 C=C(C)COCCSCCCC 7a_200000230436_100000748629 [0,2,0,0,0,0|1,1,0]=4 11255 B11R0.148 C=C(C)CSCCOCCCC 62a_100000743108_100000211660 [0,2,0,0,0,0|1,1,0]=4 11256 B11R0.148 C=C(C)CSCCOCCCC 62a_100000748629_100000743108 [0,2,0,0,0,0|1,1,0]=4 11257 B11R0.148 C=C(C)CSCCOCCOC 62a_100000695917_100000211660 [0,2,0,0,0,0|0,1,0]=3 11258 B11R0.148 C=C(C)CSCCOCCOC 62a_100000748629_100000695917 [0,2,0,0,0,0|0,1,0]=3 11259 B11R0.148 C=C(F)CNCCOCCOC 2230a_100000745349_100009893438 [0,2,0,0,0,0|1,0,1]=4 11260 B11R0.148 C=C(F)CNCCOCCOC 34a_100000745349_100009893438 [0,2,0,0,0,0|1,0,1]=4 11261 B11R0.148 C=C(F)COCCOCCCC 34a_100000210238_100009893438 [0,2,0,0,0,0|1,0,1]=4 11262 B11R0.148 C=C(F)COCCOCCCC 34a_200010262243_100000743108 [0,2,0,0,0,0|1,0,1]=4 11263 B11R0.148 C=C(F)COCCOCCCC 7a_100000210238_100000042424 [0,2,0,0,0,0|1,0,1]=4 11264 B11R0.148 C=C(F)COCCOCCNC 34a_100000228057_100009893438 [0,2,0,0,0,0|1,0,1]=4 11265 B11R0.148 C=C(F)COCCOCCOC 34a_100011215163_100009893438 [0,2,0,0,0,0|0,0,1]=3 11266 B11R0.148 C=C(F)COCCOCCOC 34a_200010262243_100000695917 [0,2,0,0,0,0|0,0,1]=3 11267 B11R0.148 C=C(F)COCCOCCOC 7a_100011215163_100000042424 [0,2,0,0,0,0|0,0,1]=3 11268 B11R0.148 C=C(F)CSCCOCCOC 62a_100000042424_100000695917 [0,2,0,0,0,0|0,1,1]=4 11269 B11R0.148 C=C(F)CSCCOCCOC 62a_100000695917_100000042424 [0,2,0,0,0,0|0,1,1]=4 11270 B11R0.148 C=CCCCOCCOC(C)C 34a_100000211219_100000757094 [0,2,0,0,0,0|1,0,1]=4 11271 B11R0.148 C=CCCCOCCOC(C)C 34a_100000758997_100000211751 [0,2,0,0,0,0|1,0,1]=4 11272 B11R0.148 C=CCCCOCCOC(C)C 7a_100000211219_100000757094 [0,2,0,0,0,0|1,0,1]=4 11273 B11R0.148 C=CCCCOCCOC(C)C 7a_100000758997_100000211751 [0,2,0,0,0,0|1,0,1]=4 11274 B11R0.148 C=CCCOCCOCC(C)C 34a_100000703358_100000754431 [0,2,0,0,0,0|1,0,1]=4 11275 B11R0.148 C=CCCOCCOCC(C)C 7a_100000703358_100000754431 [0,2,0,0,0,0|1,0,1]=4 11276 B11R0.148 C=CCCOCCOCC(F)F 34a_100000704375_100000754431 [0,2,0,0,0,0|1,0,1]=4 11277 B11R0.148 C=CCCOCCOCC(F)F 34a_100011205117_200012177212 [0,2,0,0,0,0|1,0,1]=4 11278 B11R0.148 C=CCCOCCOCC(F)F 7a_100000704375_100000754431 [0,2,0,0,0,0|1,0,1]=4 11279 B11R0.148 C=CCOCCOCCC(=C)C 34a_100000037705_100000730704 [0,2,0,0,0,0|1,0,1]=4 11280 B11R0.148 C=CCOCCOCCC(=C)C 7a_100000037705_100000730704 [0,2,0,0,0,0|1,0,1]=4 11281 B11R0.148 C=CCOCCOCCC(=O)C 7a_100000037705_100000053229 [0,2,0,0,0,0|1,0,1]=4 11282 B11R0.148 C=CCOCCOCCC(C)C 34a_100000037705_100000210312 [0,2,0,0,0,0|1,0,1]=4 11283 B11R0.148 C=CCOCCOCCC(C)C 7a_100000037705_100000210626 [0,2,0,0,0,0|1,0,1]=4 11284 B11R0.148 C=CCOCCOCCC(C)O 34a_100000037705_100012276601 [0,2,0,0,0,0|1,0,1]=4 11285 B11R0.148 C=CCOCCOCCC(C)O 7a_100000037705_100012276601 [0,2,0,0,0,0|1,0,1]=4 11286 B11R0.148 C=CCOCCOCCN(C)C 7a_100000037705_100000755713 [0,2,0,0,0,0|1,0,1]=4 11287 B11R0.148 C=COCCNCCOC(C)C 2230a_100000701111_100000039644 [0,2,0,0,0,0|1,0,1]=4 11288 B11R0.148 C=COCCNCCOC(C)C 34a_100000701111_100000039644 [0,2,0,0,0,0|1,0,1]=4 11289 B11R0.148 C=COCCOCCCC(C)C 34a_100000033082_100011214892 [0,2,0,0,0,0|1,0,1]=4 11290 B11R0.148 C=COCCOCCCC(C)C 34a_100000210774_100000039644 [0,2,0,0,0,0|1,0,1]=4 11291 B11R0.148 C=COCCOCCCC(C)C 7a_100000210774_100000039644 [0,2,0,0,0,0|1,0,1]=4 11292 B11R0.148 C=COCCOCCCC(C)O 34a_100000033082_200000718107 [0,2,0,0,0,0|1,0,1]=4 11293 B11R0.148 C=COCCOCCNC(C)C 34a_100000224655_100000039644 [0,2,0,0,0,0|1,0,1]=4 11294 B11R0.148 C=COCCOCCOC(=O)C 34a_100000033082_100009814007 [0,2,0,0,0,0|0,0,2]=4 11295 B11R0.148 C=COCCOCCOC(C)C 34a_100000033082_100000211751 [0,2,0,0,0,0|0,0,1]=3 11296 B11R0.148 C=COCCOCCOC(C)C 34a_100000039918_100000210206 [0,2,0,0,0,0|0,0,1]=3 11297 B11R0.148 C=COCCOCCOC(C)C 34a_100000211219_100000039644 [0,2,0,0,0,0|0,0,1]=3 11298 B11R0.148 C=COCCOCCOC(C)C 7a_100000039918_100000210206 [0,2,0,0,0,0|0,0,1]=3 11299 B11R0.148 C=COCCOCCOC(C)C 7a_100000211219_100000039644 [0,2,0,0,0,0|0,0,1]=3 11300 B11R0.148 C=COCCOCCSC(C)C 34a_100000033082_100000730970 [0,2,0,0,0,0|0,1,1]=4 11301 B11R0.148 C=COCCOCCSC(C)C 34a_200011212901_100000039644 [0,2,0,0,0,0|0,1,1]=4 11302 B11R0.148 C=COCCOCCSC(C)C 7a_200011212901_100000039644 [0,2,0,0,0,0|0,1,1]=4 11303 B11R0.148 C=COCCSCCOC(C)C 62a_100000039644_100000211751 [0,2,0,0,0,0|0,1,1]=4 11304 B11R0.148 C=COCCSCCOC(C)C 62a_100000211751_100000039644 [0,2,0,0,0,0|0,1,1]=4 11305 B11R0.148 CC#CCCOCCCC(C)C 34a_100000750427_100011214892 [0,2,0,0,0,0|2,0,0]=4 11306 B11R0.148 CC#CCCOCCCC(C)O 34a_100000750427_200000718107 [0,2,0,0,0,0|2,0,0]=4 11307 B11R0.148 CC#CCCOCCOC(=O)C 34a_100000750427_100009814007 [0,2,0,0,0,0|1,0,1]=4 11308 B11R0.148 CC#CCCOCCOC(C)C 34a_100000750427_100000211751 [0,2,0,0,0,0|1,0,0]=3 11309 B11R0.148 CC#CCCOCCSC(C)C 34a_100000750427_100000730970 [0,2,0,0,0,0|1,1,0]=4 11310 B11R0.148 CC#CCOCCOCC(C)C 34a_100000703358_100000748600 [0,2,0,0,0,0|1,0,1]=4 11311 B11R0.148 CC#CCOCCOCC(C)C 7a_100000703358_100000748600 [0,2,0,0,0,0|1,0,1]=4 11312 B11R0.148 CC#CCOCCOCC(F)F 34a_100000704375_100000748600 [0,2,0,0,0,0|1,0,1]=4 11313 B11R0.148 CC#CCOCCOCC(F)F 34a_100000761923_200012177212 [0,2,0,0,0,0|1,0,1]=4 11314 B11R0.148 CC#CCOCCOCC(F)F 7a_100000704375_100000748600 [0,2,0,0,0,0|1,0,1]=4 11315 B11R0.148 CC(=CCOCCOCCBr)C 34a_100000692535_100000761012 [0,2,0,0,0,0|1,0,1]=4 11316 B11R0.148 CC(=CCOCCOCCBr)C 7a_100000692535_100000761012 [0,2,0,0,0,0|1,0,1]=4 11317 B11R0.148 CC(=CCOCCOCCCl)C 34a_100011215305_100000761012 [0,2,0,0,0,0|1,0,1]=4 11318 B11R0.148 CC(=CCOCCOCCCl)C 7a_100011215305_100000761012 [0,2,0,0,0,0|1,0,1]=4 11319 B11R0.148 CC(=CCOCCOCCF)C 34a_200015357709_100000761012 [0,2,0,0,0,0|1,0,1]=4 11320 B11R0.148 CC(=CCOCCOCCF)C 7a_200015357709_100000761012 [0,2,0,0,0,0|1,0,1]=4 11321 B11R0.148 CC(=CCOCCOCCI)C 34a_100012149058_100000761012 [0,2,0,0,0,0|1,0,1]=4 11322 B11R0.148 CC(=CCOCCOCCI)C 7a_100012149058_100000761012 [0,2,0,0,0,0|1,0,1]=4 11323 B11R0.148 CC(=CCOCCOCCN)C 34a_100000211614_100000761012 [0,2,0,0,0,0|1,0,1]=4 11324 B11R0.148 CC(=CCOCCOCCO)C 34a_100000753907_100000692535 [0,2,0,0,0,0|1,0,1]=4 11325 B11R0.148 CC(=O)CCCCOCCON 34a_100000700252_100009817362 [0,2,0,0,0,0|2,0,0]=4 11326 B11R0.148 CC(=O)CCOCCCCCBr 7a_100000746331_100000053229 [0,2,0,0,0,0|2,0,0]=4 11327 B11R0.148 CC(=O)CCOCCCCCCl 7a_100000746330_100000053229 [0,2,0,0,0,0|2,0,0]=4 11328 B11R0.148 CC(=O)CCOCCCCCF 34a_100000759926_100000729378 [0,2,0,0,0,0|2,0,0]=4 11329 B11R0.148 CC(=O)CCOCCCCCF 7a_100000759926_100000729378 [0,2,0,0,0,0|2,0,0]=4 11330 B11R0.148 CC(=O)CCOCCCCCI 7a_200012148887_100000053229 [0,2,0,0,0,0|2,0,0]=4 11331 B11R0.148 CC(=O)CCOCCCCCO 34a_100000759926_100000746330 [0,2,0,0,0,0|2,0,0]=4 11332 B11R0.148 CC(=O)CCOCCCCCO 7a_100000759926_100000746330 [0,2,0,0,0,0|2,0,0]=4 11333 B11R0.148 CC(=O)CCOCCOCC#N 7a_100000759926_200000047693 [0,2,0,0,0,0|1,0,1]=4 11334 B11R0.148 CC(=O)CCOCCOCCBr 7a_100000692535_100000053229 [0,2,0,0,0,0|1,0,0]=3 11335 B11R0.148 CC(=O)CCOCCOCCCl 7a_100011215305_100000053229 [0,2,0,0,0,0|1,0,0]=3 11336 B11R0.148 CC(=O)CCOCCOCCF 7a_200015357709_100000053229 [0,2,0,0,0,0|1,0,0]=3 11337 B11R0.148 CC(=O)CCOCCOCCI 7a_100012149058_100000053229 [0,2,0,0,0,0|1,0,0]=3 11338 B11R0.148 CC(=O)CCOCCOCCO 1458a_100000070787_100000032323 [0,2,0,0,0,0|1,0,0]=3 11339 B11R0.148 CC(=O)CCOCCOCCO 1458a_100009915118_200000210301 [0,2,0,0,0,0|1,0,0]=3 11340 B11R0.148 CC(=O)CCOCCOCCO 34a_100000759926_100000692535 [0,2,0,0,0,0|1,0,0]=3 11341 B11R0.148 CC(=O)CCOCCOCCO 7a_100000759926_100011215305 [0,2,0,0,0,0|1,0,0]=3 11342 B11R0.148 CC(=O)CCSCCOCCO 62a_100000053229_100011215305 [0,2,0,0,0,0|1,1,0]=4 11343 B11R0.148 CC(=O)CCSCCOCCO 62a_100011215305_100000053229 [0,2,0,0,0,0|1,1,0]=4 11344 B11R0.148 CC(=O)OCCCOCCON 34a_100000700252_100000042594 [0,2,0,0,0,0|1,0,1]=4 11345 B11R0.148 CC(=O)OCCOCCCCBr 34a_100011216708_100009814007 [0,2,0,0,0,0|1,0,1]=4 11346 B11R0.148 CC(=O)OCCOCCCCCl 34a_100000210776_100009814007 [0,2,0,0,0,0|1,0,1]=4 11347 B11R0.148 CC(=O)OCCOCCCCCl 7a_100000210776_100009814007 [0,2,0,0,0,0|1,0,1]=4 11348 B11R0.148 CC(=O)OCCOCCCCF 34a_100011995726_100009814007 [0,2,0,0,0,0|1,0,1]=4 11349 B11R0.148 CC(=O)OCCOCCCCF 7a_100011995726_100009814007 [0,2,0,0,0,0|1,0,1]=4 11350 B11R0.148 CC(=O)OCCOCCCCI 34a_200012148704_100009814007 [0,2,0,0,0,0|1,0,1]=4 11351 B11R0.148 CC(=O)OCCOCCCCN 34a_100000750430_100009814007 [0,2,0,0,0,0|1,0,1]=4 11352 B11R0.148 CC(=O)OCCOCCSCF 62a_100015361967_200000083610 [0,2,0,0,0,0|0,1,1]=4 11353 B11R0.148 CC(=O)OCCOCCSCF 62a_200000083610_100015361967 [0,2,0,0,0,0|0,1,1]=4 11354 B11R0.148 CC(=O)OCOCCOCCBr 34a_100000692535_100009813279 [0,2,0,0,0,0|2,0,0]=4 11355 B11R0.148 CC(=O)OCOCCOCCCl 34a_100011215305_100009813279 [0,2,0,0,0,0|2,0,0]=4 11356 B11R0.148 CC(=O)OCOCCOCCF 34a_200015357709_100009813279 [0,2,0,0,0,0|2,0,0]=4 11357 B11R0.148 CC(=O)OCOCCOCCI 34a_100012149058_100009813279 [0,2,0,0,0,0|2,0,0]=4 11358 B11R0.148 CC(=O)OCOCCOCCN 34a_100000211614_100009813279 [0,2,0,0,0,0|2,0,0]=4 11359 B11R0.148 CC(=S)OCCCOCCON 34a_100000700252_200135323944 [0,2,0,0,0,0|1,0,1]=4 11360 B11R0.148 CC(Br)CCOCCCCCF 34a_100009893172_100000729378 [0,2,0,0,0,0|2,0,0]=4 11361 B11R0.148 CC(Br)CCOCCCCCO 34a_100009893172_100000746330 [0,2,0,0,0,0|2,0,0]=4 11362 B11R0.148 CC(Br)CCOCCOCCO 34a_100009893172_100000692535 [0,2,0,0,0,0|1,0,0]=3 11363 B11R0.148 CC(C)CCCCCCCO[13CH3] 34a_200000210741_200025704644 [0,2,0,0,0,0|2,0,0]=4 11364 B11R0.148 CC(C)CCCCCCCO[13CH3] 7a_200000210741_200025704644 [0,2,0,0,0,0|2,0,0]=4 11365 B11R0.148 CC(C)CCCCCOCCBr 34a_100000211926_100000210682 [0,2,0,0,0,0|2,0,0]=4 11366 B11R0.148 CC(C)CCCCCOCCF 34a_100011995859_100011217306 [0,2,0,0,0,0|2,0,0]=4 11367 B11R0.148 CC(C)CCCCCOCCF 7a_100011995859_100011217306 [0,2,0,0,0,0|2,0,0]=4 11368 B11R0.148 CC(C)CCCCCOCCN 34a_100000210304_100000210682 [0,2,0,0,0,0|2,0,0]=4 11369 B11R0.148 CC(C)CCCCCOCCO 34a_100011995859_100000211926 [0,2,0,0,0,0|2,0,0]=4 11370 B11R0.148 CC(C)CCCCCOCCO 7a_100011995859_100000211926 [0,2,0,0,0,0|2,0,0]=4 11371 B11R0.148 CC(C)CCCCOCCON 34a_100000700252_100011216152 [0,2,0,0,0,0|2,0,0]=4 11372 B11R0.148 CC(C)CCCOCCCCBr 34a_100011216708_100011214892 [0,2,0,0,0,0|2,0,0]=4 11373 B11R0.148 CC(C)CCCOCCCCCl 34a_100000210776_100011214892 [0,2,0,0,0,0|2,0,0]=4 11374 B11R0.148 CC(C)CCCOCCCCCl 7a_100000210776_100011214892 [0,2,0,0,0,0|2,0,0]=4 11375 B11R0.148 CC(C)CCCOCCCCF 34a_100000210774_100000729493 [0,2,0,0,0,0|2,0,0]=4 11376 B11R0.148 CC(C)CCCOCCCCF 34a_100011995726_100011214892 [0,2,0,0,0,0|2,0,0]=4 11377 B11R0.148 CC(C)CCCOCCCCF 7a_100000210774_100000729493 [0,2,0,0,0,0|2,0,0]=4 11378 B11R0.148 CC(C)CCCOCCCCF 7a_100011995726_100011214892 [0,2,0,0,0,0|2,0,0]=4 11379 B11R0.148 CC(C)CCCOCCCCI 34a_200012148704_100011214892 [0,2,0,0,0,0|2,0,0]=4 11380 B11R0.148 CC(C)CCCOCCCCN 34a_100000750430_100011214892 [0,2,0,0,0,0|2,0,0]=4 11381 B11R0.148 CC(C)CCCOCCCCO 34a_100000210774_100011216708 [0,2,0,0,0,0|2,0,0]=4 11382 B11R0.148 CC(C)CCCOCCCCO 7a_100000210774_100000210776 [0,2,0,0,0,0|2,0,0]=4 11383 B11R0.148 CC(C)CCNCCOCCO 2230a_100000211614_100000210312 [0,2,0,0,0,0|2,0,0]=4 11384 B11R0.148 CC(C)CCNCCOCCO 269862a_100000211614_100000185833 [0,2,0,0,0,0|2,0,0]=4 11385 B11R0.148 CC(C)CCNCCOCCO 34a_100000211614_100000210312 [0,2,0,0,0,0|2,0,0]=4 11386 B11R0.148 CC(C)CCOCCCCCBr 34a_100000746331_100000210312 [0,2,0,0,0,0|2,0,0]=4 11387 B11R0.148 CC(C)CCOCCCCCBr 7a_100000746331_100000210626 [0,2,0,0,0,0|2,0,0]=4 11388 B11R0.148 CC(C)CCOCCCCCCl 34a_100000746330_100000210312 [0,2,0,0,0,0|2,0,0]=4 11389 B11R0.148 CC(C)CCOCCCCCCl 7a_100000746330_100000210626 [0,2,0,0,0,0|2,0,0]=4 11390 B11R0.148 CC(C)CCOCCCCCF 34a_100000210254_100000729378 [0,2,0,0,0,0|2,0,0]=4 11391 B11R0.148 CC(C)CCOCCCCCF 7a_100000210254_100000729378 [0,2,0,0,0,0|2,0,0]=4 11392 B11R0.148 CC(C)CCOCCCCCI 34a_200012148887_100000210312 [0,2,0,0,0,0|2,0,0]=4 11393 B11R0.148 CC(C)CCOCCCCCI 7a_200012148887_100000210626 [0,2,0,0,0,0|2,0,0]=4 11394 B11R0.148 CC(C)CCOCCCCCN 34a_100000762737_100000210312 [0,2,0,0,0,0|2,0,0]=4 11395 B11R0.148 CC(C)CCOCCCCCO 34a_100000210254_100000746330 [0,2,0,0,0,0|2,0,0]=4 11396 B11R0.148 CC(C)CCOCCCCCO 7a_100000210254_100000746330 [0,2,0,0,0,0|2,0,0]=4 11397 B11R0.148 CC(C)CCOCCOCC#N 7a_100000210254_200000047693 [0,2,0,0,0,0|1,0,1]=4 11398 B11R0.148 CC(C)CCOCCOCCBr 34a_100000692535_100000210312 [0,2,0,0,0,0|1,0,0]=3 11399 B11R0.148 CC(C)CCOCCOCCBr 7a_100000692535_100000210626 [0,2,0,0,0,0|1,0,0]=3 11400 B11R0.148 CC(C)CCOCCOCCCl 34a_100011215305_100000210312 [0,2,0,0,0,0|1,0,0]=3 11401 B11R0.148 CC(C)CCOCCOCCCl 7a_100011215305_100000210626 [0,2,0,0,0,0|1,0,0]=3 11402 B11R0.148 CC(C)CCOCCOCCF 34a_200015357709_100000210312 [0,2,0,0,0,0|1,0,0]=3 11403 B11R0.148 CC(C)CCOCCOCCF 7a_200015357709_100000210626 [0,2,0,0,0,0|1,0,0]=3 11404 B11R0.148 CC(C)CCOCCOCCI 34a_100012149058_100000210312 [0,2,0,0,0,0|1,0,0]=3 11405 B11R0.148 CC(C)CCOCCOCCI 7a_100012149058_100000210626 [0,2,0,0,0,0|1,0,0]=3 11406 B11R0.148 CC(C)CCOCCOCCN 34a_100000211614_100000210312 [0,2,0,0,0,0|1,0,0]=3 11407 B11R0.148 CC(C)CCOCCOCCO 34a_100000210254_100000692535 [0,2,0,0,0,0|1,0,0]=3 11408 B11R0.148 CC(C)CCOCCOCCO 7a_100000210254_100011215305 [0,2,0,0,0,0|1,0,0]=3 11409 B11R0.148 CC(C)CCSCCOCCO 62a_100000210312_100011215305 [0,2,0,0,0,0|1,1,0]=4 11410 B11R0.148 CC(C)CCSCCOCCO 62a_100011215305_100000210312 [0,2,0,0,0,0|1,1,0]=4 11411 B11R0.148 CC(C)COCCOCCC#N 7a_100000703358_100000184422 [0,2,0,0,0,0|2,0,0]=4 11412 B11R0.148 CC(C)COCCOCCCF 34a_100000703358_100011934791 [0,2,0,0,0,0|2,0,0]=4 11413 B11R0.148 CC(C)COCCOCCCF 7a_100000703358_100011934791 [0,2,0,0,0,0|2,0,0]=4 11414 B11R0.148 CC(C)COCCOCCCO 34a_100000703358_100000230001 [0,2,0,0,0,0|2,0,0]=4 11415 B11R0.148 CC(C)COCCOCCCO 7a_100000703358_100011215043 [0,2,0,0,0,0|2,0,0]=4 11416 B11R0.148 CC(C)NCCCCCOCF 34a_100011629493_100015361967 [0,2,0,0,0,0|2,0,0]=4 11417 B11R0.148 CC(C)NCCOCCCCF 34a_100000224655_100000729493 [0,2,0,0,0,0|2,0,0]=4 11418 B11R0.148 CC(C)NCCOCCCCO 34a_100000224655_100011216708 [0,2,0,0,0,0|2,0,0]=4 11419 B11R0.148 CC(C)OCCCCCCCBr 34a_100000760002_100000210206 [0,2,0,0,0,0|2,0,0]=4 11420 B11R0.148 CC(C)OCCCCCCCBr 7a_100000760002_100000210206 [0,2,0,0,0,0|2,0,0]=4 11421 B11R0.148 CC(C)OCCCCCCCN 34a_100011996573_100000210206 [0,2,0,0,0,0|2,0,0]=4 11422 B11R0.148 CC(C)OCCCCCCCO 34a_100000212225_100000760002 [0,2,0,0,0,0|2,0,0]=4 11423 B11R0.148 CC(C)OCCCOCCCN 34a_100011310245_100000210206 [0,2,0,0,0,0|2,0,0]=4 11424 B11R0.148 CC(C)OCCNCCCCF 2230a_100000701111_100000729493 [0,2,0,0,0,0|2,0,0]=4 11425 B11R0.148 CC(C)OCCNCCCCF 34a_100000701111_100000729493 [0,2,0,0,0,0|2,0,0]=4 11426 B11R0.148 CC(C)OCCNCCCCO 2230a_100000701111_100000210776 [0,2,0,0,0,0|2,0,0]=4 11427 B11R0.148 CC(C)OCCNCCCCO 2230a_100000750430_100000211751 [0,2,0,0,0,0|2,0,0]=4 11428 B11R0.148 CC(C)OCCNCCCCO 34a_100000701111_100011216708 [0,2,0,0,0,0|2,0,0]=4 11429 B11R0.148 CC(C)OCCNCCCCO 34a_100000750430_100000211751 [0,2,0,0,0,0|2,0,0]=4 11430 B11R0.148 CC(C)OCCOCC#CCCl 34a_200000047223_100000211751 [0,2,0,0,0,0|1,0,1]=4 11431 B11R0.148 CC(C)OCCOCC#CCO 34a_100000211219_200000047223 [0,2,0,0,0,0|1,0,1]=4 11432 B11R0.148 CC(C)OCCOCC#CCO 7a_100000211219_200000047223 [0,2,0,0,0,0|1,0,1]=4 11433 B11R0.148 CC(C)OCCOCCCC#N 7a_100000211219_100000687738 [0,2,0,0,0,0|1,0,1]=4 11434 B11R0.148 CC(C)OCCOCCCC=O 7a_100000211219_200011292268 [0,2,0,0,0,0|1,0,1]=4 11435 B11R0.148 CC(C)OCCOCCCCBr 34a_100011216708_100000211751 [0,2,0,0,0,0|1,0,0]=3 11436 B11R0.148 CC(C)OCCOCCCCCl 34a_100000210776_100000211751 [0,2,0,0,0,0|1,0,0]=3 11437 B11R0.148 CC(C)OCCOCCCCCl 7a_100000210776_100000211751 [0,2,0,0,0,0|1,0,0]=3 11438 B11R0.148 CC(C)OCCOCCCCF 34a_100000211219_100000729493 [0,2,0,0,0,0|1,0,0]=3 11439 B11R0.148 CC(C)OCCOCCCCF 34a_100011995726_100000211751 [0,2,0,0,0,0|1,0,0]=3 11440 B11R0.148 CC(C)OCCOCCCCF 7a_100000211219_100000729493 [0,2,0,0,0,0|1,0,0]=3 11441 B11R0.148 CC(C)OCCOCCCCF 7a_100011995726_100000211751 [0,2,0,0,0,0|1,0,0]=3 11442 B11R0.148 CC(C)OCCOCCCCI 34a_200012148704_100000211751 [0,2,0,0,0,0|1,0,0]=3 11443 B11R0.148 CC(C)OCCOCCCCN 34a_100000750430_100000211751 [0,2,0,0,0,0|1,0,0]=3 11444 B11R0.148 CC(C)OCCOCCCCO 34a_100000211219_100011216708 [0,2,0,0,0,0|1,0,0]=3 11445 B11R0.148 CC(C)OCCOCCCCO 7a_100000211219_100000210776 [0,2,0,0,0,0|1,0,0]=3 11446 B11R0.148 CC(C)OCCSCCCCF 62a_100000211751_100000729493 [0,2,0,0,0,0|1,1,0]=4 11447 B11R0.148 CC(C)OCCSCCCCF 62a_100000729493_100000211751 [0,2,0,0,0,0|1,1,0]=4 11448 B11R0.148 CC(C)OCCSCCCCO 62a_100000210776_100000211751 [0,2,0,0,0,0|1,1,0]=4 11449 B11R0.148 CC(C)OCCSCCCCO 62a_100000211751_100000210776 [0,2,0,0,0,0|1,1,0]=4 11450 B11R0.148 CC(C)OCOCCOCCBr 34a_100000692535_100000709892 [0,2,0,0,0,0|2,0,0]=4 11451 B11R0.148 CC(C)OCOCCOCCCl 34a_100011215305_100000709892 [0,2,0,0,0,0|2,0,0]=4 11452 B11R0.148 CC(C)OCOCCOCCF 34a_200015357709_100000709892 [0,2,0,0,0,0|2,0,0]=4 11453 B11R0.148 CC(C)OCOCCOCCI 34a_100012149058_100000709892 [0,2,0,0,0,0|2,0,0]=4 11454 B11R0.148 CC(C)OCOCCOCCN 34a_100000211614_100000709892 [0,2,0,0,0,0|2,0,0]=4 11455 B11R0.148 CC(C)SCCOCCCCBr 34a_100011216708_100000730970 [0,2,0,0,0,0|1,1,0]=4 11456 B11R0.148 CC(C)SCCOCCCCCl 34a_100000210776_100000730970 [0,2,0,0,0,0|1,1,0]=4 11457 B11R0.148 CC(C)SCCOCCCCCl 7a_100000210776_100000730970 [0,2,0,0,0,0|1,1,0]=4 11458 B11R0.148 CC(C)SCCOCCCCF 34a_100011995726_100000730970 [0,2,0,0,0,0|1,1,0]=4 11459 B11R0.148 CC(C)SCCOCCCCF 34a_200011212901_100000729493 [0,2,0,0,0,0|1,1,0]=4 11460 B11R0.148 CC(C)SCCOCCCCF 7a_100011995726_100000730970 [0,2,0,0,0,0|1,1,0]=4 11461 B11R0.148 CC(C)SCCOCCCCF 7a_200011212901_100000729493 [0,2,0,0,0,0|1,1,0]=4 11462 B11R0.148 CC(C)SCCOCCCCI 34a_200012148704_100000730970 [0,2,0,0,0,0|1,1,0]=4 11463 B11R0.148 CC(C)SCCOCCCCN 34a_100000750430_100000730970 [0,2,0,0,0,0|1,1,0]=4 11464 B11R0.148 CC(C)SCCOCCCCO 34a_200011212901_100011216708 [0,2,0,0,0,0|1,1,0]=4 11465 B11R0.148 CC(C)SCCOCCCCO 7a_200011212901_100000210776 [0,2,0,0,0,0|1,1,0]=4 11466 B11R0.148 CC(O)CCCOCCCCBr 34a_100011216708_200000718107 [0,2,0,0,0,0|2,0,0]=4 11467 B11R0.148 CC(O)CCCOCCCCCl 34a_100000210776_200000718107 [0,2,0,0,0,0|2,0,0]=4 11468 B11R0.148 CC(O)CCCOCCCCCl 7a_100000210776_200000718107 [0,2,0,0,0,0|2,0,0]=4 11469 B11R0.148 CC(O)CCCOCCCCF 34a_100011995726_200000718107 [0,2,0,0,0,0|2,0,0]=4 11470 B11R0.148 CC(O)CCCOCCCCF 7a_100011995726_200000718107 [0,2,0,0,0,0|2,0,0]=4 11471 B11R0.148 CC(O)CCCOCCCCI 34a_200012148704_200000718107 [0,2,0,0,0,0|2,0,0]=4 11472 B11R0.148 CC(O)CCCOCCCCN 34a_100000750430_200000718107 [0,2,0,0,0,0|2,0,0]=4 11473 B11R0.148 CC(O)CCNCCOCCO 2230a_100000211614_100012276601 [0,2,0,0,0,0|2,0,0]=4 11474 B11R0.148 CC(O)CCNCCOCCO 2230a_200000755665_100011215305 [0,2,0,0,0,0|2,0,0]=4 11475 B11R0.148 CC(O)CCNCCOCCO 34a_100000211614_100012276601 [0,2,0,0,0,0|2,0,0]=4 11476 B11R0.148 CC(O)CCOCCCCCBr 34a_100000746331_100012276601 [0,2,0,0,0,0|2,0,0]=4 11477 B11R0.148 CC(O)CCOCCCCCBr 7a_100000746331_100012276601 [0,2,0,0,0,0|2,0,0]=4 11478 B11R0.148 CC(O)CCOCCCCCCl 34a_100000746330_100012276601 [0,2,0,0,0,0|2,0,0]=4 11479 B11R0.148 CC(O)CCOCCCCCCl 7a_100000746330_100012276601 [0,2,0,0,0,0|2,0,0]=4 11480 B11R0.148 CC(O)CCOCCCCCI 34a_200012148887_100012276601 [0,2,0,0,0,0|2,0,0]=4 11481 B11R0.148 CC(O)CCOCCCCCI 7a_200012148887_100012276601 [0,2,0,0,0,0|2,0,0]=4 11482 B11R0.148 CC(O)CCOCCCCCN 34a_100000762737_100012276601 [0,2,0,0,0,0|2,0,0]=4 11483 B11R0.148 CC(O)CCOCCOCCBr 34a_100000692535_100012276601 [0,2,0,0,0,0|1,0,0]=3 11484 B11R0.148 CC(O)CCOCCOCCBr 7a_100000692535_100012276601 [0,2,0,0,0,0|1,0,0]=3 11485 B11R0.148 CC(O)CCOCCOCCCl 34a_100011215305_100012276601 [0,2,0,0,0,0|1,0,0]=3 11486 B11R0.148 CC(O)CCOCCOCCCl 7a_100011215305_100012276601 [0,2,0,0,0,0|1,0,0]=3 11487 B11R0.148 CC(O)CCOCCOCCF 34a_200015357709_100012276601 [0,2,0,0,0,0|1,0,0]=3 11488 B11R0.148 CC(O)CCOCCOCCF 7a_200015357709_100012276601 [0,2,0,0,0,0|1,0,0]=3 11489 B11R0.148 CC(O)CCOCCOCCI 34a_100012149058_100012276601 [0,2,0,0,0,0|1,0,0]=3 11490 B11R0.148 CC(O)CCOCCOCCI 7a_100012149058_100012276601 [0,2,0,0,0,0|1,0,0]=3 11491 B11R0.148 CC(O)CCOCCOCCN 34a_100000211614_100012276601 [0,2,0,0,0,0|1,0,0]=3 11492 B11R0.148 CC(O)CCSCCOCCO 62a_100011215305_100012276601 [0,2,0,0,0,0|1,1,0]=4 11493 B11R0.148 CC(O)CCSCCOCCO 62a_100012276601_100011215305 [0,2,0,0,0,0|1,1,0]=4 11494 B11R0.148 CC/C=C\CCOCCC(=O)C 34a_100000759926_100015370543 [0,2,0,0,0,0|2,0,0]=4 11495 B11R0.148 CC/C=C\CCOCCC(=O)C 7a_100000759926_100015370543 [0,2,0,0,0,0|2,0,0]=4 11496 B11R0.148 CC/C=C\CCOCCC(=O)C 7a_100016288707_100000053229 [0,2,0,0,0,0|2,0,0]=4 11497 B11R0.148 CC/C=C\CCOCCC(C)Br 34a_100009893172_100015370543 [0,2,0,0,0,0|2,0,0]=4 11498 B11R0.148 CC/C=C\CCOCCC(C)C 34a_100000210254_100015370543 [0,2,0,0,0,0|2,0,0]=4 11499 B11R0.148 CC/C=C\CCOCCC(C)C 34a_100016288707_100000210312 [0,2,0,0,0,0|2,0,0]=4 11500 B11R0.148 CC/C=C\CCOCCC(C)C 7a_100000210254_100015370543 [0,2,0,0,0,0|2,0,0]=4 11501 B11R0.148 CC/C=C\CCOCCC(C)C 7a_100016288707_100000210626 [0,2,0,0,0,0|2,0,0]=4 11502 B11R0.148 CC/C=C\CCOCCC(C)O 34a_100016288707_100012276601 [0,2,0,0,0,0|2,0,0]=4 11503 B11R0.148 CC/C=C\CCOCCC(C)O 7a_100016288707_100012276601 [0,2,0,0,0,0|2,0,0]=4 11504 B11R0.148 CC/C=C\CCOCCN(C)C 7a_100016288707_100000755713 [0,2,0,0,0,0|2,0,0]=4 11505 B11R0.148 CC/C=C\CCOCC[C@@H](C)N 34a_100000706166_100015370543 [0,2,0,0,0,0|2,0,0]=4 11506 B11R0.148 CC/C=C\COCCOC(=O)C 34a_100016268518_100009814007 [0,2,0,0,0,0|1,0,1]=4 11507 B11R0.148 CC/C=C\COCCOC(C)C 34a_100000211219_100103147603 [0,2,0,0,0,0|1,0,1]=4 11508 B11R0.148 CC/C=C\COCCOC(C)C 34a_100016268518_100000211751 [0,2,0,0,0,0|1,0,1]=4 11509 B11R0.148 CC/C=C\COCCOC(C)C 7a_100000211219_100103147603 [0,2,0,0,0,0|1,0,1]=4 11510 B11R0.148 CC=CCOCCOCC(C)C 34a_100000703358_100000070051 [0,2,0,0,0,0|1,0,1]=4 11511 B11R0.148 CC=CCOCCOCC(C)C 7a_100000703358_100000070051 [0,2,0,0,0,0|1,0,1]=4 11512 B11R0.148 CC=CCOCCOCC(F)F 34a_100000704375_100000070051 [0,2,0,0,0,0|1,0,1]=4 11513 B11R0.148 CC=CCOCCOCC(F)F 7a_100000704375_100000070051 [0,2,0,0,0,0|1,0,1]=4 11514 B11R0.148 CCC#CCCOCCC(=O)C 7a_100000036655_100000053229 [0,2,0,0,0,0|2,0,0]=4 11515 B11R0.148 CCC#CCCOCCC(C)C 34a_100000036655_100000210312 [0,2,0,0,0,0|2,0,0]=4 11516 B11R0.148 CCC#CCCOCCC(C)C 7a_100000036655_100000210626 [0,2,0,0,0,0|2,0,0]=4 11517 B11R0.148 CCC#CCCOCCC(C)O 34a_100000036655_100012276601 [0,2,0,0,0,0|2,0,0]=4 11518 B11R0.148 CCC#CCCOCCC(C)O 7a_100000036655_100012276601 [0,2,0,0,0,0|2,0,0]=4 11519 B11R0.148 CCC#CCCOCCN(C)C 7a_100000036655_100000755713 [0,2,0,0,0,0|2,0,0]=4 11520 B11R0.148 CCC#CCOCCOC(=O)C 34a_100000032950_100009814007 [0,2,0,0,0,0|1,0,1]=4 11521 B11R0.148 CCC#CCOCCOC(C)C 34a_100000032950_100000211751 [0,2,0,0,0,0|1,0,1]=4 11522 B11R0.148 CCC#CCOCCOC(C)C 34a_100000211219_100009813939 [0,2,0,0,0,0|1,0,1]=4 11523 B11R0.148 CCC#CCOCCOC(C)C 7a_100000211219_100009813939 [0,2,0,0,0,0|1,0,1]=4 11524 B11R0.148 CCCC/C=C\CCOC(C)C 34a_200016286491_100000210206 [0,2,0,0,0,0|2,0,0]=4 11525 B11R0.148 CCCC/C=C\CCOC(C)C 7a_200016286491_100000210206 [0,2,0,0,0,0|2,0,0]=4 11526 B11R0.148 CCCCC#CCCOC(C)C 34a_100000037610_100000210206 [0,2,0,0,0,0|2,0,0]=4 11527 B11R0.148 CCCCC#CCCOC(C)C 7a_100000037610_100000210206 [0,2,0,0,0,0|2,0,0]=4 11528 B11R0.148 CCCCCCCCOC(C)C 34a_100000210232_100000210206 [0,2,0,0,0,0|2,0,0]=4 11529 B11R0.148 CCCCCCCCOC(C)C 34a_100000212225_100000210759 [0,2,0,0,0,0|2,0,0]=4 11530 B11R0.148 CCCCCCCCOC(C)C 7a_100000210232_100000210206 [0,2,0,0,0,0|2,0,0]=4 11531 B11R0.148 CCCCCCCOCC(=O)C 34a_100000211253_100000210614 [0,2,0,0,0,0|2,0,0]=4 11532 B11R0.148 CCCCCCCOCC(C)Br 34a_100012180447_100000210614 [0,2,0,0,0,0|2,0,0]=4 11533 B11R0.148 CCCCCCCOCC(C)C 34a_100000210257_100000210614 [0,2,0,0,0,0|2,0,0]=4 11534 B11R0.148 CCCCCCCOCC(C)C 34a_100000210272_100000210624 [0,2,0,0,0,0|2,0,0]=4 11535 B11R0.148 CCCCCCCOCC(C)C 7a_100000210272_100000210760 [0,2,0,0,0,0|2,0,0]=4 11536 B11R0.148 CCCCCCCOCC(C)F 34a_100015925927_100000210614 [0,2,0,0,0,0|2,0,0]=4 11537 B11R0.148 CCCCCCCOCC(C)O 34a_100000210272_100011218427 [0,2,0,0,0,0|2,0,0]=4 11538 B11R0.148 CCCCCCCOCC(C)O 7a_100000210272_100011218427 [0,2,0,0,0,0|2,0,0]=4 11539 B11R0.148 CCCCCCCOCC(F)F 34a_100000210272_100011934356 [0,2,0,0,0,0|2,0,0]=4 11540 B11R0.148 CCCCCCCOCC(F)F 34a_100000743014_100000210614 [0,2,0,0,0,0|2,0,0]=4 11541 B11R0.148 CCCCCCCOCC(F)F 7a_100000210272_100011934356 [0,2,0,0,0,0|2,0,0]=4 11542 B11R0.148 CCCCCCCOC[C@@H](C)Cl 34a_100016084084_100000210614 [0,2,0,0,0,0|2,0,0]=4 11543 B11R0.148 CCCCCCCOC[C@@H](C)N 34a_100000737577_100000210614 [0,2,0,0,0,0|2,0,0]=4 11544 B11R0.148 CCCCCCCOC[C@@H](C)O 34a_100000210272_100009817552 [0,2,0,0,0,0|2,0,0]=4 11545 B11R0.148 CCCCCCCOC[C@@H](C)O 7a_100000210272_100009817552 [0,2,0,0,0,0|2,0,0]=4 11546 B11R0.148 CCCCCCNCOC(C)C 2230a_100000210581_100000709892 [0,2,0,0,0,0|2,0,0]=4 11547 B11R0.148 CCCCCCOCCC(=O)C 34a_100000759926_100000210314 [0,2,0,0,0,0|2,0,0]=4 11548 B11R0.148 CCCCCCOCCC(=O)C 7a_100000210259_100000053229 [0,2,0,0,0,0|2,0,0]=4 11549 B11R0.148 CCCCCCOCCC(=O)C 7a_100000759926_100000210314 [0,2,0,0,0,0|2,0,0]=4 11550 B11R0.148 CCCCCCOCCC(C)Br 34a_100009893172_100000210314 [0,2,0,0,0,0|2,0,0]=4 11551 B11R0.148 CCCCCCOCCC(C)C 34a_100000210254_100000210314 [0,2,0,0,0,0|2,0,0]=4 11552 B11R0.148 CCCCCCOCCC(C)C 34a_100000210259_100000210312 [0,2,0,0,0,0|2,0,0]=4 11553 B11R0.148 CCCCCCOCCC(C)C 7a_100000210254_100000210314 [0,2,0,0,0,0|2,0,0]=4 11554 B11R0.148 CCCCCCOCCC(C)C 7a_100000210259_100000210626 [0,2,0,0,0,0|2,0,0]=4 11555 B11R0.148 CCCCCCOCCC(C)O 34a_100000210259_100012276601 [0,2,0,0,0,0|2,0,0]=4 11556 B11R0.148 CCCCCCOCCC(C)O 7a_100000210259_100012276601 [0,2,0,0,0,0|2,0,0]=4 11557 B11R0.148 CCCCCCOCCN(C)C 7a_100000210259_100000755713 [0,2,0,0,0,0|2,0,0]=4 11558 B11R0.148 CCCCCCOCC[C@@H](C)N 34a_100000706166_100000210314 [0,2,0,0,0,0|2,0,0]=4 11559 B11R0.148 CCCCCCOCOC(C)C 34a_100000210259_100000709892 [0,2,0,0,0,0|2,0,0]=4 11560 B11R0.148 CCCCCCSCOC(C)C 62a_100000210314_100000709892 [0,2,0,0,0,0|2,0,0]=4 11561 B11R0.148 CCCCCCSCOC(C)C 62a_100000709892_100000210757 [0,2,0,0,0,0|2,0,0]=4 11562 B11R0.148 CCCCCNCCOC(C)C 2230a_100000209983_100000211751 [0,2,0,0,0,0|2,0,0]=4 11563 B11R0.148 CCCCCNCCOC(C)C 2230a_100000701111_100000210326 [0,2,0,0,0,0|2,0,0]=4 11564 B11R0.148 CCCCCNCCOC(C)C 34a_100000224656_100000210206 [0,2,0,0,0,0|2,0,0]=4 11565 B11R0.148 CCCCCNCCOC(C)C 34a_100000701111_100000718602 [0,2,0,0,0,0|2,0,0]=4 11566 B11R0.148 CCCCCOCCC=C(C)C 34a_100000210253_100011217483 [0,2,0,0,0,0|2,0,0]=4 11567 B11R0.148 CCCCCOCCC=C(C)C 7a_100000210253_100011217483 [0,2,0,0,0,0|2,0,0]=4 11568 B11R0.148 CCCCCOCCCC(=O)C 34a_100000210253_100000685027 [0,2,0,0,0,0|2,0,0]=4 11569 B11R0.148 CCCCCOCCCC(=O)C 34a_100000759063_100000718602 [0,2,0,0,0,0|2,0,0]=4 11570 B11R0.148 CCCCCOCCCC(=O)C 7a_100000210253_100011215641 [0,2,0,0,0,0|2,0,0]=4 11571 B11R0.148 CCCCCOCCCC(=O)C 7a_100000759063_100000210326 [0,2,0,0,0,0|2,0,0]=4 11572 B11R0.148 CCCCCOCCCC(C)C 34a_100000210253_100011214892 [0,2,0,0,0,0|2,0,0]=4 11573 B11R0.148 CCCCCOCCCC(C)C 34a_100000210774_100000718602 [0,2,0,0,0,0|2,0,0]=4 11574 B11R0.148 CCCCCOCCCC(C)C 7a_100000210253_100011214892 [0,2,0,0,0,0|2,0,0]=4 11575 B11R0.148 CCCCCOCCCC(C)C 7a_100000210774_100000210326 [0,2,0,0,0,0|2,0,0]=4 11576 B11R0.148 CCCCCOCCCC(C)O 34a_100000210253_200000718107 [0,2,0,0,0,0|2,0,0]=4 11577 B11R0.148 CCCCCOCCCC(C)O 7a_100000210253_200000718107 [0,2,0,0,0,0|2,0,0]=4 11578 B11R0.148 CCCCCOCCCN(C)C 7a_100000210253_100000757444 [0,2,0,0,0,0|2,0,0]=4 11579 B11R0.148 CCCCCOCCNC(=O)C 34a_100000158858_100000718602 [0,2,0,0,0,0|2,0,0]=4 11580 B11R0.148 CCCCCOCCNC(=O)C 7a_100000210253_100000189650 [0,2,0,0,0,0|2,0,0]=4 11581 B11R0.148 CCCCCOCCNC(C)C 34a_100000224655_100000718602 [0,2,0,0,0,0|2,0,0]=4 11582 B11R0.148 CCCCCOCCOC(=O)C 34a_100000210253_100009814007 [0,2,0,0,0,0|1,0,0]=3 11583 B11R0.148 CCCCCOCCOC(=O)C 7a_100000210253_100009814007 [0,2,0,0,0,0|1,0,0]=3 11584 B11R0.148 CCCCCOCCOC(=O)N 34a_100000210253_200011214921 [0,2,0,0,0,0|1,0,1]=4 11585 B11R0.148 CCCCCOCCOC(=O)N 7a_100000210253_200011214921 [0,2,0,0,0,0|1,0,1]=4 11586 B11R0.148 CCCCCOCCOC(=O)N 7a_100000766696_100000210326 [0,2,0,0,0,0|1,0,1]=4 11587 B11R0.148 CCCCCOCCOC(C)C 34a_100000210253_100000211751 [0,2,0,0,0,0|1,0,0]=3 11588 B11R0.148 CCCCCOCCOC(C)C 34a_100000211219_100000718602 [0,2,0,0,0,0|1,0,0]=3 11589 B11R0.148 CCCCCOCCOC(C)C 34a_100011215259_100000210206 [0,2,0,0,0,0|1,0,0]=3 11590 B11R0.148 CCCCCOCCOC(C)C 7a_100000210253_100000211751 [0,2,0,0,0,0|1,0,0]=3 11591 B11R0.148 CCCCCOCCOC(C)C 7a_100000211219_100000210326 [0,2,0,0,0,0|1,0,0]=3 11592 B11R0.148 CCCCCOCCOC(C)C 7a_100011215259_100000210206 [0,2,0,0,0,0|1,0,0]=3 11593 B11R0.148 CCCCCOCCSC(C)C 34a_100000210253_100000730970 [0,2,0,0,0,0|1,1,0]=4 11594 B11R0.148 CCCCCOCCSC(C)C 34a_200011212901_100000718602 [0,2,0,0,0,0|1,1,0]=4 11595 B11R0.148 CCCCCOCCSC(C)C 7a_100000210253_100000730970 [0,2,0,0,0,0|1,1,0]=4 11596 B11R0.148 CCCCCOCCSC(C)C 7a_200011212901_100000210326 [0,2,0,0,0,0|1,1,0]=4 11597 B11R0.148 CCCCCSCCOC(=O)C 62a_100000210326_100009814007 [0,2,0,0,0,0|1,1,0]=4 11598 B11R0.148 CCCCCSCCOC(=O)C 62a_100009814007_100000210326 [0,2,0,0,0,0|1,1,0]=4 11599 B11R0.148 CCCCCSCCOC(C)C 62a_100000210326_100000211751 [0,2,0,0,0,0|1,1,0]=4 11600 B11R0.148 CCCCCSCCOC(C)C 62a_100000211751_100000210326 [0,2,0,0,0,0|1,1,0]=4 11601 B11R0.148 CCCCNCCCOC(C)C 2230a_100000737246_100000210211 [0,2,0,0,0,0|2,0,0]=4 11602 B11R0.148 CCCCNCCCOC(C)C 34a_100000737246_100000210210 [0,2,0,0,0,0|2,0,0]=4 11603 B11R0.148 CCCCNCCOCC(F)F 2230a_100000102301_200012177212 [0,2,0,0,0,0|2,0,0]=4 11604 B11R0.148 CCCCNCCOCC(F)F 7a_106832991798_200012177212 [0,2,0,0,0,0|2,0,0]=4 11605 B11R0.148 CCCCOCCCCC(=O)C 34a_100000210227_100009817362 [0,2,0,0,0,0|2,0,0]=4 11606 B11R0.148 CCCCOCCCCC(=O)C 7a_100000210227_100000735457 [0,2,0,0,0,0|2,0,0]=4 11607 B11R0.148 CCCCOCCCCC(C)C 34a_100000210227_100011216152 [0,2,0,0,0,0|2,0,0]=4 11608 B11R0.148 CCCCOCCCCC(C)C 34a_100011214890_100000210210 [0,2,0,0,0,0|2,0,0]=4 11609 B11R0.148 CCCCOCCCCC(C)C 7a_100000210227_100011216152 [0,2,0,0,0,0|2,0,0]=4 11610 B11R0.148 CCCCOCCCCC(C)C 7a_100011214890_100000210211 [0,2,0,0,0,0|2,0,0]=4 11611 B11R0.148 CCCCOCCCNC(C)C 2230a_200000211371_100000210206 [0,2,0,0,0,0|2,0,0]=4 11612 B11R0.148 CCCCOCCCNC(C)C 34a_100000182298_100000210210 [0,2,0,0,0,0|2,0,0]=4 11613 B11R0.148 CCCCOCCCNC(C)C 34a_200000211371_100000210206 [0,2,0,0,0,0|2,0,0]=4 11614 B11R0.148 CCCCOCCCOC(=O)C 34a_100000210227_100000042594 [0,2,0,0,0,0|1,0,1]=4 11615 B11R0.148 CCCCOCCCOC(=O)C 7a_100000210227_100000042594 [0,2,0,0,0,0|1,0,1]=4 11616 B11R0.148 CCCCOCCCOC(=S)C 34a_100000210227_200135323944 [0,2,0,0,0,0|1,0,1]=4 11617 B11R0.148 CCCCOCCCOC(=S)C 7a_100000210227_200135323944 [0,2,0,0,0,0|1,0,1]=4 11618 B11R0.148 CCCCOCCCOC(C)C 34a_200011215613_100000210206 [0,2,0,0,0,0|1,0,0]=3 11619 B11R0.148 CCCCOCCCOC(C)C 7a_200011215613_100000210206 [0,2,0,0,0,0|1,0,0]=3 11620 B11R0.148 CCCCOCCNCC(C)C 2230a_100000210953_100000743108 [0,2,0,0,0,0|2,0,0]=4 11621 B11R0.148 CCCCOCCNCC(C)C 34a_100000210953_100000743108 [0,2,0,0,0,0|2,0,0]=4 11622 B11R0.148 CCCCOCCNCC(C)C 34a_100015185251_100000210210 [0,2,0,0,0,0|2,0,0]=4 11623 B11R0.148 CCCCOCCNCC(C)O 2230a_100000210904_100000743108 [0,2,0,0,0,0|2,0,0]=4 11624 B11R0.148 CCCCOCCNCC(C)O 34a_100000210904_100000743108 [0,2,0,0,0,0|2,0,0]=4 11625 B11R0.148 CCCCOCCNCC(F)F 34a_100000765723_100000743108 [0,2,0,0,0,0|2,0,0]=4 11626 B11R0.148 CCCCOCCOCC(=O)C 1458a_100011216887_200000210301 [0,2,0,0,0,0|1,0,0]=3 11627 B11R0.148 CCCCOCCOCC(=O)C 34a_100000211253_100000743108 [0,2,0,0,0,0|1,0,0]=3 11628 B11R0.148 CCCCOCCOCC(=O)N 34a_100000210227_100000076697 [0,2,0,0,0,0|1,0,1]=4 11629 B11R0.148 CCCCOCCOCC(=O)N 34a_100000210238_100000187820 [0,2,0,0,0,0|1,0,1]=4 11630 B11R0.148 CCCCOCCOCC(=O)N 7a_100000210227_100000076697 [0,2,0,0,0,0|1,0,1]=4 11631 B11R0.148 CCCCOCCOCC(=O)N 7a_100000210238_100000187820 [0,2,0,0,0,0|1,0,1]=4 11632 B11R0.148 CCCCOCCOCC(=O)[13CH3] 1458a_100011216887_200025704644 [0,2,0,0,0,0|1,0,0]=3 11633 B11R0.148 CCCCOCCOCC(=O)[O-] 34a_100000210238_100020667443 [0,2,0,0,0,0|1,0,1]=4 11634 B11R0.148 CCCCOCCOCC(C)Br 34a_100012180447_100000743108 [0,2,0,0,0,0|1,0,0]=3 11635 B11R0.148 CCCCOCCOCC(C)C 34a_100000210238_100000210624 [0,2,0,0,0,0|1,0,0]=3 11636 B11R0.148 CCCCOCCOCC(C)C 34a_100000210257_100000743108 [0,2,0,0,0,0|1,0,0]=3 11637 B11R0.148 CCCCOCCOCC(C)C 34a_100000703358_100000210210 [0,2,0,0,0,0|1,0,0]=3 11638 B11R0.148 CCCCOCCOCC(C)C 7a_100000210238_100000210760 [0,2,0,0,0,0|1,0,0]=3 11639 B11R0.148 CCCCOCCOCC(C)C 7a_100000703358_100000210211 [0,2,0,0,0,0|1,0,0]=3 11640 B11R0.148 CCCCOCCOCC(C)F 34a_100015925927_100000743108 [0,2,0,0,0,0|1,0,0]=3 11641 B11R0.148 CCCCOCCOCC(C)O 34a_100000210238_100011218427 [0,2,0,0,0,0|1,0,0]=3 11642 B11R0.148 CCCCOCCOCC(C)O 7a_100000210238_100011218427 [0,2,0,0,0,0|1,0,0]=3 11643 B11R0.148 CCCCOCCOCC(F)F 34a_100000210227_200012177212 [0,2,0,0,0,0|1,0,0]=3 11644 B11R0.148 CCCCOCCOCC(F)F 34a_100000210238_100011934356 [0,2,0,0,0,0|1,0,0]=3 11645 B11R0.148 CCCCOCCOCC(F)F 34a_100000704375_100000210210 [0,2,0,0,0,0|1,0,0]=3 11646 B11R0.148 CCCCOCCOCC(F)F 34a_100000743014_100000743108 [0,2,0,0,0,0|1,0,0]=3 11647 B11R0.148 CCCCOCCOCC(F)F 7a_100000210227_200012177212 [0,2,0,0,0,0|1,0,0]=3 11648 B11R0.148 CCCCOCCOCC(F)F 7a_100000210238_100011934356 [0,2,0,0,0,0|1,0,0]=3 11649 B11R0.148 CCCCOCCOCC(F)F 7a_100000704375_100000210211 [0,2,0,0,0,0|1,0,0]=3 11650 B11R0.148 CCCCOCCOC[C@@H](C)Cl 34a_100016084084_100000743108 [0,2,0,0,0,0|1,0,0]=3 11651 B11R0.148 CCCCOCCOC[C@@H](C)N 34a_100000737577_100000743108 [0,2,0,0,0,0|1,0,0]=3 11652 B11R0.148 CCCCOCCOC[C@@H](C)O 34a_100000210238_100009817552 [0,2,0,0,0,0|1,0,0]=3 11653 B11R0.148 CCCCOCCOC[C@@H](C)O 7a_100000210238_100009817552 [0,2,0,0,0,0|1,0,0]=3 11654 B11R0.148 CCCCOCCOC[N+](=O)[O-] 34a_100000210238_100000761209 [0,2,0,0,0,0|2,0,0]=4 11655 B11R0.148 CCCCOCCSCC(C)C 34a_200000230437_100000210210 [0,2,0,0,0,0|1,1,0]=4 11656 B11R0.148 CCCCOCCSCC(C)C 62a_100000210624_100000743108 [0,2,0,0,0,0|1,1,0]=4 11657 B11R0.148 CCCCOCCSCC(C)C 62a_100000743108_100000210760 [0,2,0,0,0,0|1,1,0]=4 11658 B11R0.148 CCCCOCCSCC(C)C 7a_200000230437_100000210211 [0,2,0,0,0,0|1,1,0]=4 11659 B11R0.148 CCCCOCCSCC(C)O 62a_100000743108_100011218427 [0,2,0,0,0,0|1,1,0]=4 11660 B11R0.148 CCCCOCCSCC(C)O 62a_100011218427_100000743108 [0,2,0,0,0,0|1,1,0]=4 11661 B11R0.148 CCCCOCCSCC(F)F 62a_100000743108_100011934356 [0,2,0,0,0,0|1,1,0]=4 11662 B11R0.148 CCCCOCCSCC(F)F 62a_100011934356_100000743108 [0,2,0,0,0,0|1,1,0]=4 11663 B11R0.148 CCCCOCCSC[C@@H](C)O 62a_100000743108_100009817552 [0,2,0,0,0,0|1,1,0]=4 11664 B11R0.148 CCCCOCCSC[C@@H](C)O 62a_100009817552_100000743108 [0,2,0,0,0,0|1,1,0]=4 11665 B11R0.148 CCCCOCNCCC(C)O 2230a_200000755665_100011995733 [0,2,0,0,0,0|2,0,0]=4 11666 B11R0.148 CCCCOCOCCC(=O)C 34a_100000759926_100011995733 [0,2,0,0,0,0|2,0,0]=4 11667 B11R0.148 CCCCOCOCCC(C)Br 34a_100009893172_100011995733 [0,2,0,0,0,0|2,0,0]=4 11668 B11R0.148 CCCCOCOCCC(C)C 34a_100000210254_100011995733 [0,2,0,0,0,0|2,0,0]=4 11669 B11R0.148 CCCCOCOCC[C@@H](C)N 34a_100000706166_100011995733 [0,2,0,0,0,0|2,0,0]=4 11670 B11R0.148 CCCCOCSCCC(C)C 62a_100000210312_100011995733 [0,2,0,0,0,0|2,0,0]=4 11671 B11R0.148 CCCCOCSCCC(C)C 62a_100011995733_100000210312 [0,2,0,0,0,0|2,0,0]=4 11672 B11R0.148 CCCCOCSCCC(C)O 62a_100011995733_100012276601 [0,2,0,0,0,0|2,0,0]=4 11673 B11R0.148 CCCCOCSCCC(C)O 62a_100012276601_100011995733 [0,2,0,0,0,0|2,0,0]=4 11674 B11R0.148 CCCCOCSCOC(=O)C 62a_100000076356_100011995733 [0,2,0,0,0,0|1,0,1]=4 11675 B11R0.148 CCCCOCSCOC(=O)C 62a_100011995733_100000076356 [0,2,0,0,0,0|1,0,1]=4 11676 B11R0.148 CCCCOCSCOC(C)C 62a_100000709892_100011995733 [0,2,0,0,0,0|1,0,0]=3 11677 B11R0.148 CCCCOCSCOC(C)C 62a_100011995733_100000709892 [0,2,0,0,0,0|1,0,0]=3 11678 B11R0.148 CCCCSCCOCC(C)C 34a_200000230436_100000210624 [0,2,0,0,0,0|1,1,0]=4 11679 B11R0.148 CCCCSCCOCC(C)C 7a_200000230436_100000210760 [0,2,0,0,0,0|1,1,0]=4 11680 B11R0.148 CCCCSCCOCC(C)O 34a_200000230436_100011218427 [0,2,0,0,0,0|1,1,0]=4 11681 B11R0.148 CCCCSCCOCC(C)O 7a_200000230436_100011218427 [0,2,0,0,0,0|1,1,0]=4 11682 B11R0.148 CCCCSCCOCC(F)F 34a_200000230436_100011934356 [0,2,0,0,0,0|1,1,0]=4 11683 B11R0.148 CCCCSCCOCC(F)F 62a_100000210211_200012177212 [0,2,0,0,0,0|1,1,0]=4 11684 B11R0.148 CCCCSCCOCC(F)F 62a_200012177212_100000210210 [0,2,0,0,0,0|1,1,0]=4 11685 B11R0.148 CCCCSCCOCC(F)F 7a_200000230436_100011934356 [0,2,0,0,0,0|1,1,0]=4 11686 B11R0.148 CCCCSCCOC[C@@H](C)O 34a_200000230436_100009817552 [0,2,0,0,0,0|1,1,0]=4 11687 B11R0.148 CCCCSCCOC[C@@H](C)O 7a_200000230436_100009817552 [0,2,0,0,0,0|1,1,0]=4 11688 B11R0.148 CCCOCCCCCC(C)C 34a_100000210258_100000210682 [0,2,0,0,0,0|2,0,0]=4 11689 B11R0.148 CCCOCCCCCC(C)C 34a_100011995859_100000210303 [0,2,0,0,0,0|2,0,0]=4 11690 B11R0.148 CCCOCCCCCC(C)C 7a_100011995859_100000210303 [0,2,0,0,0,0|2,0,0]=4 11691 B11R0.148 CCCOCCNCCC(C)C 2230a_100161115042_100000210312 [0,2,0,0,0,0|2,0,0]=4 11692 B11R0.148 CCCOCCNCCC(C)C 269862a_100161115042_100000185833 [0,2,0,0,0,0|2,0,0]=4 11693 B11R0.148 CCCOCCNCCC(C)C 34a_100161115042_100000210312 [0,2,0,0,0,0|2,0,0]=4 11694 B11R0.148 CCCOCCNCCC(C)O 2230a_100161115042_100012276601 [0,2,0,0,0,0|2,0,0]=4 11695 B11R0.148 CCCOCCNCCC(C)O 2230a_200000755665_100011215938 [0,2,0,0,0,0|2,0,0]=4 11696 B11R0.148 CCCOCCNCCC(C)O 34a_100161115042_100012276601 [0,2,0,0,0,0|2,0,0]=4 11697 B11R0.148 CCCOCCOCC=C(C)C 34a_100000752267_100000761012 [0,2,0,0,0,0|1,0,1]=4 11698 B11R0.148 CCCOCCOCC=C(C)C 34a_100000753907_100011215938 [0,2,0,0,0,0|1,0,1]=4 11699 B11R0.148 CCCOCCOCC=C(C)C 7a_100000752267_100000761012 [0,2,0,0,0,0|1,0,1]=4 11700 B11R0.148 CCCOCCOCCC(=O)C 34a_100000759926_100011215938 [0,2,0,0,0,0|1,0,0]=3 11701 B11R0.148 CCCOCCOCCC(=O)C 7a_100000752267_100000053229 [0,2,0,0,0,0|1,0,0]=3 11702 B11R0.148 CCCOCCOCCC(=O)C 7a_100000759926_100011215938 [0,2,0,0,0,0|1,0,0]=3 11703 B11R0.148 CCCOCCOCCC(=O)N 34a_100000752267_100000731001 [0,2,0,0,0,0|2,0,0]=4 11704 B11R0.148 CCCOCCOCCC(=O)N 34a_100000757172_100011215938 [0,2,0,0,0,0|2,0,0]=4 11705 B11R0.148 CCCOCCOCCC(=O)N 7a_100000752267_100000744528 [0,2,0,0,0,0|2,0,0]=4 11706 B11R0.148 CCCOCCOCCC(=O)N 7a_100000757172_100011215938 [0,2,0,0,0,0|2,0,0]=4 11707 B11R0.148 CCCOCCOCCC(C)Br 34a_100009893172_100011215938 [0,2,0,0,0,0|1,0,0]=3 11708 B11R0.148 CCCOCCOCCC(C)C 34a_100000210254_100011215938 [0,2,0,0,0,0|1,0,0]=3 11709 B11R0.148 CCCOCCOCCC(C)C 34a_100000752267_100000210312 [0,2,0,0,0,0|1,0,0]=3 11710 B11R0.148 CCCOCCOCCC(C)C 7a_100000210254_100011215938 [0,2,0,0,0,0|1,0,0]=3 11711 B11R0.148 CCCOCCOCCC(C)C 7a_100000752267_100000210626 [0,2,0,0,0,0|1,0,0]=3 11712 B11R0.148 CCCOCCOCCC(C)O 34a_100000752267_100012276601 [0,2,0,0,0,0|1,0,0]=3 11713 B11R0.148 CCCOCCOCCC(C)O 7a_100000752267_100012276601 [0,2,0,0,0,0|1,0,0]=3 11714 B11R0.148 CCCOCCOCCC(F)F 34a_100103093639_100011215938 [0,2,0,0,0,0|2,0,0]=4 11715 B11R0.148 CCCOCCOCCN(C)C 7a_100000752267_100000755713 [0,2,0,0,0,0|1,0,0]=3 11716 B11R0.148 CCCOCCOCC[C@@H](C)N 34a_100000706166_100011215938 [0,2,0,0,0,0|1,0,0]=3 11717 B11R0.148 CCCOCCOCOC(=O)C 34a_100000752267_100009813279 [0,2,0,0,0,0|2,0,0]=4 11718 B11R0.148 CCCOCCOCOC(C)C 34a_100000752267_100000709892 [0,2,0,0,0,0|2,0,0]=4 11719 B11R0.148 CCCOCCSCCC(=O)C 62a_100000053229_100011215938 [0,2,0,0,0,0|1,1,0]=4 11720 B11R0.148 CCCOCCSCCC(=O)C 62a_100011215938_100000053229 [0,2,0,0,0,0|1,1,0]=4 11721 B11R0.148 CCCOCCSCCC(C)C 62a_100000210312_100011215938 [0,2,0,0,0,0|1,1,0]=4 11722 B11R0.148 CCCOCCSCCC(C)C 62a_100011215938_100000210312 [0,2,0,0,0,0|1,1,0]=4 11723 B11R0.148 CCCOCCSCCC(C)O 62a_100011215938_100012276601 [0,2,0,0,0,0|1,1,0]=4 11724 B11R0.148 CCCOCCSCCC(C)O 62a_100012276601_100011215938 [0,2,0,0,0,0|1,1,0]=4 11725 B11R0.148 CCCOCCSCCN(C)C 62a_100011215938_100000755713 [0,2,0,0,0,0|1,1,0]=4 11726 B11R0.148 CCCOCOCCOC(=O)C 34a_100000210258_100000076355 [0,2,0,0,0,0|1,0,1]=4 11727 B11R0.148 CCCSCCOCCC(=O)C 7a_200000230433_100000053229 [0,2,0,0,0,0|1,1,0]=4 11728 B11R0.148 CCCSCCOCCC(C)C 34a_200000230433_100000210312 [0,2,0,0,0,0|1,1,0]=4 11729 B11R0.148 CCCSCCOCCC(C)C 7a_200000230433_100000210626 [0,2,0,0,0,0|1,1,0]=4 11730 B11R0.148 CCCSCCOCCC(C)O 34a_200000230433_100012276601 [0,2,0,0,0,0|1,1,0]=4 11731 B11R0.148 CCCSCCOCCC(C)O 7a_200000230433_100012276601 [0,2,0,0,0,0|1,1,0]=4 11732 B11R0.148 CCCSCCOCCN(C)C 7a_200000230433_100000755713 [0,2,0,0,0,0|1,1,0]=4 11733 B11R0.148 CCCSCOCCOC(=O)C 62a_100000076355_100000210303 [0,2,0,0,0,0|1,0,1]=4 11734 B11R0.148 CCCSCOCCOC(=O)C 62a_100000210303_100000076355 [0,2,0,0,0,0|1,0,1]=4 11735 B11R0.148 CCNCCCCCOC(=O)C 2230a_100015525214_100009813381 [0,2,0,0,0,0|2,0,0]=4 11736 B11R0.148 CCNCCOCCOC(=O)C 2230a_100015525214_200000083610 [0,2,0,0,0,0|1,0,0]=3 11737 B11R0.148 CCOCCCCCNC(C)C 34a_100011629493_100000210202 [0,2,0,0,0,0|2,0,0]=4 11738 B11R0.148 CCOCCCCCOC(=O)C 34a_100121572206_100000033007 [0,2,0,0,0,0|1,0,0]=3 11739 B11R0.148 CCOCCCNCCC(C)C 2230a_100000210961_100000210312 [0,2,0,0,0,0|2,0,0]=4 11740 B11R0.148 CCOCCCNCCC(C)C 269862a_100000210961_100000185833 [0,2,0,0,0,0|2,0,0]=4 11741 B11R0.148 CCOCCCNCCC(C)C 34a_100000210961_100000210312 [0,2,0,0,0,0|2,0,0]=4 11742 B11R0.148 CCOCCCNCCC(C)O 2230a_100000210961_100012276601 [0,2,0,0,0,0|2,0,0]=4 11743 B11R0.148 CCOCCCNCCC(C)O 2230a_200000755665_100012232248 [0,2,0,0,0,0|2,0,0]=4 11744 B11R0.148 CCOCCCNCCC(C)O 34a_100000210961_100012276601 [0,2,0,0,0,0|2,0,0]=4 11745 B11R0.148 CCOCCCNCOC(=O)C 34a_100000210961_100009813279 [0,2,0,0,0,0|2,0,0]=4 11746 B11R0.148 CCOCCCNCOC(C)C 2230a_100000210961_100000709892 [0,2,0,0,0,0|2,0,0]=4 11747 B11R0.148 CCOCCCNCOC(C)C 34a_100000210961_100000709892 [0,2,0,0,0,0|2,0,0]=4 11748 B11R0.148 CCOCCCOCC=C(C)C 34a_100000753907_100012232248 [0,2,0,0,0,0|1,0,1]=4 11749 B11R0.148 CCOCCCOCC=C(C)C 34a_100000757476_100000761012 [0,2,0,0,0,0|1,0,1]=4 11750 B11R0.148 CCOCCCOCC=C(C)C 7a_100000757476_100000761012 [0,2,0,0,0,0|1,0,1]=4 11751 B11R0.148 CCOCCCOCCC(=O)C 34a_100000759926_100012232248 [0,2,0,0,0,0|1,0,0]=3 11752 B11R0.148 CCOCCCOCCC(=O)C 7a_100000757476_100000053229 [0,2,0,0,0,0|1,0,0]=3 11753 B11R0.148 CCOCCCOCCC(=O)C 7a_100000759926_100012232248 [0,2,0,0,0,0|1,0,0]=3 11754 B11R0.148 CCOCCCOCCC(=O)N 34a_100000757172_100012232248 [0,2,0,0,0,0|2,0,0]=4 11755 B11R0.148 CCOCCCOCCC(=O)N 34a_100000757476_100000731001 [0,2,0,0,0,0|2,0,0]=4 11756 B11R0.148 CCOCCCOCCC(=O)N 7a_100000757172_100012232248 [0,2,0,0,0,0|2,0,0]=4 11757 B11R0.148 CCOCCCOCCC(=O)N 7a_100000757476_100000744528 [0,2,0,0,0,0|2,0,0]=4 11758 B11R0.148 CCOCCCOCCC(C)Br 34a_100009893172_100012232248 [0,2,0,0,0,0|1,0,0]=3 11759 B11R0.148 CCOCCCOCCC(C)C 34a_100000210254_100012232248 [0,2,0,0,0,0|1,0,0]=3 11760 B11R0.148 CCOCCCOCCC(C)C 34a_100000757476_100000210312 [0,2,0,0,0,0|1,0,0]=3 11761 B11R0.148 CCOCCCOCCC(C)C 7a_100000210254_100012232248 [0,2,0,0,0,0|1,0,0]=3 11762 B11R0.148 CCOCCCOCCC(C)C 7a_100000757476_100000210626 [0,2,0,0,0,0|1,0,0]=3 11763 B11R0.148 CCOCCCOCCC(C)O 34a_100000757476_100012276601 [0,2,0,0,0,0|1,0,0]=3 11764 B11R0.148 CCOCCCOCCC(C)O 7a_100000757476_100012276601 [0,2,0,0,0,0|1,0,0]=3 11765 B11R0.148 CCOCCCOCCC(F)F 34a_100103093639_100012232248 [0,2,0,0,0,0|2,0,0]=4 11766 B11R0.148 CCOCCCOCCN(C)C 7a_100000757476_100000755713 [0,2,0,0,0,0|1,0,0]=3 11767 B11R0.148 CCOCCCOCC[C@@H](C)N 34a_100000706166_100012232248 [0,2,0,0,0,0|1,0,0]=3 11768 B11R0.148 CCOCCCOCOC(=O)C 34a_100000757476_100009813279 [0,2,0,0,0,0|2,0,0]=4 11769 B11R0.148 CCOCCCOCOC(C)C 34a_100000757476_100000709892 [0,2,0,0,0,0|2,0,0]=4 11770 B11R0.148 CCOCCCSCCC(=O)C 62a_100000053229_100012232248 [0,2,0,0,0,0|1,1,0]=4 11771 B11R0.148 CCOCCCSCCC(=O)C 62a_100012232248_100000053229 [0,2,0,0,0,0|1,1,0]=4 11772 B11R0.148 CCOCCCSCCC(C)C 62a_100000210312_100012232248 [0,2,0,0,0,0|1,1,0]=4 11773 B11R0.148 CCOCCCSCCC(C)C 62a_100012232248_100000210312 [0,2,0,0,0,0|1,1,0]=4 11774 B11R0.148 CCOCCCSCCC(C)O 62a_100012232248_100012276601 [0,2,0,0,0,0|1,1,0]=4 11775 B11R0.148 CCOCCCSCCC(C)O 62a_100012276601_100012232248 [0,2,0,0,0,0|1,1,0]=4 11776 B11R0.148 CCOCCCSCCN(C)C 62a_100012232248_100000755713 [0,2,0,0,0,0|1,1,0]=4 11777 B11R0.148 CCOCCCSCOC(=O)C 62a_100000076356_100012232248 [0,2,0,0,0,0|2,0,0]=4 11778 B11R0.148 CCOCCCSCOC(=O)C 62a_100012232248_100000076356 [0,2,0,0,0,0|2,0,0]=4 11779 B11R0.148 CCOCCCSCOC(C)C 62a_100000709892_100012232248 [0,2,0,0,0,0|2,0,0]=4 11780 B11R0.148 CCOCCCSCOC(C)C 62a_100012232248_100000709892 [0,2,0,0,0,0|2,0,0]=4 11781 B11R0.148 CCOCCNCCC=C(C)C 2230a_102516460346_100011217483 [0,2,0,0,0,0|2,0,0]=4 11782 B11R0.148 CCOCCNCCC=C(C)C 34a_102516460346_100011217483 [0,2,0,0,0,0|2,0,0]=4 11783 B11R0.148 CCOCCNCCCC(=O)C 34a_102516460346_100000685027 [0,2,0,0,0,0|2,0,0]=4 11784 B11R0.148 CCOCCNCCCC(C)C 2230a_102516460346_100011214892 [0,2,0,0,0,0|2,0,0]=4 11785 B11R0.148 CCOCCNCCCC(C)C 2230a_200000737386_100011215890 [0,2,0,0,0,0|2,0,0]=4 11786 B11R0.148 CCOCCNCCCC(C)C 34a_102516460346_100011214892 [0,2,0,0,0,0|2,0,0]=4 11787 B11R0.148 CCOCCNCCCC(C)C 34a_200000737386_100000210147 [0,2,0,0,0,0|2,0,0]=4 11788 B11R0.148 CCOCCNCCCC(C)O 2230a_102516460346_200000718107 [0,2,0,0,0,0|2,0,0]=4 11789 B11R0.148 CCOCCNCCCC(C)O 34a_102516460346_200000718107 [0,2,0,0,0,0|2,0,0]=4 11790 B11R0.148 CCOCCNCCCS(=O)C 2230a_200000753449_100011215890 [0,2,0,0,0,0|1,1,0]=4 11791 B11R0.148 CCOCCNCCNC(=O)C 2230a_100000209853_100011215890 [0,2,0,0,0,0|2,0,0]=4 11792 B11R0.148 CCOCCNCCNC(=O)C 2230a_102516460346_100000189650 [0,2,0,0,0,0|2,0,0]=4 11793 B11R0.148 CCOCCNCCOC(=O)C 34a_102516460346_100009814007 [0,2,0,0,0,0|1,0,0]=3 11794 B11R0.148 CCOCCNCCOC(=O)N 34a_102516460346_200011214921 [0,2,0,0,0,0|1,0,1]=4 11795 B11R0.148 CCOCCNCCOC(C)C 2230a_100000701111_100011215890 [0,2,0,0,0,0|1,0,0]=3 11796 B11R0.148 CCOCCNCCOC(C)C 2230a_102516460346_100000211751 [0,2,0,0,0,0|1,0,0]=3 11797 B11R0.148 CCOCCNCCOC(C)C 34a_100000701111_100000210147 [0,2,0,0,0,0|1,0,0]=3 11798 B11R0.148 CCOCCNCCOC(C)C 34a_102516460346_100000211751 [0,2,0,0,0,0|1,0,0]=3 11799 B11R0.148 CCOCCNCCSC(C)C 2230a_100000731138_100011215890 [0,2,0,0,0,0|1,1,0]=4 11800 B11R0.148 CCOCCNCCSC(C)C 2230a_102516460346_100000730970 [0,2,0,0,0,0|1,1,0]=4 11801 B11R0.148 CCOCCNCCSC(C)C 34a_100000731138_100000210147 [0,2,0,0,0,0|1,1,0]=4 11802 B11R0.148 CCOCCNCCSC(C)C 34a_102516460346_100000730970 [0,2,0,0,0,0|1,1,0]=4 11803 B11R0.148 CCOCCOCCC=C(C)C 34a_100000210136_100011217483 [0,2,0,0,0,0|1,0,0]=3 11804 B11R0.148 CCOCCOCCC=C(C)C 7a_100000210136_100011217483 [0,2,0,0,0,0|1,0,0]=3 11805 B11R0.148 CCOCCOCCC=C(F)F 34a_100000210136_200009816681 [0,2,0,0,0,0|1,0,1]=4 11806 B11R0.148 CCOCCOCCC=C(F)F 7a_100000210136_200009816681 [0,2,0,0,0,0|1,0,1]=4 11807 B11R0.148 CCOCCOCCCC(=O)C 34a_100000210136_100000685027 [0,2,0,0,0,0|1,0,0]=3 11808 B11R0.148 CCOCCOCCCC(=O)C 34a_100000759063_100000210147 [0,2,0,0,0,0|1,0,0]=3 11809 B11R0.148 CCOCCOCCCC(=O)C 7a_100000210136_100011215641 [0,2,0,0,0,0|1,0,0]=3 11810 B11R0.148 CCOCCOCCCC(=O)C 7a_100000759063_100011215890 [0,2,0,0,0,0|1,0,0]=3 11811 B11R0.148 CCOCCOCCCC(=O)N 34a_100000210136_100102525003 [0,2,0,0,0,0|1,0,1]=4 11812 B11R0.148 CCOCCOCCCC(=O)N 7a_100000210136_100102525003 [0,2,0,0,0,0|1,0,1]=4 11813 B11R0.148 CCOCCOCCCC(C)C 34a_100000210136_100011214892 [0,2,0,0,0,0|1,0,0]=3 11814 B11R0.148 CCOCCOCCCC(C)C 34a_100000210774_100000210147 [0,2,0,0,0,0|1,0,0]=3 11815 B11R0.148 CCOCCOCCCC(C)C 7a_100000210136_100011214892 [0,2,0,0,0,0|1,0,0]=3 11816 B11R0.148 CCOCCOCCCC(C)C 7a_100000210774_100011215890 [0,2,0,0,0,0|1,0,0]=3 11817 B11R0.148 CCOCCOCCCC(C)O 34a_100000210136_200000718107 [0,2,0,0,0,0|1,0,0]=3 11818 B11R0.148 CCOCCOCCCC(C)O 7a_100000210136_200000718107 [0,2,0,0,0,0|1,0,0]=3 11819 B11R0.148 CCOCCOCCCN(C)C 7a_100000210136_100000757444 [0,2,0,0,0,0|1,0,0]=3 11820 B11R0.148 CCOCCOCCC[N+](=O)[O-] 34a_200000037920_100000210147 [0,2,0,0,0,0|2,0,0]=4 11821 B11R0.148 CCOCCOCCNC(=O)C 11a_100102712874_100015343762 [0,2,0,0,0,0|1,0,0]=3 11822 B11R0.148 CCOCCOCCNC(=O)C 1626a_100102712874_100015343762 [0,2,0,0,0,0|1,0,0]=3 11823 B11R0.148 CCOCCOCCNC(=O)C 240690a_100102712874_100015343762 [0,2,0,0,0,0|1,0,0]=3 11824 B11R0.148 CCOCCOCCNC(=O)C 34a_100000158858_100000210147 [0,2,0,0,0,0|1,0,0]=3 11825 B11R0.148 CCOCCOCCNC(=O)C 527a_100102712874_100103153847 [0,2,0,0,0,0|1,0,0]=3 11826 B11R0.148 CCOCCOCCNC(=O)C 7a_100000210136_100000189650 [0,2,0,0,0,0|1,0,0]=3 11827 B11R0.148 CCOCCOCCNC(=O)N 34a_100000181757_100000210147 [0,2,0,0,0,0|1,0,1]=4 11828 B11R0.148 CCOCCOCCNC(=O)N 7a_100000210136_200000034859 [0,2,0,0,0,0|1,0,1]=4 11829 B11R0.148 CCOCCOCCNC(C)C 2230a_100102712874_100000210206 [0,2,0,0,0,0|1,0,0]=3 11830 B11R0.148 CCOCCOCCNC(C)C 2230a_100138425928_100011211534 [0,2,0,0,0,0|1,0,0]=3 11831 B11R0.148 CCOCCOCCNC(C)C 34a_100000224655_100000210147 [0,2,0,0,0,0|1,0,0]=3 11832 B11R0.148 CCOCCOCCNC(C)C 34a_100102712874_100000210206 [0,2,0,0,0,0|1,0,0]=3 11833 B11R0.148 CCOCCOCCNC(C)C 34a_100138425928_100011211534 [0,2,0,0,0,0|1,0,0]=3 11834 B11R0.148 CCOCCOCCOC(=O)C 34a_100000210136_100009814007 [0,2,0,0,0,0|0,0,0]=2 11835 B11R0.148 CCOCCOCCOC(=O)C 34a_100121572206_200000083610 [0,2,0,0,0,0|0,0,0]=2 11836 B11R0.148 CCOCCOCCOC(=O)C 7a_100000210136_100009814007 [0,2,0,0,0,0|0,0,0]=2 11837 B11R0.148 CCOCCOCCOC(=O)N 34a_100000210136_200011214921 [0,2,0,0,0,0|0,0,1]=3 11838 B11R0.148 CCOCCOCCOC(=O)N 7a_100000210136_200011214921 [0,2,0,0,0,0|0,0,1]=3 11839 B11R0.148 CCOCCOCCOC(=O)N 7a_100000766696_100011215890 [0,2,0,0,0,0|0,0,1]=3 11840 B11R0.148 CCOCCOCCOC(C)C 34a_100000210136_100000211751 [0,2,0,0,0,0|0,0,0]=2 11841 B11R0.148 CCOCCOCCOC(C)C 34a_100000210240_100000210206 [0,2,0,0,0,0|0,0,0]=2 11842 B11R0.148 CCOCCOCCOC(C)C 34a_100000211219_100000210147 [0,2,0,0,0,0|0,0,0]=2 11843 B11R0.148 CCOCCOCCOC(C)C 34a_100000212225_100011211534 [0,2,0,0,0,0|0,0,0]=2 11844 B11R0.148 CCOCCOCCOC(C)C 7a_100000210136_100000211751 [0,2,0,0,0,0|0,0,0]=2 11845 B11R0.148 CCOCCOCCOC(C)C 7a_100000210240_100000210206 [0,2,0,0,0,0|0,0,0]=2 11846 B11R0.148 CCOCCOCCOC(C)C 7a_100000211219_100011215890 [0,2,0,0,0,0|0,0,0]=2 11847 B11R0.148 CCOCCOCCSC(C)C 34a_100000210136_100000730970 [0,2,0,0,0,0|0,1,0]=3 11848 B11R0.148 CCOCCOCCSC(C)C 34a_200011212901_100000210147 [0,2,0,0,0,0|0,1,0]=3 11849 B11R0.148 CCOCCOCCSC(C)C 62a_100000210206_100011211534 [0,2,0,0,0,0|0,1,0]=3 11850 B11R0.148 CCOCCOCCSC(C)C 62a_100011211534_100000210206 [0,2,0,0,0,0|0,1,0]=3 11851 B11R0.148 CCOCCOCCSC(C)C 7a_100000210136_100000730970 [0,2,0,0,0,0|0,1,0]=3 11852 B11R0.148 CCOCCOCCSC(C)C 7a_200011212901_100011215890 [0,2,0,0,0,0|0,1,0]=3 11853 B11R0.148 CCOCCSCCC=C(C)C 62a_100000210147_100011217483 [0,2,0,0,0,0|1,1,0]=4 11854 B11R0.148 CCOCCSCCC=C(C)C 62a_100011217483_100011215890 [0,2,0,0,0,0|1,1,0]=4 11855 B11R0.148 CCOCCSCCCC(=O)C 62a_100000210147_100011215641 [0,2,0,0,0,0|1,1,0]=4 11856 B11R0.148 CCOCCSCCCC(=O)C 62a_100011215641_100011215890 [0,2,0,0,0,0|1,1,0]=4 11857 B11R0.148 CCOCCSCCCC(C)C 62a_100000210147_100011214892 [0,2,0,0,0,0|1,1,0]=4 11858 B11R0.148 CCOCCSCCCC(C)C 62a_100011214892_100011215890 [0,2,0,0,0,0|1,1,0]=4 11859 B11R0.148 CCOCCSCCCC(C)O 62a_100000210147_200000718107 [0,2,0,0,0,0|1,1,0]=4 11860 B11R0.148 CCOCCSCCCC(C)O 62a_200000718107_100011215890 [0,2,0,0,0,0|1,1,0]=4 11861 B11R0.148 CCOCCSCCCN(C)C 62a_100000210147_100000757444 [0,2,0,0,0,0|1,1,0]=4 11862 B11R0.148 CCOCCSCCNC(=O)C 62a_100000189650_100011215890 [0,2,0,0,0,0|1,1,0]=4 11863 B11R0.148 CCOCCSCCNC(=O)C 62a_100000210147_100000189650 [0,2,0,0,0,0|1,1,0]=4 11864 B11R0.148 CCOCCSCCOC(=O)C 62a_100000210147_100009814007 [0,2,0,0,0,0|0,1,0]=3 11865 B11R0.148 CCOCCSCCOC(=O)C 62a_100009814007_100011215890 [0,2,0,0,0,0|0,1,0]=3 11866 B11R0.148 CCOCCSCCOC(=O)N 62a_100000210147_200011214921 [0,2,0,0,0,0|0,1,1]=4 11867 B11R0.148 CCOCCSCCOC(=O)N 62a_200011214921_100011215890 [0,2,0,0,0,0|0,1,1]=4 11868 B11R0.148 CCOCCSCCOC(C)C 62a_100000210147_100000211751 [0,2,0,0,0,0|0,1,0]=3 11869 B11R0.148 CCOCCSCCOC(C)C 62a_100000211751_100011215890 [0,2,0,0,0,0|0,1,0]=3 11870 B11R0.148 CCOCCSCCSC(C)C 62a_100000210147_100000730970 [0,2,0,0,0,0|0,2,0]=4 11871 B11R0.148 CCOCCSCCSC(C)C 62a_100000730970_100011215890 [0,2,0,0,0,0|0,2,0]=4 11872 B11R0.148 CCOCSCCCCC(=O)C 62a_100000735457_100000739092 [0,2,0,0,0,0|2,0,0]=4 11873 B11R0.148 CCOCSCCCCC(=O)C 62a_100000739092_100000735457 [0,2,0,0,0,0|2,0,0]=4 11874 B11R0.148 CCOCSCCCCC(C)C 62a_100000739092_100011216152 [0,2,0,0,0,0|2,0,0]=4 11875 B11R0.148 CCOCSCCCCC(C)C 62a_100011216152_100000739092 [0,2,0,0,0,0|2,0,0]=4 11876 B11R0.148 CCOCSCCCCN(C)C 62a_100000739092_100000690147 [0,2,0,0,0,0|2,0,0]=4 11877 B11R0.148 CCOCSCCCOC(=O)C 62a_100000042594_100000739092 [0,2,0,0,0,0|2,0,0]=4 11878 B11R0.148 CCOCSCCCOC(=O)C 62a_100000739092_100000042594 [0,2,0,0,0,0|2,0,0]=4 11879 B11R0.148 CCOCSCCCOC(=S)C 62a_100000739092_200135323944 [0,2,0,0,0,0|2,0,0]=4 11880 B11R0.148 CCOCSCCCOC(=S)C 62a_200135323944_100000739092 [0,2,0,0,0,0|2,0,0]=4 11881 B11R0.148 CCSCCCCCOC(=O)C 62a_100000033007_100000210202 [0,2,0,0,0,0|1,1,0]=4 11882 B11R0.148 CCSCCCCCOC(=O)C 62a_100000210202_100000033007 [0,2,0,0,0,0|1,1,0]=4 11883 B11R0.148 CCSCCCOCCC(=O)C 7a_100011216438_100000053229 [0,2,0,0,0,0|1,1,0]=4 11884 B11R0.148 CCSCCCOCCC(C)C 34a_100011216438_100000210312 [0,2,0,0,0,0|1,1,0]=4 11885 B11R0.148 CCSCCCOCCC(C)C 7a_100011216438_100000210626 [0,2,0,0,0,0|1,1,0]=4 11886 B11R0.148 CCSCCCOCCC(C)O 34a_100011216438_100012276601 [0,2,0,0,0,0|1,1,0]=4 11887 B11R0.148 CCSCCCOCCC(C)O 7a_100011216438_100012276601 [0,2,0,0,0,0|1,1,0]=4 11888 B11R0.148 CCSCCCOCCN(C)C 7a_100011216438_100000755713 [0,2,0,0,0,0|1,1,0]=4 11889 B11R0.148 CCSCCNCCOC(C)C 2230a_100000106463_100000211751 [0,2,0,0,0,0|1,1,0]=4 11890 B11R0.148 CCSCCNCCOC(C)C 2230a_100000701111_100000757381 [0,2,0,0,0,0|1,1,0]=4 11891 B11R0.148 CCSCCNCCOC(C)C 34a_100000701111_100000757381 [0,2,0,0,0,0|1,1,0]=4 11892 B11R0.148 CCSCCOCCC=C(C)C 34a_100000212035_100011217483 [0,2,0,0,0,0|1,1,0]=4 11893 B11R0.148 CCSCCOCCC=C(C)C 7a_100000212035_100011217483 [0,2,0,0,0,0|1,1,0]=4 11894 B11R0.148 CCSCCOCCCC(=O)C 34a_100000212035_100000685027 [0,2,0,0,0,0|1,1,0]=4 11895 B11R0.148 CCSCCOCCCC(=O)C 34a_100000759063_100000757381 [0,2,0,0,0,0|1,1,0]=4 11896 B11R0.148 CCSCCOCCCC(=O)C 7a_100000212035_100011215641 [0,2,0,0,0,0|1,1,0]=4 11897 B11R0.148 CCSCCOCCCC(=O)C 7a_100000759063_100000757381 [0,2,0,0,0,0|1,1,0]=4 11898 B11R0.148 CCSCCOCCCC(C)C 34a_100000210774_100000757381 [0,2,0,0,0,0|1,1,0]=4 11899 B11R0.148 CCSCCOCCCC(C)C 34a_100000212035_100011214892 [0,2,0,0,0,0|1,1,0]=4 11900 B11R0.148 CCSCCOCCCC(C)C 7a_100000210774_100000757381 [0,2,0,0,0,0|1,1,0]=4 11901 B11R0.148 CCSCCOCCCC(C)C 7a_100000212035_100011214892 [0,2,0,0,0,0|1,1,0]=4 11902 B11R0.148 CCSCCOCCCC(C)O 34a_100000212035_200000718107 [0,2,0,0,0,0|1,1,0]=4 11903 B11R0.148 CCSCCOCCCC(C)O 7a_100000212035_200000718107 [0,2,0,0,0,0|1,1,0]=4 11904 B11R0.148 CCSCCOCCCN(C)C 7a_100000212035_100000757444 [0,2,0,0,0,0|1,1,0]=4 11905 B11R0.148 CCSCCOCCNC(=O)C 34a_100000158858_100000757381 [0,2,0,0,0,0|1,1,0]=4 11906 B11R0.148 CCSCCOCCNC(=O)C 7a_100000212035_100000189650 [0,2,0,0,0,0|1,1,0]=4 11907 B11R0.148 CCSCCOCCNC(C)C 34a_100000224655_100000757381 [0,2,0,0,0,0|1,1,0]=4 11908 B11R0.148 CCSCCOCCOC(=O)C 34a_100000212035_100009814007 [0,2,0,0,0,0|0,1,0]=3 11909 B11R0.148 CCSCCOCCOC(=O)C 62a_100000210202_200000083610 [0,2,0,0,0,0|0,1,0]=3 11910 B11R0.148 CCSCCOCCOC(=O)C 62a_200000083610_100000210202 [0,2,0,0,0,0|0,1,0]=3 11911 B11R0.148 CCSCCOCCOC(=O)C 7a_100000212035_100009814007 [0,2,0,0,0,0|0,1,0]=3 11912 B11R0.148 CCSCCOCCOC(=O)N 34a_100000212035_200011214921 [0,2,0,0,0,0|0,1,1]=4 11913 B11R0.148 CCSCCOCCOC(=O)N 7a_100000212035_200011214921 [0,2,0,0,0,0|0,1,1]=4 11914 B11R0.148 CCSCCOCCOC(=O)N 7a_100000766696_100000757381 [0,2,0,0,0,0|0,1,1]=4 11915 B11R0.148 CCSCCOCCOC(C)C 34a_100000211219_100000757381 [0,2,0,0,0,0|0,1,0]=3 11916 B11R0.148 CCSCCOCCOC(C)C 34a_100000212035_100000211751 [0,2,0,0,0,0|0,1,0]=3 11917 B11R0.148 CCSCCOCCOC(C)C 7a_100000211219_100000757381 [0,2,0,0,0,0|0,1,0]=3 11918 B11R0.148 CCSCCOCCOC(C)C 7a_100000212035_100000211751 [0,2,0,0,0,0|0,1,0]=3 11919 B11R0.148 CCSCCOCCSC(C)C 34a_100000212035_100000730970 [0,2,0,0,0,0|0,2,0]=4 11920 B11R0.148 CCSCCOCCSC(C)C 34a_200011212901_100000757381 [0,2,0,0,0,0|0,2,0]=4 11921 B11R0.148 CCSCCOCCSC(C)C 7a_100000212035_100000730970 [0,2,0,0,0,0|0,2,0]=4 11922 B11R0.148 CCSCCOCCSC(C)C 7a_200011212901_100000757381 [0,2,0,0,0,0|0,2,0]=4 11923 B11R0.148 CCSCCSCCOC(=O)C 62a_100000757381_100009814007 [0,2,0,0,0,0|0,2,0]=4 11924 B11R0.148 CCSCCSCCOC(=O)C 62a_100009814007_100000757381 [0,2,0,0,0,0|0,2,0]=4 11925 B11R0.148 CCSCCSCCOC(C)C 62a_100000211751_100000757381 [0,2,0,0,0,0|0,2,0]=4 11926 B11R0.148 CCSCCSCCOC(C)C 62a_100000757381_100000211751 [0,2,0,0,0,0|0,2,0]=4 11927 B11R0.148 CN(C)CCOCCCCCBr 7a_100000746331_100000755713 [0,2,0,0,0,0|2,0,0]=4 11928 B11R0.148 CN(C)CCOCCCCCCl 7a_100000746330_100000755713 [0,2,0,0,0,0|2,0,0]=4 11929 B11R0.148 CN(C)CCOCCCCCI 7a_200012148887_100000755713 [0,2,0,0,0,0|2,0,0]=4 11930 B11R0.148 CN(C)CCOCCOCCBr 7a_100000692535_100000755713 [0,2,0,0,0,0|1,0,0]=3 11931 B11R0.148 CN(C)CCOCCOCCCl 7a_100011215305_100000755713 [0,2,0,0,0,0|1,0,0]=3 11932 B11R0.148 CN(C)CCOCCOCCF 7a_200015357709_100000755713 [0,2,0,0,0,0|1,0,0]=3 11933 B11R0.148 CN(C)CCOCCOCCI 7a_100012149058_100000755713 [0,2,0,0,0,0|1,0,0]=3 11934 B11R0.148 CN(C)CCOCCOCCO 2230a_100102631434_100000032323 [0,2,0,0,0,0|1,0,0]=3 11935 B11R0.148 CN(C)CCOCCOCCO 2230a_200014138305_200000210301 [0,2,0,0,0,0|1,0,0]=3 11936 B11R0.148 CN(C)CCOCCOCCO 269982a_100102631434_100000032323 [0,2,0,0,0,0|1,0,0]=3 11937 B11R0.148 CN(C)CCOCCOCCO 269982a_200014138305_200000210301 [0,2,0,0,0,0|1,0,0]=3 11938 B11R0.148 CN(C)CCOCCOCCO 34a_200014138305_200000210301 [0,2,0,0,0,0|1,0,0]=3 11939 B11R0.148 CN(C)CCSCCOCCO 62a_100011215305_100000755713 [0,2,0,0,0,0|1,1,0]=4 11940 B11R0.148 CN([13CH3])CCOCCOCCO 2230a_200014138305_200025704644 [0,2,0,0,0,0|1,0,0]=3 11941 B11R0.148 CN([13CH3])CCOCCOCCO 269982a_200014138305_200025704644 [0,2,0,0,0,0|1,0,0]=3 11942 B11R0.148 CN([13CH3])CCOCCOCCO 34a_200014138305_200025704644 [0,2,0,0,0,0|1,0,0]=3 11943 B11R0.148 CNCCCCCOCC(C)C 34a_100000722520_100000210624 [0,2,0,0,0,0|2,0,0]=4 11944 B11R0.148 CNCCCCCOCC(C)O 34a_100000722520_100011218427 [0,2,0,0,0,0|2,0,0]=4 11945 B11R0.148 CNCCCCCOCC(F)F 34a_100000722520_100011934356 [0,2,0,0,0,0|2,0,0]=4 11946 B11R0.148 CNCCCCCOC[C@@H](C)O 34a_100000722520_100009817552 [0,2,0,0,0,0|2,0,0]=4 11947 B11R0.148 CNCCCOCCCC(C)C 34a_100000213112_100011214892 [0,2,0,0,0,0|2,0,0]=4 11948 B11R0.148 CNCCCOCCCC(C)O 34a_100000213112_200000718107 [0,2,0,0,0,0|2,0,0]=4 11949 B11R0.148 CNCCCOCCOC(=O)C 34a_100000213112_100009814007 [0,2,0,0,0,0|1,0,1]=4 11950 B11R0.148 CNCCCOCCOC(C)C 34a_100000213112_100000211751 [0,2,0,0,0,0|1,0,0]=3 11951 B11R0.148 CNCCCOCCSC(C)C 34a_100000213112_100000730970 [0,2,0,0,0,0|1,1,0]=4 11952 B11R0.148 CNCCOCCOCC(=O)N 34a_100000228057_100000187820 [0,2,0,0,0,0|1,0,1]=4 11953 B11R0.148 CNCCOCCOCC(=O)O 269956a_100009854275_200000210301 [0,2,0,0,0,0|1,0,1]=4 11954 B11R0.148 CNCCOCCOCC(=O)[O-] 34a_100000228057_100020667443 [0,2,0,0,0,0|1,0,1]=4 11955 B11R0.148 CNCCOCCOCC(C)C 34a_100000228057_100000210624 [0,2,0,0,0,0|1,0,0]=3 11956 B11R0.148 CNCCOCCOCC(C)O 34a_100000228057_100011218427 [0,2,0,0,0,0|1,0,0]=3 11957 B11R0.148 CNCCOCCOCC(F)F 34a_100000228057_100011934356 [0,2,0,0,0,0|1,0,0]=3 11958 B11R0.148 CNCCOCCOC[C@@H](C)O 34a_100000228057_100009817552 [0,2,0,0,0,0|1,0,0]=3 11959 B11R0.148 CNCCOCCOC[N+](=O)[O-] 34a_100000228057_100000761209 [0,2,0,0,0,0|2,0,0]=4 11960 B11R0.148 COCCCCCCCC(C)C 34a_200000210741_200000210301 [0,2,0,0,0,0|2,0,0]=4 11961 B11R0.148 COCCCCCCCC(C)C 7a_200000210741_200000210301 [0,2,0,0,0,0|2,0,0]=4 11962 B11R0.148 COCCCCCCNC(C)C 2230a_100138425928_100011998445 [0,2,0,0,0,0|2,0,0]=4 11963 B11R0.148 COCCCCCCNC(C)C 34a_100138425928_100011998445 [0,2,0,0,0,0|2,0,0]=4 11964 B11R0.148 COCCCCCCOC(C)C 34a_100000212225_100011998445 [0,2,0,0,0,0|1,0,0]=3 11965 B11R0.148 COCCCCCCOC(C)C 34a_200012092642_100000210206 [0,2,0,0,0,0|1,0,0]=3 11966 B11R0.148 COCCCCCCOC(C)C 7a_200012092642_100000210206 [0,2,0,0,0,0|1,0,0]=3 11967 B11R0.148 COCCCCCCSC(C)C 62a_100000210206_100011998445 [0,2,0,0,0,0|1,1,0]=4 11968 B11R0.148 COCCCCCCSC(C)C 62a_100011998445_100000210206 [0,2,0,0,0,0|1,1,0]=4 11969 B11R0.148 COCCCCCNCC(C)C 2230a_100000747528_100000210760 [0,2,0,0,0,0|2,0,0]=4 11970 B11R0.148 COCCCCCNCC(C)C 270004a_100000747528_100000210432 [0,2,0,0,0,0|2,0,0]=4 11971 B11R0.148 COCCCCCNCC(C)C 34a_100000747528_100000210624 [0,2,0,0,0,0|2,0,0]=4 11972 B11R0.148 COCCCCCNCC(C)O 2230a_100000747528_100011218427 [0,2,0,0,0,0|2,0,0]=4 11973 B11R0.148 COCCCCCNCC(C)O 34a_100000747528_100011218427 [0,2,0,0,0,0|2,0,0]=4 11974 B11R0.148 COCCCCCNCC(F)F 2230a_100000747528_100011934356 [0,2,0,0,0,0|2,0,0]=4 11975 B11R0.148 COCCCCCNCC(F)F 34a_100000747528_100011934356 [0,2,0,0,0,0|2,0,0]=4 11976 B11R0.148 COCCCCCNC[C@@H](C)O 2230a_100000747528_100009817552 [0,2,0,0,0,0|2,0,0]=4 11977 B11R0.148 COCCCCCNC[C@@H](C)O 34a_100000747528_100009817552 [0,2,0,0,0,0|2,0,0]=4 11978 B11R0.148 COCCCCNCCC(C)O 2230a_200000755665_100000730899 [0,2,0,0,0,0|2,0,0]=4 11979 B11R0.148 COCCCCOCCC(=O)C 34a_100000759926_100000755781 [0,2,0,0,0,0|2,0,0]=4 11980 B11R0.148 COCCCCOCCC(=O)C 7a_100000759926_100000730899 [0,2,0,0,0,0|2,0,0]=4 11981 B11R0.148 COCCCCOCCC(C)Br 34a_100009893172_100000755781 [0,2,0,0,0,0|2,0,0]=4 11982 B11R0.148 COCCCCOCCC(C)C 34a_100000210254_100000755781 [0,2,0,0,0,0|2,0,0]=4 11983 B11R0.148 COCCCCOCCC(C)C 34a_100000740925_100000210312 [0,2,0,0,0,0|2,0,0]=4 11984 B11R0.148 COCCCCOCCC(C)C 7a_100000210254_100000730899 [0,2,0,0,0,0|2,0,0]=4 11985 B11R0.148 COCCCCOCCC(C)O 34a_100000740925_100012276601 [0,2,0,0,0,0|2,0,0]=4 11986 B11R0.148 COCCCCOCC[C@@H](C)N 34a_100000706166_100000755781 [0,2,0,0,0,0|2,0,0]=4 11987 B11R0.148 COCCCCOCOC(=O)C 34a_100000740925_100009813279 [0,2,0,0,0,0|1,0,1]=4 11988 B11R0.148 COCCCCOCOC(C)C 34a_100000740925_100000709892 [0,2,0,0,0,0|1,0,0]=3 11989 B11R0.148 COCCCCSCCC(C)C 62a_100000210312_100000730899 [0,2,0,0,0,0|2,0,0]=4 11990 B11R0.148 COCCCCSCCC(C)C 62a_100000730899_100000210312 [0,2,0,0,0,0|2,0,0]=4 11991 B11R0.148 COCCCCSCCC(C)O 62a_100000730899_100012276601 [0,2,0,0,0,0|2,0,0]=4 11992 B11R0.148 COCCCCSCCC(C)O 62a_100012276601_100000730899 [0,2,0,0,0,0|2,0,0]=4 11993 B11R0.148 COCCCCSCOC(=O)C 62a_100000076356_100000730899 [0,2,0,0,0,0|1,0,1]=4 11994 B11R0.148 COCCCCSCOC(=O)C 62a_100000730899_100000076356 [0,2,0,0,0,0|1,0,1]=4 11995 B11R0.148 COCCCCSCOC(C)C 62a_100000709892_100000730899 [0,2,0,0,0,0|1,0,0]=3 11996 B11R0.148 COCCCCSCOC(C)C 62a_100000730899_100000709892 [0,2,0,0,0,0|1,0,0]=3 11997 B11R0.148 COCCCNCCCC(C)C 2230a_200000737386_100000740836 [0,2,0,0,0,0|2,0,0]=4 11998 B11R0.148 COCCCNCCCC(C)C 34a_100150723488_100011214892 [0,2,0,0,0,0|2,0,0]=4 11999 B11R0.148 COCCCNCCCC(C)C 34a_200000737386_100000740836 [0,2,0,0,0,0|2,0,0]=4 12000 B11R0.148 COCCCNCCCC(C)O 34a_100150723488_200000718107 [0,2,0,0,0,0|2,0,0]=4 12001 B11R0.148 COCCCNCCOC(=O)C 34a_100150723488_100009814007 [0,2,0,0,0,0|1,0,1]=4 12002 B11R0.148 COCCCNCCOC(C)C 2230a_100000701111_100000740836 [0,2,0,0,0,0|1,0,0]=3 12003 B11R0.148 COCCCNCCOC(C)C 34a_100000701111_100000740836 [0,2,0,0,0,0|1,0,0]=3 12004 B11R0.148 COCCCNCCOC(C)C 34a_100150723488_100000211751 [0,2,0,0,0,0|1,0,0]=3 12005 B11R0.148 COCCCNCCSC(C)C 2230a_100000731138_100000740836 [0,2,0,0,0,0|1,1,0]=4 12006 B11R0.148 COCCCNCCSC(C)C 34a_100000731138_100000740836 [0,2,0,0,0,0|1,1,0]=4 12007 B11R0.148 COCCCNCCSC(C)C 34a_100150723488_100000730970 [0,2,0,0,0,0|1,1,0]=4 12008 B11R0.148 COCCCOCCC=C(C)C 34a_100000740835_100011217483 [0,2,0,0,0,0|1,0,1]=4 12009 B11R0.148 COCCCOCCCC(=O)C 34a_100000740835_100000685027 [0,2,0,0,0,0|1,0,1]=4 12010 B11R0.148 COCCCOCCCC(=O)C 34a_100000759063_100000740836 [0,2,0,0,0,0|1,0,1]=4 12011 B11R0.148 COCCCOCCCC(=O)C 7a_100000759063_100000740836 [0,2,0,0,0,0|1,0,1]=4 12012 B11R0.148 COCCCOCCCC(C)C 34a_100000210774_100000740836 [0,2,0,0,0,0|1,0,0]=3 12013 B11R0.148 COCCCOCCCC(C)C 34a_100000740835_100011214892 [0,2,0,0,0,0|1,0,0]=3 12014 B11R0.148 COCCCOCCCC(C)C 7a_100000210774_100000740836 [0,2,0,0,0,0|1,0,0]=3 12015 B11R0.148 COCCCOCCCC(C)O 34a_100000740835_200000718107 [0,2,0,0,0,0|1,0,0]=3 12016 B11R0.148 COCCCOCCNC(=O)C 34a_100000158858_100000740836 [0,2,0,0,0,0|1,0,1]=4 12017 B11R0.148 COCCCOCCNC(C)C 34a_100000224655_100000740836 [0,2,0,0,0,0|1,0,0]=3 12018 B11R0.148 COCCCOCCOC(=O)C 34a_100000740835_100009814007 [0,2,0,0,0,0|0,0,1]=3 12019 B11R0.148 COCCCOCCOC(=O)N 34a_100000740835_200011214921 [0,2,0,0,0,0|1,0,1]=4 12020 B11R0.148 COCCCOCCOC(=O)N 7a_100000766696_100000740836 [0,2,0,0,0,0|1,0,1]=4 12021 B11R0.148 COCCCOCCOC(C)C 34a_100000211219_100000740836 [0,2,0,0,0,0|0,0,0]=2 12022 B11R0.148 COCCCOCCOC(C)C 34a_100000740835_100000211751 [0,2,0,0,0,0|0,0,0]=2 12023 B11R0.148 COCCCOCCOC(C)C 7a_100000211219_100000740836 [0,2,0,0,0,0|0,0,0]=2 12024 B11R0.148 COCCCOCCSC(C)C 34a_100000740835_100000730970 [0,2,0,0,0,0|0,1,0]=3 12025 B11R0.148 COCCCOCCSC(C)C 34a_200011212901_100000740836 [0,2,0,0,0,0|0,1,0]=3 12026 B11R0.148 COCCCOCCSC(C)C 7a_200011212901_100000740836 [0,2,0,0,0,0|0,1,0]=3 12027 B11R0.148 COCCCSCCCC(C)C 62a_100000709357_100011214892 [0,2,0,0,0,0|1,1,0]=4 12028 B11R0.148 COCCCSCCCC(C)C 62a_100011214892_100000709357 [0,2,0,0,0,0|1,1,0]=4 12029 B11R0.148 COCCCSCCCC(C)O 62a_100000709357_200000718107 [0,2,0,0,0,0|1,1,0]=4 12030 B11R0.148 COCCCSCCCC(C)O 62a_200000718107_100000709357 [0,2,0,0,0,0|1,1,0]=4 12031 B11R0.148 COCCCSCCOC(=O)C 62a_100000709357_100009814007 [0,2,0,0,0,0|0,1,1]=4 12032 B11R0.148 COCCCSCCOC(=O)C 62a_100009814007_100000709357 [0,2,0,0,0,0|0,1,1]=4 12033 B11R0.148 COCCCSCCOC(C)C 62a_100000211751_100000709357 [0,2,0,0,0,0|0,1,0]=3 12034 B11R0.148 COCCCSCCOC(C)C 62a_100000709357_100000211751 [0,2,0,0,0,0|0,1,0]=3 12035 B11R0.148 COCCCSCCSC(C)C 62a_100000709357_100000730970 [0,2,0,0,0,0|0,2,0]=4 12036 B11R0.148 COCCCSCCSC(C)C 62a_100000730970_100000709357 [0,2,0,0,0,0|0,2,0]=4 12037 B11R0.148 COCCNCCCCC(C)C 2230a_100000209980_100011216152 [0,2,0,0,0,0|2,0,0]=4 12038 B11R0.148 COCCNCCCOC(=S)C 2230a_100000209980_200135323944 [0,2,0,0,0,0|1,0,1]=4 12039 B11R0.148 COCCNCCCOC(C)C 2230a_100000737246_100011201679 [0,2,0,0,0,0|1,0,0]=3 12040 B11R0.148 COCCNCCCOC(C)C 34a_100000737246_100011201679 [0,2,0,0,0,0|1,0,0]=3 12041 B11R0.148 COCCNCCOCC(=O)N 2230a_100000209980_100000076697 [0,2,0,0,0,0|1,0,1]=4 12042 B11R0.148 COCCNCCOCC(=O)O 269956a_100000700818_100000233755 [0,2,0,0,0,0|1,0,1]=4 12043 B11R0.148 COCCNCCOCC(F)F 2230a_100000209980_200012177212 [0,2,0,0,0,0|1,0,0]=3 12044 B11R0.148 COCCOCCCCB(O)O 34a_100000210237_200009817182 [0,2,0,0,0,0|2,0,0]=4 12045 B11R0.148 COCCOCCCCC(=O)C 34a_100000210237_100009817362 [0,2,0,0,0,0|1,0,0]=3 12046 B11R0.148 COCCOCCCCC(=O)N 34a_100012022536_100011201679 [0,2,0,0,0,0|1,0,1]=4 12047 B11R0.148 COCCOCCCCC(=O)N 7a_100012022536_100000233755 [0,2,0,0,0,0|1,0,1]=4 12048 B11R0.148 COCCOCCCCC(C)C 34a_100000210237_100011216152 [0,2,0,0,0,0|1,0,0]=3 12049 B11R0.148 COCCOCCCCC(C)C 34a_100011214890_100011201679 [0,2,0,0,0,0|1,0,0]=3 12050 B11R0.148 COCCOCCCCC(C)C 7a_100011214890_100000233755 [0,2,0,0,0,0|1,0,0]=3 12051 B11R0.148 COCCOCCCC[N+](=O)[O-] 34a_200015379883_100011201679 [0,2,0,0,0,0|2,0,0]=4 12052 B11R0.148 COCCOCCCC[N+](=O)[O-] 7a_200015379883_100000233755 [0,2,0,0,0,0|2,0,0]=4 12053 B11R0.148 COCCOCCCNC(=O)C 1626a_100000206027_100015343762 [0,2,0,0,0,0|1,0,1]=4 12054 B11R0.148 COCCOCCCNC(=O)C 240690a_100000206027_100015343762 [0,2,0,0,0,0|1,0,1]=4 12055 B11R0.148 COCCOCCCNC(=O)C 34a_100000752032_100011201679 [0,2,0,0,0,0|1,0,1]=4 12056 B11R0.148 COCCOCCCNC(C)C 2230a_100000206027_100000210206 [0,2,0,0,0,0|1,0,0]=3 12057 B11R0.148 COCCOCCCNC(C)C 2230a_100138425928_100011216529 [0,2,0,0,0,0|1,0,0]=3 12058 B11R0.148 COCCOCCCNC(C)C 34a_100000182298_100011201679 [0,2,0,0,0,0|1,0,0]=3 12059 B11R0.148 COCCOCCCNC(C)C 34a_100000206027_100000210206 [0,2,0,0,0,0|1,0,0]=3 12060 B11R0.148 COCCOCCCNC(C)C 34a_100138425928_100011216529 [0,2,0,0,0,0|1,0,0]=3 12061 B11R0.148 COCCOCCCOC(=O)C 34a_100000210237_100000042594 [0,2,0,0,0,0|0,0,1]=3 12062 B11R0.148 COCCOCCCOC(=S)C 34a_100000210237_200135323944 [0,2,0,0,0,0|0,0,1]=3 12063 B11R0.148 COCCOCCCOC(C)C 34a_100000212225_100011216529 [0,2,0,0,0,0|0,0,0]=2 12064 B11R0.148 COCCOCCCSC(=O)C 34a_100000210237_100000038929 [0,2,0,0,0,0|0,1,1]=4 12065 B11R0.148 COCCOCCCSC(C)C 62a_100000210206_100011216529 [0,2,0,0,0,0|0,1,0]=3 12066 B11R0.148 COCCOCCCSC(C)C 62a_100011216529_100000210206 [0,2,0,0,0,0|0,1,0]=3 12067 B11R0.148 COCCOCCNCC(=O)N 2230a_100000711301_100000695917 [0,2,0,0,0,0|1,0,1]=4 12068 B11R0.148 COCCOCCNCC(=O)N 2230a_100000745349_100000747473 [0,2,0,0,0,0|1,0,1]=4 12069 B11R0.148 COCCOCCNCC(=O)N 34a_100000745349_100000187820 [0,2,0,0,0,0|1,0,1]=4 12070 B11R0.148 COCCOCCNCC(=O)O 269956a_100016091260_100000695917 [0,2,0,0,0,0|1,0,1]=4 12071 B11R0.148 COCCOCCNCC(=O)[O-] 34a_100000745349_100020667443 [0,2,0,0,0,0|1,0,1]=4 12072 B11R0.148 COCCOCCNCC(C)C 2230a_100000210953_100000695917 [0,2,0,0,0,0|1,0,0]=3 12073 B11R0.148 COCCOCCNCC(C)C 2230a_100000745349_100000210760 [0,2,0,0,0,0|1,0,0]=3 12074 B11R0.148 COCCOCCNCC(C)C 270004a_100000745349_100000210432 [0,2,0,0,0,0|1,0,0]=3 12075 B11R0.148 COCCOCCNCC(C)C 34a_100000210953_100000695917 [0,2,0,0,0,0|1,0,0]=3 12076 B11R0.148 COCCOCCNCC(C)C 34a_100000745349_100000210624 [0,2,0,0,0,0|1,0,0]=3 12077 B11R0.148 COCCOCCNCC(C)C 34a_100015185251_100011201679 [0,2,0,0,0,0|1,0,0]=3 12078 B11R0.148 COCCOCCNCC(C)O 2230a_100000210904_100000695917 [0,2,0,0,0,0|1,0,0]=3 12079 B11R0.148 COCCOCCNCC(C)O 2230a_100000745349_100011218427 [0,2,0,0,0,0|1,0,0]=3 12080 B11R0.148 COCCOCCNCC(C)O 34a_100000210904_100000695917 [0,2,0,0,0,0|1,0,0]=3 12081 B11R0.148 COCCOCCNCC(C)O 34a_100000745349_100011218427 [0,2,0,0,0,0|1,0,0]=3 12082 B11R0.148 COCCOCCNCC(F)F 2230a_100000745349_100011934356 [0,2,0,0,0,0|1,0,0]=3 12083 B11R0.148 COCCOCCNCC(F)F 34a_100000745349_100011934356 [0,2,0,0,0,0|1,0,0]=3 12084 B11R0.148 COCCOCCNCC(F)F 34a_100000765723_100000695917 [0,2,0,0,0,0|1,0,0]=3 12085 B11R0.148 COCCOCCNC[C@@H](C)O 2230a_100000745349_100009817552 [0,2,0,0,0,0|1,0,0]=3 12086 B11R0.148 COCCOCCNC[C@@H](C)O 34a_100000745349_100009817552 [0,2,0,0,0,0|1,0,0]=3 12087 B11R0.148 COCCOCCNC[N+](=O)[O-] 34a_100000745349_100000761209 [0,2,0,0,0,0|2,0,0]=4 12088 B11R0.148 COCCOCCOCC(=O)C 1458a_100011214951_200000210301 [0,2,0,0,0,0|0,0,0]=2 12089 B11R0.148 COCCOCCOCC(=O)C 34a_100000211253_100000695917 [0,2,0,0,0,0|0,0,0]=2 12090 B11R0.148 COCCOCCOCC(=O)N 34a_100000210237_100000076697 [0,2,0,0,0,0|0,0,1]=3 12091 B11R0.148 COCCOCCOCC(=O)N 34a_100011215163_100000187820 [0,2,0,0,0,0|0,0,1]=3 12092 B11R0.148 COCCOCCOCC(=O)N 7a_100011215163_100000187820 [0,2,0,0,0,0|0,0,1]=3 12093 B11R0.148 COCCOCCOCC(=O)[13CH3] 1458a_100011214951_200025704644 [0,2,0,0,0,0|0,0,0]=2 12094 B11R0.148 COCCOCCOCC(=O)[O-] 34a_100011215163_100020667443 [0,2,0,0,0,0|0,0,1]=3 12095 B11R0.148 COCCOCCOCC(C)Br 34a_100012180447_100000695917 [0,2,0,0,0,0|0,0,0]=2 12096 B11R0.148 COCCOCCOCC(C)C 34a_100000210257_100000695917 [0,2,0,0,0,0|0,0,0]=2 12097 B11R0.148 COCCOCCOCC(C)C 34a_100000703358_100011201679 [0,2,0,0,0,0|0,0,0]=2 12098 B11R0.148 COCCOCCOCC(C)C 34a_100011215163_100000210624 [0,2,0,0,0,0|0,0,0]=2 12099 B11R0.148 COCCOCCOCC(C)C 7a_100000703358_100000233755 [0,2,0,0,0,0|0,0,0]=2 12100 B11R0.148 COCCOCCOCC(C)C 7a_100011215163_100000210760 [0,2,0,0,0,0|0,0,0]=2 12101 B11R0.148 COCCOCCOCC(C)F 34a_100015925927_100000695917 [0,2,0,0,0,0|0,0,0]=2 12102 B11R0.148 COCCOCCOCC(C)O 34a_100011215163_100011218427 [0,2,0,0,0,0|0,0,0]=2 12103 B11R0.148 COCCOCCOCC(C)O 7a_100011215163_100011218427 [0,2,0,0,0,0|0,0,0]=2 12104 B11R0.148 COCCOCCOCC(F)F 34a_100000210237_200012177212 [0,2,0,0,0,0|0,0,0]=2 12105 B11R0.148 COCCOCCOCC(F)F 34a_100000704375_100011201679 [0,2,0,0,0,0|0,0,0]=2 12106 B11R0.148 COCCOCCOCC(F)F 34a_100000743014_100000695917 [0,2,0,0,0,0|0,0,0]=2 12107 B11R0.148 COCCOCCOCC(F)F 34a_100010782186_200000210301 [0,2,0,0,0,0|0,0,0]=2 12108 B11R0.148 COCCOCCOCC(F)F 34a_100011215163_100011934356 [0,2,0,0,0,0|0,0,0]=2 12109 B11R0.148 COCCOCCOCC(F)F 7a_100000704375_100000233755 [0,2,0,0,0,0|0,0,0]=2 12110 B11R0.148 COCCOCCOCC(F)F 7a_100010782186_200000210301 [0,2,0,0,0,0|0,0,0]=2 12111 B11R0.148 COCCOCCOCC(F)F 7a_100011215163_100011934356 [0,2,0,0,0,0|0,0,0]=2 12112 B11R0.148 COCCOCCOC[C@@H](C)Cl 34a_100016084084_100000695917 [0,2,0,0,0,0|0,0,0]=2 12113 B11R0.148 COCCOCCOC[C@@H](C)N 34a_100000737577_100000695917 [0,2,0,0,0,0|0,0,0]=2 12114 B11R0.148 COCCOCCOC[C@@H](C)O 34a_100011215163_100009817552 [0,2,0,0,0,0|0,0,0]=2 12115 B11R0.148 COCCOCCOC[C@@H](C)O 7a_100011215163_100009817552 [0,2,0,0,0,0|0,0,0]=2 12116 B11R0.148 COCCOCCOC[N+](=O)[O-] 34a_100011215163_100000761209 [0,2,0,0,0,0|1,0,0]=3 12117 B11R0.148 COCCOCCSCC(=O)N 62a_100000695917_100000747473 [0,2,0,0,0,0|0,1,1]=4 12118 B11R0.148 COCCOCCSCC(=O)N 62a_100000747473_100000695917 [0,2,0,0,0,0|0,1,1]=4 12119 B11R0.148 COCCOCCSCC(=O)[O-] 62a_100000695917_100020667443 [0,2,0,0,0,0|0,1,1]=4 12120 B11R0.148 COCCOCCSCC(=O)[O-] 62a_100020667443_100000695917 [0,2,0,0,0,0|0,1,1]=4 12121 B11R0.148 COCCOCCSCC(C)C 34a_200000230437_100011201679 [0,2,0,0,0,0|0,1,0]=3 12122 B11R0.148 COCCOCCSCC(C)C 62a_100000210624_100000695917 [0,2,0,0,0,0|0,1,0]=3 12123 B11R0.148 COCCOCCSCC(C)C 62a_100000695917_100000210760 [0,2,0,0,0,0|0,1,0]=3 12124 B11R0.148 COCCOCCSCC(C)C 7a_200000230437_100000233755 [0,2,0,0,0,0|0,1,0]=3 12125 B11R0.148 COCCOCCSCC(C)O 62a_100000695917_100011218427 [0,2,0,0,0,0|0,1,0]=3 12126 B11R0.148 COCCOCCSCC(C)O 62a_100011218427_100000695917 [0,2,0,0,0,0|0,1,0]=3 12127 B11R0.148 COCCOCCSCC(F)F 62a_100000695917_100011934356 [0,2,0,0,0,0|0,1,0]=3 12128 B11R0.148 COCCOCCSCC(F)F 62a_100011934356_100000695917 [0,2,0,0,0,0|0,1,0]=3 12129 B11R0.148 COCCOCCSC[C@@H](C)O 62a_100000695917_100009817552 [0,2,0,0,0,0|0,1,0]=3 12130 B11R0.148 COCCOCCSC[C@@H](C)O 62a_100009817552_100000695917 [0,2,0,0,0,0|0,1,0]=3 12131 B11R0.148 COCCOCCSC[N+](=O)[O-] 62a_100000695917_100000761209 [0,2,0,0,0,0|1,1,0]=4 12132 B11R0.148 COCCOCNCCC(C)O 2230a_200000755665_100000231047 [0,2,0,0,0,0|1,0,0]=3 12133 B11R0.148 COCCOCNOCC(=O)O 269956a_100000106656_100000231047 [0,2,0,0,0,0|1,0,1]=4 12134 B11R0.148 COCCOCSCC=C(C)C 62a_100000231047_100000761012 [0,2,0,0,0,0|1,0,1]=4 12135 B11R0.148 COCCOCSCC=C(C)C 62a_100000761012_100000231047 [0,2,0,0,0,0|1,0,1]=4 12136 B11R0.148 COCCOCSCCC(=O)C 62a_100000053229_100000231047 [0,2,0,0,0,0|1,0,1]=4 12137 B11R0.148 COCCOCSCCC(=O)C 62a_100000231047_100000053229 [0,2,0,0,0,0|1,0,1]=4 12138 B11R0.148 COCCOCSCCC(C)C 62a_100000210312_100000231047 [0,2,0,0,0,0|1,0,0]=3 12139 B11R0.148 COCCOCSCCC(C)C 62a_100000231047_100000210312 [0,2,0,0,0,0|1,0,0]=3 12140 B11R0.148 COCCOCSCCC(C)O 62a_100000231047_100012276601 [0,2,0,0,0,0|1,0,0]=3 12141 B11R0.148 COCCOCSCCC(C)O 62a_100012276601_100000231047 [0,2,0,0,0,0|1,0,0]=3 12142 B11R0.148 COCCOCSCCN(C)C 62a_100000231047_100000755713 [0,2,0,0,0,0|2,0,0]=4 12143 B11R0.148 COCCOCSCOC(=O)C 62a_100000076356_100000231047 [0,2,0,0,0,0|0,0,1]=3 12144 B11R0.148 COCCOCSCOC(=O)C 62a_100000231047_100000076356 [0,2,0,0,0,0|0,0,1]=3 12145 B11R0.148 COCCOCSCOC(C)C 62a_100000231047_100000709892 [0,2,0,0,0,0|0,0,0]=2 12146 B11R0.148 COCCOCSCOC(C)C 62a_100000709892_100000231047 [0,2,0,0,0,0|0,0,0]=2 12147 B11R0.148 COCCSCCCCC(=O)C 62a_100000233755_100000735457 [0,2,0,0,0,0|1,1,0]=4 12148 B11R0.148 COCCSCCCCC(=O)C 62a_100000735457_100000233755 [0,2,0,0,0,0|1,1,0]=4 12149 B11R0.148 COCCSCCCCC(C)C 62a_100000233755_100011216152 [0,2,0,0,0,0|1,1,0]=4 12150 B11R0.148 COCCSCCCCC(C)C 62a_100011216152_100000233755 [0,2,0,0,0,0|1,1,0]=4 12151 B11R0.148 COCCSCCCCN(C)C 62a_100000233755_100000690147 [0,2,0,0,0,0|1,1,0]=4 12152 B11R0.148 COCCSCCCOC(=O)C 62a_100000042594_100000233755 [0,2,0,0,0,0|0,1,1]=4 12153 B11R0.148 COCCSCCCOC(=O)C 62a_100000233755_100000042594 [0,2,0,0,0,0|0,1,1]=4 12154 B11R0.148 COCCSCCCOC(=S)C 62a_100000233755_200135323944 [0,2,0,0,0,0|0,1,1]=4 12155 B11R0.148 COCCSCCCOC(=S)C 62a_200135323944_100000233755 [0,2,0,0,0,0|0,1,1]=4 12156 B11R0.148 COCCSCCOCC(=O)N 62a_100000076697_100000233755 [0,2,0,0,0,0|0,1,1]=4 12157 B11R0.148 COCCSCCOCC(=O)N 62a_100000233755_100000076697 [0,2,0,0,0,0|0,1,1]=4 12158 B11R0.148 COCCSCCOCC(F)F 62a_100000233755_200012177212 [0,2,0,0,0,0|0,1,0]=3 12159 B11R0.148 COCCSCCOCC(F)F 62a_200012177212_100000233755 [0,2,0,0,0,0|0,1,0]=3 12160 B11R0.148 COCNCCCCCC(C)C 2230a_100011290863_100000766300 [0,2,0,0,0,0|2,0,0]=4 12161 B11R0.148 COCNCCCOCC(C)C 2230a_100000205972_100000766300 [0,2,0,0,0,0|2,0,0]=4 12162 B11R0.148 COCSCCCCCC(C)C 62a_100000210682_100000766300 [0,2,0,0,0,0|2,0,0]=4 12163 B11R0.148 COCSCCCCCC(C)C 62a_100000766300_100000210682 [0,2,0,0,0,0|2,0,0]=4 12164 B11R0.148 COCSCCCCOC(=O)C 62a_100000033659_100000766300 [0,2,0,0,0,0|1,0,1]=4 12165 B11R0.148 COCSCCCCOC(=O)C 62a_100000766300_100000033659 [0,2,0,0,0,0|1,0,1]=4 12166 B11R0.148 COCSCOCCOC(=O)C 62a_100000076355_100000766300 [0,2,0,0,0,0|0,0,1]=3 12167 B11R0.148 COCSCOCCOC(=O)C 62a_100000766300_100000076355 [0,2,0,0,0,0|0,0,1]=3 12168 B11R0.148 CSCCCCOCCC(=O)C 7a_100011217163_100000053229 [0,2,0,0,0,0|2,0,0]=4 12169 B11R0.148 CSCCCCOCCC(C)C 34a_100011217163_100000210312 [0,2,0,0,0,0|2,0,0]=4 12170 B11R0.148 CSCCCCOCCC(C)C 7a_100011217163_100000210626 [0,2,0,0,0,0|2,0,0]=4 12171 B11R0.148 CSCCCCOCCC(C)O 34a_100011217163_100012276601 [0,2,0,0,0,0|2,0,0]=4 12172 B11R0.148 CSCCCCOCCC(C)O 7a_100011217163_100012276601 [0,2,0,0,0,0|2,0,0]=4 12173 B11R0.148 CSCCCCOCCN(C)C 7a_100011217163_100000755713 [0,2,0,0,0,0|2,0,0]=4 12174 B11R0.148 CSCCCCOCOC(C)C 34a_100011217163_100000709892 [0,2,0,0,0,0|1,1,0]=4 12175 B11R0.148 CSCCCNCCOC(C)C 2230a_100000749238_100000211751 [0,2,0,0,0,0|1,1,0]=4 12176 B11R0.148 CSCCCOCCCC(C)C 34a_100000690336_100011214892 [0,2,0,0,0,0|1,1,0]=4 12177 B11R0.148 CSCCCOCCCC(C)C 7a_100000690336_100011214892 [0,2,0,0,0,0|1,1,0]=4 12178 B11R0.148 CSCCCOCCCC(C)O 34a_100000690336_200000718107 [0,2,0,0,0,0|1,1,0]=4 12179 B11R0.148 CSCCCOCCCC(C)O 7a_100000690336_200000718107 [0,2,0,0,0,0|1,1,0]=4 12180 B11R0.148 CSCCCOCCOC(=O)C 34a_100000690336_100009814007 [0,2,0,0,0,0|0,1,1]=4 12181 B11R0.148 CSCCCOCCOC(=O)C 7a_100000690336_100009814007 [0,2,0,0,0,0|0,1,1]=4 12182 B11R0.148 CSCCCOCCOC(C)C 34a_100000690336_100000211751 [0,2,0,0,0,0|0,1,0]=3 12183 B11R0.148 CSCCCOCCOC(C)C 7a_100000690336_100000211751 [0,2,0,0,0,0|0,1,0]=3 12184 B11R0.148 CSCCCOCCSC(C)C 34a_100000690336_100000730970 [0,2,0,0,0,0|0,2,0]=4 12185 B11R0.148 CSCCCOCCSC(C)C 7a_100000690336_100000730970 [0,2,0,0,0,0|0,2,0]=4 12186 B11R0.148 CSCCNCCCOC(C)C 2230a_100000737246_100000751147 [0,2,0,0,0,0|1,1,0]=4 12187 B11R0.148 CSCCNCCCOC(C)C 34a_100000737246_100000212216 [0,2,0,0,0,0|1,1,0]=4 12188 B11R0.148 CSCCNCCOCC(F)F 2230a_100020590264_200012177212 [0,2,0,0,0,0|1,1,0]=4 12189 B11R0.148 CSCCOCCCCC(=O)C 34a_100000230434_100009817362 [0,2,0,0,0,0|1,1,0]=4 12190 B11R0.148 CSCCOCCCCC(=O)C 7a_100000230434_100000735457 [0,2,0,0,0,0|1,1,0]=4 12191 B11R0.148 CSCCOCCCCC(C)C 34a_100000230434_100011216152 [0,2,0,0,0,0|1,1,0]=4 12192 B11R0.148 CSCCOCCCCC(C)C 34a_100011214890_100000212216 [0,2,0,0,0,0|1,1,0]=4 12193 B11R0.148 CSCCOCCCCC(C)C 7a_100000230434_100011216152 [0,2,0,0,0,0|1,1,0]=4 12194 B11R0.148 CSCCOCCCCC(C)C 7a_100011214890_100000212216 [0,2,0,0,0,0|1,1,0]=4 12195 B11R0.148 CSCCOCCCNC(C)C 34a_100000182298_100000212216 [0,2,0,0,0,0|1,1,0]=4 12196 B11R0.148 CSCCOCCCOC(=O)C 34a_100000230434_100000042594 [0,2,0,0,0,0|0,1,1]=4 12197 B11R0.148 CSCCOCCCOC(=O)C 7a_100000230434_100000042594 [0,2,0,0,0,0|0,1,1]=4 12198 B11R0.148 CSCCOCCCOC(=S)C 34a_100000230434_200135323944 [0,2,0,0,0,0|0,1,1]=4 12199 B11R0.148 CSCCOCCCOC(=S)C 7a_100000230434_200135323944 [0,2,0,0,0,0|0,1,1]=4 12200 B11R0.148 CSCCOCCNCC(C)C 34a_100015185251_100000212216 [0,2,0,0,0,0|1,1,0]=4 12201 B11R0.148 CSCCOCCOCC(=O)N 34a_100000230434_100000076697 [0,2,0,0,0,0|0,1,1]=4 12202 B11R0.148 CSCCOCCOCC(=O)N 7a_100000230434_100000076697 [0,2,0,0,0,0|0,1,1]=4 12203 B11R0.148 CSCCOCCOCC(C)C 34a_100000703358_100000212216 [0,2,0,0,0,0|0,1,0]=3 12204 B11R0.148 CSCCOCCOCC(C)C 7a_100000703358_100000212216 [0,2,0,0,0,0|0,1,0]=3 12205 B11R0.148 CSCCOCCOCC(F)F 34a_100000230434_200012177212 [0,2,0,0,0,0|0,1,0]=3 12206 B11R0.148 CSCCOCCOCC(F)F 34a_100000704375_100000212216 [0,2,0,0,0,0|0,1,0]=3 12207 B11R0.148 CSCCOCCOCC(F)F 7a_100000230434_200012177212 [0,2,0,0,0,0|0,1,0]=3 12208 B11R0.148 CSCCOCCOCC(F)F 7a_100000704375_100000212216 [0,2,0,0,0,0|0,1,0]=3 12209 B11R0.148 CSCCOCCSCC(C)C 34a_200000230437_100000212216 [0,2,0,0,0,0|0,2,0]=4 12210 B11R0.148 CSCCOCCSCC(C)C 7a_200000230437_100000212216 [0,2,0,0,0,0|0,2,0]=4 12211 B11R0.148 CSCCSCCOCC(F)F 62a_100000212216_200012177212 [0,2,0,0,0,0|0,2,0]=4 12212 B11R0.148 CSCCSCCOCC(F)F 62a_200012177212_100000751147 [0,2,0,0,0,0|0,2,0]=4 12213 B11R0.148 CSCOCCCCCC(C)C 34a_100011995859_100011218213 [0,2,0,0,0,0|2,0,0]=4 12214 B11R0.148 CSCSCOCCOC(=O)C 62a_100000076355_100011218213 [0,2,0,0,0,0|0,1,1]=4 12215 B11R0.148 CSCSCOCCOC(=O)C 62a_100011218213_100000076355 [0,2,0,0,0,0|0,1,1]=4 12216 B11R0.148 C[C@@H](N)CCOCCCCCF 34a_100000706166_100000729378 [0,2,0,0,0,0|2,0,0]=4 12217 B11R0.148 C[C@@H](N)CCOCCCCCO 34a_100000706166_100000746330 [0,2,0,0,0,0|2,0,0]=4 12218 B11R0.148 C[C@@H](N)CCOCCOCCO 34a_100000706166_100000692535 [0,2,0,0,0,0|1,0,0]=3 12219 B11R0.148 FC(F)COCCOCCCBr 34a_100011217188_200012177212 [0,2,0,0,0,0|2,0,0]=4 12220 B11R0.148 FC(F)COCCOCCCCl 34a_100000230001_200012177212 [0,2,0,0,0,0|2,0,0]=4 12221 B11R0.148 FCCCOCCOCC(F)F 34a_100000704375_100011934791 [0,2,0,0,0,0|2,0,0]=4 12222 B11R0.148 FCCCOCCOCC(F)F 34a_100000759539_200012177212 [0,2,0,0,0,0|2,0,0]=4 12223 B11R0.148 FCCCOCCOCC(F)F 7a_100000704375_100011934791 [0,2,0,0,0,0|2,0,0]=4 12224 B11R0.148 N#CCCOCCOCC(F)F 7a_100000704375_100000184422 [0,2,0,0,0,0|2,0,0]=4 12225 B11R0.148 NC(=O)CCOCCOCCBr 34a_100000692535_100000731001 [0,2,0,0,0,0|2,0,0]=4 12226 B11R0.148 NC(=O)CCOCCOCCBr 7a_100000692535_100000744528 [0,2,0,0,0,0|2,0,0]=4 12227 B11R0.148 NC(=O)CCOCCOCCCl 34a_100011215305_100000731001 [0,2,0,0,0,0|2,0,0]=4 12228 B11R0.148 NC(=O)CCOCCOCCCl 7a_100011215305_100000744528 [0,2,0,0,0,0|2,0,0]=4 12229 B11R0.148 NC(=O)CCOCCOCCF 34a_200015357709_100000731001 [0,2,0,0,0,0|2,0,0]=4 12230 B11R0.148 NC(=O)CCOCCOCCF 7a_200015357709_100000744528 [0,2,0,0,0,0|2,0,0]=4 12231 B11R0.148 NC(=O)CCOCCOCCI 34a_100012149058_100000731001 [0,2,0,0,0,0|2,0,0]=4 12232 B11R0.148 NC(=O)CCOCCOCCI 7a_100012149058_100000744528 [0,2,0,0,0,0|2,0,0]=4 12233 B11R0.148 NC(=O)CCOCCOCCO 34a_100000757172_100000692535 [0,2,0,0,0,0|2,0,0]=4 12234 B11R0.148 NC(=O)CCOCCOCCO 7a_100000757172_100011215305 [0,2,0,0,0,0|2,0,0]=4 12235 B11R0.148 NCCCOCCOCC(F)F 34a_100000182051_200012177212 [0,2,0,0,0,0|2,0,0]=4 12236 B11R0.148 NCCOCCOCCC(=O)N 34a_100000211614_100000731001 [0,2,0,0,0,0|2,0,0]=4 12237 B11R0.148 NOCCOCCOCC(=O)N 34a_100000700252_100000076697 [0,2,0,0,0,0|1,0,1]=4 12238 B11R0.148 NOCCOCCOCC(F)F 34a_100000700252_200012177212 [0,2,0,0,0,0|1,0,0]=3 12239 B11R0.148 OCCCOCCOCC(F)F 34a_100000704375_100000230001 [0,2,0,0,0,0|2,0,0]=4 12240 B11R0.148 OCCCOCCOCC(F)F 7a_100000704375_100011215043 [0,2,0,0,0,0|2,0,0]=4 12241 B11R0.148 OCCOCCOCCC(F)F 34a_100103093639_100000692535 [0,2,0,0,0,0|2,0,0]=4 12242 B11R0.148 [13CH3]C(=O)CCOCCOCCO 1458a_100009915118_200025704644 [0,2,0,0,0,0|1,0,0]=3 12243 B11R0.148 [13CH3]NCCOCCOCC(=O)O 269956a_100009854275_200025704644 [0,2,0,0,0,0|1,0,1]=4 12244 B11R0.148 [13CH3]OCCOCCOCC(F)F 34a_100010782186_200025704644 [0,2,0,0,0,0|0,0,0]=2 12245 B11R0.148 [13CH3]OCCOCCOCC(F)F 7a_100010782186_200025704644 [0,2,0,0,0,0|0,0,0]=2 12246 B11R0.159 C#CCCOCCOC(C)(C)C 34a_100000693234_100000688953 [0,2,0,0,0,0|1,0,1]=4 12247 B11R0.159 C#CCCOCCOC(C)(C)C 7a_100000693234_100000688953 [0,2,0,0,0,0|1,0,1]=4 12248 B11R0.159 C/C=C/COCCOC(C)(C)C 34a_100000693234_100102629194 [0,2,0,0,0,0|1,0,1]=4 12249 B11R0.159 C/C=C/COCCOC(C)(C)C 7a_100000693234_100102629194 [0,2,0,0,0,0|1,0,1]=4 12250 B11R0.159 C=CCCOCCOC(C)(C)C 34a_100000693234_100000754431 [0,2,0,0,0,0|1,0,1]=4 12251 B11R0.159 C=CCCOCCOC(C)(C)C 7a_100000693234_100000754431 [0,2,0,0,0,0|1,0,1]=4 12252 B11R0.159 CC#CCOCCOC(C)(C)C 34a_100000693234_100000748600 [0,2,0,0,0,0|1,0,1]=4 12253 B11R0.159 CC#CCOCCOC(C)(C)C 7a_100000693234_100000748600 [0,2,0,0,0,0|1,0,1]=4 12254 B11R0.159 CC(C)(C)OCCOCCC#N 7a_100000693234_100000184422 [0,2,0,0,0,0|2,0,0]=4 12255 B11R0.159 CC(C)(C)OCCOCCCF 34a_100000693234_100011934791 [0,2,0,0,0,0|2,0,0]=4 12256 B11R0.159 CC(C)(C)OCCOCCCF 7a_100000693234_100011934791 [0,2,0,0,0,0|2,0,0]=4 12257 B11R0.159 CC(C)(C)OCCOCCCO 34a_100000693234_100000230001 [0,2,0,0,0,0|2,0,0]=4 12258 B11R0.159 CC(C)(C)OCCOCCCO 7a_100000693234_100011215043 [0,2,0,0,0,0|2,0,0]=4 12259 B11R0.159 CC(C)(C)OCCOCCO[13CH3] 34a_100011997631_200025704644 [0,2,0,0,0,0|0,0,0]=2 12260 B11R0.159 CC(C)(C)OCCOCCO[13CH3] 7a_100011997631_200025704644 [0,2,0,0,0,0|0,0,0]=2 12261 B11R0.159 CC(C)(O)CCCOCCON 34a_100000700252_100009888830 [0,2,0,0,0,0|2,0,0]=4 12262 B11R0.159 CC=CCOCCOC(C)(C)C 34a_100000693234_100000070051 [0,2,0,0,0,0|1,0,1]=4 12263 B11R0.159 CC=CCOCCOC(C)(C)C 7a_100000693234_100000070051 [0,2,0,0,0,0|1,0,1]=4 12264 B11R0.159 CCCCCCCOC(C)(C)C 34a_100000210272_100000210625 [0,2,0,0,0,0|2,0,0]=4 12265 B11R0.159 CCCCCCCOC(C)(C)C 34a_100015890283_100000210614 [0,2,0,0,0,0|2,0,0]=4 12266 B11R0.159 CCCCCCCOC(C)(C)C 7a_100015890283_100000210614 [0,2,0,0,0,0|2,0,0]=4 12267 B11R0.159 CCCCCOCCC(C)(C)C 34a_100000210253_100000755188 [0,2,0,0,0,0|2,0,0]=4 12268 B11R0.159 CCCCCOCCC(C)(C)C 7a_100000210253_100000755188 [0,2,0,0,0,0|2,0,0]=4 12269 B11R0.159 CCCCCOCCC(C)(C)C 7a_100000765024_100000210326 [0,2,0,0,0,0|2,0,0]=4 12270 B11R0.159 CCCCCOCCC(C)(C)O 34a_100000210253_100000702414 [0,2,0,0,0,0|2,0,0]=4 12271 B11R0.159 CCCCCOCCC(C)(C)O 7a_100000210253_100000702414 [0,2,0,0,0,0|2,0,0]=4 12272 B11R0.159 CCCCCOCCS(=O)(=O)C 34a_100000210253_100000731031 [0,2,0,0,0,0|1,1,0]=4 12273 B11R0.159 CCCCCOCCS(=O)(=O)C 34a_100000211924_100000718602 [0,2,0,0,0,0|1,1,0]=4 12274 B11R0.159 CCCCCOCCS(=O)(=O)C 7a_100000210253_100000230027 [0,2,0,0,0,0|1,1,0]=4 12275 B11R0.159 CCCCCOCCS(=O)(=O)C 7a_100000211924_100000210326 [0,2,0,0,0,0|1,1,0]=4 12276 B11R0.159 CCCCCOCC[N+](C)(C)C 34a_100000210253_100000085578 [0,2,0,0,0,0|2,0,0]=4 12277 B11R0.159 CCCCCOCC[N+](C)(C)C 7a_100000210253_100000085578 [0,2,0,0,0,0|2,0,0]=4 12278 B11R0.159 CCCCCOCC[N+](C)(C)C 7a_200020618287_100000210326 [0,2,0,0,0,0|2,0,0]=4 12279 B11R0.159 CCCCCOCC[Si](C)(C)C 34a_100000210253_200000733723 [0,2,0,0,0,0|2,0,0]=4 12280 B11R0.159 CCCCCOCC[Si](C)(C)C 7a_100000039746_100000210326 [0,2,0,0,0,0|2,0,0]=4 12281 B11R0.159 CCCCCOCC[Si](C)(C)C 7a_100000210253_200000733723 [0,2,0,0,0,0|2,0,0]=4 12282 B11R0.159 CCCCNCCOC(C)(C)C 2230a_100000747557_100000210211 [0,2,0,0,0,0|2,0,0]=4 12283 B11R0.159 CCCCOCCCC(C)(C)O 34a_100000210227_100009888830 [0,2,0,0,0,0|2,0,0]=4 12284 B11R0.159 CCCCOCCCC(C)(C)O 7a_100000210227_100009888830 [0,2,0,0,0,0|2,0,0]=4 12285 B11R0.159 CCCCOCCNC(C)(C)C 2230a_100000715429_100000743108 [0,2,0,0,0,0|2,0,0]=4 12286 B11R0.159 CCCCOCCOC(C)(C)C 34a_100000210238_100000210625 [0,2,0,0,0,0|1,0,0]=3 12287 B11R0.159 CCCCOCCOC(C)(C)C 34a_100000693234_100000210210 [0,2,0,0,0,0|1,0,0]=3 12288 B11R0.159 CCCCOCCOC(C)(C)C 34a_100015890283_100000743108 [0,2,0,0,0,0|1,0,0]=3 12289 B11R0.159 CCCCOCCOC(C)(C)C 7a_100000693234_100000210211 [0,2,0,0,0,0|1,0,0]=3 12290 B11R0.159 CCCCOCCOC(C)(C)C 7a_100015890283_100000743108 [0,2,0,0,0,0|1,0,0]=3 12291 B11R0.159 CCCCOCCOC(F)(F)F 34a_100000210238_200103152311 [0,2,0,0,0,0|2,0,0]=4 12292 B11R0.159 CCCCOCCOC(F)(F)F 34a_100000761981_100000210210 [0,2,0,0,0,0|2,0,0]=4 12293 B11R0.159 CCCCOCCOC(F)(F)F 7a_100000210238_200000243211 [0,2,0,0,0,0|2,0,0]=4 12294 B11R0.159 CCCCOCCOS(=O)(=O)C 34a_100000210227_200000036756 [0,2,0,0,0,0|2,0,0]=4 12295 B11R0.159 CCCCOCCOS(=O)(=O)C 7a_100000210227_200000036756 [0,2,0,0,0,0|2,0,0]=4 12296 B11R0.159 CCCCOCCO[Si](C)(C)C 34a_100000210227_200000032530 [0,2,0,0,0,0|1,1,0]=4 12297 B11R0.159 CCCCOCCO[Si](C)(C)C 7a_100000210227_200000032530 [0,2,0,0,0,0|1,1,0]=4 12298 B11R0.159 CCCCOCCSC(C)(C)C 62a_100000211941_100000743108 [0,2,0,0,0,0|1,1,0]=4 12299 B11R0.159 CCCCOCCSC(C)(C)C 62a_100000743108_100000211941 [0,2,0,0,0,0|1,1,0]=4 12300 B11R0.159 CCCCSCCOC(C)(C)C 34a_200000230436_100000210625 [0,2,0,0,0,0|1,1,0]=4 12301 B11R0.159 CCOCCCCCC(C)(C)O 34a_100121572206_100010402123 [0,2,0,0,0,0|2,0,0]=4 12302 B11R0.159 CCOCCCCC[N+](C)(C)C 34a_100121572206_100009813293 [0,2,0,0,0,0|2,0,0]=4 12303 B11R0.159 CCOCCNCCC(C)(C)C 2230a_100000738805_100011215890 [0,2,0,0,0,0|2,0,0]=4 12304 B11R0.159 CCOCCNCCC(C)(C)C 2230a_102516460346_100000755188 [0,2,0,0,0,0|2,0,0]=4 12305 B11R0.159 CCOCCNCCC(C)(C)C 34a_102516460346_100000755188 [0,2,0,0,0,0|2,0,0]=4 12306 B11R0.159 CCOCCNCCC(C)(C)F 2230a_100016253952_100011215890 [0,2,0,0,0,0|2,0,0]=4 12307 B11R0.159 CCOCCNCCC(C)(C)O 2230a_102516460346_100000702414 [0,2,0,0,0,0|2,0,0]=4 12308 B11R0.159 CCOCCNCCC(C)(C)O 34a_102516460346_100000702414 [0,2,0,0,0,0|2,0,0]=4 12309 B11R0.159 CCOCCNCCS(=O)(=O)C 2230a_100000740961_100011215890 [0,2,0,0,0,0|1,1,0]=4 12310 B11R0.159 CCOCCNCCS(=O)(=O)C 2230a_102516460346_100000731031 [0,2,0,0,0,0|1,1,0]=4 12311 B11R0.159 CCOCCNCCS(=O)(=O)C 34a_100000740961_100000210147 [0,2,0,0,0,0|1,1,0]=4 12312 B11R0.159 CCOCCNCCS(=O)(=O)C 34a_102516460346_100000731031 [0,2,0,0,0,0|1,1,0]=4 12313 B11R0.159 CCOCCNCC[N+](C)(C)C 34a_102516460346_100000085578 [0,2,0,0,0,0|2,0,0]=4 12314 B11R0.159 CCOCCNCC[Si](C)(C)C 2230a_102516460346_200000733723 [0,2,0,0,0,0|2,0,0]=4 12315 B11R0.159 CCOCCNCC[Si](C)(C)C 34a_102516460346_200000733723 [0,2,0,0,0,0|2,0,0]=4 12316 B11R0.159 CCOCCOCCC(C)(C)C 34a_100000210136_100000755188 [0,2,0,0,0,0|1,0,0]=3 12317 B11R0.159 CCOCCOCCC(C)(C)C 7a_100000210136_100000755188 [0,2,0,0,0,0|1,0,0]=3 12318 B11R0.159 CCOCCOCCC(C)(C)C 7a_100000765024_100011215890 [0,2,0,0,0,0|1,0,0]=3 12319 B11R0.159 CCOCCOCCC(C)(C)O 34a_100000210136_100000702414 [0,2,0,0,0,0|1,0,0]=3 12320 B11R0.159 CCOCCOCCC(C)(C)O 7a_100000210136_100000702414 [0,2,0,0,0,0|1,0,0]=3 12321 B11R0.159 CCOCCOCCC(F)(F)F 34a_100000210136_100011219754 [0,2,0,0,0,0|2,0,0]=4 12322 B11R0.159 CCOCCOCCC(F)(F)F 34a_100000752437_100000210147 [0,2,0,0,0,0|2,0,0]=4 12323 B11R0.159 CCOCCOCCC(F)(F)F 7a_100000210136_100011219754 [0,2,0,0,0,0|2,0,0]=4 12324 B11R0.159 CCOCCOCCS(=O)(=O)C 34a_100000210136_100000731031 [0,2,0,0,0,0|0,1,0]=3 12325 B11R0.159 CCOCCOCCS(=O)(=O)C 34a_100000211924_100000210147 [0,2,0,0,0,0|0,1,0]=3 12326 B11R0.159 CCOCCOCCS(=O)(=O)C 7a_100000210136_100000230027 [0,2,0,0,0,0|0,1,0]=3 12327 B11R0.159 CCOCCOCCS(=O)(=O)C 7a_100000211924_100011215890 [0,2,0,0,0,0|0,1,0]=3 12328 B11R0.159 CCOCCOCCS(=O)(=O)N 34a_100012334274_100000210147 [0,2,0,0,0,0|1,1,0]=4 12329 B11R0.159 CCOCCOCCS(=O)(=O)[O-] 34a_100000210136_100000762736 [0,2,0,0,0,0|1,1,0]=4 12330 B11R0.159 CCOCCOCC[N+](C)(C)C 34a_100000210136_100000085578 [0,2,0,0,0,0|1,0,0]=3 12331 B11R0.159 CCOCCOCC[N+](C)(C)C 7a_100000210136_100000085578 [0,2,0,0,0,0|1,0,0]=3 12332 B11R0.159 CCOCCOCC[N+](C)(C)C 7a_200020618287_100011215890 [0,2,0,0,0,0|1,0,0]=3 12333 B11R0.159 CCOCCOCC[Si](C)(C)C 34a_100000210136_200000733723 [0,2,0,0,0,0|1,0,0]=3 12334 B11R0.159 CCOCCOCC[Si](C)(C)C 7a_100000039746_100011215890 [0,2,0,0,0,0|1,0,0]=3 12335 B11R0.159 CCOCCOCC[Si](C)(C)C 7a_100000210136_200000733723 [0,2,0,0,0,0|1,0,0]=3 12336 B11R0.159 CCOCCSCCC(C)(C)C 62a_100000210147_100000755188 [0,2,0,0,0,0|1,1,0]=4 12337 B11R0.159 CCOCCSCCC(C)(C)C 62a_100000755188_100011215890 [0,2,0,0,0,0|1,1,0]=4 12338 B11R0.159 CCOCCSCCC(C)(C)O 62a_100000210147_100000702414 [0,2,0,0,0,0|1,1,0]=4 12339 B11R0.159 CCOCCSCCC(C)(C)O 62a_100000702414_100011215890 [0,2,0,0,0,0|1,1,0]=4 12340 B11R0.159 CCOCCSCCS(=O)(=O)C 62a_100000210147_100000230027 [0,2,0,0,0,0|0,2,0]=4 12341 B11R0.159 CCOCCSCCS(=O)(=O)C 62a_100000731031_100011215890 [0,2,0,0,0,0|0,2,0]=4 12342 B11R0.159 CCOCCSCC[N+](C)(C)C 62a_100000085578_100011215890 [0,2,0,0,0,0|1,1,0]=4 12343 B11R0.159 CCOCCSCC[N+](C)(C)C 62a_100000210147_100000085578 [0,2,0,0,0,0|1,1,0]=4 12344 B11R0.159 CCOCCSCC[Si](C)(C)C 62a_100000210147_200000733723 [0,2,0,0,0,0|1,1,0]=4 12345 B11R0.159 CCOCCSCC[Si](C)(C)C 62a_200000733723_100011215890 [0,2,0,0,0,0|1,1,0]=4 12346 B11R0.159 CCSCCOCCC(C)(C)C 34a_100000212035_100000755188 [0,2,0,0,0,0|1,1,0]=4 12347 B11R0.159 CCSCCOCCC(C)(C)C 7a_100000212035_100000755188 [0,2,0,0,0,0|1,1,0]=4 12348 B11R0.159 CCSCCOCCC(C)(C)C 7a_100000765024_100000757381 [0,2,0,0,0,0|1,1,0]=4 12349 B11R0.159 CCSCCOCCC(C)(C)O 34a_100000212035_100000702414 [0,2,0,0,0,0|1,1,0]=4 12350 B11R0.159 CCSCCOCCC(C)(C)O 7a_100000212035_100000702414 [0,2,0,0,0,0|1,1,0]=4 12351 B11R0.159 CCSCCOCCS(=O)(=O)C 34a_100000211924_100000757381 [0,2,0,0,0,0|0,2,0]=4 12352 B11R0.159 CCSCCOCCS(=O)(=O)C 34a_100000212035_100000731031 [0,2,0,0,0,0|0,2,0]=4 12353 B11R0.159 CCSCCOCCS(=O)(=O)C 7a_100000211924_100000757381 [0,2,0,0,0,0|0,2,0]=4 12354 B11R0.159 CCSCCOCCS(=O)(=O)C 7a_100000212035_100000230027 [0,2,0,0,0,0|0,2,0]=4 12355 B11R0.159 CCSCCOCC[N+](C)(C)C 34a_100000212035_100000085578 [0,2,0,0,0,0|1,1,0]=4 12356 B11R0.159 CCSCCOCC[N+](C)(C)C 7a_100000212035_100000085578 [0,2,0,0,0,0|1,1,0]=4 12357 B11R0.159 CCSCCOCC[N+](C)(C)C 7a_200020618287_100000757381 [0,2,0,0,0,0|1,1,0]=4 12358 B11R0.159 CCSCCOCC[Si](C)(C)C 34a_100000212035_200000733723 [0,2,0,0,0,0|1,1,0]=4 12359 B11R0.159 CCSCCOCC[Si](C)(C)C 7a_100000039746_100000757381 [0,2,0,0,0,0|1,1,0]=4 12360 B11R0.159 CCSCCOCC[Si](C)(C)C 7a_100000212035_200000733723 [0,2,0,0,0,0|1,1,0]=4 12361 B11R0.159 CNCCCCCOC(C)(C)C 34a_100000722520_100000210625 [0,2,0,0,0,0|2,0,0]=4 12362 B11R0.159 CNCCOCCOC(C)(C)C 34a_100000228057_100000210625 [0,2,0,0,0,0|1,0,0]=3 12363 B11R0.159 CNCCOCCOC(F)(F)F 34a_100000228057_200103152311 [0,2,0,0,0,0|2,0,0]=4 12364 B11R0.159 CNCCOCCOS(=O)(=O)C 2230a_106832991635_100015571617 [0,2,0,0,0,0|2,0,0]=4 12365 B11R0.159 CNCCOCCOS(=O)(=O)C 34a_100102657272_100015571617 [0,2,0,0,0,0|2,0,0]=4 12366 B11R0.159 CNCCOCCOS(=O)(=O)C 7a_106832991635_100015571617 [0,2,0,0,0,0|2,0,0]=4 12367 B11R0.159 COCCCCCNC(C)(C)C 34a_100000747528_100000210625 [0,2,0,0,0,0|2,0,0]=4 12368 B11R0.159 COCCNCCCC(C)(C)O 2230a_100000209980_100009888830 [0,2,0,0,0,0|2,0,0]=4 12369 B11R0.159 COCCNCCOC(C)(C)C 2230a_100000747557_100011201679 [0,2,0,0,0,0|1,0,0]=3 12370 B11R0.159 COCCNCCOC(F)(F)F 34a_100000709367_100011201679 [0,2,0,0,0,0|2,0,0]=4 12371 B11R0.159 COCCNCCOS(=O)(=O)C 2230a_100000209980_200000036756 [0,2,0,0,0,0|2,0,0]=4 12372 B11R0.159 COCCNCCO[Si](C)(C)C 2230a_100000209980_200000032530 [0,2,0,0,0,0|1,1,0]=4 12373 B11R0.159 COCCNCCSC(C)(C)C 2230a_100000689375_100011201679 [0,2,0,0,0,0|1,1,0]=4 12374 B11R0.159 COCCOCCCC(C)(C)O 34a_100000210237_100009888830 [0,2,0,0,0,0|1,0,0]=3 12375 B11R0.159 COCCOCCCC(F)(F)F 34a_100000210237_100011215983 [0,2,0,0,0,0|2,0,0]=4 12376 B11R0.159 COCCOCCCC(F)(F)F 34a_100000749235_100011201679 [0,2,0,0,0,0|2,0,0]=4 12377 B11R0.159 COCCOCCCS(=O)(=O)C 34a_100000210237_100000754308 [0,2,0,0,0,0|2,0,0]=4 12378 B11R0.159 COCCOCCCS(=O)(=O)C 34a_100000689940_100011201679 [0,2,0,0,0,0|2,0,0]=4 12379 B11R0.159 COCCOCCCS(=O)(=O)C 7a_100000689940_100000233755 [0,2,0,0,0,0|2,0,0]=4 12380 B11R0.159 COCCOCCC[N+](C)(C)C 34a_100000210237_100016990835 [0,2,0,0,0,0|2,0,0]=4 12381 B11R0.159 COCCOCCC[Si](C)(C)C 34a_100000210237_100011219597 [0,2,0,0,0,0|1,1,0]=4 12382 B11R0.159 COCCOCCC[Si](C)(C)C 7a_200011215415_100000233755 [0,2,0,0,0,0|1,1,0]=4 12383 B11R0.159 COCCOCCNC(C)(C)C 2230a_100000715429_100000695917 [0,2,0,0,0,0|1,0,0]=3 12384 B11R0.159 COCCOCCNC(C)(C)C 34a_100000745349_100000210625 [0,2,0,0,0,0|1,0,0]=3 12385 B11R0.159 COCCOCCNC(F)(F)F 34a_100000745349_200103152311 [0,2,0,0,0,0|2,0,0]=4 12386 B11R0.159 COCCOCCNS(=O)(=O)C 40a_100000745349_100000738038 [0,2,0,0,0,0|2,0,0]=4 12387 B11R0.159 COCCOCCOC(C)(C)C 34a_100000693234_100011201679 [0,2,0,0,0,0|0,0,0]=2 12388 B11R0.159 COCCOCCOC(C)(C)C 34a_100011215163_100000210625 [0,2,0,0,0,0|0,0,0]=2 12389 B11R0.159 COCCOCCOC(C)(C)C 34a_100011997631_200000210301 [0,2,0,0,0,0|0,0,0]=2 12390 B11R0.159 COCCOCCOC(C)(C)C 34a_100015890283_100000695917 [0,2,0,0,0,0|0,0,0]=2 12391 B11R0.159 COCCOCCOC(C)(C)C 7a_100000693234_100000233755 [0,2,0,0,0,0|0,0,0]=2 12392 B11R0.159 COCCOCCOC(C)(C)C 7a_100011997631_200000210301 [0,2,0,0,0,0|0,0,0]=2 12393 B11R0.159 COCCOCCOC(C)(C)C 7a_100015890283_100000695917 [0,2,0,0,0,0|0,0,0]=2 12394 B11R0.159 COCCOCCOC(F)(F)F 34a_100000761981_100011201679 [0,2,0,0,0,0|1,0,0]=3 12395 B11R0.159 COCCOCCOC(F)(F)F 34a_100011215163_200103152311 [0,2,0,0,0,0|1,0,0]=3 12396 B11R0.159 COCCOCCOC(F)(F)F 7a_100011215163_200000243211 [0,2,0,0,0,0|1,0,0]=3 12397 B11R0.159 COCCOCCOS(=O)(=O)C 34a_100000210237_200000036756 [0,2,0,0,0,0|1,0,0]=3 12398 B11R0.159 COCCOCCOS(=O)(=O)C 34a_100138415774_100015571617 [0,2,0,0,0,0|1,0,0]=3 12399 B11R0.159 COCCOCCO[Si](C)(C)C 34a_100000210237_200000032530 [0,2,0,0,0,0|0,1,0]=3 12400 B11R0.159 COCCOCCSC(C)(C)C 62a_100000211941_100000695917 [0,2,0,0,0,0|0,1,0]=3 12401 B11R0.159 COCCOCCSC(C)(C)C 62a_100000695917_100000211941 [0,2,0,0,0,0|0,1,0]=3 12402 B11R0.159 COCCOCCSC(F)(F)F 62a_100000695917_200103152311 [0,2,0,0,0,0|1,1,0]=4 12403 B11R0.159 COCCOCCSC(F)(F)F 62a_200000243211_100000695917 [0,2,0,0,0,0|1,1,0]=4 12404 B11R0.159 COCCOCNCC(C)(C)C 2230a_100000743828_100000231047 [0,2,0,0,0,0|2,0,0]=4 12405 B11R0.159 COCCOCNCC(C)(C)F 2230a_100020643315_100000231047 [0,2,0,0,0,0|2,0,0]=4 12406 B11R0.159 COCCOCNCC(C)(C)O 2230a_100000751335_100000231047 [0,2,0,0,0,0|2,0,0]=4 12407 B11R0.159 COCCOCSCC(C)(C)C 62a_100000231047_100011219605 [0,2,0,0,0,0|2,0,0]=4 12408 B11R0.159 COCCOCSCC(C)(C)C 62a_100011219605_100000231047 [0,2,0,0,0,0|2,0,0]=4 12409 B11R0.159 COCCOCSCC(C)(C)F 62a_100000231047_100011997219 [0,2,0,0,0,0|2,0,0]=4 12410 B11R0.159 COCCOCSCC(C)(C)F 62a_100011997219_100000231047 [0,2,0,0,0,0|2,0,0]=4 12411 B11R0.159 COCCOCSCC(C)(C)O 62a_100000231047_100000764493 [0,2,0,0,0,0|2,0,0]=4 12412 B11R0.159 COCCOCSCC(C)(C)O 62a_100000764493_100000231047 [0,2,0,0,0,0|2,0,0]=4 12413 B11R0.159 COCCSCCCC(C)(C)O 62a_100000233755_100009888830 [0,2,0,0,0,0|1,1,0]=4 12414 B11R0.159 COCCSCCCC(C)(C)O 62a_100009888830_100000233755 [0,2,0,0,0,0|1,1,0]=4 12415 B11R0.159 COCCSCCOS(=O)(=O)C 62a_100000233755_200000036756 [0,2,0,0,0,0|1,1,0]=4 12416 B11R0.159 COCCSCCOS(=O)(=O)C 62a_200000036756_100000233755 [0,2,0,0,0,0|1,1,0]=4 12417 B11R0.159 COCCSCCO[Si](C)(C)C 62a_100000233755_200000032530 [0,2,0,0,0,0|0,2,0]=4 12418 B11R0.159 COCCSCCO[Si](C)(C)C 62a_200000032530_100000233755 [0,2,0,0,0,0|0,2,0]=4 12419 B11R0.159 COCNCCCOC(C)(C)C 2230a_100011250582_100000766300 [0,2,0,0,0,0|2,0,0]=4 12420 B11R0.159 CS(=O)(=O)OCCOCCON 34a_100000700252_200000036756 [0,2,0,0,0,0|2,0,0]=4 12421 B11R0.159 CS(=O)(=O)OCCOCCS[13CH3] 62a_100015571617_200025704644 [0,2,0,0,0,0|1,1,0]=4 12422 B11R0.159 CS(=O)(=O)OCCOCCS[13CH3] 62a_200025704644_100015571617 [0,2,0,0,0,0|1,1,0]=4 12423 B11R0.159 CSCCNCCOC(C)(C)C 2230a_100000747557_100000751147 [0,2,0,0,0,0|1,1,0]=4 12424 B11R0.159 CSCCOCCCC(C)(C)O 34a_100000230434_100009888830 [0,2,0,0,0,0|1,1,0]=4 12425 B11R0.159 CSCCOCCCC(C)(C)O 7a_100000230434_100009888830 [0,2,0,0,0,0|1,1,0]=4 12426 B11R0.159 CSCCOCCOC(C)(C)C 34a_100000693234_100000212216 [0,2,0,0,0,0|0,1,0]=3 12427 B11R0.159 CSCCOCCOC(C)(C)C 7a_100000693234_100000212216 [0,2,0,0,0,0|0,1,0]=3 12428 B11R0.159 CSCCOCCOC(F)(F)F 34a_100000761981_100000212216 [0,2,0,0,0,0|1,1,0]=4 12429 B11R0.159 CSCCOCCOS(=O)(=O)C 34a_100000230434_200000036756 [0,2,0,0,0,0|1,1,0]=4 12430 B11R0.159 CSCCOCCOS(=O)(=O)C 62a_100015571617_200000210301 [0,2,0,0,0,0|1,1,0]=4 12431 B11R0.159 CSCCOCCOS(=O)(=O)C 62a_200000210301_100015571617 [0,2,0,0,0,0|1,1,0]=4 12432 B11R0.159 CSCCOCCOS(=O)(=O)C 7a_100000230434_200000036756 [0,2,0,0,0,0|1,1,0]=4 12433 B11R0.159 CSCCOCCO[Si](C)(C)C 34a_100000230434_200000032530 [0,2,0,0,0,0|0,2,0]=4 12434 B11R0.159 CSCCOCCO[Si](C)(C)C 7a_100000230434_200000032530 [0,2,0,0,0,0|0,2,0]=4 12435 B11R0.159 C[Si](C)(C)OCCOCCON 34a_100000700252_200000032530 [0,2,0,0,0,0|1,1,0]=4 12436 B11R0.3 C#CCCCCCCCCOC 34a_100000065265_200000210301 [0,2,0,0,0,0|2,0,0]=4 12437 B11R0.3 C#CCCCCCCCCOC 7a_100000065265_200000210301 [0,2,0,0,0,0|2,0,0]=4 12438 B11R0.3 C#CCCCCCCCCO[13CH3] 34a_100000065265_200025704644 [0,2,0,0,0,0|2,0,0]=4 12439 B11R0.3 C#CCCCCCCCCO[13CH3] 7a_100000065265_200025704644 [0,2,0,0,0,0|2,0,0]=4 12440 B11R0.3 C#CCCCCCCCOCC 34a_100000054614_100000210202 [0,2,0,0,0,0|2,0,0]=4 12441 B11R0.3 C#CCCCCCCCOCC 34a_100121572206_100153394163 [0,2,0,0,0,0|2,0,0]=4 12442 B11R0.3 C#CCCCCCCCOCC 7a_100000054614_100000210202 [0,2,0,0,0,0|2,0,0]=4 12443 B11R0.3 C#CCCCCCNCCOC 2230a_100000209980_100012094781 [0,2,0,0,0,0|2,0,0]=4 12444 B11R0.3 C#CCCCCCOCCCC 34a_100000210227_100012094781 [0,2,0,0,0,0|2,0,0]=4 12445 B11R0.3 C#CCCCCCOCCCC 34a_100000766912_100000210210 [0,2,0,0,0,0|2,0,0]=4 12446 B11R0.3 C#CCCCCCOCCCC 7a_100000210227_100012094781 [0,2,0,0,0,0|2,0,0]=4 12447 B11R0.3 C#CCCCCCOCCCC 7a_100000766912_100000210211 [0,2,0,0,0,0|2,0,0]=4 12448 B11R0.3 C#CCCCCCOCCOC 34a_100000210237_100012094781 [0,2,0,0,0,0|1,0,0]=3 12449 B11R0.3 C#CCCCCCOCCOC 34a_100000766912_100011201679 [0,2,0,0,0,0|1,0,0]=3 12450 B11R0.3 C#CCCCCCOCCOC 7a_100000766912_100000233755 [0,2,0,0,0,0|1,0,0]=3 12451 B11R0.3 C#CCCCCCOCCON 34a_100000700252_100012094781 [0,2,0,0,0,0|2,0,0]=4 12452 B11R0.3 C#CCCCCCOCCSC 34a_100000230434_100012094781 [0,2,0,0,0,0|1,1,0]=4 12453 B11R0.3 C#CCCCCCOCCSC 34a_100000766912_100000212216 [0,2,0,0,0,0|1,1,0]=4 12454 B11R0.3 C#CCCCCCOCCSC 7a_100000230434_100012094781 [0,2,0,0,0,0|1,1,0]=4 12455 B11R0.3 C#CCCCCCOCCSC 7a_100000766912_100000212216 [0,2,0,0,0,0|1,1,0]=4 12456 B11R0.3 C#CCCCCCSCCOC 62a_100000233755_100012094781 [0,2,0,0,0,0|1,1,0]=4 12457 B11R0.3 C#CCCCCCSCCOC 62a_100012094781_100000233755 [0,2,0,0,0,0|1,1,0]=4 12458 B11R0.3 C#CCCCCNCCOCC 2230a_100000706060_100011215890 [0,2,0,0,0,0|2,0,0]=4 12459 B11R0.3 C#CCCCCNCCOCC 2230a_102516460346_100010269958 [0,2,0,0,0,0|2,0,0]=4 12460 B11R0.3 C#CCCCCNCCOCC 34a_100000706060_100000210147 [0,2,0,0,0,0|2,0,0]=4 12461 B11R0.3 C#CCCCCNCCOCC 34a_102516460346_100010269958 [0,2,0,0,0,0|2,0,0]=4 12462 B11R0.3 C#CCCCCOCCCCC 34a_100000210253_100010269958 [0,2,0,0,0,0|2,0,0]=4 12463 B11R0.3 C#CCCCCOCCCCC 34a_100000766709_100000718602 [0,2,0,0,0,0|2,0,0]=4 12464 B11R0.3 C#CCCCCOCCCCC 7a_100000210253_100010269958 [0,2,0,0,0,0|2,0,0]=4 12465 B11R0.3 C#CCCCCOCCCCC 7a_100000766709_100000210326 [0,2,0,0,0,0|2,0,0]=4 12466 B11R0.3 C#CCCCCOCCCOC 34a_100000740835_100010269958 [0,2,0,0,0,0|1,0,1]=4 12467 B11R0.3 C#CCCCCOCCCOC 34a_100000766709_100000740836 [0,2,0,0,0,0|1,0,1]=4 12468 B11R0.3 C#CCCCCOCCCOC 7a_100000766709_100000740836 [0,2,0,0,0,0|1,0,1]=4 12469 B11R0.3 C#CCCCCOCCOCC 34a_100000210136_100010269958 [0,2,0,0,0,0|1,0,0]=3 12470 B11R0.3 C#CCCCCOCCOCC 34a_100000766709_100000210147 [0,2,0,0,0,0|1,0,0]=3 12471 B11R0.3 C#CCCCCOCCOCC 7a_100000210136_100010269958 [0,2,0,0,0,0|1,0,0]=3 12472 B11R0.3 C#CCCCCOCCOCC 7a_100000766709_100011215890 [0,2,0,0,0,0|1,0,0]=3 12473 B11R0.3 C#CCCCCOCCSCC 34a_100000212035_100010269958 [0,2,0,0,0,0|1,1,0]=4 12474 B11R0.3 C#CCCCCOCCSCC 34a_100000766709_100000757381 [0,2,0,0,0,0|1,1,0]=4 12475 B11R0.3 C#CCCCCOCCSCC 7a_100000212035_100010269958 [0,2,0,0,0,0|1,1,0]=4 12476 B11R0.3 C#CCCCCOCCSCC 7a_100000766709_100000757381 [0,2,0,0,0,0|1,1,0]=4 12477 B11R0.3 C#CCCCCSCCOCC 62a_100000210147_100010269958 [0,2,0,0,0,0|1,1,0]=4 12478 B11R0.3 C#CCCCCSCCOCC 62a_100010269958_100011215890 [0,2,0,0,0,0|1,1,0]=4 12479 B11R0.3 C#CCCCOCCCOCC 34a_100000215630_100012232248 [0,2,0,0,0,0|1,0,1]=4 12480 B11R0.3 C#CCCCOCCCOCC 34a_100000757476_100000695029 [0,2,0,0,0,0|1,0,1]=4 12481 B11R0.3 C#CCCCOCCCOCC 7a_100000215630_100012232248 [0,2,0,0,0,0|1,0,1]=4 12482 B11R0.3 C#CCCCOCCCOCC 7a_100000757476_100011215417 [0,2,0,0,0,0|1,0,1]=4 12483 B11R0.3 C#CCCCOCCOCCBr 34a_100000692535_100000695029 [0,2,0,0,0,0|1,0,1]=4 12484 B11R0.3 C#CCCCOCCOCCBr 7a_100000692535_100011215417 [0,2,0,0,0,0|1,0,1]=4 12485 B11R0.3 C#CCCCOCCOCCC 34a_100000215630_100011215938 [0,2,0,0,0,0|1,0,1]=4 12486 B11R0.3 C#CCCCOCCOCCC 34a_100000752267_100000695029 [0,2,0,0,0,0|1,0,1]=4 12487 B11R0.3 C#CCCCOCCOCCC 7a_100000215630_100011215938 [0,2,0,0,0,0|1,0,1]=4 12488 B11R0.3 C#CCCCOCCOCCC 7a_100000752267_100011215417 [0,2,0,0,0,0|1,0,1]=4 12489 B11R0.3 C#CCCCOCCOCCCl 34a_100011215305_100000695029 [0,2,0,0,0,0|1,0,1]=4 12490 B11R0.3 C#CCCCOCCOCCCl 7a_100011215305_100011215417 [0,2,0,0,0,0|1,0,1]=4 12491 B11R0.3 C#CCCCOCCOCCF 34a_200015357709_100000695029 [0,2,0,0,0,0|1,0,1]=4 12492 B11R0.3 C#CCCCOCCOCCF 7a_200015357709_100011215417 [0,2,0,0,0,0|1,0,1]=4 12493 B11R0.3 C#CCCCOCCOCCI 34a_100012149058_100000695029 [0,2,0,0,0,0|1,0,1]=4 12494 B11R0.3 C#CCCCOCCOCCI 7a_100012149058_100011215417 [0,2,0,0,0,0|1,0,1]=4 12495 B11R0.3 C#CCCCOCCOCCN 34a_100000211614_100000695029 [0,2,0,0,0,0|1,0,1]=4 12496 B11R0.3 C#CCCCOCCOCCO 34a_100000215630_100000692535 [0,2,0,0,0,0|1,0,1]=4 12497 B11R0.3 C#CCCCOCCOCCO 7a_100000215630_100011215305 [0,2,0,0,0,0|1,0,1]=4 12498 B11R0.3 C#CCCCSCOCCOC 62a_100000231047_100011215417 [0,2,0,0,0,0|1,0,1]=4 12499 B11R0.3 C#CCCCSCOCCOC 62a_100011215417_100000231047 [0,2,0,0,0,0|1,0,1]=4 12500 B11R0.3 C#CCCNCCCCCOC 2230a_100000747528_100000688953 [0,2,0,0,0,0|2,0,0]=4 12501 B11R0.3 C#CCCNCCCCCOC 34a_100000747528_100000688953 [0,2,0,0,0,0|2,0,0]=4 12502 B11R0.3 C#CCCNCCOCCCC 34a_100000755551_100000743108 [0,2,0,0,0,0|2,0,0]=4 12503 B11R0.3 C#CCCNCCOCCOC 2230a_100000745349_100000688953 [0,2,0,0,0,0|1,0,0]=3 12504 B11R0.3 C#CCCNCCOCCOC 34a_100000745349_100000688953 [0,2,0,0,0,0|1,0,0]=3 12505 B11R0.3 C#CCCNCCOCCOC 34a_100000755551_100000695917 [0,2,0,0,0,0|1,0,0]=3 12506 B11R0.3 C#CCCOCCCCCCC 34a_100000210272_100000688953 [0,2,0,0,0,0|2,0,0]=4 12507 B11R0.3 C#CCCOCCCCCCC 34a_100011215631_100000210614 [0,2,0,0,0,0|2,0,0]=4 12508 B11R0.3 C#CCCOCCCCCCC 7a_100000210272_100000688953 [0,2,0,0,0,0|2,0,0]=4 12509 B11R0.3 C#CCCOCCCCCNC 34a_100000722520_100000688953 [0,2,0,0,0,0|2,0,0]=4 12510 B11R0.3 C#CCCOCCOCCCC 34a_100000210238_100000688953 [0,2,0,0,0,0|1,0,0]=3 12511 B11R0.3 C#CCCOCCOCCCC 34a_100011215631_100000743108 [0,2,0,0,0,0|1,0,0]=3 12512 B11R0.3 C#CCCOCCOCCCC 7a_100000210238_100000688953 [0,2,0,0,0,0|1,0,0]=3 12513 B11R0.3 C#CCCOCCOCCNC 34a_100000228057_100000688953 [0,2,0,0,0,0|1,0,0]=3 12514 B11R0.3 C#CCCOCCOCCOC 34a_100011215163_100000688953 [0,2,0,0,0,0|0,0,0]=2 12515 B11R0.3 C#CCCOCCOCCOC 34a_100011215631_100000695917 [0,2,0,0,0,0|0,0,0]=2 12516 B11R0.3 C#CCCOCCOCCOC 7a_100011215163_100000688953 [0,2,0,0,0,0|0,0,0]=2 12517 B11R0.3 C#CCCOCCSCCCC 34a_200000230436_100000688953 [0,2,0,0,0,0|1,1,0]=4 12518 B11R0.3 C#CCCOCCSCCCC 7a_200000230436_100000688953 [0,2,0,0,0,0|1,1,0]=4 12519 B11R0.3 C#CCCSCCOCCCC 62a_100000688953_100000743108 [0,2,0,0,0,0|1,1,0]=4 12520 B11R0.3 C#CCCSCCOCCCC 62a_100000743108_100000688953 [0,2,0,0,0,0|1,1,0]=4 12521 B11R0.3 C#CCCSCCOCCOC 62a_100000688953_100000695917 [0,2,0,0,0,0|0,1,0]=3 12522 B11R0.3 C#CCCSCCOCCOC 62a_100000695917_100000688953 [0,2,0,0,0,0|0,1,0]=3 12523 B11R0.3 C#CCNCCCOCCOC 2230a_100000206027_100000038162 [0,2,0,0,0,0|1,0,1]=4 12524 B11R0.3 C#CCNCCCOCCOC 34a_100000206027_100000184674 [0,2,0,0,0,0|1,0,1]=4 12525 B11R0.3 C#CCNCCCOCCOC 34a_100000212058_100011216529 [0,2,0,0,0,0|1,0,1]=4 12526 B11R0.3 C#CCNCCOCCOCC 2230a_100102712874_100000038162 [0,2,0,0,0,0|1,0,0]=3 12527 B11R0.3 C#CCNCCOCCOCC 34a_100000212058_100011211534 [0,2,0,0,0,0|1,0,0]=3 12528 B11R0.3 C#CCNCCOCCOCC 34a_100102712874_100000184674 [0,2,0,0,0,0|1,0,0]=3 12529 B11R0.3 C#CCOCCCCCCCC 34a_100000210232_100000184674 [0,2,0,0,0,0|2,0,0]=4 12530 B11R0.3 C#CCOCCCCCCCC 34a_100000210247_100000210759 [0,2,0,0,0,0|2,0,0]=4 12531 B11R0.3 C#CCOCCCCCCCC 7a_100000210232_100000038162 [0,2,0,0,0,0|2,0,0]=4 12532 B11R0.3 C#CCOCCCCCCOC 34a_100000210247_100011998445 [0,2,0,0,0,0|1,0,1]=4 12533 B11R0.3 C#CCOCCCCCCOC 34a_200011021349_200000210301 [0,2,0,0,0,0|1,0,1]=4 12534 B11R0.3 C#CCOCCCCCCOC 34a_200012092642_100000184674 [0,2,0,0,0,0|1,0,1]=4 12535 B11R0.3 C#CCOCCCCCCOC 7a_200011021349_200000210301 [0,2,0,0,0,0|1,0,1]=4 12536 B11R0.3 C#CCOCCCCCCOC 7a_200012092642_100000038162 [0,2,0,0,0,0|1,0,1]=4 12537 B11R0.3 C#CCOCCCCCCO[13CH3] 34a_200011021349_200025704644 [0,2,0,0,0,0|1,0,1]=4 12538 B11R0.3 C#CCOCCCCCCO[13CH3] 7a_200011021349_200025704644 [0,2,0,0,0,0|1,0,1]=4 12539 B11R0.3 C#CCOCCCOCCCC 34a_200011215613_100000184674 [0,2,0,0,0,0|1,0,1]=4 12540 B11R0.3 C#CCOCCCOCCCC 7a_200011215613_100000038162 [0,2,0,0,0,0|1,0,1]=4 12541 B11R0.3 C#CCOCCCOCCOC 34a_100000210247_100011216529 [0,2,0,0,0,0|0,0,1]=3 12542 B11R0.3 C#CCOCCNCCCCC 2230a_100000209983_100010402529 [0,2,0,0,0,0|2,0,0]=4 12543 B11R0.3 C#CCOCCNCCCCC 2230a_100000700922_100000210326 [0,2,0,0,0,0|2,0,0]=4 12544 B11R0.3 C#CCOCCNCCCCC 34a_100000224656_100000184674 [0,2,0,0,0,0|2,0,0]=4 12545 B11R0.3 C#CCOCCNCCCCC 34a_100000700922_100000718602 [0,2,0,0,0,0|2,0,0]=4 12546 B11R0.3 C#CCOCCNCCCOC 2230a_100000700922_100000740836 [0,2,0,0,0,0|1,0,1]=4 12547 B11R0.3 C#CCOCCNCCCOC 34a_100000700922_100000740836 [0,2,0,0,0,0|1,0,1]=4 12548 B11R0.3 C#CCOCCNCCCOC 34a_100150723488_100010402529 [0,2,0,0,0,0|1,0,1]=4 12549 B11R0.3 C#CCOCCNCCOCC 2230a_100000700922_100011215890 [0,2,0,0,0,0|1,0,0]=3 12550 B11R0.3 C#CCOCCNCCOCC 2230a_102516460346_100010402529 [0,2,0,0,0,0|1,0,0]=3 12551 B11R0.3 C#CCOCCNCCOCC 34a_100000700922_100000210147 [0,2,0,0,0,0|1,0,0]=3 12552 B11R0.3 C#CCOCCNCCOCC 34a_102516460346_100010402529 [0,2,0,0,0,0|1,0,0]=3 12553 B11R0.3 C#CCOCCNCCSCC 2230a_100000106463_100010402529 [0,2,0,0,0,0|1,1,0]=4 12554 B11R0.3 C#CCOCCNCCSCC 2230a_100000700922_100000757381 [0,2,0,0,0,0|1,1,0]=4 12555 B11R0.3 C#CCOCCNCCSCC 34a_100000700922_100000757381 [0,2,0,0,0,0|1,1,0]=4 12556 B11R0.3 C#CCOCCOC/C=C\CC 34a_100000054580_100103147603 [0,2,0,0,0,0|1,0,1]=4 12557 B11R0.3 C#CCOCCOC/C=C\CC 34a_100016268518_100010402529 [0,2,0,0,0,0|1,0,1]=4 12558 B11R0.3 C#CCOCCOC/C=C\CC 7a_100000054580_100103147603 [0,2,0,0,0,0|1,0,1]=4 12559 B11R0.3 C#CCOCCOCC#CCC 34a_100000032950_100010402529 [0,2,0,0,0,0|1,0,1]=4 12560 B11R0.3 C#CCOCCOCC#CCC 34a_100000054580_100009813939 [0,2,0,0,0,0|1,0,1]=4 12561 B11R0.3 C#CCOCCOCC#CCC 7a_100000054580_100009813939 [0,2,0,0,0,0|1,0,1]=4 12562 B11R0.3 C#CCOCCOCC/C=C/C 34a_100016278192_100010402529 [0,2,0,0,0,0|1,0,1]=4 12563 B11R0.3 C#CCOCCOCCC#CC 34a_100000750427_100010402529 [0,2,0,0,0,0|1,0,1]=4 12564 B11R0.3 C#CCOCCOCCCCBr 34a_100011216708_100010402529 [0,2,0,0,0,0|1,0,1]=4 12565 B11R0.3 C#CCOCCOCCCCC 34a_100000054580_100000718602 [0,2,0,0,0,0|1,0,0]=3 12566 B11R0.3 C#CCOCCOCCCCC 34a_100000210253_100010402529 [0,2,0,0,0,0|1,0,0]=3 12567 B11R0.3 C#CCOCCOCCCCC 34a_100011215259_100000184674 [0,2,0,0,0,0|1,0,0]=3 12568 B11R0.3 C#CCOCCOCCCCC 7a_100000054580_100000210326 [0,2,0,0,0,0|1,0,0]=3 12569 B11R0.3 C#CCOCCOCCCCC 7a_100000210253_100010402529 [0,2,0,0,0,0|1,0,0]=3 12570 B11R0.3 C#CCOCCOCCCCC 7a_100011215259_100000038162 [0,2,0,0,0,0|1,0,0]=3 12571 B11R0.3 C#CCOCCOCCCCCl 34a_100000210776_100010402529 [0,2,0,0,0,0|1,0,1]=4 12572 B11R0.3 C#CCOCCOCCCCCl 7a_100000210776_100010402529 [0,2,0,0,0,0|1,0,1]=4 12573 B11R0.3 C#CCOCCOCCCCF 34a_100000054580_100000729493 [0,2,0,0,0,0|1,0,1]=4 12574 B11R0.3 C#CCOCCOCCCCF 34a_100011995726_100010402529 [0,2,0,0,0,0|1,0,1]=4 12575 B11R0.3 C#CCOCCOCCCCF 7a_100000054580_100000729493 [0,2,0,0,0,0|1,0,1]=4 12576 B11R0.3 C#CCOCCOCCCCF 7a_100011995726_100010402529 [0,2,0,0,0,0|1,0,1]=4 12577 B11R0.3 C#CCOCCOCCCCI 34a_200012148704_100010402529 [0,2,0,0,0,0|1,0,1]=4 12578 B11R0.3 C#CCOCCOCCCCN 34a_100000750430_100010402529 [0,2,0,0,0,0|1,0,1]=4 12579 B11R0.3 C#CCOCCOCCCCO 34a_100000054580_100011216708 [0,2,0,0,0,0|1,0,1]=4 12580 B11R0.3 C#CCOCCOCCCCO 7a_100000054580_100000210776 [0,2,0,0,0,0|1,0,1]=4 12581 B11R0.3 C#CCOCCOCCCNC 34a_100000213112_100010402529 [0,2,0,0,0,0|1,0,1]=4 12582 B11R0.3 C#CCOCCOCCCOC 34a_100000054580_100000740836 [0,2,0,0,0,0|0,0,1]=3 12583 B11R0.3 C#CCOCCOCCCOC 34a_100000740835_100010402529 [0,2,0,0,0,0|0,0,1]=3 12584 B11R0.3 C#CCOCCOCCCOC 7a_100000054580_100000740836 [0,2,0,0,0,0|0,0,1]=3 12585 B11R0.3 C#CCOCCOCCCSC 34a_100000690336_100010402529 [0,2,0,0,0,0|0,1,1]=4 12586 B11R0.3 C#CCOCCOCCCSC 7a_100000690336_100010402529 [0,2,0,0,0,0|0,1,1]=4 12587 B11R0.3 C#CCOCCOCCNCC 2230a_100000056377_100000210202 [0,2,0,0,0,0|1,0,0]=3 12588 B11R0.3 C#CCOCCOCCNCC 2230a_100015525214_100010408581 [0,2,0,0,0,0|1,0,0]=3 12589 B11R0.3 C#CCOCCOCCNCC 34a_100000056377_100000210202 [0,2,0,0,0,0|1,0,0]=3 12590 B11R0.3 C#CCOCCOCCNCF 34a_100000056377_100015361967 [0,2,0,0,0,0|1,0,1]=4 12591 B11R0.3 C#CCOCCOCCOC=C 34a_100000033082_100010402529 [0,2,0,0,0,0|0,0,2]=4 12592 B11R0.3 C#CCOCCOCCOC=C 34a_100000039918_100000184674 [0,2,0,0,0,0|0,0,2]=4 12593 B11R0.3 C#CCOCCOCCOC=C 34a_100000054580_100000039644 [0,2,0,0,0,0|0,0,2]=4 12594 B11R0.3 C#CCOCCOCCOC=C 7a_100000039918_100000038162 [0,2,0,0,0,0|0,0,2]=4 12595 B11R0.3 C#CCOCCOCCOC=C 7a_100000054580_100000039644 [0,2,0,0,0,0|0,0,2]=4 12596 B11R0.3 C#CCOCCOCCOCC 34a_100000041007_100000210202 [0,2,0,0,0,0|0,0,0]=2 12597 B11R0.3 C#CCOCCOCCOCC 34a_100000054580_100000210147 [0,2,0,0,0,0|0,0,0]=2 12598 B11R0.3 C#CCOCCOCCOCC 34a_100000210136_100010402529 [0,2,0,0,0,0|0,0,0]=2 12599 B11R0.3 C#CCOCCOCCOCC 34a_100000210240_100000184674 [0,2,0,0,0,0|0,0,0]=2 12600 B11R0.3 C#CCOCCOCCOCC 34a_100000210247_100011211534 [0,2,0,0,0,0|0,0,0]=2 12601 B11R0.3 C#CCOCCOCCOCC 34a_100121572206_100010408581 [0,2,0,0,0,0|0,0,0]=2 12602 B11R0.3 C#CCOCCOCCOCC 7a_100000041007_100000210202 [0,2,0,0,0,0|0,0,0]=2 12603 B11R0.3 C#CCOCCOCCOCC 7a_100000054580_100011215890 [0,2,0,0,0,0|0,0,0]=2 12604 B11R0.3 C#CCOCCOCCOCC 7a_100000210136_100010402529 [0,2,0,0,0,0|0,0,0]=2 12605 B11R0.3 C#CCOCCOCCOCC 7a_100000210240_100000038162 [0,2,0,0,0,0|0,0,0]=2 12606 B11R0.3 C#CCOCCOCCOCF 34a_100000041007_100015361967 [0,2,0,0,0,0|0,0,1]=3 12607 B11R0.3 C#CCOCCOCCOCF 7a_100000041007_100015361967 [0,2,0,0,0,0|0,0,1]=3 12608 B11R0.3 C#CCOCCOCCSCC 34a_100000054580_100000757381 [0,2,0,0,0,0|0,1,0]=3 12609 B11R0.3 C#CCOCCOCCSCC 34a_100000212035_100010402529 [0,2,0,0,0,0|0,1,0]=3 12610 B11R0.3 C#CCOCCOCCSCC 62a_100000210202_100010408581 [0,2,0,0,0,0|0,1,0]=3 12611 B11R0.3 C#CCOCCOCCSCC 62a_100010408581_100000210202 [0,2,0,0,0,0|0,1,0]=3 12612 B11R0.3 C#CCOCCOCCSCC 7a_100000054580_100000757381 [0,2,0,0,0,0|0,1,0]=3 12613 B11R0.3 C#CCOCCOCCSCC 7a_100000212035_100010402529 [0,2,0,0,0,0|0,1,0]=3 12614 B11R0.3 C#CCOCCOCCSCF 62a_100010408581_100015361967 [0,2,0,0,0,0|0,1,1]=4 12615 B11R0.3 C#CCOCCOCCSCF 62a_100015361967_100010408581 [0,2,0,0,0,0|0,1,1]=4 12616 B11R0.3 C#CCOCCSCCCCC 62a_100000210326_100010402529 [0,2,0,0,0,0|1,1,0]=4 12617 B11R0.3 C#CCOCCSCCCCC 62a_100010402529_100000210326 [0,2,0,0,0,0|1,1,0]=4 12618 B11R0.3 C#CCOCCSCCCOC 62a_100000709357_100010402529 [0,2,0,0,0,0|0,1,1]=4 12619 B11R0.3 C#CCOCCSCCCOC 62a_100010402529_100000709357 [0,2,0,0,0,0|0,1,1]=4 12620 B11R0.3 C#CCOCCSCCOCC 62a_100000210147_100010402529 [0,2,0,0,0,0|0,1,0]=3 12621 B11R0.3 C#CCOCCSCCOCC 62a_100010402529_100011215890 [0,2,0,0,0,0|0,1,0]=3 12622 B11R0.3 C#CCOCCSCCSCC 62a_100000757381_100010402529 [0,2,0,0,0,0|0,2,0]=4 12623 B11R0.3 C#CCOCCSCCSCC 62a_100010402529_100000757381 [0,2,0,0,0,0|0,2,0]=4 12624 B11R0.3 C#CCSCCCOCCOC 62a_100000038162_100011216529 [0,2,0,0,0,0|0,1,1]=4 12625 B11R0.3 C#CCSCCOCCOCC 62a_100000038162_100011211534 [0,2,0,0,0,0|0,1,0]=3 12626 B11R0.3 C/C=C/C=C/COCCOCC 34a_100016283227_100000210147 [0,2,0,0,0,0|1,0,1]=4 12627 B11R0.3 C/C=C/CCOCC/C=C\CC 34a_100016278192_100015370543 [0,2,0,0,0,0|2,0,0]=4 12628 B11R0.3 C/C=C/CCOCCCCCC 34a_100016278192_100000210314 [0,2,0,0,0,0|2,0,0]=4 12629 B11R0.3 C/C=C/CCOCCCCCF 34a_100016278192_100000729378 [0,2,0,0,0,0|2,0,0]=4 12630 B11R0.3 C/C=C/CCOCCCCCO 34a_100016278192_100000746330 [0,2,0,0,0,0|2,0,0]=4 12631 B11R0.3 C/C=C/CCOCCCCOC 34a_100016278192_100000755781 [0,2,0,0,0,0|1,0,1]=4 12632 B11R0.3 C/C=C/CCOCCCOCC 34a_100016278192_100012232248 [0,2,0,0,0,0|1,0,0]=3 12633 B11R0.3 C/C=C/CCOCCOCCC 34a_100016278192_100011215938 [0,2,0,0,0,0|1,0,0]=3 12634 B11R0.3 C/C=C/CCOCCOCCO 34a_100016278192_100000692535 [0,2,0,0,0,0|1,0,0]=3 12635 B11R0.3 C/C=C/CCOCOCCCC 34a_100016278192_100011995733 [0,2,0,0,0,0|2,0,0]=4 12636 B11R0.3 C/C=C/CNCCCCCOC 34a_100000747528_100102629194 [0,2,0,0,0,0|2,0,0]=4 12637 B11R0.3 C/C=C/CNCCOCCOC 34a_100000745349_100102629194 [0,2,0,0,0,0|1,0,0]=3 12638 B11R0.3 C/C=C/COCCCCCCC 34a_100000210272_100102629194 [0,2,0,0,0,0|2,0,0]=4 12639 B11R0.3 C/C=C/COCCCCCCC 34a_100016270725_100000210614 [0,2,0,0,0,0|2,0,0]=4 12640 B11R0.3 C/C=C/COCCCCCCC 7a_100000210272_100102629194 [0,2,0,0,0,0|2,0,0]=4 12641 B11R0.3 C/C=C/COCCCCCNC 34a_100000722520_100102629194 [0,2,0,0,0,0|2,0,0]=4 12642 B11R0.3 C/C=C/COCCOCCCC 34a_100000210238_100102629194 [0,2,0,0,0,0|1,0,0]=3 12643 B11R0.3 C/C=C/COCCOCCCC 34a_100016270725_100000743108 [0,2,0,0,0,0|1,0,0]=3 12644 B11R0.3 C/C=C/COCCOCCCC 7a_100000210238_100102629194 [0,2,0,0,0,0|1,0,0]=3 12645 B11R0.3 C/C=C/COCCOCCNC 34a_100000228057_100102629194 [0,2,0,0,0,0|1,0,0]=3 12646 B11R0.3 C/C=C/COCCOCCOC 34a_100011215163_100102629194 [0,2,0,0,0,0|0,0,0]=2 12647 B11R0.3 C/C=C/COCCOCCOC 34a_100016270725_100000695917 [0,2,0,0,0,0|0,0,0]=2 12648 B11R0.3 C/C=C/COCCOCCOC 7a_100011215163_100102629194 [0,2,0,0,0,0|0,0,0]=2 12649 B11R0.3 C/C=C/COCCSCCCC 34a_200000230436_100102629194 [0,2,0,0,0,0|1,1,0]=4 12650 B11R0.3 C/C=C/COCCSCCCC 7a_200000230436_100102629194 [0,2,0,0,0,0|1,1,0]=4 12651 B11R0.3 C/C=C/CSCCOCCCC 62a_100000743108_100102629194 [0,2,0,0,0,0|1,1,0]=4 12652 B11R0.3 C/C=C/CSCCOCCCC 62a_100102629194_100000743108 [0,2,0,0,0,0|1,1,0]=4 12653 B11R0.3 C/C=C/CSCCOCCOC 62a_100000695917_100102629194 [0,2,0,0,0,0|0,1,0]=3 12654 B11R0.3 C/C=C/CSCCOCCOC 62a_100102629194_100000695917 [0,2,0,0,0,0|0,1,0]=3 12655 B11R0.3 C=CCCCCCCCCOC 34a_100011215194_200000210301 [0,2,0,0,0,0|2,0,0]=4 12656 B11R0.3 C=CCCCCCCCCOC 34a_100138415774_100011933949 [0,2,0,0,0,0|2,0,0]=4 12657 B11R0.3 C=CCCCCCCCCOC 7a_100011215194_200000210301 [0,2,0,0,0,0|2,0,0]=4 12658 B11R0.3 C=CCCCCCCCCO[13CH3] 34a_100011215194_200025704644 [0,2,0,0,0,0|2,0,0]=4 12659 B11R0.3 C=CCCCCCCCCO[13CH3] 7a_100011215194_200025704644 [0,2,0,0,0,0|2,0,0]=4 12660 B11R0.3 C=CCCCCCCCOCC 34a_100000730831_100000210202 [0,2,0,0,0,0|2,0,0]=4 12661 B11R0.3 C=CCCCCCCCOCC 34a_100121572206_100012355270 [0,2,0,0,0,0|2,0,0]=4 12662 B11R0.3 C=CCCCCCCCOCC 7a_100000730831_100000210202 [0,2,0,0,0,0|2,0,0]=4 12663 B11R0.3 C=CCCCCCNCCOC 2230a_100000209980_100000700193 [0,2,0,0,0,0|2,0,0]=4 12664 B11R0.3 C=CCCCCCOCCCC 34a_100000210227_100000700193 [0,2,0,0,0,0|2,0,0]=4 12665 B11R0.3 C=CCCCCCOCCCC 34a_100011216702_100000210210 [0,2,0,0,0,0|2,0,0]=4 12666 B11R0.3 C=CCCCCCOCCCC 7a_100000210227_100000700193 [0,2,0,0,0,0|2,0,0]=4 12667 B11R0.3 C=CCCCCCOCCCC 7a_100011216702_100000210211 [0,2,0,0,0,0|2,0,0]=4 12668 B11R0.3 C=CCCCCCOCCOC 34a_100000210237_100000700193 [0,2,0,0,0,0|1,0,0]=3 12669 B11R0.3 C=CCCCCCOCCOC 34a_100011216702_100011201679 [0,2,0,0,0,0|1,0,0]=3 12670 B11R0.3 C=CCCCCCOCCOC 7a_100011216702_100000233755 [0,2,0,0,0,0|1,0,0]=3 12671 B11R0.3 C=CCCCCCOCCON 34a_100000700252_100000700193 [0,2,0,0,0,0|2,0,0]=4 12672 B11R0.3 C=CCCCCCOCCSC 34a_100000230434_100000700193 [0,2,0,0,0,0|1,1,0]=4 12673 B11R0.3 C=CCCCCCOCCSC 34a_100011216702_100000212216 [0,2,0,0,0,0|1,1,0]=4 12674 B11R0.3 C=CCCCCCOCCSC 7a_100000230434_100000700193 [0,2,0,0,0,0|1,1,0]=4 12675 B11R0.3 C=CCCCCCOCCSC 7a_100011216702_100000212216 [0,2,0,0,0,0|1,1,0]=4 12676 B11R0.3 C=CCCCCCSCCOC 62a_100000233755_100000700193 [0,2,0,0,0,0|1,1,0]=4 12677 B11R0.3 C=CCCCCCSCCOC 62a_100000700193_100000233755 [0,2,0,0,0,0|1,1,0]=4 12678 B11R0.3 C=CCCCCNCCOCC 2230a_100000703577_100011215890 [0,2,0,0,0,0|2,0,0]=4 12679 B11R0.3 C=CCCCCNCCOCC 2230a_102516460346_100011215482 [0,2,0,0,0,0|2,0,0]=4 12680 B11R0.3 C=CCCCCNCCOCC 34a_100000703577_100000210147 [0,2,0,0,0,0|2,0,0]=4 12681 B11R0.3 C=CCCCCNCCOCC 34a_102516460346_100011215482 [0,2,0,0,0,0|2,0,0]=4 12682 B11R0.3 C=CCCCCOCCCCC 34a_100000210253_100011215482 [0,2,0,0,0,0|2,0,0]=4 12683 B11R0.3 C=CCCCCOCCCCC 34a_100000766645_100000718602 [0,2,0,0,0,0|2,0,0]=4 12684 B11R0.3 C=CCCCCOCCCCC 7a_100000210253_100011215482 [0,2,0,0,0,0|2,0,0]=4 12685 B11R0.3 C=CCCCCOCCCCC 7a_100000766645_100000210326 [0,2,0,0,0,0|2,0,0]=4 12686 B11R0.3 C=CCCCCOCCCOC 34a_100000740835_100011215482 [0,2,0,0,0,0|1,0,1]=4 12687 B11R0.3 C=CCCCCOCCCOC 34a_100000766645_100000740836 [0,2,0,0,0,0|1,0,1]=4 12688 B11R0.3 C=CCCCCOCCCOC 7a_100000766645_100000740836 [0,2,0,0,0,0|1,0,1]=4 12689 B11R0.3 C=CCCCCOCCOCC 34a_100000210136_100011215482 [0,2,0,0,0,0|1,0,0]=3 12690 B11R0.3 C=CCCCCOCCOCC 34a_100000766645_100000210147 [0,2,0,0,0,0|1,0,0]=3 12691 B11R0.3 C=CCCCCOCCOCC 7a_100000210136_100011215482 [0,2,0,0,0,0|1,0,0]=3 12692 B11R0.3 C=CCCCCOCCOCC 7a_100000766645_100011215890 [0,2,0,0,0,0|1,0,0]=3 12693 B11R0.3 C=CCCCCOCCSCC 34a_100000212035_100011215482 [0,2,0,0,0,0|1,1,0]=4 12694 B11R0.3 C=CCCCCOCCSCC 34a_100000766645_100000757381 [0,2,0,0,0,0|1,1,0]=4 12695 B11R0.3 C=CCCCCOCCSCC 7a_100000212035_100011215482 [0,2,0,0,0,0|1,1,0]=4 12696 B11R0.3 C=CCCCCOCCSCC 7a_100000766645_100000757381 [0,2,0,0,0,0|1,1,0]=4 12697 B11R0.3 C=CCCCCSCCOCC 62a_100000210147_100011215482 [0,2,0,0,0,0|1,1,0]=4 12698 B11R0.3 C=CCCCCSCCOCC 62a_100011215482_100011215890 [0,2,0,0,0,0|1,1,0]=4 12699 B11R0.3 C=CCCCNCOCCOC 2230a_100000700776_100000231047 [0,2,0,0,0,0|1,0,1]=4 12700 B11R0.3 C=CCCCOCCCOCC 34a_100000757476_100000757094 [0,2,0,0,0,0|1,0,1]=4 12701 B11R0.3 C=CCCCOCCCOCC 34a_100000758997_100012232248 [0,2,0,0,0,0|1,0,1]=4 12702 B11R0.3 C=CCCCOCCCOCC 7a_100000757476_100000757094 [0,2,0,0,0,0|1,0,1]=4 12703 B11R0.3 C=CCCCOCCCOCC 7a_100000758997_100012232248 [0,2,0,0,0,0|1,0,1]=4 12704 B11R0.3 C=CCCCOCCOCCBr 34a_100000692535_100000757094 [0,2,0,0,0,0|1,0,1]=4 12705 B11R0.3 C=CCCCOCCOCCBr 7a_100000692535_100000757094 [0,2,0,0,0,0|1,0,1]=4 12706 B11R0.3 C=CCCCOCCOCCC 34a_100000752267_100000757094 [0,2,0,0,0,0|1,0,1]=4 12707 B11R0.3 C=CCCCOCCOCCC 34a_100000758997_100011215938 [0,2,0,0,0,0|1,0,1]=4 12708 B11R0.3 C=CCCCOCCOCCC 7a_100000752267_100000757094 [0,2,0,0,0,0|1,0,1]=4 12709 B11R0.3 C=CCCCOCCOCCC 7a_100000758997_100011215938 [0,2,0,0,0,0|1,0,1]=4 12710 B11R0.3 C=CCCCOCCOCCCl 34a_100011215305_100000757094 [0,2,0,0,0,0|1,0,1]=4 12711 B11R0.3 C=CCCCOCCOCCCl 7a_100011215305_100000757094 [0,2,0,0,0,0|1,0,1]=4 12712 B11R0.3 C=CCCCOCCOCCF 34a_200015357709_100000757094 [0,2,0,0,0,0|1,0,1]=4 12713 B11R0.3 C=CCCCOCCOCCF 7a_200015357709_100000757094 [0,2,0,0,0,0|1,0,1]=4 12714 B11R0.3 C=CCCCOCCOCCI 34a_100012149058_100000757094 [0,2,0,0,0,0|1,0,1]=4 12715 B11R0.3 C=CCCCOCCOCCI 7a_100012149058_100000757094 [0,2,0,0,0,0|1,0,1]=4 12716 B11R0.3 C=CCCCOCCOCCN 34a_100000211614_100000757094 [0,2,0,0,0,0|1,0,1]=4 12717 B11R0.3 C=CCCCOCCOCCO 34a_100000758997_100000692535 [0,2,0,0,0,0|1,0,1]=4 12718 B11R0.3 C=CCCCOCCOCCO 7a_100000758997_100011215305 [0,2,0,0,0,0|1,0,1]=4 12719 B11R0.3 C=CCCCSCOCCOC 62a_100000231047_100000757094 [0,2,0,0,0,0|1,0,1]=4 12720 B11R0.3 C=CCCCSCOCCOC 62a_100011713584_100000231047 [0,2,0,0,0,0|1,0,1]=4 12721 B11R0.3 C=CCCNCCCCCOC 2230a_100000747528_100000754431 [0,2,0,0,0,0|2,0,0]=4 12722 B11R0.3 C=CCCNCCCCCOC 34a_100000747528_100000754431 [0,2,0,0,0,0|2,0,0]=4 12723 B11R0.3 C=CCCNCCOCCCC 2230a_100015191253_100000743108 [0,2,0,0,0,0|2,0,0]=4 12724 B11R0.3 C=CCCNCCOCCOC 2230a_100000745349_100000754431 [0,2,0,0,0,0|1,0,0]=3 12725 B11R0.3 C=CCCNCCOCCOC 2230a_100015191253_100000695917 [0,2,0,0,0,0|1,0,0]=3 12726 B11R0.3 C=CCCNCCOCCOC 34a_100000745349_100000754431 [0,2,0,0,0,0|1,0,0]=3 12727 B11R0.3 C=CCCOCCCCCCC 34a_100000210272_100000754431 [0,2,0,0,0,0|2,0,0]=4 12728 B11R0.3 C=CCCOCCCCCCC 34a_100011205117_100000210614 [0,2,0,0,0,0|2,0,0]=4 12729 B11R0.3 C=CCCOCCCCCCC 7a_100000210272_100000754431 [0,2,0,0,0,0|2,0,0]=4 12730 B11R0.3 C=CCCOCCCCCNC 34a_100000722520_100000754431 [0,2,0,0,0,0|2,0,0]=4 12731 B11R0.3 C=CCCOCCOCCCC 34a_100000210238_100000754431 [0,2,0,0,0,0|1,0,0]=3 12732 B11R0.3 C=CCCOCCOCCCC 34a_100011205117_100000743108 [0,2,0,0,0,0|1,0,0]=3 12733 B11R0.3 C=CCCOCCOCCCC 7a_100000210238_100000754431 [0,2,0,0,0,0|1,0,0]=3 12734 B11R0.3 C=CCCOCCOCCNC 34a_100000228057_100000754431 [0,2,0,0,0,0|1,0,0]=3 12735 B11R0.3 C=CCCOCCOCCOC 34a_100011205117_100000695917 [0,2,0,0,0,0|0,0,0]=2 12736 B11R0.3 C=CCCOCCOCCOC 34a_100011215163_100000754431 [0,2,0,0,0,0|0,0,0]=2 12737 B11R0.3 C=CCCOCCOCCOC 7a_100011215163_100000754431 [0,2,0,0,0,0|0,0,0]=2 12738 B11R0.3 C=CCCOCCSCCCC 34a_200000230436_100000754431 [0,2,0,0,0,0|1,1,0]=4 12739 B11R0.3 C=CCCOCCSCCCC 7a_200000230436_100000754431 [0,2,0,0,0,0|1,1,0]=4 12740 B11R0.3 C=CCCSCCOCCCC 62a_100000743108_100000754431 [0,2,0,0,0,0|1,1,0]=4 12741 B11R0.3 C=CCCSCCOCCCC 62a_100000754431_100000743108 [0,2,0,0,0,0|1,1,0]=4 12742 B11R0.3 C=CCCSCCOCCOC 62a_100000695917_100000754431 [0,2,0,0,0,0|0,1,0]=3 12743 B11R0.3 C=CCCSCCOCCOC 62a_100000754431_100000695917 [0,2,0,0,0,0|0,1,0]=3 12744 B11R0.3 C=CCNCCCOCCOC 2230a_100000206027_100000210623 [0,2,0,0,0,0|1,0,1]=4 12745 B11R0.3 C=CCNCCCOCCOC 2230a_100020586998_100011216529 [0,2,0,0,0,0|1,0,1]=4 12746 B11R0.3 C=CCNCCCOCCOC 34a_100000206027_100015514636 [0,2,0,0,0,0|1,0,1]=4 12747 B11R0.3 C=CCNCCOCCOCC 2230a_100020586998_100011211534 [0,2,0,0,0,0|1,0,0]=3 12748 B11R0.3 C=CCNCCOCCOCC 2230a_100102712874_100000210623 [0,2,0,0,0,0|1,0,0]=3 12749 B11R0.3 C=CCNCCOCCOCC 34a_100102712874_100015514636 [0,2,0,0,0,0|1,0,0]=3 12750 B11R0.3 C=CCOCCCCCCCC 34a_100000210232_100015514636 [0,2,0,0,0,0|2,0,0]=4 12751 B11R0.3 C=CCOCCCCCCCC 34a_200000210373_100000210759 [0,2,0,0,0,0|2,0,0]=4 12752 B11R0.3 C=CCOCCCCCCCC 7a_100000210232_100015514636 [0,2,0,0,0,0|2,0,0]=4 12753 B11R0.3 C=CCOCCCCCCOC 34a_200000210373_100011998445 [0,2,0,0,0,0|1,0,1]=4 12754 B11R0.3 C=CCOCCCCCCOC 34a_200012092642_100015514636 [0,2,0,0,0,0|1,0,1]=4 12755 B11R0.3 C=CCOCCCCCCOC 7a_200012092642_100015514636 [0,2,0,0,0,0|1,0,1]=4 12756 B11R0.3 C=CCOCCCOCCCC 34a_200011215613_100015514636 [0,2,0,0,0,0|1,0,1]=4 12757 B11R0.3 C=CCOCCCOCCCC 7a_200011215613_100015514636 [0,2,0,0,0,0|1,0,1]=4 12758 B11R0.3 C=CCOCCCOCCOC 34a_200000210373_100011216529 [0,2,0,0,0,0|0,0,1]=3 12759 B11R0.3 C=CCOCCNCCCCC 34a_100000224656_100015514636 [0,2,0,0,0,0|2,0,0]=4 12760 B11R0.3 C=CCOCCOC/C=C\CC 34a_100000037705_100103147603 [0,2,0,0,0,0|1,0,1]=4 12761 B11R0.3 C=CCOCCOC/C=C\CC 7a_100000037705_100103147603 [0,2,0,0,0,0|1,0,1]=4 12762 B11R0.3 C=CCOCCOCC#CCC 34a_100000037705_100009813939 [0,2,0,0,0,0|1,0,1]=4 12763 B11R0.3 C=CCOCCOCC#CCC 7a_100000037705_100009813939 [0,2,0,0,0,0|1,0,1]=4 12764 B11R0.3 C=CCOCCOCCCCC 34a_100000037705_100000718602 [0,2,0,0,0,0|1,0,0]=3 12765 B11R0.3 C=CCOCCOCCCCC 34a_100011215259_100015514636 [0,2,0,0,0,0|1,0,0]=3 12766 B11R0.3 C=CCOCCOCCCCC 7a_100000037705_100000210326 [0,2,0,0,0,0|1,0,0]=3 12767 B11R0.3 C=CCOCCOCCCCC 7a_100011215259_100015514636 [0,2,0,0,0,0|1,0,0]=3 12768 B11R0.3 C=CCOCCOCCCCF 34a_100000037705_100000729493 [0,2,0,0,0,0|1,0,1]=4 12769 B11R0.3 C=CCOCCOCCCCF 7a_100000037705_100000729493 [0,2,0,0,0,0|1,0,1]=4 12770 B11R0.3 C=CCOCCOCCCCO 34a_100000037705_100011216708 [0,2,0,0,0,0|1,0,1]=4 12771 B11R0.3 C=CCOCCOCCCCO 7a_100000037705_100000210776 [0,2,0,0,0,0|1,0,1]=4 12772 B11R0.3 C=CCOCCOCCCOC 34a_100000037705_100000740836 [0,2,0,0,0,0|0,0,1]=3 12773 B11R0.3 C=CCOCCOCCCOC 7a_100000037705_100000740836 [0,2,0,0,0,0|0,0,1]=3 12774 B11R0.3 C=CCOCCOCCOC=C 34a_100000037705_100000039644 [0,2,0,0,0,0|0,0,2]=4 12775 B11R0.3 C=CCOCCOCCOC=C 34a_100000039918_100015514636 [0,2,0,0,0,0|0,0,2]=4 12776 B11R0.3 C=CCOCCOCCOC=C 7a_100000037705_100000039644 [0,2,0,0,0,0|0,0,2]=4 12777 B11R0.3 C=CCOCCOCCOC=C 7a_100000039918_100015514636 [0,2,0,0,0,0|0,0,2]=4 12778 B11R0.3 C=CCOCCOCCOCC 34a_100000037705_100000210147 [0,2,0,0,0,0|0,0,0]=2 12779 B11R0.3 C=CCOCCOCCOCC 34a_100000065479_100000210202 [0,2,0,0,0,0|0,0,0]=2 12780 B11R0.3 C=CCOCCOCCOCC 34a_100000210240_100015514636 [0,2,0,0,0,0|0,0,0]=2 12781 B11R0.3 C=CCOCCOCCOCC 34a_200000210373_100011211534 [0,2,0,0,0,0|0,0,0]=2 12782 B11R0.3 C=CCOCCOCCOCC 7a_100000037705_100011215890 [0,2,0,0,0,0|0,0,0]=2 12783 B11R0.3 C=CCOCCOCCOCC 7a_100000065479_100000210202 [0,2,0,0,0,0|0,0,0]=2 12784 B11R0.3 C=CCOCCOCCOCC 7a_100000210240_100015514636 [0,2,0,0,0,0|0,0,0]=2 12785 B11R0.3 C=CCOCCOCCOCF 34a_100000065479_100015361967 [0,2,0,0,0,0|0,0,1]=3 12786 B11R0.3 C=CCOCCOCCOCF 7a_100000065479_100015361967 [0,2,0,0,0,0|0,0,1]=3 12787 B11R0.3 C=CCOCCOCCSCC 34a_100000037705_100000757381 [0,2,0,0,0,0|0,1,0]=3 12788 B11R0.3 C=CCOCCOCCSCC 7a_100000037705_100000757381 [0,2,0,0,0,0|0,1,0]=3 12789 B11R0.3 C=CCSCCCOCCOC 62a_100000210623_100011216529 [0,2,0,0,0,0|0,1,1]=4 12790 B11R0.3 C=CCSCCCOCCOC 62a_100011216529_100000210623 [0,2,0,0,0,0|0,1,1]=4 12791 B11R0.3 C=CCSCCOCCOCC 62a_100000210623_100011211534 [0,2,0,0,0,0|0,1,0]=3 12792 B11R0.3 C=CCSCCOCCOCC 62a_100011211534_100000210623 [0,2,0,0,0,0|0,1,0]=3 12793 B11R0.3 C=COCCCCOCCOC 34a_100000031558_100011201679 [0,2,0,0,0,0|0,0,2]=4 12794 B11R0.3 C=COCCCCOCCOC 7a_100000031558_100000233755 [0,2,0,0,0,0|0,0,2]=4 12795 B11R0.3 C=COCCCNCCOCC 2230a_100000210767_100011215890 [0,2,0,0,0,0|1,0,1]=4 12796 B11R0.3 C=COCCCNCCOCC 34a_100000210767_100000210147 [0,2,0,0,0,0|1,0,1]=4 12797 B11R0.3 C=COCCNCCCOCC 2230a_100000210961_100000039644 [0,2,0,0,0,0|1,0,1]=4 12798 B11R0.3 C=COCCNCCCOCC 34a_100000210961_100000039644 [0,2,0,0,0,0|1,0,1]=4 12799 B11R0.3 C=COCCNCCOCCC 2230a_100161115042_100000039644 [0,2,0,0,0,0|1,0,1]=4 12800 B11R0.3 C=COCCNCCOCCC 34a_100161115042_100000039644 [0,2,0,0,0,0|1,0,1]=4 12801 B11R0.3 C=COCCNCCOCCO 2230a_100000211614_100000039644 [0,2,0,0,0,0|1,0,1]=4 12802 B11R0.3 C=COCCNCCOCCO 34a_100000211614_100000039644 [0,2,0,0,0,0|1,0,1]=4 12803 B11R0.3 C=COCCOCC/C=C\CC 34a_100000033082_100015370543 [0,2,0,0,0,0|1,0,1]=4 12804 B11R0.3 C=COCCOCC/C=C\CC 34a_100016288707_100000039644 [0,2,0,0,0,0|1,0,1]=4 12805 B11R0.3 C=COCCOCC/C=C\CC 7a_100016288707_100000039644 [0,2,0,0,0,0|1,0,1]=4 12806 B11R0.3 C=COCCOCCC#CCC 34a_100000036655_100000039644 [0,2,0,0,0,0|1,0,1]=4 12807 B11R0.3 C=COCCOCCC#CCC 7a_100000036655_100000039644 [0,2,0,0,0,0|1,0,1]=4 12808 B11R0.3 C=COCCOCCCCCBr 34a_100000746331_100000039644 [0,2,0,0,0,0|1,0,1]=4 12809 B11R0.3 C=COCCOCCCCCBr 7a_100000746331_100000039644 [0,2,0,0,0,0|1,0,1]=4 12810 B11R0.3 C=COCCOCCCCCC 34a_100000033082_100000210314 [0,2,0,0,0,0|1,0,1]=4 12811 B11R0.3 C=COCCOCCCCCC 34a_100000210259_100000039644 [0,2,0,0,0,0|1,0,1]=4 12812 B11R0.3 C=COCCOCCCCCC 7a_100000210259_100000039644 [0,2,0,0,0,0|1,0,1]=4 12813 B11R0.3 C=COCCOCCCCCCl 34a_100000746330_100000039644 [0,2,0,0,0,0|1,0,1]=4 12814 B11R0.3 C=COCCOCCCCCCl 7a_100000746330_100000039644 [0,2,0,0,0,0|1,0,1]=4 12815 B11R0.3 C=COCCOCCCCCF 34a_100000033082_100000729378 [0,2,0,0,0,0|1,0,1]=4 12816 B11R0.3 C=COCCOCCCCCI 34a_200012148887_100000039644 [0,2,0,0,0,0|1,0,1]=4 12817 B11R0.3 C=COCCOCCCCCI 7a_200012148887_100000039644 [0,2,0,0,0,0|1,0,1]=4 12818 B11R0.3 C=COCCOCCCCCN 34a_100000762737_100000039644 [0,2,0,0,0,0|1,0,1]=4 12819 B11R0.3 C=COCCOCCCCCO 34a_100000033082_100000746330 [0,2,0,0,0,0|1,0,1]=4 12820 B11R0.3 C=COCCOCCCCOC 34a_100000033082_100000755781 [0,2,0,0,0,0|0,0,2]=4 12821 B11R0.3 C=COCCOCCCCOC 34a_100000740925_100000039644 [0,2,0,0,0,0|0,0,2]=4 12822 B11R0.3 C=COCCOCCCCSC 34a_100011217163_100000039644 [0,2,0,0,0,0|1,0,1]=4 12823 B11R0.3 C=COCCOCCCCSC 7a_100011217163_100000039644 [0,2,0,0,0,0|1,0,1]=4 12824 B11R0.3 C=COCCOCCCOCC 34a_100000033082_100012232248 [0,2,0,0,0,0|0,0,1]=3 12825 B11R0.3 C=COCCOCCCOCC 34a_100000757476_100000039644 [0,2,0,0,0,0|0,0,1]=3 12826 B11R0.3 C=COCCOCCCOCC 7a_100000757476_100000039644 [0,2,0,0,0,0|0,0,1]=3 12827 B11R0.3 C=COCCOCCCSCC 34a_100011216438_100000039644 [0,2,0,0,0,0|0,1,1]=4 12828 B11R0.3 C=COCCOCCCSCC 7a_100011216438_100000039644 [0,2,0,0,0,0|0,1,1]=4 12829 B11R0.3 C=COCCOCCOCC#N 7a_100000039918_100011215382 [0,2,0,0,0,0|0,0,2]=4 12830 B11R0.3 C=COCCOCCOCC=O 34a_100000039918_200009817547 [0,2,0,0,0,0|0,0,2]=4 12831 B11R0.3 C=COCCOCCOCC=O 7a_100000039918_200015260668 [0,2,0,0,0,0|0,0,2]=4 12832 B11R0.3 C=COCCOCCOCCBr 34a_100000692535_100000039644 [0,2,0,0,0,0|0,0,1]=3 12833 B11R0.3 C=COCCOCCOCCBr 7a_100000692535_100000039644 [0,2,0,0,0,0|0,0,1]=3 12834 B11R0.3 C=COCCOCCOCCC 34a_100000033082_100011215938 [0,2,0,0,0,0|0,0,1]=3 12835 B11R0.3 C=COCCOCCOCCC 34a_100000039918_100000210303 [0,2,0,0,0,0|0,0,1]=3 12836 B11R0.3 C=COCCOCCOCCC 34a_100000752267_100000039644 [0,2,0,0,0,0|0,0,1]=3 12837 B11R0.3 C=COCCOCCOCCC 7a_100000039918_100000210303 [0,2,0,0,0,0|0,0,1]=3 12838 B11R0.3 C=COCCOCCOCCC 7a_100000752267_100000039644 [0,2,0,0,0,0|0,0,1]=3 12839 B11R0.3 C=COCCOCCOCCCl 34a_100011215305_100000039644 [0,2,0,0,0,0|0,0,1]=3 12840 B11R0.3 C=COCCOCCOCCCl 7a_100011215305_100000039644 [0,2,0,0,0,0|0,0,1]=3 12841 B11R0.3 C=COCCOCCOCCF 34a_100000039918_100011217306 [0,2,0,0,0,0|0,0,1]=3 12842 B11R0.3 C=COCCOCCOCCF 34a_200015357709_100000039644 [0,2,0,0,0,0|0,0,1]=3 12843 B11R0.3 C=COCCOCCOCCF 7a_100000039918_100011217306 [0,2,0,0,0,0|0,0,1]=3 12844 B11R0.3 C=COCCOCCOCCF 7a_200015357709_100000039644 [0,2,0,0,0,0|0,0,1]=3 12845 B11R0.3 C=COCCOCCOCCI 34a_100012149058_100000039644 [0,2,0,0,0,0|0,0,1]=3 12846 B11R0.3 C=COCCOCCOCCI 7a_100012149058_100000039644 [0,2,0,0,0,0|0,0,1]=3 12847 B11R0.3 C=COCCOCCOCCN 34a_100000211614_100000039644 [0,2,0,0,0,0|0,0,1]=3 12848 B11R0.3 C=COCCOCCOCCO 34a_100000033082_100000692535 [0,2,0,0,0,0|0,0,1]=3 12849 B11R0.3 C=COCCOCCOCCO 34a_100000039918_100000211926 [0,2,0,0,0,0|0,0,1]=3 12850 B11R0.3 C=COCCOCCOCCO 7a_100000039918_100000211926 [0,2,0,0,0,0|0,0,1]=3 12851 B11R0.3 C=COCCOCCOCSC 34a_100000039918_100011218213 [0,2,0,0,0,0|0,0,1]=3 12852 B11R0.3 C=COCCOCCSCCC 34a_200000230433_100000039644 [0,2,0,0,0,0|0,1,1]=4 12853 B11R0.3 C=COCCOCCSCCC 7a_200000230433_100000039644 [0,2,0,0,0,0|0,1,1]=4 12854 B11R0.3 C=COCCOCOCCCC 34a_100000033082_100011995733 [0,2,0,0,0,0|1,0,1]=4 12855 B11R0.3 C=COCCSCCCOCC 62a_100000039644_100012232248 [0,2,0,0,0,0|0,1,1]=4 12856 B11R0.3 C=COCCSCCCOCC 62a_100012232248_100000039644 [0,2,0,0,0,0|0,1,1]=4 12857 B11R0.3 C=COCCSCCOCCC 62a_100000039644_100011215938 [0,2,0,0,0,0|0,1,1]=4 12858 B11R0.3 C=COCCSCCOCCC 62a_100011215938_100000039644 [0,2,0,0,0,0|0,1,1]=4 12859 B11R0.3 C=COCCSCCOCCO 62a_100000039644_100011215305 [0,2,0,0,0,0|0,1,1]=4 12860 B11R0.3 C=COCCSCCOCCO 62a_100011215305_100000039644 [0,2,0,0,0,0|0,1,1]=4 12861 B11R0.3 C=COCCSCOCCOC 62a_100000039644_100000231047 [0,2,0,0,0,0|0,0,2]=4 12862 B11R0.3 C=COCCSCOCCOC 62a_100000231047_100000039644 [0,2,0,0,0,0|0,0,2]=4 12863 B11R0.3 CC#CCCOCC/C=C\CC 34a_100000750427_100015370543 [0,2,0,0,0,0|2,0,0]=4 12864 B11R0.3 CC#CCCOCCCCCC 34a_100000750427_100000210314 [0,2,0,0,0,0|2,0,0]=4 12865 B11R0.3 CC#CCCOCCCCCF 34a_100000750427_100000729378 [0,2,0,0,0,0|2,0,0]=4 12866 B11R0.3 CC#CCCOCCCCCO 34a_100000750427_100000746330 [0,2,0,0,0,0|2,0,0]=4 12867 B11R0.3 CC#CCCOCCCCOC 34a_100000750427_100000755781 [0,2,0,0,0,0|1,0,1]=4 12868 B11R0.3 CC#CCCOCCCOCC 34a_100000750427_100012232248 [0,2,0,0,0,0|1,0,0]=3 12869 B11R0.3 CC#CCCOCCOCCC 34a_100000750427_100011215938 [0,2,0,0,0,0|1,0,0]=3 12870 B11R0.3 CC#CCCOCCOCCO 34a_100000750427_100000692535 [0,2,0,0,0,0|1,0,0]=3 12871 B11R0.3 CC#CCCOCOCCCC 34a_100000750427_100011995733 [0,2,0,0,0,0|2,0,0]=4 12872 B11R0.3 CC#CCNCCCCCOC 2230a_100000747528_100000748600 [0,2,0,0,0,0|2,0,0]=4 12873 B11R0.3 CC#CCNCCCCCOC 34a_100000747528_100000748600 [0,2,0,0,0,0|2,0,0]=4 12874 B11R0.3 CC#CCNCCOCCCC 2230a_100000685387_100000743108 [0,2,0,0,0,0|2,0,0]=4 12875 B11R0.3 CC#CCNCCOCCCC 34a_100000685387_100000743108 [0,2,0,0,0,0|2,0,0]=4 12876 B11R0.3 CC#CCNCCOCCOC 2230a_100000685387_100000695917 [0,2,0,0,0,0|1,0,0]=3 12877 B11R0.3 CC#CCNCCOCCOC 2230a_100000745349_100000748600 [0,2,0,0,0,0|1,0,0]=3 12878 B11R0.3 CC#CCNCCOCCOC 34a_100000685387_100000695917 [0,2,0,0,0,0|1,0,0]=3 12879 B11R0.3 CC#CCNCCOCCOC 34a_100000745349_100000748600 [0,2,0,0,0,0|1,0,0]=3 12880 B11R0.3 CC#CCOCCCCCCC 34a_100000210272_100000748600 [0,2,0,0,0,0|2,0,0]=4 12881 B11R0.3 CC#CCOCCCCCCC 34a_100000761923_100000210614 [0,2,0,0,0,0|2,0,0]=4 12882 B11R0.3 CC#CCOCCCCCCC 7a_100000210272_100000748600 [0,2,0,0,0,0|2,0,0]=4 12883 B11R0.3 CC#CCOCCCCCNC 34a_100000722520_100000748600 [0,2,0,0,0,0|2,0,0]=4 12884 B11R0.3 CC#CCOCCOCCCC 34a_100000210238_100000748600 [0,2,0,0,0,0|1,0,0]=3 12885 B11R0.3 CC#CCOCCOCCCC 34a_100000761923_100000743108 [0,2,0,0,0,0|1,0,0]=3 12886 B11R0.3 CC#CCOCCOCCCC 7a_100000210238_100000748600 [0,2,0,0,0,0|1,0,0]=3 12887 B11R0.3 CC#CCOCCOCCNC 34a_100000228057_100000748600 [0,2,0,0,0,0|1,0,0]=3 12888 B11R0.3 CC#CCOCCOCCOC 34a_100000761923_100000695917 [0,2,0,0,0,0|0,0,0]=2 12889 B11R0.3 CC#CCOCCOCCOC 34a_100011215163_100000748600 [0,2,0,0,0,0|0,0,0]=2 12890 B11R0.3 CC#CCOCCOCCOC 7a_100011215163_100000748600 [0,2,0,0,0,0|0,0,0]=2 12891 B11R0.3 CC#CCOCCSCCCC 34a_200000230436_100000748600 [0,2,0,0,0,0|1,1,0]=4 12892 B11R0.3 CC#CCOCCSCCCC 7a_200000230436_100000748600 [0,2,0,0,0,0|1,1,0]=4 12893 B11R0.3 CC#CCSCCOCCCC 62a_100000743108_100000748600 [0,2,0,0,0,0|1,1,0]=4 12894 B11R0.3 CC#CCSCCOCCCC 62a_100000748600_100000743108 [0,2,0,0,0,0|1,1,0]=4 12895 B11R0.3 CC#CCSCCOCCOC 62a_100000695917_100000748600 [0,2,0,0,0,0|0,1,0]=3 12896 B11R0.3 CC#CCSCCOCCOC 62a_100000748600_100000695917 [0,2,0,0,0,0|0,1,0]=3 12897 B11R0.3 CC/C=C/CCCOCCCC 34a_100016287902_100000210210 [0,2,0,0,0,0|2,0,0]=4 12898 B11R0.3 CC/C=C/CCCOCCCC 7a_100016287902_100000210211 [0,2,0,0,0,0|2,0,0]=4 12899 B11R0.3 CC/C=C/CCCOCCOC 34a_100016287902_100011201679 [0,2,0,0,0,0|1,0,0]=3 12900 B11R0.3 CC/C=C/CCCOCCOC 7a_100016287902_100000233755 [0,2,0,0,0,0|1,0,0]=3 12901 B11R0.3 CC/C=C/CCCOCCSC 34a_100016287902_100000212216 [0,2,0,0,0,0|1,1,0]=4 12902 B11R0.3 CC/C=C/CCCOCCSC 7a_100016287902_100000212216 [0,2,0,0,0,0|1,1,0]=4 12903 B11R0.3 CC/C=C\CCCCCOCC 34a_100016268722_100000210202 [0,2,0,0,0,0|2,0,0]=4 12904 B11R0.3 CC/C=C\CCCCCOCC 7a_100016268722_100000210202 [0,2,0,0,0,0|2,0,0]=4 12905 B11R0.3 CC/C=C\CCCCCOCF 34a_100016268722_100015361967 [0,2,0,0,0,0|2,0,0]=4 12906 B11R0.3 CC/C=C\CCCCCOCF 7a_100016268722_100015361967 [0,2,0,0,0,0|2,0,0]=4 12907 B11R0.3 CC/C=C\CCNCCCOC 34a_100150723488_100015370543 [0,2,0,0,0,0|2,0,0]=4 12908 B11R0.3 CC/C=C\CCNCCOCC 2230a_102516460346_100015370543 [0,2,0,0,0,0|2,0,0]=4 12909 B11R0.3 CC/C=C\CCNCCOCC 34a_102516460346_100015370543 [0,2,0,0,0,0|2,0,0]=4 12910 B11R0.3 CC/C=C\CCOCCCCBr 34a_100011216708_100015370543 [0,2,0,0,0,0|2,0,0]=4 12911 B11R0.3 CC/C=C\CCOCCCCC 34a_100000210253_100015370543 [0,2,0,0,0,0|2,0,0]=4 12912 B11R0.3 CC/C=C\CCOCCCCC 34a_100016288707_100000718602 [0,2,0,0,0,0|2,0,0]=4 12913 B11R0.3 CC/C=C\CCOCCCCC 7a_100000210253_100015370543 [0,2,0,0,0,0|2,0,0]=4 12914 B11R0.3 CC/C=C\CCOCCCCC 7a_100016288707_100000210326 [0,2,0,0,0,0|2,0,0]=4 12915 B11R0.3 CC/C=C\CCOCCCCCl 34a_100000210776_100015370543 [0,2,0,0,0,0|2,0,0]=4 12916 B11R0.3 CC/C=C\CCOCCCCCl 7a_100000210776_100015370543 [0,2,0,0,0,0|2,0,0]=4 12917 B11R0.3 CC/C=C\CCOCCCCF 34a_100011995726_100015370543 [0,2,0,0,0,0|2,0,0]=4 12918 B11R0.3 CC/C=C\CCOCCCCF 34a_100016288707_100000729493 [0,2,0,0,0,0|2,0,0]=4 12919 B11R0.3 CC/C=C\CCOCCCCF 7a_100011995726_100015370543 [0,2,0,0,0,0|2,0,0]=4 12920 B11R0.3 CC/C=C\CCOCCCCF 7a_100016288707_100000729493 [0,2,0,0,0,0|2,0,0]=4 12921 B11R0.3 CC/C=C\CCOCCCCI 34a_200012148704_100015370543 [0,2,0,0,0,0|2,0,0]=4 12922 B11R0.3 CC/C=C\CCOCCCCN 34a_100000750430_100015370543 [0,2,0,0,0,0|2,0,0]=4 12923 B11R0.3 CC/C=C\CCOCCCCO 34a_100016288707_100011216708 [0,2,0,0,0,0|2,0,0]=4 12924 B11R0.3 CC/C=C\CCOCCCCO 7a_100016288707_100000210776 [0,2,0,0,0,0|2,0,0]=4 12925 B11R0.3 CC/C=C\CCOCCCNC 34a_100000213112_100015370543 [0,2,0,0,0,0|2,0,0]=4 12926 B11R0.3 CC/C=C\CCOCCCOC 34a_100000740835_100015370543 [0,2,0,0,0,0|1,0,0]=3 12927 B11R0.3 CC/C=C\CCOCCCOC 34a_100016288707_100000740836 [0,2,0,0,0,0|1,0,0]=3 12928 B11R0.3 CC/C=C\CCOCCCOC 7a_100016288707_100000740836 [0,2,0,0,0,0|1,0,0]=3 12929 B11R0.3 CC/C=C\CCOCCCSC 34a_100000690336_100015370543 [0,2,0,0,0,0|1,1,0]=4 12930 B11R0.3 CC/C=C\CCOCCCSC 7a_100000690336_100015370543 [0,2,0,0,0,0|1,1,0]=4 12931 B11R0.3 CC/C=C\CCOCCOCC 34a_100000210136_100015370543 [0,2,0,0,0,0|1,0,0]=3 12932 B11R0.3 CC/C=C\CCOCCOCC 34a_100016288707_100000210147 [0,2,0,0,0,0|1,0,0]=3 12933 B11R0.3 CC/C=C\CCOCCOCC 7a_100000210136_100015370543 [0,2,0,0,0,0|1,0,0]=3 12934 B11R0.3 CC/C=C\CCOCCOCC 7a_100016288707_100011215890 [0,2,0,0,0,0|1,0,0]=3 12935 B11R0.3 CC/C=C\CCOCCSCC 34a_100000212035_100015370543 [0,2,0,0,0,0|1,1,0]=4 12936 B11R0.3 CC/C=C\CCOCCSCC 34a_100016288707_100000757381 [0,2,0,0,0,0|1,1,0]=4 12937 B11R0.3 CC/C=C\CCOCCSCC 7a_100000212035_100015370543 [0,2,0,0,0,0|1,1,0]=4 12938 B11R0.3 CC/C=C\CCOCCSCC 7a_100016288707_100000757381 [0,2,0,0,0,0|1,1,0]=4 12939 B11R0.3 CC/C=C\CCSCCCOC 62a_100000709357_100015370543 [0,2,0,0,0,0|1,1,0]=4 12940 B11R0.3 CC/C=C\CCSCCCOC 62a_100015370543_100000709357 [0,2,0,0,0,0|1,1,0]=4 12941 B11R0.3 CC/C=C\CCSCCOCC 62a_100000210147_100015370543 [0,2,0,0,0,0|1,1,0]=4 12942 B11R0.3 CC/C=C\CCSCCOCC 62a_100015370543_100011215890 [0,2,0,0,0,0|1,1,0]=4 12943 B11R0.3 CC/C=C\COCCCCOC 34a_100000740925_100103147603 [0,2,0,0,0,0|1,0,1]=4 12944 B11R0.3 CC/C=C\COCCCCOC 34a_100016268518_100000755781 [0,2,0,0,0,0|1,0,1]=4 12945 B11R0.3 CC/C=C\COCCCOCC 34a_100000757476_100103147603 [0,2,0,0,0,0|1,0,1]=4 12946 B11R0.3 CC/C=C\COCCCOCC 34a_100016268518_100012232248 [0,2,0,0,0,0|1,0,1]=4 12947 B11R0.3 CC/C=C\COCCCOCC 7a_100000757476_100103147603 [0,2,0,0,0,0|1,0,1]=4 12948 B11R0.3 CC/C=C\COCCOCCBr 34a_100000692535_100103147603 [0,2,0,0,0,0|1,0,1]=4 12949 B11R0.3 CC/C=C\COCCOCCBr 7a_100000692535_100103147603 [0,2,0,0,0,0|1,0,1]=4 12950 B11R0.3 CC/C=C\COCCOCCC 34a_100000752267_100103147603 [0,2,0,0,0,0|1,0,1]=4 12951 B11R0.3 CC/C=C\COCCOCCC 34a_100016268518_100011215938 [0,2,0,0,0,0|1,0,1]=4 12952 B11R0.3 CC/C=C\COCCOCCC 7a_100000752267_100103147603 [0,2,0,0,0,0|1,0,1]=4 12953 B11R0.3 CC/C=C\COCCOCCCl 34a_100011215305_100103147603 [0,2,0,0,0,0|1,0,1]=4 12954 B11R0.3 CC/C=C\COCCOCCCl 7a_100011215305_100103147603 [0,2,0,0,0,0|1,0,1]=4 12955 B11R0.3 CC/C=C\COCCOCCF 34a_200015357709_100103147603 [0,2,0,0,0,0|1,0,1]=4 12956 B11R0.3 CC/C=C\COCCOCCF 7a_200015357709_100103147603 [0,2,0,0,0,0|1,0,1]=4 12957 B11R0.3 CC/C=C\COCCOCCI 34a_100012149058_100103147603 [0,2,0,0,0,0|1,0,1]=4 12958 B11R0.3 CC/C=C\COCCOCCI 7a_100012149058_100103147603 [0,2,0,0,0,0|1,0,1]=4 12959 B11R0.3 CC/C=C\COCCOCCN 34a_100000211614_100103147603 [0,2,0,0,0,0|1,0,1]=4 12960 B11R0.3 CC/C=C\COCCOCCO 34a_100016268518_100000692535 [0,2,0,0,0,0|1,0,1]=4 12961 B11R0.3 CC/C=C\COCOCCCC 34a_100016268518_100011995733 [0,2,0,0,0,0|2,0,0]=4 12962 B11R0.3 CC/C=C\CSCCCCOC 62a_100000730899_100103147603 [0,2,0,0,0,0|2,0,0]=4 12963 B11R0.3 CC/C=C\CSCCCCOC 62a_100103147603_100000730899 [0,2,0,0,0,0|2,0,0]=4 12964 B11R0.3 CC/C=C\CSCOCCCC 62a_100011995733_100103147603 [0,2,0,0,0,0|2,0,0]=4 12965 B11R0.3 CC/C=C\CSCOCCCC 62a_100103147603_100011995733 [0,2,0,0,0,0|2,0,0]=4 12966 B11R0.3 CC/C=C\CSCOCCOC 62a_100000231047_100103147603 [0,2,0,0,0,0|1,0,0]=3 12967 B11R0.3 CC/C=C\CSCOCCOC 62a_100103147603_100000231047 [0,2,0,0,0,0|1,0,0]=3 12968 B11R0.3 CC=C=CCCOCCCCC 34a_100011020354_100000718602 [0,2,0,0,0,0|2,0,0]=4 12969 B11R0.3 CC=C=CCCOCCCOC 34a_100011020354_100000740836 [0,2,0,0,0,0|1,0,1]=4 12970 B11R0.3 CC=C=CCCOCCOCC 34a_100011020354_100000210147 [0,2,0,0,0,0|1,0,0]=3 12971 B11R0.3 CC=C=CCCOCCSCC 34a_100011020354_100000757381 [0,2,0,0,0,0|1,1,0]=4 12972 B11R0.3 CC=CCCCOCCCCC 34a_100020645299_100000718602 [0,2,0,0,0,0|2,0,0]=4 12973 B11R0.3 CC=CCCCOCCCOC 34a_100020645299_100000740836 [0,2,0,0,0,0|1,0,1]=4 12974 B11R0.3 CC=CCCCOCCOCC 34a_100020645299_100000210147 [0,2,0,0,0,0|1,0,0]=3 12975 B11R0.3 CC=CCCCOCCSCC 34a_100020645299_100000757381 [0,2,0,0,0,0|1,1,0]=4 12976 B11R0.3 CC=CCNCCCCCOC 2230a_100000747528_100000070051 [0,2,0,0,0,0|2,0,0]=4 12977 B11R0.3 CC=CCNCCCCCOC 34a_100000747528_100000070051 [0,2,0,0,0,0|2,0,0]=4 12978 B11R0.3 CC=CCNCCOCCOC 2230a_100000745349_100000070051 [0,2,0,0,0,0|1,0,0]=3 12979 B11R0.3 CC=CCNCCOCCOC 34a_100000745349_100000070051 [0,2,0,0,0,0|1,0,0]=3 12980 B11R0.3 CC=CCOCCCCCCC 34a_100000210272_100000070051 [0,2,0,0,0,0|2,0,0]=4 12981 B11R0.3 CC=CCOCCCCCCC 7a_100000210272_100000070051 [0,2,0,0,0,0|2,0,0]=4 12982 B11R0.3 CC=CCOCCCCCNC 34a_100000722520_100000070051 [0,2,0,0,0,0|2,0,0]=4 12983 B11R0.3 CC=CCOCCOCCCC 34a_100000210238_100000070051 [0,2,0,0,0,0|1,0,0]=3 12984 B11R0.3 CC=CCOCCOCCCC 7a_100000210238_100000070051 [0,2,0,0,0,0|1,0,0]=3 12985 B11R0.3 CC=CCOCCOCCNC 34a_100000228057_100000070051 [0,2,0,0,0,0|1,0,0]=3 12986 B11R0.3 CC=CCOCCOCCOC 34a_100011215163_100000070051 [0,2,0,0,0,0|0,0,0]=2 12987 B11R0.3 CC=CCOCCOCCOC 7a_100011215163_100000070051 [0,2,0,0,0,0|0,0,0]=2 12988 B11R0.3 CC=CCOCCSCCCC 34a_200000230436_100000070051 [0,2,0,0,0,0|1,1,0]=4 12989 B11R0.3 CC=CCOCCSCCCC 7a_200000230436_100000070051 [0,2,0,0,0,0|1,1,0]=4 12990 B11R0.3 CC=CCSCCOCCCC 62a_100000070051_100000743108 [0,2,0,0,0,0|1,1,0]=4 12991 B11R0.3 CC=CCSCCOCCCC 62a_100000743108_100000070051 [0,2,0,0,0,0|1,1,0]=4 12992 B11R0.3 CC=CCSCCOCCOC 62a_100000070051_100000695917 [0,2,0,0,0,0|0,1,0]=3 12993 B11R0.3 CC=CCSCCOCCOC 62a_100000695917_100000070051 [0,2,0,0,0,0|0,1,0]=3 12994 B11R0.3 CCC#CCCCCCCOC 34a_100138415774_200000036426 [0,2,0,0,0,0|2,0,0]=4 12995 B11R0.3 CCC#CCCOCCCCC 34a_100000036655_100000718602 [0,2,0,0,0,0|2,0,0]=4 12996 B11R0.3 CCC#CCCOCCCCC 7a_100000036655_100000210326 [0,2,0,0,0,0|2,0,0]=4 12997 B11R0.3 CCC#CCCOCCCCF 34a_100000036655_100000729493 [0,2,0,0,0,0|2,0,0]=4 12998 B11R0.3 CCC#CCCOCCCCF 7a_100000036655_100000729493 [0,2,0,0,0,0|2,0,0]=4 12999 B11R0.3 CCC#CCCOCCCCO 34a_100000036655_100011216708 [0,2,0,0,0,0|2,0,0]=4 13000 B11R0.3 CCC#CCCOCCCCO 7a_100000036655_100000210776 [0,2,0,0,0,0|2,0,0]=4 13001 B11R0.3 CCC#CCCOCCCOC 34a_100000036655_100000740836 [0,2,0,0,0,0|1,0,0]=3 13002 B11R0.3 CCC#CCCOCCCOC 7a_100000036655_100000740836 [0,2,0,0,0,0|1,0,0]=3 13003 B11R0.3 CCC#CCCOCCOCC 34a_100000036655_100000210147 [0,2,0,0,0,0|1,0,0]=3 13004 B11R0.3 CCC#CCCOCCOCC 7a_100000036655_100011215890 [0,2,0,0,0,0|1,0,0]=3 13005 B11R0.3 CCC#CCCOCCSCC 34a_100000036655_100000757381 [0,2,0,0,0,0|1,1,0]=4 13006 B11R0.3 CCC#CCCOCCSCC 7a_100000036655_100000757381 [0,2,0,0,0,0|1,1,0]=4 13007 B11R0.3 CCC#CCOCCCCOC 34a_100000032950_100000755781 [0,2,0,0,0,0|1,0,1]=4 13008 B11R0.3 CCC#CCOCCCCOC 34a_100000740925_100009813939 [0,2,0,0,0,0|1,0,1]=4 13009 B11R0.3 CCC#CCOCCCOCC 34a_100000032950_100012232248 [0,2,0,0,0,0|1,0,1]=4 13010 B11R0.3 CCC#CCOCCCOCC 34a_100000757476_100009813939 [0,2,0,0,0,0|1,0,1]=4 13011 B11R0.3 CCC#CCOCCCOCC 7a_100000757476_100009813939 [0,2,0,0,0,0|1,0,1]=4 13012 B11R0.3 CCC#CCOCCOCCBr 34a_100000692535_100009813939 [0,2,0,0,0,0|1,0,1]=4 13013 B11R0.3 CCC#CCOCCOCCBr 7a_100000692535_100009813939 [0,2,0,0,0,0|1,0,1]=4 13014 B11R0.3 CCC#CCOCCOCCC 34a_100000032950_100011215938 [0,2,0,0,0,0|1,0,1]=4 13015 B11R0.3 CCC#CCOCCOCCC 34a_100000752267_100009813939 [0,2,0,0,0,0|1,0,1]=4 13016 B11R0.3 CCC#CCOCCOCCC 7a_100000752267_100009813939 [0,2,0,0,0,0|1,0,1]=4 13017 B11R0.3 CCC#CCOCCOCCCl 34a_100011215305_100009813939 [0,2,0,0,0,0|1,0,1]=4 13018 B11R0.3 CCC#CCOCCOCCCl 7a_100011215305_100009813939 [0,2,0,0,0,0|1,0,1]=4 13019 B11R0.3 CCC#CCOCCOCCF 34a_200015357709_100009813939 [0,2,0,0,0,0|1,0,1]=4 13020 B11R0.3 CCC#CCOCCOCCF 7a_200015357709_100009813939 [0,2,0,0,0,0|1,0,1]=4 13021 B11R0.3 CCC#CCOCCOCCI 34a_100012149058_100009813939 [0,2,0,0,0,0|1,0,1]=4 13022 B11R0.3 CCC#CCOCCOCCI 7a_100012149058_100009813939 [0,2,0,0,0,0|1,0,1]=4 13023 B11R0.3 CCC#CCOCCOCCN 34a_100000211614_100009813939 [0,2,0,0,0,0|1,0,1]=4 13024 B11R0.3 CCC#CCOCCOCCO 34a_100000032950_100000692535 [0,2,0,0,0,0|1,0,1]=4 13025 B11R0.3 CCC#CCOCOCCCC 34a_100000032950_100011995733 [0,2,0,0,0,0|2,0,0]=4 13026 B11R0.3 CCC#CCSCCCCOC 62a_100000730899_100009813939 [0,2,0,0,0,0|2,0,0]=4 13027 B11R0.3 CCC#CCSCCCCOC 62a_100009813939_100000730899 [0,2,0,0,0,0|2,0,0]=4 13028 B11R0.3 CCC#CCSCOCCCC 62a_100009813939_100011995733 [0,2,0,0,0,0|2,0,0]=4 13029 B11R0.3 CCC#CCSCOCCCC 62a_100011995733_100009813939 [0,2,0,0,0,0|2,0,0]=4 13030 B11R0.3 CCC#CCSCOCCOC 62a_100000231047_100009813939 [0,2,0,0,0,0|1,0,0]=3 13031 B11R0.3 CCC#CCSCOCCOC 62a_100009813939_100000231047 [0,2,0,0,0,0|1,0,0]=3 13032 B11R0.3 CCC/C=C/COCCCCC 34a_100016278788_100000718602 [0,2,0,0,0,0|2,0,0]=4 13033 B11R0.3 CCC/C=C/COCCCCC 7a_100016278788_100000210326 [0,2,0,0,0,0|2,0,0]=4 13034 B11R0.3 CCC/C=C/COCCCOC 34a_100016278788_100000740836 [0,2,0,0,0,0|1,0,1]=4 13035 B11R0.3 CCC/C=C/COCCCOC 7a_100016278788_100000740836 [0,2,0,0,0,0|1,0,1]=4 13036 B11R0.3 CCC/C=C/COCCOCC 34a_100016278788_100000210147 [0,2,0,0,0,0|1,0,0]=3 13037 B11R0.3 CCC/C=C/COCCOCC 7a_100016278788_100011215890 [0,2,0,0,0,0|1,0,0]=3 13038 B11R0.3 CCC/C=C/COCCSCC 34a_100016278788_100000757381 [0,2,0,0,0,0|1,1,0]=4 13039 B11R0.3 CCC/C=C/COCCSCC 7a_100016278788_100000757381 [0,2,0,0,0,0|1,1,0]=4 13040 B11R0.3 CCCC#CCCOCCCC 34a_100000042726_100000210210 [0,2,0,0,0,0|2,0,0]=4 13041 B11R0.3 CCCC#CCCOCCCC 7a_100000042726_100000210211 [0,2,0,0,0,0|2,0,0]=4 13042 B11R0.3 CCCC#CCCOCCOC 34a_100000042726_100011201679 [0,2,0,0,0,0|1,0,0]=3 13043 B11R0.3 CCCC#CCCOCCOC 7a_100000042726_100000233755 [0,2,0,0,0,0|1,0,0]=3 13044 B11R0.3 CCCC#CCCOCCSC 34a_100000042726_100000212216 [0,2,0,0,0,0|1,1,0]=4 13045 B11R0.3 CCCC#CCCOCCSC 7a_100000042726_100000212216 [0,2,0,0,0,0|1,1,0]=4 13046 B11R0.3 CCCC#CCOCCCCC 34a_100000034806_100000718602 [0,2,0,0,0,0|2,0,0]=4 13047 B11R0.3 CCCC#CCOCCCCC 7a_100000034806_100000210326 [0,2,0,0,0,0|2,0,0]=4 13048 B11R0.3 CCCC#CCOCCCOC 34a_100000034806_100000740836 [0,2,0,0,0,0|1,0,1]=4 13049 B11R0.3 CCCC#CCOCCCOC 7a_100000034806_100000740836 [0,2,0,0,0,0|1,0,1]=4 13050 B11R0.3 CCCC#CCOCCOCC 34a_100000034806_100000210147 [0,2,0,0,0,0|1,0,0]=3 13051 B11R0.3 CCCC#CCOCCOCC 7a_100000034806_100011215890 [0,2,0,0,0,0|1,0,0]=3 13052 B11R0.3 CCCC#CCOCCSCC 34a_100000034806_100000757381 [0,2,0,0,0,0|1,1,0]=4 13053 B11R0.3 CCCC#CCOCCSCC 7a_100000034806_100000757381 [0,2,0,0,0,0|1,1,0]=4 13054 B11R0.3 CCCC/C=C/CCCCOC 34a_200020645093_200000210301 [0,2,0,0,0,0|2,0,0]=4 13055 B11R0.3 CCCC/C=C/CCCCOC 7a_200020645093_200000210301 [0,2,0,0,0,0|2,0,0]=4 13056 B11R0.3 CCCC/C=C/CCCCO[13CH3] 34a_200020645093_200025704644 [0,2,0,0,0,0|2,0,0]=4 13057 B11R0.3 CCCC/C=C/CCCCO[13CH3] 7a_200020645093_200025704644 [0,2,0,0,0,0|2,0,0]=4 13058 B11R0.3 CCCC/C=C/COCCCC 34a_200016272032_100000210210 [0,2,0,0,0,0|2,0,0]=4 13059 B11R0.3 CCCC/C=C/COCCCC 7a_200016272032_100000210211 [0,2,0,0,0,0|2,0,0]=4 13060 B11R0.3 CCCC/C=C/COCCOC 34a_200016272032_100011201679 [0,2,0,0,0,0|1,0,0]=3 13061 B11R0.3 CCCC/C=C/COCCOC 7a_200016272032_100000233755 [0,2,0,0,0,0|1,0,0]=3 13062 B11R0.3 CCCC/C=C/COCCSC 34a_200016272032_100000212216 [0,2,0,0,0,0|1,1,0]=4 13063 B11R0.3 CCCC/C=C/COCCSC 7a_200016272032_100000212216 [0,2,0,0,0,0|1,1,0]=4 13064 B11R0.3 CCCC/C=C\CCOCCC 34a_200016286491_100000210303 [0,2,0,0,0,0|2,0,0]=4 13065 B11R0.3 CCCC/C=C\CCOCCC 7a_200016286491_100000210303 [0,2,0,0,0,0|2,0,0]=4 13066 B11R0.3 CCCC/C=C\CCOCCF 34a_200016286491_100011217306 [0,2,0,0,0,0|2,0,0]=4 13067 B11R0.3 CCCC/C=C\CCOCCF 7a_200016286491_100011217306 [0,2,0,0,0,0|2,0,0]=4 13068 B11R0.3 CCCC/C=C\CCOCCO 34a_200016286491_100000211926 [0,2,0,0,0,0|2,0,0]=4 13069 B11R0.3 CCCC/C=C\CCOCCO 7a_200016286491_100000211926 [0,2,0,0,0,0|2,0,0]=4 13070 B11R0.3 CCCC/C=C\CCOCSC 34a_200016286491_100011218213 [0,2,0,0,0,0|2,0,0]=4 13071 B11R0.3 CCCCC#CCCCCOC 34a_200000066234_200000210301 [0,2,0,0,0,0|2,0,0]=4 13072 B11R0.3 CCCCC#CCCCCOC 7a_200000066234_200000210301 [0,2,0,0,0,0|2,0,0]=4 13073 B11R0.3 CCCCC#CCCCCO[13CH3] 34a_200000066234_200025704644 [0,2,0,0,0,0|2,0,0]=4 13074 B11R0.3 CCCCC#CCCCCO[13CH3] 7a_200000066234_200025704644 [0,2,0,0,0,0|2,0,0]=4 13075 B11R0.3 CCCCC#CCCCOCC 34a_100121572206_200000047210 [0,2,0,0,0,0|2,0,0]=4 13076 B11R0.3 CCCCC#CCCOCCC 34a_100000037610_100000210303 [0,2,0,0,0,0|2,0,0]=4 13077 B11R0.3 CCCCC#CCCOCCC 7a_100000037610_100000210303 [0,2,0,0,0,0|2,0,0]=4 13078 B11R0.3 CCCCC#CCCOCCF 34a_100000037610_100011217306 [0,2,0,0,0,0|2,0,0]=4 13079 B11R0.3 CCCCC#CCCOCCF 7a_100000037610_100011217306 [0,2,0,0,0,0|2,0,0]=4 13080 B11R0.3 CCCCC#CCCOCCO 34a_100000037610_100000211926 [0,2,0,0,0,0|2,0,0]=4 13081 B11R0.3 CCCCC#CCCOCCO 7a_100000037610_100000211926 [0,2,0,0,0,0|2,0,0]=4 13082 B11R0.3 CCCCC#CCCOCSC 34a_100000037610_100011218213 [0,2,0,0,0,0|2,0,0]=4 13083 B11R0.3 CCCCC#CCOCCCC 34a_200000034558_100000210210 [0,2,0,0,0,0|2,0,0]=4 13084 B11R0.3 CCCCC#CCOCCCC 7a_200000034558_100000210211 [0,2,0,0,0,0|2,0,0]=4 13085 B11R0.3 CCCCC#CCOCCOC 34a_200000034558_100011201679 [0,2,0,0,0,0|1,0,0]=3 13086 B11R0.3 CCCCC#CCOCCOC 7a_200000034558_100000233755 [0,2,0,0,0,0|1,0,0]=3 13087 B11R0.3 CCCCC#CCOCCSC 34a_200000034558_100000212216 [0,2,0,0,0,0|1,1,0]=4 13088 B11R0.3 CCCCC#CCOCCSC 7a_200000034558_100000212216 [0,2,0,0,0,0|1,1,0]=4 13089 B11R0.3 CCCCC/C=C\CCCOC 34a_100020655193_200000210301 [0,2,0,0,0,0|2,0,0]=4 13090 B11R0.3 CCCCC/C=C\CCCOC 7a_100020655193_200000210301 [0,2,0,0,0,0|2,0,0]=4 13091 B11R0.3 CCCCC/C=C\CCCO[13CH3] 34a_100020655193_200025704644 [0,2,0,0,0,0|2,0,0]=4 13092 B11R0.3 CCCCC/C=C\CCCO[13CH3] 7a_100020655193_200025704644 [0,2,0,0,0,0|2,0,0]=4 13093 B11R0.3 CCCCC/C=C\CCOCC 34a_100016277358_100000210202 [0,2,0,0,0,0|2,0,0]=4 13094 B11R0.3 CCCCC/C=C\CCOCC 7a_100016277358_100000210202 [0,2,0,0,0,0|2,0,0]=4 13095 B11R0.3 CCCCC/C=C\CCOCF 34a_100016277358_100015361967 [0,2,0,0,0,0|2,0,0]=4 13096 B11R0.3 CCCCC/C=C\CCOCF 7a_100016277358_100015361967 [0,2,0,0,0,0|2,0,0]=4 13097 B11R0.3 CCCCC=NNCCOCC 4a_100000732670_100000210104 [0,2,0,0,0,0|2,0,0]=4 13098 B11R0.3 CCCCCC#CCCOCC 34a_200000042877_100000210202 [0,2,0,0,0,0|2,0,0]=4 13099 B11R0.3 CCCCCC#CCCOCC 7a_200000042877_100000210202 [0,2,0,0,0,0|2,0,0]=4 13100 B11R0.3 CCCCCC#CCCOCF 34a_200000042877_100015361967 [0,2,0,0,0,0|2,0,0]=4 13101 B11R0.3 CCCCCC#CCCOCF 7a_200000042877_100015361967 [0,2,0,0,0,0|2,0,0]=4 13102 B11R0.3 CCCCCC#CCSCOC 62a_100000766300_100009816472 [0,2,0,0,0,0|2,0,0]=4 13103 B11R0.3 CCCCCC#CCSCOC 62a_100009816472_100000766300 [0,2,0,0,0,0|2,0,0]=4 13104 B11R0.3 CCCCCC/C=C/COCC 34a_200016276170_100000210202 [0,2,0,0,0,0|2,0,0]=4 13105 B11R0.3 CCCCCC/C=C/COCC 7a_200016276170_100000210202 [0,2,0,0,0,0|2,0,0]=4 13106 B11R0.3 CCCCCCC#CCCOC 34a_200000033163_200000210301 [0,2,0,0,0,0|2,0,0]=4 13107 B11R0.3 CCCCCCC#CCCOC 7a_200000033163_200000210301 [0,2,0,0,0,0|2,0,0]=4 13108 B11R0.3 CCCCCCC#CCCO[13CH3] 34a_200000033163_200025704644 [0,2,0,0,0,0|2,0,0]=4 13109 B11R0.3 CCCCCCC#CCCO[13CH3] 7a_200000033163_200025704644 [0,2,0,0,0,0|2,0,0]=4 13110 B11R0.3 CCCCCCC#CCOCC 34a_200000037284_100000210202 [0,2,0,0,0,0|2,0,0]=4 13111 B11R0.3 CCCCCCC#CCOCC 7a_200000037284_100000210202 [0,2,0,0,0,0|2,0,0]=4 13112 B11R0.3 CCCCCCCC#CCOC 34a_200000061759_200000210301 [0,2,0,0,0,0|2,0,0]=4 13113 B11R0.3 CCCCCCCC#CCOC 7a_200000061759_200000210301 [0,2,0,0,0,0|2,0,0]=4 13114 B11R0.3 CCCCCCCC#CCO[13CH3] 34a_200000061759_200025704644 [0,2,0,0,0,0|2,0,0]=4 13115 B11R0.3 CCCCCCCC#CCO[13CH3] 7a_200000061759_200025704644 [0,2,0,0,0,0|2,0,0]=4 13116 B11R0.3 CCCCCCCCCCOC 34a_100000210711_200000210301 [0,2,0,0,0,0|2,0,0]=4 13117 B11R0.3 CCCCCCCCCCOC 34a_100138415774_100000210320 [0,2,0,0,0,0|2,0,0]=4 13118 B11R0.3 CCCCCCCCCCOC 7a_100000210711_200000210301 [0,2,0,0,0,0|2,0,0]=4 13119 B11R0.3 CCCCCCCCCCO[13CH3] 34a_100000210711_200025704644 [0,2,0,0,0,0|2,0,0]=4 13120 B11R0.3 CCCCCCCCCCO[13CH3] 7a_100000210711_200025704644 [0,2,0,0,0,0|2,0,0]=4 13121 B11R0.3 CCCCCCCCCOCC 34a_100000210712_100000210202 [0,2,0,0,0,0|2,0,0]=4 13122 B11R0.3 CCCCCCCCCOCC 34a_100121572206_100011214924 [0,2,0,0,0,0|2,0,0]=4 13123 B11R0.3 CCCCCCCCCOCC 7a_100000210712_100000210202 [0,2,0,0,0,0|2,0,0]=4 13124 B11R0.3 CCCCCCCCCOCF 34a_100000210712_100015361967 [0,2,0,0,0,0|2,0,0]=4 13125 B11R0.3 CCCCCCCCCOCF 7a_100000210712_100015361967 [0,2,0,0,0,0|2,0,0]=4 13126 B11R0.3 CCCCCCCCNCOC 2230a_100000229939_100000766300 [0,2,0,0,0,0|2,0,0]=4 13127 B11R0.3 CCCCCCCCOCC#N 7a_100000210232_100011215382 [0,2,0,0,0,0|2,0,0]=4 13128 B11R0.3 CCCCCCCCOCC=O 34a_100000210232_200009817547 [0,2,0,0,0,0|2,0,0]=4 13129 B11R0.3 CCCCCCCCOCC=O 7a_100000210232_200015260668 [0,2,0,0,0,0|2,0,0]=4 13130 B11R0.3 CCCCCCCCOCCBr 34a_100000211926_100000210759 [0,2,0,0,0,0|2,0,0]=4 13131 B11R0.3 CCCCCCCCOCCC 34a_100000210232_100000210303 [0,2,0,0,0,0|2,0,0]=4 13132 B11R0.3 CCCCCCCCOCCC 34a_100000210258_100000210759 [0,2,0,0,0,0|2,0,0]=4 13133 B11R0.3 CCCCCCCCOCCC 7a_100000210232_100000210303 [0,2,0,0,0,0|2,0,0]=4 13134 B11R0.3 CCCCCCCCOCCF 34a_100000210232_100011217306 [0,2,0,0,0,0|2,0,0]=4 13135 B11R0.3 CCCCCCCCOCCF 7a_100000210232_100011217306 [0,2,0,0,0,0|2,0,0]=4 13136 B11R0.3 CCCCCCCCOCCN 34a_100000210304_100000210759 [0,2,0,0,0,0|2,0,0]=4 13137 B11R0.3 CCCCCCCCOCCO 34a_100000210232_100000211926 [0,2,0,0,0,0|2,0,0]=4 13138 B11R0.3 CCCCCCCCOCCO 7a_100000210232_100000211926 [0,2,0,0,0,0|2,0,0]=4 13139 B11R0.3 CCCCCCCCOCSC 34a_100000210232_100011218213 [0,2,0,0,0,0|2,0,0]=4 13140 B11R0.3 CCCCCCCCSCOC 62a_100000210759_100000766300 [0,2,0,0,0,0|2,0,0]=4 13141 B11R0.3 CCCCCCCCSCOC 62a_100000766300_100000210317 [0,2,0,0,0,0|2,0,0]=4 13142 B11R0.3 CCCCCCCNCCOC 2230a_100000209980_100000210681 [0,2,0,0,0,0|2,0,0]=4 13143 B11R0.3 CCCCCCCNCCOC 2230a_100000229938_100011201679 [0,2,0,0,0,0|2,0,0]=4 13144 B11R0.3 CCCCCCCOCCC#N 7a_100000210272_100000184422 [0,2,0,0,0,0|2,0,0]=4 13145 B11R0.3 CCCCCCCOCCCBr 34a_100011217188_100000210614 [0,2,0,0,0,0|2,0,0]=4 13146 B11R0.3 CCCCCCCOCCCC 34a_100000210227_100000210614 [0,2,0,0,0,0|2,0,0]=4 13147 B11R0.3 CCCCCCCOCCCC 34a_100000210272_100000210210 [0,2,0,0,0,0|2,0,0]=4 13148 B11R0.3 CCCCCCCOCCCC 7a_100000210227_100000210614 [0,2,0,0,0,0|2,0,0]=4 13149 B11R0.3 CCCCCCCOCCCC 7a_100000210272_100000210211 [0,2,0,0,0,0|2,0,0]=4 13150 B11R0.3 CCCCCCCOCCCCl 34a_100000230001_100000210614 [0,2,0,0,0,0|2,0,0]=4 13151 B11R0.3 CCCCCCCOCCCF 34a_100000210272_100011934791 [0,2,0,0,0,0|2,0,0]=4 13152 B11R0.3 CCCCCCCOCCCF 34a_100000759539_100000210614 [0,2,0,0,0,0|2,0,0]=4 13153 B11R0.3 CCCCCCCOCCCF 7a_100000210272_100011934791 [0,2,0,0,0,0|2,0,0]=4 13154 B11R0.3 CCCCCCCOCCCN 34a_100000182051_100000210614 [0,2,0,0,0,0|2,0,0]=4 13155 B11R0.3 CCCCCCCOCCCO 34a_100000210272_100000230001 [0,2,0,0,0,0|2,0,0]=4 13156 B11R0.3 CCCCCCCOCCCO 7a_100000210272_100011215043 [0,2,0,0,0,0|2,0,0]=4 13157 B11R0.3 CCCCCCCOCCOC 34a_100000210237_100000210614 [0,2,0,0,0,0|1,0,0]=3 13158 B11R0.3 CCCCCCCOCCOC 34a_100000210272_100011201679 [0,2,0,0,0,0|1,0,0]=3 13159 B11R0.3 CCCCCCCOCCOC 7a_100000210272_100000233755 [0,2,0,0,0,0|1,0,0]=3 13160 B11R0.3 CCCCCCCOCCON 34a_100000700252_100000210614 [0,2,0,0,0,0|2,0,0]=4 13161 B11R0.3 CCCCCCCOCCSC 34a_100000210272_100000212216 [0,2,0,0,0,0|1,1,0]=4 13162 B11R0.3 CCCCCCCOCCSC 34a_100000230434_100000210614 [0,2,0,0,0,0|1,1,0]=4 13163 B11R0.3 CCCCCCCOCCSC 7a_100000210272_100000212216 [0,2,0,0,0,0|1,1,0]=4 13164 B11R0.3 CCCCCCCOCCSC 7a_100000230434_100000210614 [0,2,0,0,0,0|1,1,0]=4 13165 B11R0.3 CCCCCCCSCCOC 62a_100000210614_100000233755 [0,2,0,0,0,0|1,1,0]=4 13166 B11R0.3 CCCCCCCSCCOC 62a_100000233755_100000210316 [0,2,0,0,0,0|1,1,0]=4 13167 B11R0.3 CCCCCCCSCOCC 62a_100000210614_100000739092 [0,2,0,0,0,0|2,0,0]=4 13168 B11R0.3 CCCCCCCSCOCC 62a_100000739092_100000210316 [0,2,0,0,0,0|2,0,0]=4 13169 B11R0.3 CCCCCCNCCCOC 2230a_100000210581_100000740836 [0,2,0,0,0,0|2,0,0]=4 13170 B11R0.3 CCCCCCNCCCOC 34a_100150723488_100000210314 [0,2,0,0,0,0|2,0,0]=4 13171 B11R0.3 CCCCCCNCCOCC 2230a_100000210581_100011215890 [0,2,0,0,0,0|2,0,0]=4 13172 B11R0.3 CCCCCCNCCOCC 2230a_102516460346_100000210314 [0,2,0,0,0,0|2,0,0]=4 13173 B11R0.3 CCCCCCNCCOCC 34a_102516460346_100000210314 [0,2,0,0,0,0|2,0,0]=4 13174 B11R0.3 CCCCCCOCCCCBr 34a_100011216708_100000210314 [0,2,0,0,0,0|2,0,0]=4 13175 B11R0.3 CCCCCCOCCCCC 34a_100000210253_100000210314 [0,2,0,0,0,0|2,0,0]=4 13176 B11R0.3 CCCCCCOCCCCC 34a_100000210259_100000718602 [0,2,0,0,0,0|2,0,0]=4 13177 B11R0.3 CCCCCCOCCCCC 7a_100000210253_100000210314 [0,2,0,0,0,0|2,0,0]=4 13178 B11R0.3 CCCCCCOCCCCC 7a_100000210259_100000210326 [0,2,0,0,0,0|2,0,0]=4 13179 B11R0.3 CCCCCCOCCCCCl 34a_100000210776_100000210314 [0,2,0,0,0,0|2,0,0]=4 13180 B11R0.3 CCCCCCOCCCCCl 7a_100000210776_100000210314 [0,2,0,0,0,0|2,0,0]=4 13181 B11R0.3 CCCCCCOCCCCF 34a_100000210259_100000729493 [0,2,0,0,0,0|2,0,0]=4 13182 B11R0.3 CCCCCCOCCCCF 34a_100011995726_100000210314 [0,2,0,0,0,0|2,0,0]=4 13183 B11R0.3 CCCCCCOCCCCF 7a_100000210259_100000729493 [0,2,0,0,0,0|2,0,0]=4 13184 B11R0.3 CCCCCCOCCCCF 7a_100011995726_100000210314 [0,2,0,0,0,0|2,0,0]=4 13185 B11R0.3 CCCCCCOCCCCI 34a_200012148704_100000210314 [0,2,0,0,0,0|2,0,0]=4 13186 B11R0.3 CCCCCCOCCCCN 34a_100000750430_100000210314 [0,2,0,0,0,0|2,0,0]=4 13187 B11R0.3 CCCCCCOCCCCO 34a_100000210259_100011216708 [0,2,0,0,0,0|2,0,0]=4 13188 B11R0.3 CCCCCCOCCCCO 7a_100000210259_100000210776 [0,2,0,0,0,0|2,0,0]=4 13189 B11R0.3 CCCCCCOCCCNC 34a_100000213112_100000210314 [0,2,0,0,0,0|2,0,0]=4 13190 B11R0.3 CCCCCCOCCCOC 34a_100000210259_100000740836 [0,2,0,0,0,0|1,0,0]=3 13191 B11R0.3 CCCCCCOCCCOC 34a_100000740835_100000210314 [0,2,0,0,0,0|1,0,0]=3 13192 B11R0.3 CCCCCCOCCCOC 7a_100000210259_100000740836 [0,2,0,0,0,0|1,0,0]=3 13193 B11R0.3 CCCCCCOCCCSC 34a_100000690336_100000210314 [0,2,0,0,0,0|1,1,0]=4 13194 B11R0.3 CCCCCCOCCCSC 7a_100000690336_100000210314 [0,2,0,0,0,0|1,1,0]=4 13195 B11R0.3 CCCCCCOCCOCC 34a_100000210136_100000210314 [0,2,0,0,0,0|1,0,0]=3 13196 B11R0.3 CCCCCCOCCOCC 34a_100000210259_100000210147 [0,2,0,0,0,0|1,0,0]=3 13197 B11R0.3 CCCCCCOCCOCC 34a_100000691444_100000210202 [0,2,0,0,0,0|1,0,0]=3 13198 B11R0.3 CCCCCCOCCOCC 7a_100000210136_100000210314 [0,2,0,0,0,0|1,0,0]=3 13199 B11R0.3 CCCCCCOCCOCC 7a_100000210259_100011215890 [0,2,0,0,0,0|1,0,0]=3 13200 B11R0.3 CCCCCCOCCOCC 7a_100000691444_100000210202 [0,2,0,0,0,0|1,0,0]=3 13201 B11R0.3 CCCCCCOCCOCF 34a_100000691444_100015361967 [0,2,0,0,0,0|1,0,0]=3 13202 B11R0.3 CCCCCCOCCOCF 7a_100000691444_100015361967 [0,2,0,0,0,0|1,0,0]=3 13203 B11R0.3 CCCCCCOCCSCC 34a_100000210259_100000757381 [0,2,0,0,0,0|1,1,0]=4 13204 B11R0.3 CCCCCCOCCSCC 34a_100000212035_100000210314 [0,2,0,0,0,0|1,1,0]=4 13205 B11R0.3 CCCCCCOCCSCC 7a_100000210259_100000757381 [0,2,0,0,0,0|1,1,0]=4 13206 B11R0.3 CCCCCCOCCSCC 7a_100000212035_100000210314 [0,2,0,0,0,0|1,1,0]=4 13207 B11R0.3 CCCCCCSCCCOC 62a_100000210314_100000709357 [0,2,0,0,0,0|1,1,0]=4 13208 B11R0.3 CCCCCCSCCCOC 62a_100000709357_100000210757 [0,2,0,0,0,0|1,1,0]=4 13209 B11R0.3 CCCCCCSCCOCC 62a_100000210147_100000210757 [0,2,0,0,0,0|1,1,0]=4 13210 B11R0.3 CCCCCCSCCOCC 62a_100000210314_100011215890 [0,2,0,0,0,0|1,1,0]=4 13211 B11R0.3 CCCCCNCCCCOC 2230a_100000209983_100000730899 [0,2,0,0,0,0|2,0,0]=4 13212 B11R0.3 CCCCCNCCCOCC 2230a_100000209983_100012232248 [0,2,0,0,0,0|2,0,0]=4 13213 B11R0.3 CCCCCNCCCOCC 2230a_100000210961_100000210326 [0,2,0,0,0,0|2,0,0]=4 13214 B11R0.3 CCCCCNCCCOCC 34a_100000210961_100000718602 [0,2,0,0,0,0|2,0,0]=4 13215 B11R0.3 CCCCCNCCOCC#N 2230a_100000209983_200000047693 [0,2,0,0,0,0|2,0,0]=4 13216 B11R0.3 CCCCCNCCOCC=O 34a_100000224656_200009817547 [0,2,0,0,0,0|2,0,0]=4 13217 B11R0.3 CCCCCNCCOCCC 2230a_100000209983_100011215938 [0,2,0,0,0,0|2,0,0]=4 13218 B11R0.3 CCCCCNCCOCCC 2230a_100161115042_100000210326 [0,2,0,0,0,0|2,0,0]=4 13219 B11R0.3 CCCCCNCCOCCC 34a_100000224656_100000210303 [0,2,0,0,0,0|2,0,0]=4 13220 B11R0.3 CCCCCNCCOCCC 34a_100161115042_100000718602 [0,2,0,0,0,0|2,0,0]=4 13221 B11R0.3 CCCCCNCCOCCF 34a_100000224656_100011217306 [0,2,0,0,0,0|2,0,0]=4 13222 B11R0.3 CCCCCNCCOCCO 2230a_100000209983_100011215305 [0,2,0,0,0,0|2,0,0]=4 13223 B11R0.3 CCCCCNCCOCCO 2230a_100000211614_100000210326 [0,2,0,0,0,0|2,0,0]=4 13224 B11R0.3 CCCCCNCCOCCO 34a_100000211614_100000718602 [0,2,0,0,0,0|2,0,0]=4 13225 B11R0.3 CCCCCNCCOCCO 34a_100000224656_100000211926 [0,2,0,0,0,0|2,0,0]=4 13226 B11R0.3 CCCCCNCCOCSC 34a_100000224656_100011218213 [0,2,0,0,0,0|2,0,0]=4 13227 B11R0.3 CCCCCNCOCCCC 2230a_100000209983_100011995733 [0,2,0,0,0,0|2,0,0]=4 13228 B11R0.3 CCCCCNCOCCOC 2230a_100000209983_100000231047 [0,2,0,0,0,0|1,0,0]=3 13229 B11R0.3 CCCCCOCCCCC#N 7a_100000210253_100000211819 [0,2,0,0,0,0|2,0,0]=4 13230 B11R0.3 CCCCCOCCCCC=O 7a_100000210253_100000139335 [0,2,0,0,0,0|2,0,0]=4 13231 B11R0.3 CCCCCOCCCCCBr 34a_100000746331_100000718602 [0,2,0,0,0,0|2,0,0]=4 13232 B11R0.3 CCCCCOCCCCCBr 7a_100000746331_100000210326 [0,2,0,0,0,0|2,0,0]=4 13233 B11R0.3 CCCCCOCCCCCCl 34a_100000746330_100000718602 [0,2,0,0,0,0|2,0,0]=4 13234 B11R0.3 CCCCCOCCCCCCl 7a_100000746330_100000210326 [0,2,0,0,0,0|2,0,0]=4 13235 B11R0.3 CCCCCOCCCCCF 34a_100000210253_100000729378 [0,2,0,0,0,0|2,0,0]=4 13236 B11R0.3 CCCCCOCCCCCF 7a_100000210253_100000729378 [0,2,0,0,0,0|2,0,0]=4 13237 B11R0.3 CCCCCOCCCCCI 34a_200012148887_100000718602 [0,2,0,0,0,0|2,0,0]=4 13238 B11R0.3 CCCCCOCCCCCI 7a_200012148887_100000210326 [0,2,0,0,0,0|2,0,0]=4 13239 B11R0.3 CCCCCOCCCCCN 34a_100000762737_100000718602 [0,2,0,0,0,0|2,0,0]=4 13240 B11R0.3 CCCCCOCCCCCO 34a_100000210253_100000746330 [0,2,0,0,0,0|2,0,0]=4 13241 B11R0.3 CCCCCOCCCCCO 7a_100000210253_100000746330 [0,2,0,0,0,0|2,0,0]=4 13242 B11R0.3 CCCCCOCCCCOC 34a_100000210253_100000755781 [0,2,0,0,0,0|1,0,0]=3 13243 B11R0.3 CCCCCOCCCCOC 34a_100000740925_100000718602 [0,2,0,0,0,0|1,0,0]=3 13244 B11R0.3 CCCCCOCCCCOC 7a_100000210253_100000730899 [0,2,0,0,0,0|1,0,0]=3 13245 B11R0.3 CCCCCOCCCCSC 34a_100011217163_100000718602 [0,2,0,0,0,0|1,1,0]=4 13246 B11R0.3 CCCCCOCCCCSC 7a_100011217163_100000210326 [0,2,0,0,0,0|1,1,0]=4 13247 B11R0.3 CCCCCOCCCOCC 34a_100000210253_100012232248 [0,2,0,0,0,0|1,0,0]=3 13248 B11R0.3 CCCCCOCCCOCC 34a_100000757476_100000718602 [0,2,0,0,0,0|1,0,0]=3 13249 B11R0.3 CCCCCOCCCOCC 7a_100000210253_100012232248 [0,2,0,0,0,0|1,0,0]=3 13250 B11R0.3 CCCCCOCCCOCC 7a_100000757476_100000210326 [0,2,0,0,0,0|1,0,0]=3 13251 B11R0.3 CCCCCOCCCSCC 34a_100011216438_100000718602 [0,2,0,0,0,0|1,1,0]=4 13252 B11R0.3 CCCCCOCCCSCC 7a_100011216438_100000210326 [0,2,0,0,0,0|1,1,0]=4 13253 B11R0.3 CCCCCOCCOCC#N 7a_100000210253_200000047693 [0,2,0,0,0,0|1,0,0]=3 13254 B11R0.3 CCCCCOCCOCC#N 7a_100011215259_100011215382 [0,2,0,0,0,0|1,0,0]=3 13255 B11R0.3 CCCCCOCCOCC=O 34a_100011215259_200009817547 [0,2,0,0,0,0|1,0,0]=3 13256 B11R0.3 CCCCCOCCOCC=O 7a_100011215259_200015260668 [0,2,0,0,0,0|1,0,0]=3 13257 B11R0.3 CCCCCOCCOCCBr 34a_100000692535_100000718602 [0,2,0,0,0,0|1,0,0]=3 13258 B11R0.3 CCCCCOCCOCCBr 7a_100000692535_100000210326 [0,2,0,0,0,0|1,0,0]=3 13259 B11R0.3 CCCCCOCCOCCC 34a_100000210253_100011215938 [0,2,0,0,0,0|1,0,0]=3 13260 B11R0.3 CCCCCOCCOCCC 34a_100000752267_100000718602 [0,2,0,0,0,0|1,0,0]=3 13261 B11R0.3 CCCCCOCCOCCC 34a_100011215259_100000210303 [0,2,0,0,0,0|1,0,0]=3 13262 B11R0.3 CCCCCOCCOCCC 7a_100000210253_100011215938 [0,2,0,0,0,0|1,0,0]=3 13263 B11R0.3 CCCCCOCCOCCC 7a_100000752267_100000210326 [0,2,0,0,0,0|1,0,0]=3 13264 B11R0.3 CCCCCOCCOCCC 7a_100011215259_100000210303 [0,2,0,0,0,0|1,0,0]=3 13265 B11R0.3 CCCCCOCCOCCCl 34a_100011215305_100000718602 [0,2,0,0,0,0|1,0,0]=3 13266 B11R0.3 CCCCCOCCOCCCl 7a_100011215305_100000210326 [0,2,0,0,0,0|1,0,0]=3 13267 B11R0.3 CCCCCOCCOCCF 34a_100011215259_100011217306 [0,2,0,0,0,0|1,0,0]=3 13268 B11R0.3 CCCCCOCCOCCF 34a_200015357709_100000718602 [0,2,0,0,0,0|1,0,0]=3 13269 B11R0.3 CCCCCOCCOCCF 7a_100011215259_100011217306 [0,2,0,0,0,0|1,0,0]=3 13270 B11R0.3 CCCCCOCCOCCF 7a_200015357709_100000210326 [0,2,0,0,0,0|1,0,0]=3 13271 B11R0.3 CCCCCOCCOCCI 34a_100012149058_100000718602 [0,2,0,0,0,0|1,0,0]=3 13272 B11R0.3 CCCCCOCCOCCI 7a_100012149058_100000210326 [0,2,0,0,0,0|1,0,0]=3 13273 B11R0.3 CCCCCOCCOCCN 34a_100000211614_100000718602 [0,2,0,0,0,0|1,0,0]=3 13274 B11R0.3 CCCCCOCCOCCO 34a_100000210253_100000692535 [0,2,0,0,0,0|1,0,0]=3 13275 B11R0.3 CCCCCOCCOCCO 34a_100011215259_100000211926 [0,2,0,0,0,0|1,0,0]=3 13276 B11R0.3 CCCCCOCCOCCO 7a_100000210253_100011215305 [0,2,0,0,0,0|1,0,0]=3 13277 B11R0.3 CCCCCOCCOCCO 7a_100011215259_100000211926 [0,2,0,0,0,0|1,0,0]=3 13278 B11R0.3 CCCCCOCCOCSC 34a_100011215259_100011218213 [0,2,0,0,0,0|1,0,0]=3 13279 B11R0.3 CCCCCOCCSCCC 34a_200000230433_100000718602 [0,2,0,0,0,0|1,1,0]=4 13280 B11R0.3 CCCCCOCCSCCC 7a_200000230433_100000210326 [0,2,0,0,0,0|1,1,0]=4 13281 B11R0.3 CCCCCOCOCCCC 34a_100000210253_100011995733 [0,2,0,0,0,0|2,0,0]=4 13282 B11R0.3 CCCCCSCCCCOC 62a_100000210326_100000730899 [0,2,0,0,0,0|1,1,0]=4 13283 B11R0.3 CCCCCSCCCCOC 62a_100000730899_100000210326 [0,2,0,0,0,0|1,1,0]=4 13284 B11R0.3 CCCCCSCCCOCC 62a_100000210326_100012232248 [0,2,0,0,0,0|1,1,0]=4 13285 B11R0.3 CCCCCSCCCOCC 62a_100012232248_100000210326 [0,2,0,0,0,0|1,1,0]=4 13286 B11R0.3 CCCCCSCCOCC#N 62a_100000210326_200000047693 [0,2,0,0,0,0|1,1,0]=4 13287 B11R0.3 CCCCCSCCOCC#N 62a_200000047693_100000210326 [0,2,0,0,0,0|1,1,0]=4 13288 B11R0.3 CCCCCSCCOCCC 62a_100000210326_100011215938 [0,2,0,0,0,0|1,1,0]=4 13289 B11R0.3 CCCCCSCCOCCC 62a_100011215938_100000210326 [0,2,0,0,0,0|1,1,0]=4 13290 B11R0.3 CCCCCSCCOCCO 62a_100000210326_100011215305 [0,2,0,0,0,0|1,1,0]=4 13291 B11R0.3 CCCCCSCCOCCO 62a_100011215305_100000210326 [0,2,0,0,0,0|1,1,0]=4 13292 B11R0.3 CCCCCSCOCCCC 62a_100000210326_100011995733 [0,2,0,0,0,0|2,0,0]=4 13293 B11R0.3 CCCCCSCOCCCC 62a_100011995733_100000210326 [0,2,0,0,0,0|2,0,0]=4 13294 B11R0.3 CCCCCSCOCCOC 62a_100000210326_100000231047 [0,2,0,0,0,0|1,0,0]=3 13295 B11R0.3 CCCCCSCOCCOC 62a_100000231047_100000210326 [0,2,0,0,0,0|1,0,0]=3 13296 B11R0.3 CCCCNCCCCCOC 2230a_100000747528_100000210211 [0,2,0,0,0,0|2,0,0]=4 13297 B11R0.3 CCCCNCCCCCOC 34a_100000747528_100000210210 [0,2,0,0,0,0|2,0,0]=4 13298 B11R0.3 CCCCNCCCCOCC 34a_200011216965_100000210202 [0,2,0,0,0,0|2,0,0]=4 13299 B11R0.3 CCCCNCCCCOCF 34a_200011216965_100015361967 [0,2,0,0,0,0|2,0,0]=4 13300 B11R0.3 CCCCNCCCOCCC 2230a_100011217757_100000210211 [0,2,0,0,0,0|2,0,0]=4 13301 B11R0.3 CCCCNCCCOCCC 34a_100011217757_100000210210 [0,2,0,0,0,0|2,0,0]=4 13302 B11R0.3 CCCCNCCOCCCC 2230a_100000102301_100000743108 [0,2,0,0,0,0|2,0,0]=4 13303 B11R0.3 CCCCNCCOCCCC 7a_106832991798_100000743108 [0,2,0,0,0,0|2,0,0]=4 13304 B11R0.3 CCCCNCCOCCOC 2230a_100000102301_100000695917 [0,2,0,0,0,0|1,0,0]=3 13305 B11R0.3 CCCCNCCOCCOC 2230a_100000745349_100000210211 [0,2,0,0,0,0|1,0,0]=3 13306 B11R0.3 CCCCNCCOCCOC 34a_100000745349_100000210210 [0,2,0,0,0,0|1,0,0]=3 13307 B11R0.3 CCCCNCCOCCOC 7a_106832991798_100000695917 [0,2,0,0,0,0|1,0,0]=3 13308 B11R0.3 CCCCOCCCCCC#N 7a_100000210227_100009813376 [0,2,0,0,0,0|2,0,0]=4 13309 B11R0.3 CCCCOCCCCCC=O 7a_100000210227_100000139337 [0,2,0,0,0,0|2,0,0]=4 13310 B11R0.3 CCCCOCCCCCCBr 34a_100011215345_100000210210 [0,2,0,0,0,0|2,0,0]=4 13311 B11R0.3 CCCCOCCCCCCBr 7a_100011215345_100000210211 [0,2,0,0,0,0|2,0,0]=4 13312 B11R0.3 CCCCOCCCCCCCl 34a_100000766143_100000210210 [0,2,0,0,0,0|2,0,0]=4 13313 B11R0.3 CCCCOCCCCCCCl 7a_100000766143_100000210211 [0,2,0,0,0,0|2,0,0]=4 13314 B11R0.3 CCCCOCCCCCCF 34a_100000210227_100015922095 [0,2,0,0,0,0|2,0,0]=4 13315 B11R0.3 CCCCOCCCCCCF 34a_100000732779_100000210210 [0,2,0,0,0,0|2,0,0]=4 13316 B11R0.3 CCCCOCCCCCCF 7a_100000210227_100015922095 [0,2,0,0,0,0|2,0,0]=4 13317 B11R0.3 CCCCOCCCCCCF 7a_100000732779_100000210211 [0,2,0,0,0,0|2,0,0]=4 13318 B11R0.3 CCCCOCCCCCCN 34a_100000686447_100000210210 [0,2,0,0,0,0|2,0,0]=4 13319 B11R0.3 CCCCOCCCCCCO 34a_100000210227_100000766143 [0,2,0,0,0,0|2,0,0]=4 13320 B11R0.3 CCCCOCCCCCCO 7a_100000210227_100000766143 [0,2,0,0,0,0|2,0,0]=4 13321 B11R0.3 CCCCOCCCCCNC 34a_100000722520_100000210210 [0,2,0,0,0,0|2,0,0]=4 13322 B11R0.3 CCCCOCCCCOCC 34a_200000760531_100000210202 [0,2,0,0,0,0|1,0,0]=3 13323 B11R0.3 CCCCOCCCCOCC 7a_200000760531_100000210202 [0,2,0,0,0,0|1,0,0]=3 13324 B11R0.3 CCCCOCCCCOCF 34a_200000760531_100015361967 [0,2,0,0,0,0|2,0,0]=4 13325 B11R0.3 CCCCOCCCCOCF 7a_200000760531_100015361967 [0,2,0,0,0,0|2,0,0]=4 13326 B11R0.3 CCCCOCCCNCCC 2230a_200000211371_100000210303 [0,2,0,0,0,0|2,0,0]=4 13327 B11R0.3 CCCCOCCCNCCC 34a_200000211371_100000210303 [0,2,0,0,0,0|2,0,0]=4 13328 B11R0.3 CCCCOCCCNCCF 2230a_200000211371_100011217306 [0,2,0,0,0,0|2,0,0]=4 13329 B11R0.3 CCCCOCCCNCCF 34a_200000211371_100011217306 [0,2,0,0,0,0|2,0,0]=4 13330 B11R0.3 CCCCOCCCNCCO 2230a_200000211371_100000211926 [0,2,0,0,0,0|2,0,0]=4 13331 B11R0.3 CCCCOCCCNCCO 34a_200000211371_100000211926 [0,2,0,0,0,0|2,0,0]=4 13332 B11R0.3 CCCCOCCCNCOC 2230a_200000211371_100000766300 [0,2,0,0,0,0|2,0,0]=4 13333 B11R0.3 CCCCOCCCNCSC 2230a_200000211371_100011218213 [0,2,0,0,0,0|2,0,0]=4 13334 B11R0.3 CCCCOCCCNCSC 34a_200000211371_100011218213 [0,2,0,0,0,0|2,0,0]=4 13335 B11R0.3 CCCCOCCCOCC#N 7a_200011215613_100011215382 [0,2,0,0,0,0|1,0,1]=4 13336 B11R0.3 CCCCOCCCOCC=O 34a_200011215613_200009817547 [0,2,0,0,0,0|1,0,1]=4 13337 B11R0.3 CCCCOCCCOCC=O 7a_200011215613_200015260668 [0,2,0,0,0,0|1,0,1]=4 13338 B11R0.3 CCCCOCCCOCCC 34a_200011215613_100000210303 [0,2,0,0,0,0|1,0,0]=3 13339 B11R0.3 CCCCOCCCOCCC 7a_200011215613_100000210303 [0,2,0,0,0,0|1,0,0]=3 13340 B11R0.3 CCCCOCCCOCCF 34a_200011215613_100011217306 [0,2,0,0,0,0|1,0,0]=3 13341 B11R0.3 CCCCOCCCOCCF 7a_200011215613_100011217306 [0,2,0,0,0,0|1,0,0]=3 13342 B11R0.3 CCCCOCCCOCCO 34a_200011215613_100000211926 [0,2,0,0,0,0|1,0,0]=3 13343 B11R0.3 CCCCOCCCOCCO 7a_200011215613_100000211926 [0,2,0,0,0,0|1,0,0]=3 13344 B11R0.3 CCCCOCCCOCSC 34a_200011215613_100011218213 [0,2,0,0,0,0|1,0,0]=3 13345 B11R0.3 CCCCOCCNCCCF 2230a_100015189416_100000743108 [0,2,0,0,0,0|2,0,0]=4 13346 B11R0.3 CCCCOCCNCCCF 34a_100015189416_100000743108 [0,2,0,0,0,0|2,0,0]=4 13347 B11R0.3 CCCCOCCNCCOC 2230a_100000209980_100000743108 [0,2,0,0,0,0|1,0,0]=3 13348 B11R0.3 CCCCOCCNCCSC 2230a_100020590264_100000743108 [0,2,0,0,0,0|1,1,0]=4 13349 B11R0.3 CCCCOCCOCCC#N 7a_100000210238_100000184422 [0,2,0,0,0,0|1,0,0]=3 13350 B11R0.3 CCCCOCCOCCCBr 34a_100011217188_100000743108 [0,2,0,0,0,0|1,0,0]=3 13351 B11R0.3 CCCCOCCOCCCC 34a_100000210227_100000743108 [0,2,0,0,0,0|1,0,0]=3 13352 B11R0.3 CCCCOCCOCCCC 34a_100000210238_100000210210 [0,2,0,0,0,0|1,0,0]=3 13353 B11R0.3 CCCCOCCOCCCC 7a_100000210227_100000743108 [0,2,0,0,0,0|1,0,0]=3 13354 B11R0.3 CCCCOCCOCCCC 7a_100000210238_100000210211 [0,2,0,0,0,0|1,0,0]=3 13355 B11R0.3 CCCCOCCOCCCCl 34a_100000230001_100000743108 [0,2,0,0,0,0|1,0,0]=3 13356 B11R0.3 CCCCOCCOCCCF 34a_100000210238_100011934791 [0,2,0,0,0,0|1,0,0]=3 13357 B11R0.3 CCCCOCCOCCCF 34a_100000759539_100000743108 [0,2,0,0,0,0|1,0,0]=3 13358 B11R0.3 CCCCOCCOCCCF 7a_100000210238_100011934791 [0,2,0,0,0,0|1,0,0]=3 13359 B11R0.3 CCCCOCCOCCCN 34a_100000182051_100000743108 [0,2,0,0,0,0|1,0,0]=3 13360 B11R0.3 CCCCOCCOCCCO 34a_100000210238_100000230001 [0,2,0,0,0,0|1,0,0]=3 13361 B11R0.3 CCCCOCCOCCCO 7a_100000210238_100011215043 [0,2,0,0,0,0|1,0,0]=3 13362 B11R0.3 CCCCOCCOCCNC 34a_100000228057_100000210210 [0,2,0,0,0,0|1,0,0]=3 13363 B11R0.3 CCCCOCCOCCOC 34a_100000210227_100000695917 [0,2,0,0,0,0|0,0,0]=2 13364 B11R0.3 CCCCOCCOCCOC 34a_100000210237_100000743108 [0,2,0,0,0,0|0,0,0]=2 13365 B11R0.3 CCCCOCCOCCOC 34a_100000210238_100011201679 [0,2,0,0,0,0|0,0,0]=2 13366 B11R0.3 CCCCOCCOCCOC 34a_100011215163_100000210210 [0,2,0,0,0,0|0,0,0]=2 13367 B11R0.3 CCCCOCCOCCOC 34a_100011215186_200000210301 [0,2,0,0,0,0|0,0,0]=2 13368 B11R0.3 CCCCOCCOCCOC 7a_100000210227_100000695917 [0,2,0,0,0,0|0,0,0]=2 13369 B11R0.3 CCCCOCCOCCOC 7a_100000210238_100000233755 [0,2,0,0,0,0|0,0,0]=2 13370 B11R0.3 CCCCOCCOCCOC 7a_100011215163_100000210211 [0,2,0,0,0,0|0,0,0]=2 13371 B11R0.3 CCCCOCCOCCOC 7a_100011215186_200000210301 [0,2,0,0,0,0|0,0,0]=2 13372 B11R0.3 CCCCOCCOCCON 34a_100000700252_100000743108 [0,2,0,0,0,0|1,0,0]=3 13373 B11R0.3 CCCCOCCOCCO[13CH3] 34a_100011215186_200025704644 [0,2,0,0,0,0|0,0,0]=2 13374 B11R0.3 CCCCOCCOCCO[13CH3] 7a_100011215186_200025704644 [0,2,0,0,0,0|0,0,0]=2 13375 B11R0.3 CCCCOCCOCCSC 34a_100000210238_100000212216 [0,2,0,0,0,0|0,1,0]=3 13376 B11R0.3 CCCCOCCOCCSC 34a_100000230434_100000743108 [0,2,0,0,0,0|0,1,0]=3 13377 B11R0.3 CCCCOCCOCCSC 7a_100000210238_100000212216 [0,2,0,0,0,0|0,1,0]=3 13378 B11R0.3 CCCCOCCOCCSC 7a_100000230434_100000743108 [0,2,0,0,0,0|0,1,0]=3 13379 B11R0.3 CCCCOCCSCCC#N 62a_100000743108_100011215226 [0,2,0,0,0,0|1,1,0]=4 13380 B11R0.3 CCCCOCCSCCC#N 62a_100011215226_100000743108 [0,2,0,0,0,0|1,1,0]=4 13381 B11R0.3 CCCCOCCSCCCC 34a_200000230436_100000210210 [0,2,0,0,0,0|1,1,0]=4 13382 B11R0.3 CCCCOCCSCCCC 62a_100000210211_100000743108 [0,2,0,0,0,0|1,1,0]=4 13383 B11R0.3 CCCCOCCSCCCC 62a_100000743108_100000210210 [0,2,0,0,0,0|1,1,0]=4 13384 B11R0.3 CCCCOCCSCCCC 7a_200000230436_100000210211 [0,2,0,0,0,0|1,1,0]=4 13385 B11R0.3 CCCCOCCSCCCF 62a_100000743108_100011934791 [0,2,0,0,0,0|1,1,0]=4 13386 B11R0.3 CCCCOCCSCCCF 62a_100011934791_100000743108 [0,2,0,0,0,0|1,1,0]=4 13387 B11R0.3 CCCCOCCSCCCO 62a_100000743108_100011215043 [0,2,0,0,0,0|1,1,0]=4 13388 B11R0.3 CCCCOCCSCCCO 62a_100011215043_100000743108 [0,2,0,0,0,0|1,1,0]=4 13389 B11R0.3 CCCCOCCSCCOC 62a_100000233755_100000743108 [0,2,0,0,0,0|0,1,0]=3 13390 B11R0.3 CCCCOCCSCCOC 62a_100000743108_100000233755 [0,2,0,0,0,0|0,1,0]=3 13391 B11R0.3 CCCCOCCSCCSC 62a_100000212216_100000743108 [0,2,0,0,0,0|0,2,0]=4 13392 B11R0.3 CCCCOCCSCCSC 62a_100000743108_100000751147 [0,2,0,0,0,0|0,2,0]=4 13393 B11R0.3 CCCCOCCSCOCC 62a_100000739092_100000743108 [0,2,0,0,0,0|1,0,0]=3 13394 B11R0.3 CCCCOCCSCOCC 62a_100000743108_100000739092 [0,2,0,0,0,0|1,0,0]=3 13395 B11R0.3 CCCCOCNCCCCO 2230a_100000750430_100011995733 [0,2,0,0,0,0|2,0,0]=4 13396 B11R0.3 CCCCOCNCCCCO 34a_100000750430_100011995733 [0,2,0,0,0,0|2,0,0]=4 13397 B11R0.3 CCCCOCNCCCOC 34a_100150723488_100011995733 [0,2,0,0,0,0|2,0,0]=4 13398 B11R0.3 CCCCOCNCCCSC 2230a_100000749238_100011995733 [0,2,0,0,0,0|2,0,0]=4 13399 B11R0.3 CCCCOCNCCOCC 2230a_102516460346_100011995733 [0,2,0,0,0,0|1,0,0]=3 13400 B11R0.3 CCCCOCNCCOCC 34a_102516460346_100011995733 [0,2,0,0,0,0|1,0,0]=3 13401 B11R0.3 CCCCOCNCCSCC 2230a_100000106463_100011995733 [0,2,0,0,0,0|1,1,0]=4 13402 B11R0.3 CCCCOCOCCCCBr 34a_100011216708_100011995733 [0,2,0,0,0,0|2,0,0]=4 13403 B11R0.3 CCCCOCOCCCCCl 34a_100000210776_100011995733 [0,2,0,0,0,0|2,0,0]=4 13404 B11R0.3 CCCCOCOCCCCF 34a_100011995726_100011995733 [0,2,0,0,0,0|2,0,0]=4 13405 B11R0.3 CCCCOCOCCCCI 34a_200012148704_100011995733 [0,2,0,0,0,0|2,0,0]=4 13406 B11R0.3 CCCCOCOCCCCN 34a_100000750430_100011995733 [0,2,0,0,0,0|2,0,0]=4 13407 B11R0.3 CCCCOCOCCCNC 34a_100000213112_100011995733 [0,2,0,0,0,0|2,0,0]=4 13408 B11R0.3 CCCCOCOCCCOC 34a_100000740835_100011995733 [0,2,0,0,0,0|1,0,0]=3 13409 B11R0.3 CCCCOCOCCCSC 34a_100000690336_100011995733 [0,2,0,0,0,0|1,1,0]=4 13410 B11R0.3 CCCCOCOCCOCC 34a_100000210136_100011995733 [0,2,0,0,0,0|1,0,0]=3 13411 B11R0.3 CCCCOCOCCSCC 34a_100000212035_100011995733 [0,2,0,0,0,0|1,1,0]=4 13412 B11R0.3 CCCCOCSCCCCF 62a_100000729493_100011995733 [0,2,0,0,0,0|2,0,0]=4 13413 B11R0.3 CCCCOCSCCCCF 62a_100011995733_100000729493 [0,2,0,0,0,0|2,0,0]=4 13414 B11R0.3 CCCCOCSCCCCO 62a_100000210776_100011995733 [0,2,0,0,0,0|2,0,0]=4 13415 B11R0.3 CCCCOCSCCCCO 62a_100011995733_100000210776 [0,2,0,0,0,0|2,0,0]=4 13416 B11R0.3 CCCCOCSCCCOC 62a_100000709357_100011995733 [0,2,0,0,0,0|1,1,0]=4 13417 B11R0.3 CCCCOCSCCCOC 62a_100011995733_100000709357 [0,2,0,0,0,0|1,1,0]=4 13418 B11R0.3 CCCCOCSCCOCC 62a_100000210147_100011995733 [0,2,0,0,0,0|1,0,0]=3 13419 B11R0.3 CCCCOCSCCOCC 62a_100011995733_100011215890 [0,2,0,0,0,0|1,0,0]=3 13420 B11R0.3 CCCCOCSCCSCC 62a_100000757381_100011995733 [0,2,0,0,0,0|1,1,0]=4 13421 B11R0.3 CCCCOCSCCSCC 62a_100011995733_100000757381 [0,2,0,0,0,0|1,1,0]=4 13422 B11R0.3 CCCCSCCNCCOC 2230a_100025743550_100011201679 [0,2,0,0,0,0|1,1,0]=4 13423 B11R0.3 CCCCSCCOCCC#N 7a_200000230436_100000184422 [0,2,0,0,0,0|1,1,0]=4 13424 B11R0.3 CCCCSCCOCCCF 34a_200000230436_100011934791 [0,2,0,0,0,0|1,1,0]=4 13425 B11R0.3 CCCCSCCOCCCF 7a_200000230436_100011934791 [0,2,0,0,0,0|1,1,0]=4 13426 B11R0.3 CCCCSCCOCCCO 34a_200000230436_100000230001 [0,2,0,0,0,0|1,1,0]=4 13427 B11R0.3 CCCCSCCOCCCO 7a_200000230436_100011215043 [0,2,0,0,0,0|1,1,0]=4 13428 B11R0.3 CCCCSCCOCCOC 34a_200000230436_100011201679 [0,2,0,0,0,0|0,1,0]=3 13429 B11R0.3 CCCCSCCOCCOC 62a_100000210211_100000695917 [0,2,0,0,0,0|0,1,0]=3 13430 B11R0.3 CCCCSCCOCCOC 62a_100000695917_100000210210 [0,2,0,0,0,0|0,1,0]=3 13431 B11R0.3 CCCCSCCOCCOC 7a_200000230436_100000233755 [0,2,0,0,0,0|0,1,0]=3 13432 B11R0.3 CCCCSCCOCCSC 34a_200000230436_100000212216 [0,2,0,0,0,0|0,2,0]=4 13433 B11R0.3 CCCCSCCOCCSC 7a_200000230436_100000212216 [0,2,0,0,0,0|0,2,0]=4 13434 B11R0.3 CCCNCCCOCCOC 2230a_100000206027_100000210303 [0,2,0,0,0,0|1,0,0]=3 13435 B11R0.3 CCCNCCCOCCOC 34a_100000206027_100000210303 [0,2,0,0,0,0|1,0,0]=3 13436 B11R0.3 CCCNCCOCCOCC 2230a_100102712874_100000210303 [0,2,0,0,0,0|1,0,0]=3 13437 B11R0.3 CCCNCCOCCOCC 34a_100102712874_100000210303 [0,2,0,0,0,0|1,0,0]=3 13438 B11R0.3 CCCOCCCCCCCBr 34a_100000760002_100000210303 [0,2,0,0,0,0|2,0,0]=4 13439 B11R0.3 CCCOCCCCCCCBr 7a_100000760002_100000210303 [0,2,0,0,0,0|2,0,0]=4 13440 B11R0.3 CCCOCCCCCCCN 34a_100011996573_100000210303 [0,2,0,0,0,0|2,0,0]=4 13441 B11R0.3 CCCOCCCCCCCO 34a_100000210258_100000760002 [0,2,0,0,0,0|2,0,0]=4 13442 B11R0.3 CCCOCCCCCCOC 34a_100000210258_100011998445 [0,2,0,0,0,0|1,0,0]=3 13443 B11R0.3 CCCOCCCCCCOC 34a_200012092642_100000210303 [0,2,0,0,0,0|1,0,0]=3 13444 B11R0.3 CCCOCCCCCCOC 7a_200012092642_100000210303 [0,2,0,0,0,0|1,0,0]=3 13445 B11R0.3 CCCOCCCNCCOC 2230a_100011217757_100011201679 [0,2,0,0,0,0|1,0,0]=3 13446 B11R0.3 CCCOCCCNCCOC 34a_100011217757_100011201679 [0,2,0,0,0,0|1,0,0]=3 13447 B11R0.3 CCCOCCCNCCSC 2230a_100011217757_100000751147 [0,2,0,0,0,0|1,1,0]=4 13448 B11R0.3 CCCOCCCNCCSC 34a_100011217757_100000212216 [0,2,0,0,0,0|1,1,0]=4 13449 B11R0.3 CCCOCCCOCCCN 34a_100011310245_100000210303 [0,2,0,0,0,0|2,0,0]=4 13450 B11R0.3 CCCOCCCOCCOC 34a_100000210258_100011216529 [0,2,0,0,0,0|0,0,0]=2 13451 B11R0.3 CCCOCCNCCCCF 2230a_100161115042_100000729493 [0,2,0,0,0,0|2,0,0]=4 13452 B11R0.3 CCCOCCNCCCCF 34a_100161115042_100000729493 [0,2,0,0,0,0|2,0,0]=4 13453 B11R0.3 CCCOCCNCCCCO 2230a_100000750430_100011215938 [0,2,0,0,0,0|2,0,0]=4 13454 B11R0.3 CCCOCCNCCCCO 2230a_100161115042_100000210776 [0,2,0,0,0,0|2,0,0]=4 13455 B11R0.3 CCCOCCNCCCCO 34a_100000750430_100011215938 [0,2,0,0,0,0|2,0,0]=4 13456 B11R0.3 CCCOCCNCCCCO 34a_100161115042_100011216708 [0,2,0,0,0,0|2,0,0]=4 13457 B11R0.3 CCCOCCNCCCOC 2230a_100161115042_100000740836 [0,2,0,0,0,0|1,0,0]=3 13458 B11R0.3 CCCOCCNCCCOC 34a_100150723488_100011215938 [0,2,0,0,0,0|1,0,0]=3 13459 B11R0.3 CCCOCCNCCCOC 34a_100161115042_100000740836 [0,2,0,0,0,0|1,0,0]=3 13460 B11R0.3 CCCOCCNCCCSC 2230a_100000749238_100011215938 [0,2,0,0,0,0|1,1,0]=4 13461 B11R0.3 CCCOCCNCCOCC 2230a_100161115042_100011215890 [0,2,0,0,0,0|1,0,0]=3 13462 B11R0.3 CCCOCCNCCOCC 2230a_102516460346_100011215938 [0,2,0,0,0,0|1,0,0]=3 13463 B11R0.3 CCCOCCNCCOCC 34a_100161115042_100000210147 [0,2,0,0,0,0|1,0,0]=3 13464 B11R0.3 CCCOCCNCCOCC 34a_102516460346_100011215938 [0,2,0,0,0,0|1,0,0]=3 13465 B11R0.3 CCCOCCNCCSCC 2230a_100000106463_100011215938 [0,2,0,0,0,0|1,1,0]=4 13466 B11R0.3 CCCOCCNCCSCC 2230a_100161115042_100000757381 [0,2,0,0,0,0|1,1,0]=4 13467 B11R0.3 CCCOCCNCCSCC 34a_100161115042_100000757381 [0,2,0,0,0,0|1,1,0]=4 13468 B11R0.3 CCCOCCOCC#CCCl 34a_200000047223_100011215938 [0,2,0,0,0,0|1,0,1]=4 13469 B11R0.3 CCCOCCOCC#CCO 34a_100000752267_200000047223 [0,2,0,0,0,0|1,0,1]=4 13470 B11R0.3 CCCOCCOCC#CCO 7a_100000752267_200000047223 [0,2,0,0,0,0|1,0,1]=4 13471 B11R0.3 CCCOCCOCCCC#N 7a_100000752267_100000687738 [0,2,0,0,0,0|1,0,1]=4 13472 B11R0.3 CCCOCCOCCCC=O 7a_100000752267_200011292268 [0,2,0,0,0,0|1,0,1]=4 13473 B11R0.3 CCCOCCOCCCCBr 34a_100011216708_100011215938 [0,2,0,0,0,0|1,0,0]=3 13474 B11R0.3 CCCOCCOCCCCCl 34a_100000210776_100011215938 [0,2,0,0,0,0|1,0,0]=3 13475 B11R0.3 CCCOCCOCCCCCl 7a_100000210776_100011215938 [0,2,0,0,0,0|1,0,0]=3 13476 B11R0.3 CCCOCCOCCCCF 34a_100000752267_100000729493 [0,2,0,0,0,0|1,0,0]=3 13477 B11R0.3 CCCOCCOCCCCF 34a_100011995726_100011215938 [0,2,0,0,0,0|1,0,0]=3 13478 B11R0.3 CCCOCCOCCCCF 7a_100000752267_100000729493 [0,2,0,0,0,0|1,0,0]=3 13479 B11R0.3 CCCOCCOCCCCF 7a_100011995726_100011215938 [0,2,0,0,0,0|1,0,0]=3 13480 B11R0.3 CCCOCCOCCCCI 34a_200012148704_100011215938 [0,2,0,0,0,0|1,0,0]=3 13481 B11R0.3 CCCOCCOCCCCN 34a_100000750430_100011215938 [0,2,0,0,0,0|1,0,0]=3 13482 B11R0.3 CCCOCCOCCCCO 34a_100000752267_100011216708 [0,2,0,0,0,0|1,0,0]=3 13483 B11R0.3 CCCOCCOCCCCO 7a_100000752267_100000210776 [0,2,0,0,0,0|1,0,0]=3 13484 B11R0.3 CCCOCCOCCCNC 34a_100000213112_100011215938 [0,2,0,0,0,0|1,0,0]=3 13485 B11R0.3 CCCOCCOCCCOC 34a_100000740835_100011215938 [0,2,0,0,0,0|0,0,0]=2 13486 B11R0.3 CCCOCCOCCCOC 34a_100000752267_100000740836 [0,2,0,0,0,0|0,0,0]=2 13487 B11R0.3 CCCOCCOCCCOC 7a_100000752267_100000740836 [0,2,0,0,0,0|0,0,0]=2 13488 B11R0.3 CCCOCCOCCCSC 34a_100000690336_100011215938 [0,2,0,0,0,0|0,1,0]=3 13489 B11R0.3 CCCOCCOCCCSC 7a_100000690336_100011215938 [0,2,0,0,0,0|0,1,0]=3 13490 B11R0.3 CCCOCCOCCNCC 2230a_200011904461_100000210202 [0,2,0,0,0,0|1,0,0]=3 13491 B11R0.3 CCCOCCOCCNCC 34a_200011904461_100000210202 [0,2,0,0,0,0|1,0,0]=3 13492 B11R0.3 CCCOCCOCCNCF 34a_200011904461_100015361967 [0,2,0,0,0,0|1,0,0]=3 13493 B11R0.3 CCCOCCOCCOCC 34a_100000210136_100011215938 [0,2,0,0,0,0|0,0,0]=2 13494 B11R0.3 CCCOCCOCCOCC 34a_100000210240_100000210303 [0,2,0,0,0,0|0,0,0]=2 13495 B11R0.3 CCCOCCOCCOCC 34a_100000210258_100011211534 [0,2,0,0,0,0|0,0,0]=2 13496 B11R0.3 CCCOCCOCCOCC 34a_100000752267_100000210147 [0,2,0,0,0,0|0,0,0]=2 13497 B11R0.3 CCCOCCOCCOCC 7a_100000210136_100011215938 [0,2,0,0,0,0|0,0,0]=2 13498 B11R0.3 CCCOCCOCCOCC 7a_100000210240_100000210303 [0,2,0,0,0,0|0,0,0]=2 13499 B11R0.3 CCCOCCOCCOCC 7a_100000752267_100011215890 [0,2,0,0,0,0|0,0,0]=2 13500 B11R0.3 CCCOCCOCCSCC 34a_100000212035_100011215938 [0,2,0,0,0,0|0,1,0]=3 13501 B11R0.3 CCCOCCOCCSCC 34a_100000752267_100000757381 [0,2,0,0,0,0|0,1,0]=3 13502 B11R0.3 CCCOCCOCCSCC 7a_100000212035_100011215938 [0,2,0,0,0,0|0,1,0]=3 13503 B11R0.3 CCCOCCOCCSCC 7a_100000752267_100000757381 [0,2,0,0,0,0|0,1,0]=3 13504 B11R0.3 CCCOCCSCCCCF 62a_100000729493_100011215938 [0,2,0,0,0,0|1,1,0]=4 13505 B11R0.3 CCCOCCSCCCCF 62a_100011215938_100000729493 [0,2,0,0,0,0|1,1,0]=4 13506 B11R0.3 CCCOCCSCCCCO 62a_100000210776_100011215938 [0,2,0,0,0,0|1,1,0]=4 13507 B11R0.3 CCCOCCSCCCCO 62a_100011215938_100000210776 [0,2,0,0,0,0|1,1,0]=4 13508 B11R0.3 CCCOCCSCCCOC 62a_100000709357_100011215938 [0,2,0,0,0,0|0,1,0]=3 13509 B11R0.3 CCCOCCSCCCOC 62a_100011215938_100000709357 [0,2,0,0,0,0|0,1,0]=3 13510 B11R0.3 CCCOCCSCCOCC 62a_100000210147_100011215938 [0,2,0,0,0,0|0,1,0]=3 13511 B11R0.3 CCCOCCSCCOCC 62a_100011215938_100011215890 [0,2,0,0,0,0|0,1,0]=3 13512 B11R0.3 CCCOCCSCCSCC 62a_100000757381_100011215938 [0,2,0,0,0,0|0,2,0]=4 13513 B11R0.3 CCCOCCSCCSCC 62a_100011215938_100000757381 [0,2,0,0,0,0|0,2,0]=4 13514 B11R0.3 CCCSCCCCCCOC 62a_100000210303_100011998445 [0,2,0,0,0,0|1,1,0]=4 13515 B11R0.3 CCCSCCCCCCOC 62a_100011998445_100000210303 [0,2,0,0,0,0|1,1,0]=4 13516 B11R0.3 CCCSCCCOCCOC 62a_100000210303_100011216529 [0,2,0,0,0,0|0,1,0]=3 13517 B11R0.3 CCCSCCCOCCOC 62a_100011216529_100000210303 [0,2,0,0,0,0|0,1,0]=3 13518 B11R0.3 CCCSCCNCCCOC 2230a_100020603323_100000740836 [0,2,0,0,0,0|1,1,0]=4 13519 B11R0.3 CCCSCCNCCOCC 2230a_100020603323_100011215890 [0,2,0,0,0,0|1,1,0]=4 13520 B11R0.3 CCCSCCOCCCCF 34a_200000230433_100000729493 [0,2,0,0,0,0|1,1,0]=4 13521 B11R0.3 CCCSCCOCCCCF 7a_200000230433_100000729493 [0,2,0,0,0,0|1,1,0]=4 13522 B11R0.3 CCCSCCOCCCCO 34a_200000230433_100011216708 [0,2,0,0,0,0|1,1,0]=4 13523 B11R0.3 CCCSCCOCCCCO 7a_200000230433_100000210776 [0,2,0,0,0,0|1,1,0]=4 13524 B11R0.3 CCCSCCOCCCOC 34a_200000230433_100000740836 [0,2,0,0,0,0|0,1,0]=3 13525 B11R0.3 CCCSCCOCCCOC 7a_200000230433_100000740836 [0,2,0,0,0,0|0,1,0]=3 13526 B11R0.3 CCCSCCOCCOCC 34a_200000230433_100000210147 [0,2,0,0,0,0|0,1,0]=3 13527 B11R0.3 CCCSCCOCCOCC 62a_100000210303_100011211534 [0,2,0,0,0,0|0,1,0]=3 13528 B11R0.3 CCCSCCOCCOCC 62a_100011211534_100000210303 [0,2,0,0,0,0|0,1,0]=3 13529 B11R0.3 CCCSCCOCCOCC 7a_200000230433_100011215890 [0,2,0,0,0,0|0,1,0]=3 13530 B11R0.3 CCCSCCOCCSCC 34a_200000230433_100000757381 [0,2,0,0,0,0|0,2,0]=4 13531 B11R0.3 CCCSCCOCCSCC 7a_200000230433_100000757381 [0,2,0,0,0,0|0,2,0]=4 13532 B11R0.3 CCNCCOCCOCCO 2230a_100011998139_100000210202 [0,2,0,0,0,0|1,0,0]=3 13533 B11R0.3 CCNCCOCCOCCO 2230a_100015525214_100000032323 [0,2,0,0,0,0|1,0,0]=3 13534 B11R0.3 CCNCCOCCOCCO 34a_100011998139_100000210202 [0,2,0,0,0,0|1,0,0]=3 13535 B11R0.3 CCOCCCCCCCCBr 34a_100009813846_100000210202 [0,2,0,0,0,0|2,0,0]=4 13536 B11R0.3 CCOCCCCCCCCBr 7a_100009813846_100000210202 [0,2,0,0,0,0|2,0,0]=4 13537 B11R0.3 CCOCCCCCCCCCl 34a_100000033203_100000210202 [0,2,0,0,0,0|2,0,0]=4 13538 B11R0.3 CCOCCCCCCCCCl 7a_100000033203_100000210202 [0,2,0,0,0,0|2,0,0]=4 13539 B11R0.3 CCOCCCCCCCCN 34a_102515433106_100000210202 [0,2,0,0,0,0|2,0,0]=4 13540 B11R0.3 CCOCCCCCCCCO 34a_100121572206_100000033203 [0,2,0,0,0,0|2,0,0]=4 13541 B11R0.3 CCOCCCCCNCCN 34a_103619048469_100000210202 [0,2,0,0,0,0|2,0,0]=4 13542 B11R0.3 CCOCCCNCCCCF 2230a_100000210961_100000729493 [0,2,0,0,0,0|2,0,0]=4 13543 B11R0.3 CCOCCCNCCCCF 34a_100000210961_100000729493 [0,2,0,0,0,0|2,0,0]=4 13544 B11R0.3 CCOCCCNCCCCO 2230a_100000210961_100000210776 [0,2,0,0,0,0|2,0,0]=4 13545 B11R0.3 CCOCCCNCCCCO 2230a_100000750430_100012232248 [0,2,0,0,0,0|2,0,0]=4 13546 B11R0.3 CCOCCCNCCCCO 34a_100000210961_100011216708 [0,2,0,0,0,0|2,0,0]=4 13547 B11R0.3 CCOCCCNCCCCO 34a_100000750430_100012232248 [0,2,0,0,0,0|2,0,0]=4 13548 B11R0.3 CCOCCCNCCCOC 2230a_100000210961_100000740836 [0,2,0,0,0,0|1,0,0]=3 13549 B11R0.3 CCOCCCNCCCOC 34a_100000210961_100000740836 [0,2,0,0,0,0|1,0,0]=3 13550 B11R0.3 CCOCCCNCCCOC 34a_100150723488_100012232248 [0,2,0,0,0,0|1,0,0]=3 13551 B11R0.3 CCOCCCNCCCSC 2230a_100000749238_100012232248 [0,2,0,0,0,0|1,1,0]=4 13552 B11R0.3 CCOCCCNCCOCC 2230a_100000210961_100011215890 [0,2,0,0,0,0|1,0,0]=3 13553 B11R0.3 CCOCCCNCCOCC 2230a_102516460346_100012232248 [0,2,0,0,0,0|1,0,0]=3 13554 B11R0.3 CCOCCCNCCOCC 34a_100000210961_100000210147 [0,2,0,0,0,0|1,0,0]=3 13555 B11R0.3 CCOCCCNCCOCC 34a_102516460346_100012232248 [0,2,0,0,0,0|1,0,0]=3 13556 B11R0.3 CCOCCCNCCSCC 2230a_100000106463_100012232248 [0,2,0,0,0,0|1,1,0]=4 13557 B11R0.3 CCOCCCNCCSCC 2230a_100000210961_100000757381 [0,2,0,0,0,0|1,1,0]=4 13558 B11R0.3 CCOCCCNCCSCC 34a_100000210961_100000757381 [0,2,0,0,0,0|1,1,0]=4 13559 B11R0.3 CCOCCCOCC#CCCl 34a_200000047223_100012232248 [0,2,0,0,0,0|1,0,1]=4 13560 B11R0.3 CCOCCCOCC#CCO 34a_100000757476_200000047223 [0,2,0,0,0,0|1,0,1]=4 13561 B11R0.3 CCOCCCOCC#CCO 7a_100000757476_200000047223 [0,2,0,0,0,0|1,0,1]=4 13562 B11R0.3 CCOCCCOCCCC#N 7a_100000757476_100000687738 [0,2,0,0,0,0|1,0,1]=4 13563 B11R0.3 CCOCCCOCCCC=O 7a_100000757476_200011292268 [0,2,0,0,0,0|1,0,1]=4 13564 B11R0.3 CCOCCCOCCCCBr 34a_100011216708_100012232248 [0,2,0,0,0,0|1,0,0]=3 13565 B11R0.3 CCOCCCOCCCCCl 34a_100000210776_100012232248 [0,2,0,0,0,0|1,0,0]=3 13566 B11R0.3 CCOCCCOCCCCCl 7a_100000210776_100012232248 [0,2,0,0,0,0|1,0,0]=3 13567 B11R0.3 CCOCCCOCCCCF 34a_100000757476_100000729493 [0,2,0,0,0,0|1,0,0]=3 13568 B11R0.3 CCOCCCOCCCCF 34a_100011995726_100012232248 [0,2,0,0,0,0|1,0,0]=3 13569 B11R0.3 CCOCCCOCCCCF 7a_100000757476_100000729493 [0,2,0,0,0,0|1,0,0]=3 13570 B11R0.3 CCOCCCOCCCCF 7a_100011995726_100012232248 [0,2,0,0,0,0|1,0,0]=3 13571 B11R0.3 CCOCCCOCCCCI 34a_200012148704_100012232248 [0,2,0,0,0,0|1,0,0]=3 13572 B11R0.3 CCOCCCOCCCCN 34a_100000750430_100012232248 [0,2,0,0,0,0|1,0,0]=3 13573 B11R0.3 CCOCCCOCCCCO 34a_100000757476_100011216708 [0,2,0,0,0,0|1,0,0]=3 13574 B11R0.3 CCOCCCOCCCCO 7a_100000757476_100000210776 [0,2,0,0,0,0|1,0,0]=3 13575 B11R0.3 CCOCCCOCCCNC 34a_100000213112_100012232248 [0,2,0,0,0,0|1,0,0]=3 13576 B11R0.3 CCOCCCOCCCOC 34a_100000740835_100012232248 [0,2,0,0,0,0|0,0,0]=2 13577 B11R0.3 CCOCCCOCCCOC 34a_100000757476_100000740836 [0,2,0,0,0,0|0,0,0]=2 13578 B11R0.3 CCOCCCOCCCOC 34a_200011215475_100000210202 [0,2,0,0,0,0|0,0,0]=2 13579 B11R0.3 CCOCCCOCCCOC 7a_100000757476_100000740836 [0,2,0,0,0,0|0,0,0]=2 13580 B11R0.3 CCOCCCOCCCOC 7a_200011215475_100000210202 [0,2,0,0,0,0|0,0,0]=2 13581 B11R0.3 CCOCCCOCCCSC 34a_100000690336_100012232248 [0,2,0,0,0,0|0,1,0]=3 13582 B11R0.3 CCOCCCOCCCSC 7a_100000690336_100012232248 [0,2,0,0,0,0|0,1,0]=3 13583 B11R0.3 CCOCCCOCCOCC 34a_100000210136_100012232248 [0,2,0,0,0,0|0,0,0]=2 13584 B11R0.3 CCOCCCOCCOCC 34a_100000757476_100000210147 [0,2,0,0,0,0|0,0,0]=2 13585 B11R0.3 CCOCCCOCCOCC 7a_100000210136_100012232248 [0,2,0,0,0,0|0,0,0]=2 13586 B11R0.3 CCOCCCOCCOCC 7a_100000757476_100011215890 [0,2,0,0,0,0|0,0,0]=2 13587 B11R0.3 CCOCCCOCCSCC 34a_100000212035_100012232248 [0,2,0,0,0,0|0,1,0]=3 13588 B11R0.3 CCOCCCOCCSCC 34a_100000757476_100000757381 [0,2,0,0,0,0|0,1,0]=3 13589 B11R0.3 CCOCCCOCCSCC 7a_100000212035_100012232248 [0,2,0,0,0,0|0,1,0]=3 13590 B11R0.3 CCOCCCOCCSCC 7a_100000757476_100000757381 [0,2,0,0,0,0|0,1,0]=3 13591 B11R0.3 CCOCCCSCCCCF 62a_100000729493_100012232248 [0,2,0,0,0,0|1,1,0]=4 13592 B11R0.3 CCOCCCSCCCCF 62a_100012232248_100000729493 [0,2,0,0,0,0|1,1,0]=4 13593 B11R0.3 CCOCCCSCCCCO 62a_100000210776_100012232248 [0,2,0,0,0,0|1,1,0]=4 13594 B11R0.3 CCOCCCSCCCCO 62a_100012232248_100000210776 [0,2,0,0,0,0|1,1,0]=4 13595 B11R0.3 CCOCCCSCCCOC 62a_100000709357_100012232248 [0,2,0,0,0,0|0,1,0]=3 13596 B11R0.3 CCOCCCSCCCOC 62a_100012232248_100000709357 [0,2,0,0,0,0|0,1,0]=3 13597 B11R0.3 CCOCCCSCCOCC 62a_100000210147_100012232248 [0,2,0,0,0,0|0,1,0]=3 13598 B11R0.3 CCOCCCSCCOCC 62a_100012232248_100011215890 [0,2,0,0,0,0|0,1,0]=3 13599 B11R0.3 CCOCCCSCCSCC 62a_100000757381_100012232248 [0,2,0,0,0,0|0,2,0]=4 13600 B11R0.3 CCOCCCSCCSCC 62a_100012232248_100000757381 [0,2,0,0,0,0|0,2,0]=4 13601 B11R0.3 CCOCCNCCCCC#N 2230a_102516460346_100000211819 [0,2,0,0,0,0|2,0,0]=4 13602 B11R0.3 CCOCCNCCCCC=O 2230a_102516460346_100000139335 [0,2,0,0,0,0|2,0,0]=4 13603 B11R0.3 CCOCCNCCCCCF 2230a_102516460346_100000729378 [0,2,0,0,0,0|2,0,0]=4 13604 B11R0.3 CCOCCNCCCCCF 34a_102516460346_100000729378 [0,2,0,0,0,0|2,0,0]=4 13605 B11R0.3 CCOCCNCCCCCO 2230a_100000762737_100011215890 [0,2,0,0,0,0|2,0,0]=4 13606 B11R0.3 CCOCCNCCCCCO 2230a_102516460346_100000746330 [0,2,0,0,0,0|2,0,0]=4 13607 B11R0.3 CCOCCNCCCCCO 34a_100000762737_100000210147 [0,2,0,0,0,0|2,0,0]=4 13608 B11R0.3 CCOCCNCCCCCO 34a_102516460346_100000746330 [0,2,0,0,0,0|2,0,0]=4 13609 B11R0.3 CCOCCNCCCCOC 2230a_102516460346_100000730899 [0,2,0,0,0,0|1,0,0]=3 13610 B11R0.3 CCOCCNCCCCOC 34a_102516460346_100000755781 [0,2,0,0,0,0|1,0,0]=3 13611 B11R0.3 CCOCCNCCOCC#N 2230a_102516460346_200000047693 [0,2,0,0,0,0|1,0,0]=3 13612 B11R0.3 CCOCCNCCOCCO 2230a_100000211614_100011215890 [0,2,0,0,0,0|1,0,0]=3 13613 B11R0.3 CCOCCNCCOCCO 2230a_102516460346_100011215305 [0,2,0,0,0,0|1,0,0]=3 13614 B11R0.3 CCOCCNCCOCCO 34a_100000211614_100000210147 [0,2,0,0,0,0|1,0,0]=3 13615 B11R0.3 CCOCCNCCOCCO 34a_102516460346_100000692535 [0,2,0,0,0,0|1,0,0]=3 13616 B11R0.3 CCOCCNCCSCCO 2230a_100011219999_100011215890 [0,2,0,0,0,0|1,1,0]=4 13617 B11R0.3 CCOCCNCOCCOC 2230a_102516460346_100000231047 [0,2,0,0,0,0|0,0,0]=2 13618 B11R0.3 CCOCCNN=CCCSC 4a_100000732670_100000210997 [0,2,0,0,0,0|1,1,0]=4 13619 B11R0.3 CCOCCOCCCCC#N 7a_100000210136_100000211819 [0,2,0,0,0,0|1,0,0]=3 13620 B11R0.3 CCOCCOCCCCC=O 7a_100000210136_100000139335 [0,2,0,0,0,0|1,0,0]=3 13621 B11R0.3 CCOCCOCCCCCBr 34a_100000746331_100000210147 [0,2,0,0,0,0|1,0,0]=3 13622 B11R0.3 CCOCCOCCCCCBr 7a_100000746331_100011215890 [0,2,0,0,0,0|1,0,0]=3 13623 B11R0.3 CCOCCOCCCCCCl 34a_100000746330_100000210147 [0,2,0,0,0,0|1,0,0]=3 13624 B11R0.3 CCOCCOCCCCCCl 7a_100000746330_100011215890 [0,2,0,0,0,0|1,0,0]=3 13625 B11R0.3 CCOCCOCCCCCF 34a_100000210136_100000729378 [0,2,0,0,0,0|1,0,0]=3 13626 B11R0.3 CCOCCOCCCCCF 7a_100000210136_100000729378 [0,2,0,0,0,0|1,0,0]=3 13627 B11R0.3 CCOCCOCCCCCI 34a_200012148887_100000210147 [0,2,0,0,0,0|1,0,0]=3 13628 B11R0.3 CCOCCOCCCCCI 7a_200012148887_100011215890 [0,2,0,0,0,0|1,0,0]=3 13629 B11R0.3 CCOCCOCCCCCN 34a_100000762737_100000210147 [0,2,0,0,0,0|1,0,0]=3 13630 B11R0.3 CCOCCOCCCCCO 34a_100000210136_100000746330 [0,2,0,0,0,0|1,0,0]=3 13631 B11R0.3 CCOCCOCCCCCO 7a_100000210136_100000746330 [0,2,0,0,0,0|1,0,0]=3 13632 B11R0.3 CCOCCOCCCCOC 34a_100000210136_100000755781 [0,2,0,0,0,0|0,0,0]=2 13633 B11R0.3 CCOCCOCCCCOC 34a_100000740925_100000210147 [0,2,0,0,0,0|0,0,0]=2 13634 B11R0.3 CCOCCOCCCCOC 7a_100000210136_100000730899 [0,2,0,0,0,0|0,0,0]=2 13635 B11R0.3 CCOCCOCCCCSC 34a_100011217163_100000210147 [0,2,0,0,0,0|0,1,0]=3 13636 B11R0.3 CCOCCOCCCCSC 7a_100011217163_100011215890 [0,2,0,0,0,0|0,1,0]=3 13637 B11R0.3 CCOCCOCCCSCC 34a_100011216438_100000210147 [0,2,0,0,0,0|0,1,0]=3 13638 B11R0.3 CCOCCOCCCSCC 7a_100011216438_100011215890 [0,2,0,0,0,0|0,1,0]=3 13639 B11R0.3 CCOCCOCCNCC#N 2230a_100102712874_100011215382 [0,2,0,0,0,0|1,0,0]=3 13640 B11R0.3 CCOCCOCCNCC=O 2230a_100102712874_200015260668 [0,2,0,0,0,0|1,0,0]=3 13641 B11R0.3 CCOCCOCCNCC=O 34a_100102712874_200009817547 [0,2,0,0,0,0|1,0,0]=3 13642 B11R0.3 CCOCCOCCNCCF 2230a_100102712874_100011217306 [0,2,0,0,0,0|1,0,0]=3 13643 B11R0.3 CCOCCOCCNCCF 34a_100000724931_100011211534 [0,2,0,0,0,0|1,0,0]=3 13644 B11R0.3 CCOCCOCCNCCF 34a_100102712874_100011217306 [0,2,0,0,0,0|1,0,0]=3 13645 B11R0.3 CCOCCOCCNCCO 2230a_100016997473_100011211534 [0,2,0,0,0,0|1,0,0]=3 13646 B11R0.3 CCOCCOCCNCCO 2230a_100102712874_100000211926 [0,2,0,0,0,0|1,0,0]=3 13647 B11R0.3 CCOCCOCCNCCO 34a_100016990907_100011211534 [0,2,0,0,0,0|1,0,0]=3 13648 B11R0.3 CCOCCOCCNCCO 34a_100102712874_100000211926 [0,2,0,0,0,0|1,0,0]=3 13649 B11R0.3 CCOCCOCCNCOC 2230a_100102712874_100000766300 [0,2,0,0,0,0|0,0,0]=2 13650 B11R0.3 CCOCCOCCNCSC 2230a_100102712874_100011218213 [0,2,0,0,0,0|0,1,0]=3 13651 B11R0.3 CCOCCOCCNCSC 34a_100102712874_100011218213 [0,2,0,0,0,0|0,1,0]=3 13652 B11R0.3 CCOCCOCCOCC#N 7a_100000210136_200000047693 [0,2,0,0,0,0|0,0,0]=2 13653 B11R0.3 CCOCCOCCOCC#N 7a_100000210240_100011215382 [0,2,0,0,0,0|0,0,0]=2 13654 B11R0.3 CCOCCOCCOCC=O 34a_100000210240_200009817547 [0,2,0,0,0,0|0,0,0]=2 13655 B11R0.3 CCOCCOCCOCC=O 7a_100000210240_200015260668 [0,2,0,0,0,0|0,0,0]=2 13656 B11R0.3 CCOCCOCCOCCBr 34a_100000211926_100011211534 [0,2,0,0,0,0|0,0,0]=2 13657 B11R0.3 CCOCCOCCOCCBr 34a_100000692535_100000210147 [0,2,0,0,0,0|0,0,0]=2 13658 B11R0.3 CCOCCOCCOCCBr 34a_100010132937_100000210202 [0,2,0,0,0,0|0,0,0]=2 13659 B11R0.3 CCOCCOCCOCCBr 7a_100000692535_100011215890 [0,2,0,0,0,0|0,0,0]=2 13660 B11R0.3 CCOCCOCCOCCBr 7a_100010132937_100000210202 [0,2,0,0,0,0|0,0,0]=2 13661 B11R0.3 CCOCCOCCOCCCl 34a_100000032323_100000210202 [0,2,0,0,0,0|0,0,0]=2 13662 B11R0.3 CCOCCOCCOCCCl 34a_100011215305_100000210147 [0,2,0,0,0,0|0,0,0]=2 13663 B11R0.3 CCOCCOCCOCCCl 7a_100000032323_100000210202 [0,2,0,0,0,0|0,0,0]=2 13664 B11R0.3 CCOCCOCCOCCCl 7a_100011215305_100011215890 [0,2,0,0,0,0|0,0,0]=2 13665 B11R0.3 CCOCCOCCOCCF 34a_100000210240_100011217306 [0,2,0,0,0,0|0,0,0]=2 13666 B11R0.3 CCOCCOCCOCCF 34a_200015357709_100000210147 [0,2,0,0,0,0|0,0,0]=2 13667 B11R0.3 CCOCCOCCOCCF 7a_100000210240_100011217306 [0,2,0,0,0,0|0,0,0]=2 13668 B11R0.3 CCOCCOCCOCCF 7a_200015357709_100011215890 [0,2,0,0,0,0|0,0,0]=2 13669 B11R0.3 CCOCCOCCOCCI 34a_100012149058_100000210147 [0,2,0,0,0,0|0,0,0]=2 13670 B11R0.3 CCOCCOCCOCCI 7a_100012149058_100011215890 [0,2,0,0,0,0|0,0,0]=2 13671 B11R0.3 CCOCCOCCOCCN 34a_100000210304_100011211534 [0,2,0,0,0,0|0,0,0]=2 13672 B11R0.3 CCOCCOCCOCCN 34a_100000211614_100000210147 [0,2,0,0,0,0|0,0,0]=2 13673 B11R0.3 CCOCCOCCOCCN 34a_100011998139_100000210202 [0,2,0,0,0,0|0,0,0]=2 13674 B11R0.3 CCOCCOCCOCCO 34a_100000210136_100000692535 [0,2,0,0,0,0|0,0,0]=2 13675 B11R0.3 CCOCCOCCOCCO 34a_100000210240_100000211926 [0,2,0,0,0,0|0,0,0]=2 13676 B11R0.3 CCOCCOCCOCCO 34a_100121572206_100000032323 [0,2,0,0,0,0|0,0,0]=2 13677 B11R0.3 CCOCCOCCOCCO 7a_100000210136_100011215305 [0,2,0,0,0,0|0,0,0]=2 13678 B11R0.3 CCOCCOCCOCCO 7a_100000210240_100000211926 [0,2,0,0,0,0|0,0,0]=2 13679 B11R0.3 CCOCCOCCOCSC 34a_100000210240_100011218213 [0,2,0,0,0,0|0,0,0]=2 13680 B11R0.3 CCOCCOCCSCC#N 62a_100011211534_100011215382 [0,2,0,0,0,0|0,1,0]=3 13681 B11R0.3 CCOCCOCCSCC#N 62a_100011215382_100011211534 [0,2,0,0,0,0|0,1,0]=3 13682 B11R0.3 CCOCCOCCSCC=O 62a_100011211534_200015260668 [0,2,0,0,0,0|0,1,0]=3 13683 B11R0.3 CCOCCOCCSCC=O 62a_200015260668_100011211534 [0,2,0,0,0,0|0,1,0]=3 13684 B11R0.3 CCOCCOCCSCCF 62a_100011211534_100011217306 [0,2,0,0,0,0|0,1,0]=3 13685 B11R0.3 CCOCCOCCSCCF 62a_100011217306_100011211534 [0,2,0,0,0,0|0,1,0]=3 13686 B11R0.3 CCOCCOCCSCCO 62a_100000211926_100011211534 [0,2,0,0,0,0|0,1,0]=3 13687 B11R0.3 CCOCCOCCSCCO 62a_100011211534_100000211926 [0,2,0,0,0,0|0,1,0]=3 13688 B11R0.3 CCOCCOCCSCOC 62a_100000766300_100011211534 [0,2,0,0,0,0|0,0,0]=2 13689 B11R0.3 CCOCCOCCSCOC 62a_100011211534_100000766300 [0,2,0,0,0,0|0,0,0]=2 13690 B11R0.3 CCOCCOCCSCSC 62a_100011211534_100011218213 [0,2,0,0,0,0|0,1,0]=3 13691 B11R0.3 CCOCCOCCSCSC 62a_100011218213_100011211534 [0,2,0,0,0,0|0,1,0]=3 13692 B11R0.3 CCOCCSCCCCC#N 62a_100000210147_100000211819 [0,2,0,0,0,0|1,1,0]=4 13693 B11R0.3 CCOCCSCCCCC#N 62a_100011219923_100011215890 [0,2,0,0,0,0|1,1,0]=4 13694 B11R0.3 CCOCCSCCCCC=O 62a_100000139335_100011215890 [0,2,0,0,0,0|1,1,0]=4 13695 B11R0.3 CCOCCSCCCCC=O 62a_100000210147_100000139335 [0,2,0,0,0,0|1,1,0]=4 13696 B11R0.3 CCOCCSCCCCCF 62a_100000210147_100000729378 [0,2,0,0,0,0|1,1,0]=4 13697 B11R0.3 CCOCCSCCCCCF 62a_100000729378_100011215890 [0,2,0,0,0,0|1,1,0]=4 13698 B11R0.3 CCOCCSCCCCCO 62a_100000210147_100000746330 [0,2,0,0,0,0|1,1,0]=4 13699 B11R0.3 CCOCCSCCCCCO 62a_100000746330_100011215890 [0,2,0,0,0,0|1,1,0]=4 13700 B11R0.3 CCOCCSCCCCOC 62a_100000210147_100000730899 [0,2,0,0,0,0|0,1,0]=3 13701 B11R0.3 CCOCCSCCCCOC 62a_100000730899_100011215890 [0,2,0,0,0,0|0,1,0]=3 13702 B11R0.3 CCOCCSCCOCC#N 62a_100000210147_200000047693 [0,2,0,0,0,0|0,1,0]=3 13703 B11R0.3 CCOCCSCCOCC#N 62a_200000047693_100011215890 [0,2,0,0,0,0|0,1,0]=3 13704 B11R0.3 CCOCCSCCOCCO 62a_100000210147_100011215305 [0,2,0,0,0,0|0,1,0]=3 13705 B11R0.3 CCOCCSCCOCCO 62a_100011215305_100011215890 [0,2,0,0,0,0|0,1,0]=3 13706 B11R0.3 CCOCCSCOCCOC 62a_100000210147_100000231047 [0,2,0,0,0,0|0,0,0]=2 13707 B11R0.3 CCOCCSCOCCOC 62a_100000231047_100011215890 [0,2,0,0,0,0|0,0,0]=2 13708 B11R0.3 CCOCSCCCCCCF 62a_100000739092_100015922095 [0,2,0,0,0,0|2,0,0]=4 13709 B11R0.3 CCOCSCCCCCCF 62a_100015922095_100000739092 [0,2,0,0,0,0|2,0,0]=4 13710 B11R0.3 CCOCSCCCCCCO 62a_100000739092_100000766143 [0,2,0,0,0,0|2,0,0]=4 13711 B11R0.3 CCOCSCCCCCCO 62a_100000766143_100000739092 [0,2,0,0,0,0|2,0,0]=4 13712 B11R0.3 CCOCSCCOCCOC 62a_100000695917_100000739092 [0,2,0,0,0,0|0,0,0]=2 13713 B11R0.3 CCOCSCCOCCOC 62a_100000739092_100000695917 [0,2,0,0,0,0|0,0,0]=2 13714 B11R0.3 CCSCCCOCCCCF 34a_100011216438_100000729493 [0,2,0,0,0,0|1,1,0]=4 13715 B11R0.3 CCSCCCOCCCCF 7a_100011216438_100000729493 [0,2,0,0,0,0|1,1,0]=4 13716 B11R0.3 CCSCCCOCCCCO 34a_100011216438_100011216708 [0,2,0,0,0,0|1,1,0]=4 13717 B11R0.3 CCSCCCOCCCCO 7a_100011216438_100000210776 [0,2,0,0,0,0|1,1,0]=4 13718 B11R0.3 CCSCCCOCCCOC 34a_100011216438_100000740836 [0,2,0,0,0,0|0,1,0]=3 13719 B11R0.3 CCSCCCOCCCOC 7a_100011216438_100000740836 [0,2,0,0,0,0|0,1,0]=3 13720 B11R0.3 CCSCCCOCCSCC 34a_100011216438_100000757381 [0,2,0,0,0,0|0,2,0]=4 13721 B11R0.3 CCSCCCOCCSCC 7a_100011216438_100000757381 [0,2,0,0,0,0|0,2,0]=4 13722 B11R0.3 CCSCCNCCCCOC 2230a_100000106463_100000730899 [0,2,0,0,0,0|1,1,0]=4 13723 B11R0.3 CCSCCNCCOCC#N 2230a_100000106463_200000047693 [0,2,0,0,0,0|1,1,0]=4 13724 B11R0.3 CCSCCNCCOCCO 2230a_100000106463_100011215305 [0,2,0,0,0,0|1,1,0]=4 13725 B11R0.3 CCSCCNCCOCCO 2230a_100000211614_100000757381 [0,2,0,0,0,0|1,1,0]=4 13726 B11R0.3 CCSCCNCCOCCO 34a_100000211614_100000757381 [0,2,0,0,0,0|1,1,0]=4 13727 B11R0.3 CCSCCNCOCCOC 2230a_100000106463_100000231047 [0,2,0,0,0,0|0,1,0]=3 13728 B11R0.3 CCSCCOCCCCC#N 7a_100000212035_100000211819 [0,2,0,0,0,0|1,1,0]=4 13729 B11R0.3 CCSCCOCCCCC=O 7a_100000212035_100000139335 [0,2,0,0,0,0|1,1,0]=4 13730 B11R0.3 CCSCCOCCCCCBr 34a_100000746331_100000757381 [0,2,0,0,0,0|1,1,0]=4 13731 B11R0.3 CCSCCOCCCCCBr 7a_100000746331_100000757381 [0,2,0,0,0,0|1,1,0]=4 13732 B11R0.3 CCSCCOCCCCCCl 34a_100000746330_100000757381 [0,2,0,0,0,0|1,1,0]=4 13733 B11R0.3 CCSCCOCCCCCCl 7a_100000746330_100000757381 [0,2,0,0,0,0|1,1,0]=4 13734 B11R0.3 CCSCCOCCCCCF 34a_100000212035_100000729378 [0,2,0,0,0,0|1,1,0]=4 13735 B11R0.3 CCSCCOCCCCCF 7a_100000212035_100000729378 [0,2,0,0,0,0|1,1,0]=4 13736 B11R0.3 CCSCCOCCCCCI 34a_200012148887_100000757381 [0,2,0,0,0,0|1,1,0]=4 13737 B11R0.3 CCSCCOCCCCCI 7a_200012148887_100000757381 [0,2,0,0,0,0|1,1,0]=4 13738 B11R0.3 CCSCCOCCCCCN 34a_100000762737_100000757381 [0,2,0,0,0,0|1,1,0]=4 13739 B11R0.3 CCSCCOCCCCCO 34a_100000212035_100000746330 [0,2,0,0,0,0|1,1,0]=4 13740 B11R0.3 CCSCCOCCCCCO 7a_100000212035_100000746330 [0,2,0,0,0,0|1,1,0]=4 13741 B11R0.3 CCSCCOCCCCOC 34a_100000212035_100000755781 [0,2,0,0,0,0|0,1,0]=3 13742 B11R0.3 CCSCCOCCCCOC 34a_100000740925_100000757381 [0,2,0,0,0,0|0,1,0]=3 13743 B11R0.3 CCSCCOCCCCOC 7a_100000212035_100000730899 [0,2,0,0,0,0|0,1,0]=3 13744 B11R0.3 CCSCCOCCCCSC 34a_100011217163_100000757381 [0,2,0,0,0,0|0,2,0]=4 13745 B11R0.3 CCSCCOCCCCSC 7a_100011217163_100000757381 [0,2,0,0,0,0|0,2,0]=4 13746 B11R0.3 CCSCCOCCOCC#N 7a_100000212035_200000047693 [0,2,0,0,0,0|0,1,0]=3 13747 B11R0.3 CCSCCOCCOCCBr 34a_100000692535_100000757381 [0,2,0,0,0,0|0,1,0]=3 13748 B11R0.3 CCSCCOCCOCCBr 7a_100000692535_100000757381 [0,2,0,0,0,0|0,1,0]=3 13749 B11R0.3 CCSCCOCCOCCCl 34a_100011215305_100000757381 [0,2,0,0,0,0|0,1,0]=3 13750 B11R0.3 CCSCCOCCOCCCl 7a_100011215305_100000757381 [0,2,0,0,0,0|0,1,0]=3 13751 B11R0.3 CCSCCOCCOCCF 34a_200015357709_100000757381 [0,2,0,0,0,0|0,1,0]=3 13752 B11R0.3 CCSCCOCCOCCF 7a_200015357709_100000757381 [0,2,0,0,0,0|0,1,0]=3 13753 B11R0.3 CCSCCOCCOCCI 34a_100012149058_100000757381 [0,2,0,0,0,0|0,1,0]=3 13754 B11R0.3 CCSCCOCCOCCI 7a_100012149058_100000757381 [0,2,0,0,0,0|0,1,0]=3 13755 B11R0.3 CCSCCOCCOCCN 34a_100000211614_100000757381 [0,2,0,0,0,0|0,1,0]=3 13756 B11R0.3 CCSCCOCCOCCO 34a_100000212035_100000692535 [0,2,0,0,0,0|0,1,0]=3 13757 B11R0.3 CCSCCOCCOCCO 62a_100000032323_100000210202 [0,2,0,0,0,0|0,1,0]=3 13758 B11R0.3 CCSCCOCCOCCO 62a_100000210202_100000032323 [0,2,0,0,0,0|0,1,0]=3 13759 B11R0.3 CCSCCOCCOCCO 7a_100000212035_100011215305 [0,2,0,0,0,0|0,1,0]=3 13760 B11R0.3 CCSCCSCCCCOC 62a_100000730899_100000757381 [0,2,0,0,0,0|0,2,0]=4 13761 B11R0.3 CCSCCSCCCCOC 62a_100000757381_100000730899 [0,2,0,0,0,0|0,2,0]=4 13762 B11R0.3 CCSCCSCCOCC#N 62a_100000757381_200000047693 [0,2,0,0,0,0|0,2,0]=4 13763 B11R0.3 CCSCCSCCOCC#N 62a_200000047693_100000757381 [0,2,0,0,0,0|0,2,0]=4 13764 B11R0.3 CCSCCSCCOCCO 62a_100000757381_100011215305 [0,2,0,0,0,0|0,2,0]=4 13765 B11R0.3 CCSCCSCCOCCO 62a_100011215305_100000757381 [0,2,0,0,0,0|0,2,0]=4 13766 B11R0.3 CCSCCSCOCCOC 62a_100000231047_100000757381 [0,2,0,0,0,0|0,1,0]=3 13767 B11R0.3 CCSCCSCOCCOC 62a_100000757381_100000231047 [0,2,0,0,0,0|0,1,0]=3 13768 B11R0.3 CNCCCCCOCCCF 34a_100000722520_100011934791 [0,2,0,0,0,0|2,0,0]=4 13769 B11R0.3 CNCCCCCOCCCO 34a_100000722520_100000230001 [0,2,0,0,0,0|2,0,0]=4 13770 B11R0.3 CNCCCCCOCCOC 34a_100000722520_100011201679 [0,2,0,0,0,0|1,0,0]=3 13771 B11R0.3 CNCCCCCOCCSC 34a_100000722520_100000212216 [0,2,0,0,0,0|1,1,0]=4 13772 B11R0.3 CNCCCOCCCCCF 34a_100000213112_100000729378 [0,2,0,0,0,0|2,0,0]=4 13773 B11R0.3 CNCCCOCCCCCO 34a_100000213112_100000746330 [0,2,0,0,0,0|2,0,0]=4 13774 B11R0.3 CNCCCOCCCCOC 34a_100000213112_100000755781 [0,2,0,0,0,0|2,0,0]=4 13775 B11R0.3 CNCCCOCCOCCO 2230a_100011996194_200000210301 [0,2,0,0,0,0|1,0,0]=3 13776 B11R0.3 CNCCCOCCOCCO 34a_100000213112_100000692535 [0,2,0,0,0,0|1,0,0]=3 13777 B11R0.3 CNCCCOCCOCCO 34a_100011996194_200000210301 [0,2,0,0,0,0|1,0,0]=3 13778 B11R0.3 CNCCOCCOCCCF 34a_100000228057_100011934791 [0,2,0,0,0,0|1,0,0]=3 13779 B11R0.3 CNCCOCCOCCCO 34a_100000228057_100000230001 [0,2,0,0,0,0|1,0,0]=3 13780 B11R0.3 CNCCOCCOCCOC 2230a_100012028300_200000210301 [0,2,0,0,0,0|0,0,0]=2 13781 B11R0.3 CNCCOCCOCCOC 2230a_106832991635_100013367474 [0,2,0,0,0,0|0,0,0]=2 13782 B11R0.3 CNCCOCCOCCOC 34a_100000228057_100011201679 [0,2,0,0,0,0|0,0,0]=2 13783 B11R0.3 CNCCOCCOCCOC 34a_100012028300_200000210301 [0,2,0,0,0,0|0,0,0]=2 13784 B11R0.3 CNCCOCCOCCOC 34a_100102657272_100013367474 [0,2,0,0,0,0|0,0,0]=2 13785 B11R0.3 CNCCOCCOCCOC 34a_200014138305_200000210301 [0,2,0,0,0,0|0,0,0]=2 13786 B11R0.3 CNCCOCCOCCOC 7a_106832991635_100013367474 [0,2,0,0,0,0|0,0,0]=2 13787 B11R0.3 CNCCOCCOCCO[13CH3] 34a_200014138305_200025704644 [0,2,0,0,0,0|0,0,0]=2 13788 B11R0.3 CNCCOCCOCCSC 34a_100000228057_100000212216 [0,2,0,0,0,0|0,1,0]=3 13789 B11R0.3 COCCCCCCCCCBr 34a_100009813782_200000210301 [0,2,0,0,0,0|2,0,0]=4 13790 B11R0.3 COCCCCCCCCCBr 7a_100009813782_200000210301 [0,2,0,0,0,0|2,0,0]=4 13791 B11R0.3 COCCCCCCCCCCl 34a_100009868337_200000210301 [0,2,0,0,0,0|2,0,0]=4 13792 B11R0.3 COCCCCCCCCCCl 7a_100009868337_200000210301 [0,2,0,0,0,0|2,0,0]=4 13793 B11R0.3 COCCCCCCCCCN 34a_100000078944_200000210301 [0,2,0,0,0,0|2,0,0]=4 13794 B11R0.3 COCCCCCCCCCO 34a_100138415774_100009813782 [0,2,0,0,0,0|2,0,0]=4 13795 B11R0.3 COCCCCCCNCCF 34a_100000724931_100011998445 [0,2,0,0,0,0|2,0,0]=4 13796 B11R0.3 COCCCCCCNCCO 2230a_100016997473_100011998445 [0,2,0,0,0,0|2,0,0]=4 13797 B11R0.3 COCCCCCCNCCO 34a_100016990907_100011998445 [0,2,0,0,0,0|2,0,0]=4 13798 B11R0.3 COCCCCCCOCC#N 7a_200012092642_100011215382 [0,2,0,0,0,0|1,0,1]=4 13799 B11R0.3 COCCCCCCOCC=O 34a_200012092642_200009817547 [0,2,0,0,0,0|1,0,1]=4 13800 B11R0.3 COCCCCCCOCC=O 7a_200012092642_200015260668 [0,2,0,0,0,0|1,0,1]=4 13801 B11R0.3 COCCCCCCOCCBr 34a_100000211926_100011998445 [0,2,0,0,0,0|1,0,0]=3 13802 B11R0.3 COCCCCCCOCCF 34a_200012092642_100011217306 [0,2,0,0,0,0|1,0,0]=3 13803 B11R0.3 COCCCCCCOCCF 7a_200012092642_100011217306 [0,2,0,0,0,0|1,0,0]=3 13804 B11R0.3 COCCCCCCOCCN 34a_100000210304_100011998445 [0,2,0,0,0,0|1,0,0]=3 13805 B11R0.3 COCCCCCCOCCO 34a_200012092642_100000211926 [0,2,0,0,0,0|1,0,0]=3 13806 B11R0.3 COCCCCCCOCCO 7a_200012092642_100000211926 [0,2,0,0,0,0|1,0,0]=3 13807 B11R0.3 COCCCCCCOCSC 34a_200012092642_100011218213 [0,2,0,0,0,0|1,0,0]=3 13808 B11R0.3 COCCCCCCSCCF 62a_100011217306_100011998445 [0,2,0,0,0,0|1,1,0]=4 13809 B11R0.3 COCCCCCCSCCF 62a_100011998445_100011217306 [0,2,0,0,0,0|1,1,0]=4 13810 B11R0.3 COCCCCCCSCCO 62a_100000211926_100011998445 [0,2,0,0,0,0|1,1,0]=4 13811 B11R0.3 COCCCCCCSCCO 62a_100011998445_100000211926 [0,2,0,0,0,0|1,1,0]=4 13812 B11R0.3 COCCCCCCSCOC 62a_100000766300_100011998445 [0,2,0,0,0,0|1,1,0]=4 13813 B11R0.3 COCCCCCCSCOC 62a_100011998445_100000766300 [0,2,0,0,0,0|1,1,0]=4 13814 B11R0.3 COCCCCCCSCSC 62a_100011218213_100011998445 [0,2,0,0,0,0|1,1,0]=4 13815 B11R0.3 COCCCCCCSCSC 62a_100011998445_100011218213 [0,2,0,0,0,0|1,1,0]=4 13816 B11R0.3 COCCCCCNCCC#N 2230a_100000747528_100011215226 [0,2,0,0,0,0|2,0,0]=4 13817 B11R0.3 COCCCCCNCCCF 2230a_100000747528_100011934791 [0,2,0,0,0,0|2,0,0]=4 13818 B11R0.3 COCCCCCNCCCF 34a_100000747528_100011934791 [0,2,0,0,0,0|2,0,0]=4 13819 B11R0.3 COCCCCCNCCCO 2230a_100000747528_100000230001 [0,2,0,0,0,0|2,0,0]=4 13820 B11R0.3 COCCCCCNCCCO 34a_100000747528_100000230001 [0,2,0,0,0,0|2,0,0]=4 13821 B11R0.3 COCCCCCNCCOC 2230a_100000747528_100011201679 [0,2,0,0,0,0|2,0,0]=4 13822 B11R0.3 COCCCCCNCCOC 34a_100000747528_100011201679 [0,2,0,0,0,0|2,0,0]=4 13823 B11R0.3 COCCCCCNCCSC 2230a_100000747528_100000751147 [0,2,0,0,0,0|2,0,0]=4 13824 B11R0.3 COCCCCCNCCSC 34a_100000747528_100000212216 [0,2,0,0,0,0|2,0,0]=4 13825 B11R0.3 COCCCCNCCCCO 2230a_100000750430_100000730899 [0,2,0,0,0,0|2,0,0]=4 13826 B11R0.3 COCCCCNCCCCO 34a_100000750430_100000755781 [0,2,0,0,0,0|2,0,0]=4 13827 B11R0.3 COCCCCNCCCOC 34a_100150723488_100000755781 [0,2,0,0,0,0|2,0,0]=4 13828 B11R0.3 COCCCCNCCCSC 2230a_100000749238_100000730899 [0,2,0,0,0,0|2,0,0]=4 13829 B11R0.3 COCCCCOCCCCBr 34a_100011216708_100000755781 [0,2,0,0,0,0|2,0,0]=4 13830 B11R0.3 COCCCCOCCCCCl 34a_100000210776_100000755781 [0,2,0,0,0,0|2,0,0]=4 13831 B11R0.3 COCCCCOCCCCCl 7a_100000210776_100000730899 [0,2,0,0,0,0|2,0,0]=4 13832 B11R0.3 COCCCCOCCCCF 34a_100000740925_100000729493 [0,2,0,0,0,0|2,0,0]=4 13833 B11R0.3 COCCCCOCCCCF 34a_100011995726_100000755781 [0,2,0,0,0,0|2,0,0]=4 13834 B11R0.3 COCCCCOCCCCF 7a_100011995726_100000730899 [0,2,0,0,0,0|2,0,0]=4 13835 B11R0.3 COCCCCOCCCCI 34a_200012148704_100000755781 [0,2,0,0,0,0|2,0,0]=4 13836 B11R0.3 COCCCCOCCCCN 34a_100000750430_100000755781 [0,2,0,0,0,0|2,0,0]=4 13837 B11R0.3 COCCCCOCCCCO 34a_100000740925_100011216708 [0,2,0,0,0,0|2,0,0]=4 13838 B11R0.3 COCCCCOCCCOC 34a_100000740835_100000755781 [0,2,0,0,0,0|1,0,0]=3 13839 B11R0.3 COCCCCOCCCOC 34a_100000740925_100000740836 [0,2,0,0,0,0|1,0,0]=3 13840 B11R0.3 COCCCCOCCCSC 34a_100000690336_100000755781 [0,2,0,0,0,0|1,1,0]=4 13841 B11R0.3 COCCCCOCCCSC 7a_100000690336_100000730899 [0,2,0,0,0,0|1,1,0]=4 13842 B11R0.3 COCCCCSCCCCF 62a_100000729493_100000730899 [0,2,0,0,0,0|2,0,0]=4 13843 B11R0.3 COCCCCSCCCCF 62a_100000730899_100000729493 [0,2,0,0,0,0|2,0,0]=4 13844 B11R0.3 COCCCCSCCCCO 62a_100000210776_100000730899 [0,2,0,0,0,0|2,0,0]=4 13845 B11R0.3 COCCCCSCCCCO 62a_100000730899_100000210776 [0,2,0,0,0,0|2,0,0]=4 13846 B11R0.3 COCCCCSCCCOC 62a_100000709357_100000730899 [0,2,0,0,0,0|1,1,0]=4 13847 B11R0.3 COCCCCSCCCOC 62a_100000730899_100000709357 [0,2,0,0,0,0|1,1,0]=4 13848 B11R0.3 COCCCNCCCCCF 34a_100150723488_100000729378 [0,2,0,0,0,0|2,0,0]=4 13849 B11R0.3 COCCCNCCCCCO 2230a_100000762737_100000740836 [0,2,0,0,0,0|2,0,0]=4 13850 B11R0.3 COCCCNCCCCCO 34a_100000762737_100000740836 [0,2,0,0,0,0|2,0,0]=4 13851 B11R0.3 COCCCNCCCCCO 34a_100150723488_100000746330 [0,2,0,0,0,0|2,0,0]=4 13852 B11R0.3 COCCCNCCOCCO 2230a_100000211614_100000740836 [0,2,0,0,0,0|1,0,0]=3 13853 B11R0.3 COCCCNCCOCCO 34a_100000211614_100000740836 [0,2,0,0,0,0|1,0,0]=3 13854 B11R0.3 COCCCNCCOCCO 34a_100150723488_100000692535 [0,2,0,0,0,0|1,0,0]=3 13855 B11R0.3 COCCCNCCSCCO 2230a_100011219999_100000740836 [0,2,0,0,0,0|1,1,0]=4 13856 B11R0.3 COCCCOCCCCCBr 34a_100000746331_100000740836 [0,2,0,0,0,0|1,0,0]=3 13857 B11R0.3 COCCCOCCCCCBr 7a_100000746331_100000740836 [0,2,0,0,0,0|1,0,0]=3 13858 B11R0.3 COCCCOCCCCCCl 34a_100000746330_100000740836 [0,2,0,0,0,0|1,0,0]=3 13859 B11R0.3 COCCCOCCCCCCl 7a_100000746330_100000740836 [0,2,0,0,0,0|1,0,0]=3 13860 B11R0.3 COCCCOCCCCCF 34a_100000740835_100000729378 [0,2,0,0,0,0|1,0,0]=3 13861 B11R0.3 COCCCOCCCCCI 34a_200012148887_100000740836 [0,2,0,0,0,0|1,0,0]=3 13862 B11R0.3 COCCCOCCCCCI 7a_200012148887_100000740836 [0,2,0,0,0,0|1,0,0]=3 13863 B11R0.3 COCCCOCCCCCN 34a_100000762737_100000740836 [0,2,0,0,0,0|1,0,0]=3 13864 B11R0.3 COCCCOCCCCCO 34a_100000740835_100000746330 [0,2,0,0,0,0|1,0,0]=3 13865 B11R0.3 COCCCOCCCCSC 34a_100011217163_100000740836 [0,2,0,0,0,0|1,0,0]=3 13866 B11R0.3 COCCCOCCCCSC 7a_100011217163_100000740836 [0,2,0,0,0,0|1,0,0]=3 13867 B11R0.3 COCCCOCCCOCF 34a_200011215475_100015361967 [0,2,0,0,0,0|1,0,0]=3 13868 B11R0.3 COCCCOCCCOCF 7a_200011215475_100015361967 [0,2,0,0,0,0|1,0,0]=3 13869 B11R0.3 COCCCOCCOCCBr 34a_100000692535_100000740836 [0,2,0,0,0,0|0,0,0]=2 13870 B11R0.3 COCCCOCCOCCBr 7a_100000692535_100000740836 [0,2,0,0,0,0|0,0,0]=2 13871 B11R0.3 COCCCOCCOCCCl 34a_100011215305_100000740836 [0,2,0,0,0,0|0,0,0]=2 13872 B11R0.3 COCCCOCCOCCCl 7a_100011215305_100000740836 [0,2,0,0,0,0|0,0,0]=2 13873 B11R0.3 COCCCOCCOCCF 34a_200015357709_100000740836 [0,2,0,0,0,0|0,0,0]=2 13874 B11R0.3 COCCCOCCOCCF 7a_200015357709_100000740836 [0,2,0,0,0,0|0,0,0]=2 13875 B11R0.3 COCCCOCCOCCI 34a_100012149058_100000740836 [0,2,0,0,0,0|0,0,0]=2 13876 B11R0.3 COCCCOCCOCCI 7a_100012149058_100000740836 [0,2,0,0,0,0|0,0,0]=2 13877 B11R0.3 COCCCOCCOCCN 34a_100000211614_100000740836 [0,2,0,0,0,0|0,0,0]=2 13878 B11R0.3 COCCCOCCOCCO 34a_100000740835_100000692535 [0,2,0,0,0,0|0,0,0]=2 13879 B11R0.3 COCCCSCCCCCF 62a_100000709357_100000729378 [0,2,0,0,0,0|1,1,0]=4 13880 B11R0.3 COCCCSCCCCCF 62a_100000729378_100000709357 [0,2,0,0,0,0|1,1,0]=4 13881 B11R0.3 COCCCSCCCCCO 62a_100000709357_100000746330 [0,2,0,0,0,0|1,1,0]=4 13882 B11R0.3 COCCCSCCCCCO 62a_100000746330_100000709357 [0,2,0,0,0,0|1,1,0]=4 13883 B11R0.3 COCCCSCCOCC#N 62a_100000709357_200000047693 [0,2,0,0,0,0|0,1,1]=4 13884 B11R0.3 COCCCSCCOCC#N 62a_200000047693_100000709357 [0,2,0,0,0,0|0,1,1]=4 13885 B11R0.3 COCCCSCCOCCO 62a_100000709357_100011215305 [0,2,0,0,0,0|0,1,0]=3 13886 B11R0.3 COCCCSCCOCCO 62a_100011215305_100000709357 [0,2,0,0,0,0|0,1,0]=3 13887 B11R0.3 COCCCSCOCCOC 62a_100000231047_100000709357 [0,2,0,0,0,0|1,0,0]=3 13888 B11R0.3 COCCCSCOCCOC 62a_100000709357_100000231047 [0,2,0,0,0,0|1,0,0]=3 13889 B11R0.3 COCCNCCCCCC#N 2230a_100000209980_100009813376 [0,2,0,0,0,0|2,0,0]=4 13890 B11R0.3 COCCNCCCCCC=O 2230a_100000209980_100000139337 [0,2,0,0,0,0|2,0,0]=4 13891 B11R0.3 COCCNCCCCCCF 2230a_100000209980_100015922095 [0,2,0,0,0,0|2,0,0]=4 13892 B11R0.3 COCCNCCCCCCO 2230a_100000209980_100000766143 [0,2,0,0,0,0|2,0,0]=4 13893 B11R0.3 COCCNCCCCCCO 2230a_100000686447_100011201679 [0,2,0,0,0,0|2,0,0]=4 13894 B11R0.3 COCCNCCCCCCO 34a_100000686447_100011201679 [0,2,0,0,0,0|2,0,0]=4 13895 B11R0.3 COCCNCCOCCOC 2230a_100000209980_100000695917 [0,2,0,0,0,0|1,0,0]=3 13896 B11R0.3 COCCNCCOCCOC 2230a_100000745349_100011201679 [0,2,0,0,0,0|1,0,0]=3 13897 B11R0.3 COCCNCCOCCOC 34a_100000745349_100011201679 [0,2,0,0,0,0|1,0,0]=3 13898 B11R0.3 COCCOCCCCCCBr 34a_100011215345_100011201679 [0,2,0,0,0,0|1,0,0]=3 13899 B11R0.3 COCCOCCCCCCBr 7a_100011215345_100000233755 [0,2,0,0,0,0|1,0,0]=3 13900 B11R0.3 COCCOCCCCCCCl 34a_100000766143_100011201679 [0,2,0,0,0,0|1,0,0]=3 13901 B11R0.3 COCCOCCCCCCCl 7a_100000766143_100000233755 [0,2,0,0,0,0|1,0,0]=3 13902 B11R0.3 COCCOCCCCCCF 34a_100000210237_100015922095 [0,2,0,0,0,0|1,0,0]=3 13903 B11R0.3 COCCOCCCCCCF 34a_100000732779_100011201679 [0,2,0,0,0,0|1,0,0]=3 13904 B11R0.3 COCCOCCCCCCF 7a_100000732779_100000233755 [0,2,0,0,0,0|1,0,0]=3 13905 B11R0.3 COCCOCCCCCCN 34a_100000686447_100011201679 [0,2,0,0,0,0|1,0,0]=3 13906 B11R0.3 COCCOCCCCCCO 34a_100000210237_100000766143 [0,2,0,0,0,0|1,0,0]=3 13907 B11R0.3 COCCOCCCNCC#N 2230a_100000206027_100011215382 [0,2,0,0,0,0|1,0,1]=4 13908 B11R0.3 COCCOCCCNCC=O 2230a_100000206027_200015260668 [0,2,0,0,0,0|1,0,1]=4 13909 B11R0.3 COCCOCCCNCC=O 34a_100000206027_200009817547 [0,2,0,0,0,0|1,0,1]=4 13910 B11R0.3 COCCOCCCNCCF 2230a_100000206027_100011217306 [0,2,0,0,0,0|1,0,0]=3 13911 B11R0.3 COCCOCCCNCCF 34a_100000206027_100011217306 [0,2,0,0,0,0|1,0,0]=3 13912 B11R0.3 COCCOCCCNCCF 34a_100000724931_100011216529 [0,2,0,0,0,0|1,0,0]=3 13913 B11R0.3 COCCOCCCNCCO 2230a_100000206027_100000211926 [0,2,0,0,0,0|1,0,0]=3 13914 B11R0.3 COCCOCCCNCCO 2230a_100016997473_100011216529 [0,2,0,0,0,0|1,0,0]=3 13915 B11R0.3 COCCOCCCNCCO 34a_100000206027_100000211926 [0,2,0,0,0,0|1,0,0]=3 13916 B11R0.3 COCCOCCCNCCO 34a_100016990907_100011216529 [0,2,0,0,0,0|1,0,0]=3 13917 B11R0.3 COCCOCCCNCOC 2230a_100000206027_100000766300 [0,2,0,0,0,0|1,0,0]=3 13918 B11R0.3 COCCOCCCNCSC 2230a_100000206027_100011218213 [0,2,0,0,0,0|1,0,0]=3 13919 B11R0.3 COCCOCCCNCSC 34a_100000206027_100011218213 [0,2,0,0,0,0|1,0,0]=3 13920 B11R0.3 COCCOCCCOCCBr 34a_100000211926_100011216529 [0,2,0,0,0,0|0,0,0]=2 13921 B11R0.3 COCCOCCCOCCN 34a_100000210304_100011216529 [0,2,0,0,0,0|0,0,0]=2 13922 B11R0.3 COCCOCCCSCC#N 62a_100011215382_100011216529 [0,2,0,0,0,0|0,1,1]=4 13923 B11R0.3 COCCOCCCSCC#N 62a_100011216529_100011215382 [0,2,0,0,0,0|0,1,1]=4 13924 B11R0.3 COCCOCCCSCC=O 62a_100011216529_200015260668 [0,2,0,0,0,0|0,1,1]=4 13925 B11R0.3 COCCOCCCSCC=O 62a_200015260668_100011216529 [0,2,0,0,0,0|0,1,1]=4 13926 B11R0.3 COCCOCCCSCCF 62a_100011216529_100011217306 [0,2,0,0,0,0|0,1,0]=3 13927 B11R0.3 COCCOCCCSCCF 62a_100011217306_100011216529 [0,2,0,0,0,0|0,1,0]=3 13928 B11R0.3 COCCOCCCSCCO 62a_100000211926_100011216529 [0,2,0,0,0,0|0,1,0]=3 13929 B11R0.3 COCCOCCCSCCO 62a_100011216529_100000211926 [0,2,0,0,0,0|0,1,0]=3 13930 B11R0.3 COCCOCCCSCOC 62a_100000766300_100011216529 [0,2,0,0,0,0|0,1,0]=3 13931 B11R0.3 COCCOCCCSCOC 62a_100011216529_100000766300 [0,2,0,0,0,0|0,1,0]=3 13932 B11R0.3 COCCOCCCSCSC 62a_100011216529_100011218213 [0,2,0,0,0,0|0,1,0]=3 13933 B11R0.3 COCCOCCCSCSC 62a_100011218213_100011216529 [0,2,0,0,0,0|0,1,0]=3 13934 B11R0.3 COCCOCCNCCC#N 2230a_100000745349_100011215226 [0,2,0,0,0,0|1,0,0]=3 13935 B11R0.3 COCCOCCNCCCF 2230a_100000745349_100011934791 [0,2,0,0,0,0|1,0,0]=3 13936 B11R0.3 COCCOCCNCCCF 2230a_100015189416_100000695917 [0,2,0,0,0,0|1,0,0]=3 13937 B11R0.3 COCCOCCNCCCF 34a_100000745349_100011934791 [0,2,0,0,0,0|1,0,0]=3 13938 B11R0.3 COCCOCCNCCCF 34a_100015189416_100000695917 [0,2,0,0,0,0|1,0,0]=3 13939 B11R0.3 COCCOCCNCCCO 2230a_100000745349_100000230001 [0,2,0,0,0,0|1,0,0]=3 13940 B11R0.3 COCCOCCNCCCO 34a_100000745349_100000230001 [0,2,0,0,0,0|1,0,0]=3 13941 B11R0.3 COCCOCCNCCSC 2230a_100000745349_100000751147 [0,2,0,0,0,0|1,0,0]=3 13942 B11R0.3 COCCOCCNCCSC 2230a_100020590264_100000695917 [0,2,0,0,0,0|1,0,0]=3 13943 B11R0.3 COCCOCCNCCSC 34a_100000745349_100000212216 [0,2,0,0,0,0|1,0,0]=3 13944 B11R0.3 COCCOCCOCCC#N 7a_100011215163_100000184422 [0,2,0,0,0,0|0,0,0]=2 13945 B11R0.3 COCCOCCOCCCBr 34a_100011217188_100000695917 [0,2,0,0,0,0|0,0,0]=2 13946 B11R0.3 COCCOCCOCCCCl 34a_100000230001_100000695917 [0,2,0,0,0,0|0,0,0]=2 13947 B11R0.3 COCCOCCOCCCF 34a_100000759539_100000695917 [0,2,0,0,0,0|0,0,0]=2 13948 B11R0.3 COCCOCCOCCCF 34a_100011215163_100011934791 [0,2,0,0,0,0|0,0,0]=2 13949 B11R0.3 COCCOCCOCCCF 7a_100011215163_100011934791 [0,2,0,0,0,0|0,0,0]=2 13950 B11R0.3 COCCOCCOCCCN 34a_100000182051_100000695917 [0,2,0,0,0,0|0,0,0]=2 13951 B11R0.3 COCCOCCOCCCN 34a_100011996194_200000210301 [0,2,0,0,0,0|0,0,0]=2 13952 B11R0.3 COCCOCCOCCCO 34a_100011215163_100000230001 [0,2,0,0,0,0|0,0,0]=2 13953 B11R0.3 COCCOCCOCCCO 7a_100011215163_100011215043 [0,2,0,0,0,0|0,0,0]=2 13954 B11R0.3 COCCOCCOCCN[13CH3] 2230a_100012028300_200025704644 [0,2,0,0,0,0|0,0,0]=2 13955 B11R0.3 COCCOCCOCCN[13CH3] 34a_100012028300_200025704644 [0,2,0,0,0,0|0,0,0]=2 13956 B11R0.3 COCCOCCOCCOC 34a_100000210237_100000695917 [0,2,0,0,0,0|0,0,0]=2 13957 B11R0.3 COCCOCCOCCOC 34a_100000688194_200000210301 [0,2,0,0,0,0|0,0,0]=2 13958 B11R0.3 COCCOCCOCCOC 34a_100011215163_100011201679 [0,2,0,0,0,0|0,0,0]=2 13959 B11R0.3 COCCOCCOCCOC 34a_100138415774_100013367474 [0,2,0,0,0,0|0,0,0]=2 13960 B11R0.3 COCCOCCOCCOC 7a_100000688194_200000210301 [0,2,0,0,0,0|0,0,0]=2 13961 B11R0.3 COCCOCCOCCOC 7a_100011215163_100000233755 [0,2,0,0,0,0|0,0,0]=2 13962 B11R0.3 COCCOCCOCCON 34a_100000700252_100000695917 [0,2,0,0,0,0|0,0,0]=2 13963 B11R0.3 COCCOCCOCCO[13CH3] 34a_100000688194_200025704644 [0,2,0,0,0,0|0,0,0]=2 13964 B11R0.3 COCCOCCOCCO[13CH3] 7a_100000688194_200025704644 [0,2,0,0,0,0|0,0,0]=2 13965 B11R0.3 COCCOCCOCCSC 34a_100000230434_100000695917 [0,2,0,0,0,0|0,0,0]=2 13966 B11R0.3 COCCOCCOCCSC 34a_100011215163_100000212216 [0,2,0,0,0,0|0,0,0]=2 13967 B11R0.3 COCCOCCOCCSC 62a_100013367474_200000210301 [0,2,0,0,0,0|0,0,0]=2 13968 B11R0.3 COCCOCCOCCSC 62a_200000210301_100013367474 [0,2,0,0,0,0|0,0,0]=2 13969 B11R0.3 COCCOCCOCCSC 7a_100000230434_100000695917 [0,2,0,0,0,0|0,0,0]=2 13970 B11R0.3 COCCOCCOCCSC 7a_100011215163_100000212216 [0,2,0,0,0,0|0,0,0]=2 13971 B11R0.3 COCCOCCOCCS[13CH3] 62a_100013367474_200025704644 [0,2,0,0,0,0|0,0,0]=2 13972 B11R0.3 COCCOCCOCCS[13CH3] 62a_200025704644_100013367474 [0,2,0,0,0,0|0,0,0]=2 13973 B11R0.3 COCCOCCSCCC#N 62a_100000695917_100011215226 [0,2,0,0,0,0|0,1,0]=3 13974 B11R0.3 COCCOCCSCCC#N 62a_100011215226_100000695917 [0,2,0,0,0,0|0,1,0]=3 13975 B11R0.3 COCCOCCSCCCF 62a_100000695917_100011934791 [0,2,0,0,0,0|0,1,0]=3 13976 B11R0.3 COCCOCCSCCCF 62a_100011934791_100000695917 [0,2,0,0,0,0|0,1,0]=3 13977 B11R0.3 COCCOCCSCCCO 62a_100000695917_100011215043 [0,2,0,0,0,0|0,1,0]=3 13978 B11R0.3 COCCOCCSCCCO 62a_100011215043_100000695917 [0,2,0,0,0,0|0,1,0]=3 13979 B11R0.3 COCCOCCSCCOC 62a_100000233755_100000695917 [0,2,0,0,0,0|0,1,0]=3 13980 B11R0.3 COCCOCCSCCOC 62a_100000695917_100000233755 [0,2,0,0,0,0|0,1,0]=3 13981 B11R0.3 COCCOCCSCCSC 62a_100000212216_100000695917 [0,2,0,0,0,0|0,1,0]=3 13982 B11R0.3 COCCOCCSCCSC 62a_100000695917_100000751147 [0,2,0,0,0,0|0,1,0]=3 13983 B11R0.3 COCCOCCSCSC#N 62a_100000211825_100000695917 [0,2,0,0,0,0|0,1,1]=4 13984 B11R0.3 COCCOCCSCSC#N 62a_100000695917_100000211825 [0,2,0,0,0,0|0,1,1]=4 13985 B11R0.3 COCCOCNCCCCO 2230a_100000750430_100000231047 [0,2,0,0,0,0|1,0,0]=3 13986 B11R0.3 COCCOCNCCCSC 2230a_100000749238_100000231047 [0,2,0,0,0,0|1,0,0]=3 13987 B11R0.3 COCCOCSCC#CCO 62a_100000231047_200000047223 [0,2,0,0,0,0|1,0,1]=4 13988 B11R0.3 COCCOCSCC#CCO 62a_200000047223_100000231047 [0,2,0,0,0,0|1,0,1]=4 13989 B11R0.3 COCCOCSCCCC#N 62a_100000231047_100000687738 [0,2,0,0,0,0|1,0,1]=4 13990 B11R0.3 COCCOCSCCCC#N 62a_100000687738_100000231047 [0,2,0,0,0,0|1,0,1]=4 13991 B11R0.3 COCCOCSCCCC=O 62a_100000231047_200011292268 [0,2,0,0,0,0|1,0,1]=4 13992 B11R0.3 COCCOCSCCCC=O 62a_200011292268_100000231047 [0,2,0,0,0,0|1,0,1]=4 13993 B11R0.3 COCCOCSCCCCF 62a_100000231047_100000729493 [0,2,0,0,0,0|1,0,0]=3 13994 B11R0.3 COCCOCSCCCCF 62a_100000729493_100000231047 [0,2,0,0,0,0|1,0,0]=3 13995 B11R0.3 COCCOCSCCCCO 62a_100000210776_100000231047 [0,2,0,0,0,0|1,0,0]=3 13996 B11R0.3 COCCOCSCCCCO 62a_100000231047_100000210776 [0,2,0,0,0,0|1,0,0]=3 13997 B11R0.3 COCCSCCCCCC#N 62a_100000233755_100009813376 [0,2,0,0,0,0|1,1,0]=4 13998 B11R0.3 COCCSCCCCCC#N 62a_100009813376_100000233755 [0,2,0,0,0,0|1,1,0]=4 13999 B11R0.3 COCCSCCCCCC=O 62a_100000139337_100000233755 [0,2,0,0,0,0|1,1,0]=4 14000 B11R0.3 COCCSCCCCCC=O 62a_100000233755_100000139337 [0,2,0,0,0,0|1,1,0]=4 14001 B11R0.3 COCCSCCCCCCF 62a_100000233755_100015922095 [0,2,0,0,0,0|1,1,0]=4 14002 B11R0.3 COCCSCCCCCCF 62a_100015922095_100000233755 [0,2,0,0,0,0|1,1,0]=4 14003 B11R0.3 COCCSCCCCCCO 62a_100000233755_100000766143 [0,2,0,0,0,0|1,1,0]=4 14004 B11R0.3 COCCSCCCCCCO 62a_100000766143_100000233755 [0,2,0,0,0,0|1,1,0]=4 14005 B11R0.3 COCNCCCCCCCO 2230a_100011996573_100000766300 [0,2,0,0,0,0|2,0,0]=4 14006 B11R0.3 COCNCCCOCCCO 2230a_100011310245_100000766300 [0,2,0,0,0,0|2,0,0]=4 14007 B11R0.3 COCSCCCCCCCO 62a_100000760002_100000766300 [0,2,0,0,0,0|2,0,0]=4 14008 B11R0.3 COCSCCCCCCCO 62a_100000766300_100000760002 [0,2,0,0,0,0|2,0,0]=4 14009 B11R0.3 CSCCCCOCCCCF 34a_100011217163_100000729493 [0,2,0,0,0,0|2,0,0]=4 14010 B11R0.3 CSCCCCOCCCCF 7a_100011217163_100000729493 [0,2,0,0,0,0|2,0,0]=4 14011 B11R0.3 CSCCCCOCCCCO 34a_100011217163_100011216708 [0,2,0,0,0,0|2,0,0]=4 14012 B11R0.3 CSCCCCOCCCCO 7a_100011217163_100000210776 [0,2,0,0,0,0|2,0,0]=4 14013 B11R0.3 CSCCCNCCOCCO 2230a_100000749238_100011215305 [0,2,0,0,0,0|1,1,0]=4 14014 B11R0.3 CSCCCOCCCCCF 34a_100000690336_100000729378 [0,2,0,0,0,0|1,1,0]=4 14015 B11R0.3 CSCCCOCCCCCF 7a_100000690336_100000729378 [0,2,0,0,0,0|1,1,0]=4 14016 B11R0.3 CSCCCOCCCCCO 34a_100000690336_100000746330 [0,2,0,0,0,0|1,1,0]=4 14017 B11R0.3 CSCCCOCCCCCO 7a_100000690336_100000746330 [0,2,0,0,0,0|1,1,0]=4 14018 B11R0.3 CSCCCOCCOCC#N 7a_100000690336_200000047693 [0,2,0,0,0,0|0,1,1]=4 14019 B11R0.3 CSCCCOCCOCCO 34a_100000690336_100000692535 [0,2,0,0,0,0|0,1,0]=3 14020 B11R0.3 CSCCCOCCOCCO 7a_100000690336_100011215305 [0,2,0,0,0,0|0,1,0]=3 14021 B11R0.3 CSCCOCCCCCC#N 7a_100000230434_100009813376 [0,2,0,0,0,0|1,1,0]=4 14022 B11R0.3 CSCCOCCCCCC=O 7a_100000230434_100000139337 [0,2,0,0,0,0|1,1,0]=4 14023 B11R0.3 CSCCOCCCCCCBr 34a_100011215345_100000212216 [0,2,0,0,0,0|1,1,0]=4 14024 B11R0.3 CSCCOCCCCCCBr 7a_100011215345_100000212216 [0,2,0,0,0,0|1,1,0]=4 14025 B11R0.3 CSCCOCCCCCCCl 34a_100000766143_100000212216 [0,2,0,0,0,0|1,1,0]=4 14026 B11R0.3 CSCCOCCCCCCCl 7a_100000766143_100000212216 [0,2,0,0,0,0|1,1,0]=4 14027 B11R0.3 CSCCOCCCCCCF 34a_100000230434_100015922095 [0,2,0,0,0,0|1,1,0]=4 14028 B11R0.3 CSCCOCCCCCCF 34a_100000732779_100000212216 [0,2,0,0,0,0|1,1,0]=4 14029 B11R0.3 CSCCOCCCCCCF 7a_100000230434_100015922095 [0,2,0,0,0,0|1,1,0]=4 14030 B11R0.3 CSCCOCCCCCCF 7a_100000732779_100000212216 [0,2,0,0,0,0|1,1,0]=4 14031 B11R0.3 CSCCOCCCCCCN 34a_100000686447_100000212216 [0,2,0,0,0,0|1,1,0]=4 14032 B11R0.3 CSCCOCCCCCCO 34a_100000230434_100000766143 [0,2,0,0,0,0|1,1,0]=4 14033 B11R0.3 CSCCOCCCCCCO 7a_100000230434_100000766143 [0,2,0,0,0,0|1,1,0]=4 14034 B11R0.3 CSCOCCCCCCCBr 34a_100000760002_100011218213 [0,2,0,0,0,0|2,0,0]=4 14035 B11R0.3 CSCOCCCCCCCN 34a_100011996573_100011218213 [0,2,0,0,0,0|2,0,0]=4 14036 B11R0.3 CSCOCCCOCCCN 34a_100011310245_100011218213 [0,2,0,0,0,0|2,0,0]=4 14037 B11R0.3 FCCCCCOCCCCBr 34a_100011216708_100000729378 [0,2,0,0,0,0|2,0,0]=4 14038 B11R0.3 FCCCCCOCCCCCl 34a_100000210776_100000729378 [0,2,0,0,0,0|2,0,0]=4 14039 B11R0.3 FCCCCCOCCCCCl 7a_100000210776_100000729378 [0,2,0,0,0,0|2,0,0]=4 14040 B11R0.3 FCCCCCOCCCCF 34a_100011995726_100000729378 [0,2,0,0,0,0|2,0,0]=4 14041 B11R0.3 FCCCCCOCCCCF 7a_100011995726_100000729378 [0,2,0,0,0,0|2,0,0]=4 14042 B11R0.3 FCCCCCOCCCCI 34a_200012148704_100000729378 [0,2,0,0,0,0|2,0,0]=4 14043 B11R0.3 FCCCCOCCCCCBr 34a_100000746331_100000729493 [0,2,0,0,0,0|2,0,0]=4 14044 B11R0.3 FCCCCOCCCCCBr 7a_100000746331_100000729493 [0,2,0,0,0,0|2,0,0]=4 14045 B11R0.3 FCCCCOCCCCCCl 34a_100000746330_100000729493 [0,2,0,0,0,0|2,0,0]=4 14046 B11R0.3 FCCCCOCCCCCCl 7a_100000746330_100000729493 [0,2,0,0,0,0|2,0,0]=4 14047 B11R0.3 FCCCCOCCCCCI 34a_200012148887_100000729493 [0,2,0,0,0,0|2,0,0]=4 14048 B11R0.3 FCCCCOCCCCCI 7a_200012148887_100000729493 [0,2,0,0,0,0|2,0,0]=4 14049 B11R0.3 FCCCCOCCOCCBr 34a_100000692535_100000729493 [0,2,0,0,0,0|1,0,0]=3 14050 B11R0.3 FCCCCOCCOCCBr 7a_100000692535_100000729493 [0,2,0,0,0,0|1,0,0]=3 14051 B11R0.3 FCCCCOCCOCCCl 34a_100011215305_100000729493 [0,2,0,0,0,0|1,0,0]=3 14052 B11R0.3 FCCCCOCCOCCCl 7a_100011215305_100000729493 [0,2,0,0,0,0|1,0,0]=3 14053 B11R0.3 FCCCCOCCOCCF 34a_200015357709_100000729493 [0,2,0,0,0,0|1,0,0]=3 14054 B11R0.3 FCCCCOCCOCCF 7a_200015357709_100000729493 [0,2,0,0,0,0|1,0,0]=3 14055 B11R0.3 FCCCCOCCOCCI 34a_100012149058_100000729493 [0,2,0,0,0,0|1,0,0]=3 14056 B11R0.3 FCCCCOCCOCCI 7a_100012149058_100000729493 [0,2,0,0,0,0|1,0,0]=3 14057 B11R0.3 FCCOCCCCCCCBr 34a_100000760002_100011217306 [0,2,0,0,0,0|2,0,0]=4 14058 B11R0.3 FCCOCCCCCCCBr 7a_100000760002_100011217306 [0,2,0,0,0,0|2,0,0]=4 14059 B11R0.3 FCOCCCCCCCCBr 34a_100009813846_100015361967 [0,2,0,0,0,0|2,0,0]=4 14060 B11R0.3 FCOCCCCCCCCBr 7a_100009813846_100015361967 [0,2,0,0,0,0|2,0,0]=4 14061 B11R0.3 FCOCCCCCCCCCl 34a_100000033203_100015361967 [0,2,0,0,0,0|2,0,0]=4 14062 B11R0.3 FCOCCCCCCCCCl 7a_100000033203_100015361967 [0,2,0,0,0,0|2,0,0]=4 14063 B11R0.3 FCOCCOCCOCCBr 34a_100010132937_100015361967 [0,2,0,0,0,0|0,0,0]=2 14064 B11R0.3 FCOCCOCCOCCBr 7a_100010132937_100015361967 [0,2,0,0,0,0|0,0,0]=2 14065 B11R0.3 FCOCCOCCOCCCl 34a_100000032323_100015361967 [0,2,0,0,0,0|0,0,0]=2 14066 B11R0.3 FCOCCOCCOCCCl 7a_100000032323_100015361967 [0,2,0,0,0,0|0,0,0]=2 14067 B11R0.3 N#CCCCOCCOCCBr 7a_100000692535_100000687738 [0,2,0,0,0,0|1,0,1]=4 14068 B11R0.3 N#CCCCOCCOCCCl 7a_100011215305_100000687738 [0,2,0,0,0,0|1,0,1]=4 14069 B11R0.3 N#CCCCOCCOCCF 7a_200015357709_100000687738 [0,2,0,0,0,0|1,0,1]=4 14070 B11R0.3 N#CCCCOCCOCCI 7a_100012149058_100000687738 [0,2,0,0,0,0|1,0,1]=4 14071 B11R0.3 N#CCOCCOCCCCCl 7a_100000210776_200000047693 [0,2,0,0,0,0|1,0,1]=4 14072 B11R0.3 N#CCOCCOCCCCF 7a_100011995726_200000047693 [0,2,0,0,0,0|1,0,1]=4 14073 B11R0.3 NCCCCCCCCOCF 34a_102515433106_100015361967 [0,2,0,0,0,0|2,0,0]=4 14074 B11R0.3 NCCCCCCCOCCF 34a_100011996573_100011217306 [0,2,0,0,0,0|2,0,0]=4 14075 B11R0.3 NCCCCCCCOCCO 34a_100011996573_100000211926 [0,2,0,0,0,0|2,0,0]=4 14076 B11R0.3 NCCCCCOCCCCF 34a_100000762737_100000729493 [0,2,0,0,0,0|2,0,0]=4 14077 B11R0.3 NCCCCCOCCCCO 34a_100000762737_100011216708 [0,2,0,0,0,0|2,0,0]=4 14078 B11R0.3 NCCCCOCCCCCF 34a_100000750430_100000729378 [0,2,0,0,0,0|2,0,0]=4 14079 B11R0.3 NCCCCOCCCCCO 34a_100000750430_100000746330 [0,2,0,0,0,0|2,0,0]=4 14080 B11R0.3 NCCCCOCCOCCO 34a_100000750430_100000692535 [0,2,0,0,0,0|1,0,0]=3 14081 B11R0.3 NCCCOCCCOCCF 34a_100011310245_100011217306 [0,2,0,0,0,0|2,0,0]=4 14082 B11R0.3 NCCCOCCCOCCO 34a_100011310245_100000211926 [0,2,0,0,0,0|2,0,0]=4 14083 B11R0.3 NCCNCCCCCOCF 34a_103619048469_100015361967 [0,2,0,0,0,0|2,0,0]=4 14084 B11R0.3 NCCOCCCCCCCO 34a_100000210304_100000760002 [0,2,0,0,0,0|2,0,0]=4 14085 B11R0.3 NCCOCCOCC#CCO 34a_100000211614_200000047223 [0,2,0,0,0,0|1,0,1]=4 14086 B11R0.3 NCCOCCOCCCCF 34a_100000211614_100000729493 [0,2,0,0,0,0|1,0,0]=3 14087 B11R0.3 NCCOCCOCCCCO 34a_100000211614_100011216708 [0,2,0,0,0,0|1,0,0]=3 14088 B11R0.3 NCCOCCOCCOCF 34a_100011998139_100015361967 [0,2,0,0,0,0|0,0,0]=2 14089 B11R0.3 NOCCOCCCCCCF 34a_100000700252_100015922095 [0,2,0,0,0,0|2,0,0]=4 14090 B11R0.3 NOCCOCCCCCCO 34a_100000700252_100000766143 [0,2,0,0,0,0|2,0,0]=4 14091 B11R0.3 O=CCCCOCCOCCBr 7a_100000692535_200011292268 [0,2,0,0,0,0|1,0,1]=4 14092 B11R0.3 O=CCCCOCCOCCCl 7a_100011215305_200011292268 [0,2,0,0,0,0|1,0,1]=4 14093 B11R0.3 O=CCCCOCCOCCF 7a_200015357709_200011292268 [0,2,0,0,0,0|1,0,1]=4 14094 B11R0.3 O=CCCCOCCOCCI 7a_100012149058_200011292268 [0,2,0,0,0,0|1,0,1]=4 14095 B11R0.3 OCC#CCOCCOCCBr 34a_100000692535_200000047223 [0,2,0,0,0,0|1,0,1]=4 14096 B11R0.3 OCC#CCOCCOCCBr 7a_100000692535_200000047223 [0,2,0,0,0,0|1,0,1]=4 14097 B11R0.3 OCC#CCOCCOCCCl 34a_100011215305_200000047223 [0,2,0,0,0,0|1,0,1]=4 14098 B11R0.3 OCC#CCOCCOCCCl 7a_100011215305_200000047223 [0,2,0,0,0,0|1,0,1]=4 14099 B11R0.3 OCC#CCOCCOCCF 34a_200015357709_200000047223 [0,2,0,0,0,0|1,0,1]=4 14100 B11R0.3 OCC#CCOCCOCCF 7a_200015357709_200000047223 [0,2,0,0,0,0|1,0,1]=4 14101 B11R0.3 OCC#CCOCCOCCI 34a_100012149058_200000047223 [0,2,0,0,0,0|1,0,1]=4 14102 B11R0.3 OCC#CCOCCOCCI 7a_100012149058_200000047223 [0,2,0,0,0,0|1,0,1]=4 14103 B11R0.3 OCCCCCCCOCCBr 34a_100000211926_100000760002 [0,2,0,0,0,0|2,0,0]=4 14104 B11R0.3 OCCCCCOCCCCBr 34a_100011216708_100000746330 [0,2,0,0,0,0|2,0,0]=4 14105 B11R0.3 OCCCCCOCCCCCl 34a_100000210776_100000746330 [0,2,0,0,0,0|2,0,0]=4 14106 B11R0.3 OCCCCCOCCCCCl 7a_100000210776_100000746330 [0,2,0,0,0,0|2,0,0]=4 14107 B11R0.3 OCCCCCOCCCCF 34a_100011995726_100000746330 [0,2,0,0,0,0|2,0,0]=4 14108 B11R0.3 OCCCCCOCCCCF 7a_100011995726_100000746330 [0,2,0,0,0,0|2,0,0]=4 14109 B11R0.3 OCCCCCOCCCCI 34a_200012148704_100000746330 [0,2,0,0,0,0|2,0,0]=4 14110 B11R0.3 OCCCCNCCOCCO 2230a_100000211614_100000210776 [0,2,0,0,0,0|2,0,0]=4 14111 B11R0.3 OCCCCNCCOCCO 2230a_100000750430_100011215305 [0,2,0,0,0,0|2,0,0]=4 14112 B11R0.3 OCCCCNCCOCCO 34a_100000211614_100011216708 [0,2,0,0,0,0|2,0,0]=4 14113 B11R0.3 OCCCCNCCOCCO 34a_100000750430_100000692535 [0,2,0,0,0,0|2,0,0]=4 14114 B11R0.3 OCCCCOCCCCCBr 34a_100000746331_100011216708 [0,2,0,0,0,0|2,0,0]=4 14115 B11R0.3 OCCCCOCCCCCBr 7a_100000746331_100000210776 [0,2,0,0,0,0|2,0,0]=4 14116 B11R0.3 OCCCCOCCCCCCl 34a_100000746330_100011216708 [0,2,0,0,0,0|2,0,0]=4 14117 B11R0.3 OCCCCOCCCCCCl 7a_100000746330_100000210776 [0,2,0,0,0,0|2,0,0]=4 14118 B11R0.3 OCCCCOCCCCCI 34a_200012148887_100011216708 [0,2,0,0,0,0|2,0,0]=4 14119 B11R0.3 OCCCCOCCCCCI 7a_200012148887_100000210776 [0,2,0,0,0,0|2,0,0]=4 14120 B11R0.3 OCCCCOCCOCCBr 34a_100000692535_100011216708 [0,2,0,0,0,0|1,0,0]=3 14121 B11R0.3 OCCCCOCCOCCBr 7a_100000692535_100000210776 [0,2,0,0,0,0|1,0,0]=3 14122 B11R0.3 OCCCCOCCOCCCl 34a_100011215305_100011216708 [0,2,0,0,0,0|1,0,0]=3 14123 B11R0.3 OCCCCOCCOCCCl 7a_100011215305_100000210776 [0,2,0,0,0,0|1,0,0]=3 14124 B11R0.3 OCCCCOCCOCCF 34a_200015357709_100011216708 [0,2,0,0,0,0|1,0,0]=3 14125 B11R0.3 OCCCCOCCOCCF 7a_200015357709_100000210776 [0,2,0,0,0,0|1,0,0]=3 14126 B11R0.3 OCCCCOCCOCCI 34a_100012149058_100011216708 [0,2,0,0,0,0|1,0,0]=3 14127 B11R0.3 OCCCCOCCOCCI 7a_100012149058_100000210776 [0,2,0,0,0,0|1,0,0]=3 14128 B11R0.3 OCCCCSCCOCCO 62a_100000210776_100011215305 [0,2,0,0,0,0|1,1,0]=4 14129 B11R0.3 OCCCCSCCOCCO 62a_100011215305_100000210776 [0,2,0,0,0,0|1,1,0]=4 14130 B11R0.3 OCCOCCCCCCCBr 34a_100000760002_100000211926 [0,2,0,0,0,0|2,0,0]=4 14131 B11R0.3 OCCOCCCCCCCBr 7a_100000760002_100000211926 [0,2,0,0,0,0|2,0,0]=4 14132 B11R0.3 OCCOCCNCCCCF 2230a_100000211614_100000729493 [0,2,0,0,0,0|2,0,0]=4 14133 B11R0.3 OCCOCCNCCCCF 34a_100000211614_100000729493 [0,2,0,0,0,0|2,0,0]=4 14134 B11R0.3 OCCOCCOCC#CCCl 34a_200000047223_100000692535 [0,2,0,0,0,0|1,0,1]=4 14135 B11R0.3 OCCOCCOCCCCBr 34a_100011216708_100000692535 [0,2,0,0,0,0|1,0,0]=3 14136 B11R0.3 OCCOCCOCCCCCl 34a_100000210776_100000692535 [0,2,0,0,0,0|1,0,0]=3 14137 B11R0.3 OCCOCCOCCCCCl 7a_100000210776_100011215305 [0,2,0,0,0,0|1,0,0]=3 14138 B11R0.3 OCCOCCOCCCCF 34a_100011995726_100000692535 [0,2,0,0,0,0|1,0,0]=3 14139 B11R0.3 OCCOCCOCCCCF 7a_100011995726_100011215305 [0,2,0,0,0,0|1,0,0]=3 14140 B11R0.3 OCCOCCOCCCCI 34a_200012148704_100000692535 [0,2,0,0,0,0|1,0,0]=3 14141 B11R0.3 OCCOCCOCCNCF 34a_100011998139_100015361967 [0,2,0,0,0,0|1,0,0]=3 14142 B11R0.3 OCCOCCOCCSCF 62a_100000032323_100015361967 [0,2,0,0,0,0|0,1,0]=3 14143 B11R0.3 OCCOCCOCCSCF 62a_100015361967_100000032323 [0,2,0,0,0,0|0,1,0]=3 14144 B11R0.3 OCCOCCSCCCCF 62a_100000729493_100011215305 [0,2,0,0,0,0|1,1,0]=4 14145 B11R0.3 OCCOCCSCCCCF 62a_100011215305_100000729493 [0,2,0,0,0,0|1,1,0]=4 14146 B11R0.3 [13CH3]NCCCOCCOCCO 2230a_100011996194_200025704644 [0,2,0,0,0,0|1,0,0]=3 14147 B11R0.3 [13CH3]NCCCOCCOCCO 34a_100011996194_200025704644 [0,2,0,0,0,0|1,0,0]=3 14148 B11R0.3 [13CH3]OCCCCCCCCCBr 34a_100009813782_200025704644 [0,2,0,0,0,0|2,0,0]=4 14149 B11R0.3 [13CH3]OCCCCCCCCCBr 7a_100009813782_200025704644 [0,2,0,0,0,0|2,0,0]=4 14150 B11R0.3 [13CH3]OCCCCCCCCCCl 34a_100009868337_200025704644 [0,2,0,0,0,0|2,0,0]=4 14151 B11R0.3 [13CH3]OCCCCCCCCCCl 7a_100009868337_200025704644 [0,2,0,0,0,0|2,0,0]=4 14152 B11R0.3 [13CH3]OCCCCCCCCCN 34a_100000078944_200025704644 [0,2,0,0,0,0|2,0,0]=4 14153 B11R0.3 [13CH3]OCCOCCOCCCN 34a_100011996194_200025704644 [0,2,0,0,0,0|0,0,0]=2 14154 B11R0.140 C#CCOCC(=O)OCCOC 34a_100000210247_200000040189 [0,2,0,0,0,0|0,0,2]=4 14155 B11R0.140 C#CCOCC(C)OCCCC 34a_100011025554_100000210210 [0,2,0,0,0,0|1,0,1]=4 14156 B11R0.140 C#CCOCC(C)OCCCC 7a_100011025554_100000210211 [0,2,0,0,0,0|1,0,1]=4 14157 B11R0.140 C#CCOCC(C)OCCOC 34a_100011025554_100011201679 [0,2,0,0,0,0|0,0,1]=3 14158 B11R0.140 C#CCOCC(C)OCCOC 7a_100011025554_100000233755 [0,2,0,0,0,0|0,0,1]=3 14159 B11R0.140 C#CCOCC(C)OCCSC 34a_100011025554_100000212216 [0,2,0,0,0,0|0,1,1]=4 14160 B11R0.140 C#CCOCC(C)OCCSC 7a_100011025554_100000212216 [0,2,0,0,0,0|0,1,1]=4 14161 B11R0.140 C=CCOCC(=O)OCCOC 34a_200000210373_200000040189 [0,2,0,0,0,0|0,0,2]=4 14162 B11R0.140 C=COCCC(=O)CCOCC 1458a_100000749530_100000039644 [0,2,0,0,0,0|1,0,1]=4 14163 B11R0.140 CCC#CCC(C)OCCCC 34a_200000035118_100000210210 [0,2,0,0,0,0|2,0,0]=4 14164 B11R0.140 CCC#CCC(C)OCCCC 7a_200000035118_100000210211 [0,2,0,0,0,0|2,0,0]=4 14165 B11R0.140 CCC#CCC(C)OCCOC 34a_200000035118_100011201679 [0,2,0,0,0,0|1,0,0]=3 14166 B11R0.140 CCC#CCC(C)OCCOC 7a_200000035118_100000233755 [0,2,0,0,0,0|1,0,0]=3 14167 B11R0.140 CCC#CCC(C)OCCSC 34a_200000035118_100000212216 [0,2,0,0,0,0|1,1,0]=4 14168 B11R0.140 CCC#CCC(C)OCCSC 7a_200000035118_100000212216 [0,2,0,0,0,0|1,1,0]=4 14169 B11R0.140 CCCCCC(=O)CCCOC 1458a_100000212188_100000740836 [0,2,0,0,0,0|2,0,0]=4 14170 B11R0.140 CCCCCC(=O)CCCOC 1458a_100000741012_100000210326 [0,2,0,0,0,0|2,0,0]=4 14171 B11R0.140 CCCCCC(=O)CCOCC 1458a_100000212188_100011215890 [0,2,0,0,0,0|2,0,0]=4 14172 B11R0.140 CCCCCC(=O)CCOCC 1458a_100000749530_100000210326 [0,2,0,0,0,0|2,0,0]=4 14173 B11R0.140 CCCCCC(=O)CSCOC 62a_100000766300_200012276598 [0,2,0,0,0,0|2,0,0]=4 14174 B11R0.140 CCCCCC(=O)CSCOC 62a_200012276598_100000766300 [0,2,0,0,0,0|2,0,0]=4 14175 B11R0.140 CCCCCC(=O)NCCOC 1626a_100000209980_100000212188 [0,2,0,0,0,0|2,0,0]=4 14176 B11R0.140 CCCCCC(=O)NCCOC 240690a_100000209980_100000212188 [0,2,0,0,0,0|2,0,0]=4 14177 B11R0.140 CCCCCC(=O)NCCOC 527a_100000209980_100000212188 [0,2,0,0,0,0|2,0,0]=4 14178 B11R0.140 CCCCCC(C)NCCOC 2230a_100000209980_200011218191 [0,2,0,0,0,0|2,0,0]=4 14179 B11R0.140 CCCCCC(C)NCCOC 2230a_100000211957_100011201679 [0,2,0,0,0,0|2,0,0]=4 14180 B11R0.140 CCCCCC(C)NCCOC 270004a_100000209980_100000211708 [0,2,0,0,0,0|2,0,0]=4 14181 B11R0.140 CCCCCC(C)OCCCC 34a_100000210227_200011218191 [0,2,0,0,0,0|2,0,0]=4 14182 B11R0.140 CCCCCC(C)OCCCC 34a_100011215632_100000210210 [0,2,0,0,0,0|2,0,0]=4 14183 B11R0.140 CCCCCC(C)OCCCC 7a_100000210227_200011218191 [0,2,0,0,0,0|2,0,0]=4 14184 B11R0.140 CCCCCC(C)OCCCC 7a_100011215632_100000210211 [0,2,0,0,0,0|2,0,0]=4 14185 B11R0.140 CCCCCC(C)OCCOC 34a_100000210237_200011218191 [0,2,0,0,0,0|1,0,0]=3 14186 B11R0.140 CCCCCC(C)OCCOC 34a_100011215632_100011201679 [0,2,0,0,0,0|1,0,0]=3 14187 B11R0.140 CCCCCC(C)OCCOC 7a_100011215632_100000233755 [0,2,0,0,0,0|1,0,0]=3 14188 B11R0.140 CCCCCC(C)OCCON 34a_100000700252_200011218191 [0,2,0,0,0,0|2,0,0]=4 14189 B11R0.140 CCCCCC(C)OCCSC 34a_100000230434_200011218191 [0,2,0,0,0,0|1,1,0]=4 14190 B11R0.140 CCCCCC(C)OCCSC 34a_100011215632_100000212216 [0,2,0,0,0,0|1,1,0]=4 14191 B11R0.140 CCCCCC(C)OCCSC 7a_100000230434_200011218191 [0,2,0,0,0,0|1,1,0]=4 14192 B11R0.140 CCCCCC(C)OCCSC 7a_100011215632_100000212216 [0,2,0,0,0,0|1,1,0]=4 14193 B11R0.140 CCCCCC(C)SCCOC 62a_100000233755_200011218191 [0,2,0,0,0,0|1,1,0]=4 14194 B11R0.140 CCCCCC(C)SCCOC 62a_200011218191_100000233755 [0,2,0,0,0,0|1,1,0]=4 14195 B11R0.140 CCCCCC(C)SCOCC 62a_100000739092_200011218191 [0,2,0,0,0,0|2,0,0]=4 14196 B11R0.140 CCCCCC(C)SCOCC 62a_200011218191_100000739092 [0,2,0,0,0,0|2,0,0]=4 14197 B11R0.140 CCCCCN(C)CCCOC 2230a_100000223495_100000740836 [0,2,0,0,0,0|2,0,0]=4 14198 B11R0.140 CCCCCN(C)CCCOC 2230a_100000224831_100000210326 [0,2,0,0,0,0|2,0,0]=4 14199 B11R0.140 CCCCCN(C)CCCOC 269982a_100000223495_100000740836 [0,2,0,0,0,0|2,0,0]=4 14200 B11R0.140 CCCCCN(C)CCCOC 269982a_100000224831_100000210215 [0,2,0,0,0,0|2,0,0]=4 14201 B11R0.140 CCCCCN(C)CCOCC 2230a_100000223495_100011215890 [0,2,0,0,0,0|2,0,0]=4 14202 B11R0.140 CCCCCN(C)CCOCC 269982a_100000223495_100011215890 [0,2,0,0,0,0|2,0,0]=4 14203 B11R0.140 CCCCNC(=O)CCOCC 11a_100000102301_100000749530 [0,2,0,0,0,0|2,0,0]=4 14204 B11R0.140 CCCCNC(=O)CCOCC 1626a_100000102301_100000749530 [0,2,0,0,0,0|2,0,0]=4 14205 B11R0.140 CCCCNC(=O)CCOCC 240690a_100000102301_100000749530 [0,2,0,0,0,0|2,0,0]=4 14206 B11R0.140 CCCCNC(=O)CCOCC 527a_100000102301_100000749530 [0,2,0,0,0,0|2,0,0]=4 14207 B11R0.140 CCCCNC(C)CCOCC 270004a_100000102301_200011216536 [0,2,0,0,0,0|2,0,0]=4 14208 B11R0.140 CCCCOC(=O)COCCBr 34a_100000211926_100000211628 [0,2,0,0,0,0|1,0,1]=4 14209 B11R0.140 CCCCOC(=O)COCCC 34a_100000210258_100000211628 [0,2,0,0,0,0|1,0,1]=4 14210 B11R0.140 CCCCOC(=O)COCCN 34a_100000210304_100000211628 [0,2,0,0,0,0|1,0,1]=4 14211 B11R0.140 CCCCOC(C)CCCOC 34a_200011539412_100000210210 [0,2,0,0,0,0|2,0,0]=4 14212 B11R0.140 CCCCOC(C)CCCOC 7a_200011539412_100000210211 [0,2,0,0,0,0|2,0,0]=4 14213 B11R0.140 CCCOCC(=O)CCCOC 1458a_100000745993_100000740836 [0,2,0,0,0,0|1,0,1]=4 14214 B11R0.140 CCCOCC(=O)CCOCC 1458a_100000745993_100011215890 [0,2,0,0,0,0|2,0,0]=4 14215 B11R0.140 CCCOCC(=O)NCCOC 1626a_100000209980_100000745993 [0,2,0,0,0,0|1,0,1]=4 14216 B11R0.140 CCCOCC(=O)NCCOC 240690a_100000209980_100000745993 [0,2,0,0,0,0|1,0,1]=4 14217 B11R0.140 CCCOCC(=O)NCCOC 34a_100000210258_100000183275 [0,2,0,0,0,0|1,0,1]=4 14218 B11R0.140 CCCOCC(=O)NCCOC 527a_100000209980_100000745993 [0,2,0,0,0,0|1,0,1]=4 14219 B11R0.140 CCCOCC(=O)OCCOC 34a_100000210258_200000040189 [0,2,0,0,0,0|0,0,1]=3 14220 B11R0.140 CCCSCC(=O)CCOCC 1458a_100000217233_100011215890 [0,2,0,0,0,0|2,0,0]=4 14221 B11R0.140 CCCSCC(=O)OCCOC 62a_100000210303_200000040189 [0,2,0,0,0,0|0,1,1]=4 14222 B11R0.140 CCCSCC(=O)OCCOC 62a_200000040189_100000210303 [0,2,0,0,0,0|0,1,1]=4 14223 B11R0.140 CCCSCC(C)NCCOC 270004a_100000209980_100011343953 [0,2,0,0,0,0|1,1,0]=4 14224 B11R0.140 CCOCCC(=O)C=CCOC 1458a_100016285016_100011215890 [0,2,0,0,0,0|1,0,1]=4 14225 B11R0.140 CCOCCC(=O)CCCCF 1458a_100000749530_100000729493 [0,2,0,0,0,0|2,0,0]=4 14226 B11R0.140 CCOCCC(=O)CCCCO 1458a_100000695505_100011215890 [0,2,0,0,0,0|2,0,0]=4 14227 B11R0.140 CCOCCC(=O)CCCCO 1458a_100000749530_100000210776 [0,2,0,0,0,0|2,0,0]=4 14228 B11R0.140 CCOCCC(=O)CCCOC 1458a_100000741012_100011215890 [0,2,0,0,0,0|1,0,0]=3 14229 B11R0.140 CCOCCC(=O)CCCOC 1458a_100000749530_100000740836 [0,2,0,0,0,0|1,0,0]=3 14230 B11R0.140 CCOCCC(=O)CCCSC 1458a_100000173376_100011215890 [0,2,0,0,0,0|1,1,0]=4 14231 B11R0.140 CCOCCC(=O)CCOCC 1458a_100000749530_100011215890 [0,2,0,0,0,0|1,0,0]=3 14232 B11R0.140 CCOCCC(=O)CCSCC 1458a_100000230768_100011215890 [0,2,0,0,0,0|1,1,0]=4 14233 B11R0.140 CCOCCC(=O)CCSCC 1458a_100000749530_100000757381 [0,2,0,0,0,0|1,1,0]=4 14234 B11R0.140 CCOCCC(=O)NCCOC 1626a_100000209980_100000749530 [0,2,0,0,0,0|1,0,0]=3 14235 B11R0.140 CCOCCC(=O)NCCOC 240690a_100000209980_100000749530 [0,2,0,0,0,0|1,0,0]=3 14236 B11R0.140 CCOCCC(=O)NCCOC 527a_100000209980_100000749530 [0,2,0,0,0,0|1,0,0]=3 14237 B11R0.140 CCOCCC(=O)NCCSC 11a_100020590264_100000749530 [0,2,0,0,0,0|1,1,0]=4 14238 B11R0.140 CCOCCC(=O)NCCSC 1626a_100020590264_100000749530 [0,2,0,0,0,0|1,1,0]=4 14239 B11R0.140 CCOCCC(=O)NCCSC 240690a_100020590264_100000749530 [0,2,0,0,0,0|1,1,0]=4 14240 B11R0.140 CCOCCC(=O)NCCSC 527a_100020590264_100000749530 [0,2,0,0,0,0|1,1,0]=4 14241 B11R0.140 CCOCCC(C)NCCOC 270004a_100000209980_200011216536 [0,2,0,0,0,0|1,0,0]=3 14242 B11R0.140 CCOCCC(C)NCCSC 270004a_100020590264_200011216536 [0,2,0,0,0,0|1,1,0]=4 14243 B11R0.140 CCOCCN(C)CCCCO 2230a_100000717598_100011215890 [0,2,0,0,0,0|2,0,0]=4 14244 B11R0.140 CCOCCN(C)CCCCO 269982a_100000717598_100011215890 [0,2,0,0,0,0|2,0,0]=4 14245 B11R0.140 CCOCCN(C)CCCOC 2230a_100000224831_100011215890 [0,2,0,0,0,0|1,0,0]=3 14246 B11R0.140 CCOCCN(C)CCCOC 269982a_100000224831_100011215890 [0,2,0,0,0,0|1,0,0]=3 14247 B11R0.140 CCOCCN(C)CCOCC 2230a_100011216575_200000210301 [0,2,0,0,0,0|1,0,0]=3 14248 B11R0.140 CCOCCN(C)CCOCC 269982a_100011216575_200000210301 [0,2,0,0,0,0|1,0,0]=3 14249 B11R0.140 CCOCCN([13CH3])CCOCC 2230a_100011216575_200025704644 [0,2,0,0,0,0|1,0,0]=3 14250 B11R0.140 CCOCCN([13CH3])CCOCC 269982a_100011216575_200025704644 [0,2,0,0,0,0|1,0,0]=3 14251 B11R0.140 CCSCCC(=O)CCCOC 1458a_100000230768_100000740836 [0,2,0,0,0,0|1,1,0]=4 14252 B11R0.140 CCSCCC(=O)CCCOC 1458a_100000741012_100000757381 [0,2,0,0,0,0|1,1,0]=4 14253 B11R0.140 CCSCCC(=O)NCCOC 1626a_100000209980_100000230768 [0,2,0,0,0,0|1,1,0]=4 14254 B11R0.140 CCSCCC(=O)NCCOC 240690a_100000209980_100000230768 [0,2,0,0,0,0|1,1,0]=4 14255 B11R0.140 CCSCCC(=O)NCCOC 527a_100000209980_100000230768 [0,2,0,0,0,0|1,1,0]=4 14256 B11R0.140 CCSCCN(C)CCCOC 2230a_100000224831_100000757381 [0,2,0,0,0,0|1,1,0]=4 14257 B11R0.140 CCSCCN(C)CCCOC 269982a_100000224831_100000757381 [0,2,0,0,0,0|1,1,0]=4 14258 B11R0.140 COCCCC(=O)COCCO 1458a_100000708028_100000740836 [0,2,0,0,0,0|1,0,1]=4 14259 B11R0.140 COCCCC(C)OCCOC 34a_200011539412_100011201679 [0,2,0,0,0,0|1,0,0]=3 14260 B11R0.140 COCCCC(C)OCCOC 7a_200011539412_100000233755 [0,2,0,0,0,0|1,0,0]=3 14261 B11R0.140 COCCCC(C)OCCSC 34a_200011539412_100000212216 [0,2,0,0,0,0|1,1,0]=4 14262 B11R0.140 COCCCC(C)OCCSC 7a_200011539412_100000212216 [0,2,0,0,0,0|1,1,0]=4 14263 B11R0.140 COCCNC(=O)COCCBr 34a_100000211926_100000183275 [0,2,0,0,0,0|1,0,1]=4 14264 B11R0.140 COCCNC(=O)COCCN 34a_100000210304_100000183275 [0,2,0,0,0,0|1,0,1]=4 14265 B11R0.140 COCCNC(=O)COCCO 1626a_100000209980_100000708028 [0,2,0,0,0,0|1,0,1]=4 14266 B11R0.140 COCCNC(=O)COCCO 240690a_100000209980_100000708028 [0,2,0,0,0,0|1,0,1]=4 14267 B11R0.140 COCCNC(C)CCCSC 270004a_100000209980_100011399439 [0,2,0,0,0,0|2,0,0]=4 14268 B11R0.140 COCCOC(=O)CNCCF 34a_100000724931_200000040189 [0,2,0,0,0,0|1,0,1]=4 14269 B11R0.140 COCCOC(=O)CNCCO 2230a_100016997473_200000040189 [0,2,0,0,0,0|1,0,1]=4 14270 B11R0.140 COCCOC(=O)CNCCO 34a_100016990907_200000040189 [0,2,0,0,0,0|1,0,1]=4 14271 B11R0.140 COCCOC(=O)COCCBr 34a_100000211926_200000040189 [0,2,0,0,0,0|0,0,1]=3 14272 B11R0.140 COCCOC(=O)COCCN 34a_100000210304_200000040189 [0,2,0,0,0,0|0,0,1]=3 14273 B11R0.140 COCCOC(=O)CSCCF 62a_100011217306_200000040189 [0,2,0,0,0,0|0,1,1]=4 14274 B11R0.140 COCCOC(=O)CSCCF 62a_200000040189_100011217306 [0,2,0,0,0,0|0,1,1]=4 14275 B11R0.140 COCCOC(=O)CSCCO 62a_100000211926_200000040189 [0,2,0,0,0,0|0,1,1]=4 14276 B11R0.140 COCCOC(=O)CSCCO 62a_200000040189_100000211926 [0,2,0,0,0,0|0,1,1]=4 14277 B11R0.140 COCCOC(=O)CSCOC 62a_100000766300_200000040189 [0,2,0,0,0,0|0,1,1]=4 14278 B11R0.140 COCCOC(=O)CSCOC 62a_200000040189_100000766300 [0,2,0,0,0,0|0,1,1]=4 14279 B11R0.140 COCCOC(=O)CSCSC 62a_100011218213_200000040189 [0,2,0,0,0,0|0,1,1]=4 14280 B11R0.140 COCCOC(=O)CSCSC 62a_200000040189_100011218213 [0,2,0,0,0,0|0,1,1]=4 14281 B11R0.49 C/C=C/CCOCC(C)(C)OC 34a_100016278192_100000701081 [0,2,0,0,0,0|1,0,1]=4 14282 B11R0.49 C=COCCOCC(C)(C)OC 34a_100000033082_100000701081 [0,2,0,0,0,0|0,0,2]=4 14283 B11R0.49 CC#CCCOCC(C)(C)OC 34a_100000750427_100000701081 [0,2,0,0,0,0|1,0,1]=4 14284 B11R0.49 CC/C=C\COCC(C)(C)OC 34a_100016268518_100000701081 [0,2,0,0,0,0|1,0,1]=4 14285 B11R0.49 CCC#CCOCC(C)(C)OC 34a_100000032950_100000701081 [0,2,0,0,0,0|1,0,1]=4 14286 B11R0.49 CCC(C)(C)NCOCCOC 2230a_100000211385_100000231047 [0,2,0,0,0,0|2,0,0]=4 14287 B11R0.49 CCC(C)(C)SCOCCOC 62a_100000032637_100000231047 [0,2,0,0,0,0|2,0,0]=4 14288 B11R0.49 CCC(C)(C)SCOCCOC 62a_100000231047_100000032637 [0,2,0,0,0,0|2,0,0]=4 14289 B11R0.49 CCCCCCCC(C)(C)OC 34a_100138415774_200000046972 [0,2,0,0,0,0|2,0,0]=4 14290 B11R0.49 CCCCCNCC(C)(C)OC 2230a_100000763424_100000210326 [0,2,0,0,0,0|2,0,0]=4 14291 B11R0.49 CCCCCOCC(C)(C)CC 7a_100000765029_100000210326 [0,2,0,0,0,0|2,0,0]=4 14292 B11R0.49 CCCCCOCC(C)(C)OC 34a_100000210253_100000701081 [0,2,0,0,0,0|1,0,0]=3 14293 B11R0.49 CCCCCSCC(C)(C)OC 62a_100000210326_100000701081 [0,2,0,0,0,0|1,1,0]=4 14294 B11R0.49 CCCCCSCC(C)(C)OC 62a_100000701081_100000210326 [0,2,0,0,0,0|1,1,0]=4 14295 B11R0.49 CCCCOCCS(=O)(=O)CC 34a_100000210227_100000756660 [0,2,0,0,0,0|1,1,0]=4 14296 B11R0.49 CCCCOCCS(=O)(=O)CC 34a_200011216379_100000210210 [0,2,0,0,0,0|1,1,0]=4 14297 B11R0.49 CCCCOCCS(=O)(=O)CC 7a_100000210227_100000756660 [0,2,0,0,0,0|1,1,0]=4 14298 B11R0.49 CCCCOCCS(=O)(=O)CC 7a_200011216379_100000210211 [0,2,0,0,0,0|1,1,0]=4 14299 B11R0.49 CCOCCNCC(C)(C)OC 2230a_100000763424_100011215890 [0,2,0,0,0,0|1,0,0]=3 14300 B11R0.49 CCOCCNCC(C)(C)OC 34a_102516460346_100000701081 [0,2,0,0,0,0|1,0,0]=3 14301 B11R0.49 CCOCCNCC(C)(C)SC 270004a_102516460346_100009845794 [0,2,0,0,0,0|1,1,0]=4 14302 B11R0.49 CCOCCOCC(C)(C)CC 7a_100000765029_100011215890 [0,2,0,0,0,0|1,0,0]=3 14303 B11R0.49 CCOCCOCC(C)(C)CCl 7a_100011217199_100011215890 [0,2,0,0,0,0|2,0,0]=4 14304 B11R0.49 CCOCCOCC(C)(C)CO 34a_100000210136_100009813988 [0,2,0,0,0,0|2,0,0]=4 14305 B11R0.49 CCOCCOCC(C)(C)CO 7a_100000210136_100009813988 [0,2,0,0,0,0|2,0,0]=4 14306 B11R0.49 CCOCCOCC(C)(C)OC 34a_100000210136_100000701081 [0,2,0,0,0,0|0,0,0]=2 14307 B11R0.49 CCOCCOCC(F)(F)CN 34a_100000703232_100000210147 [0,2,0,0,0,0|2,0,0]=4 14308 B11R0.49 CCOCCSCC(C)(C)OC 62a_100000210147_100000701081 [0,2,0,0,0,0|0,1,0]=3 14309 B11R0.49 CCOCCSCC(C)(C)OC 62a_100000701081_100011215890 [0,2,0,0,0,0|0,1,0]=3 14310 B11R0.49 CCS(=O)(=O)CCNCCOC 2230a_100000209980_100000756660 [0,2,0,0,0,0|1,1,0]=4 14311 B11R0.49 CCS(=O)(=O)CCNCCOC 2230a_100000751051_100011201679 [0,2,0,0,0,0|1,1,0]=4 14312 B11R0.49 CCS(=O)(=O)CCNCCOC 34a_100000751051_100011201679 [0,2,0,0,0,0|1,1,0]=4 14313 B11R0.49 CCS(=O)(=O)CCOCCOC 34a_100000210237_100000756660 [0,2,0,0,0,0|0,1,0]=3 14314 B11R0.49 CCS(=O)(=O)CCOCCOC 34a_200011216379_100011201679 [0,2,0,0,0,0|0,1,0]=3 14315 B11R0.49 CCS(=O)(=O)CCOCCOC 7a_200011216379_100000233755 [0,2,0,0,0,0|0,1,0]=3 14316 B11R0.49 CCS(=O)(=O)CCOCCON 34a_100000700252_100000756660 [0,2,0,0,0,0|1,1,0]=4 14317 B11R0.49 CCS(=O)(=O)CCOCCSC 34a_100000230434_100000756660 [0,2,0,0,0,0|0,2,0]=4 14318 B11R0.49 CCS(=O)(=O)CCOCCSC 34a_200011216379_100000212216 [0,2,0,0,0,0|0,2,0]=4 14319 B11R0.49 CCS(=O)(=O)CCOCCSC 7a_100000230434_100000756660 [0,2,0,0,0,0|0,2,0]=4 14320 B11R0.49 CCS(=O)(=O)CCOCCSC 7a_200011216379_100000212216 [0,2,0,0,0,0|0,2,0]=4 14321 B11R0.49 CCS(=O)(=O)CCSCCOC 62a_100000233755_100000756660 [0,2,0,0,0,0|0,2,0]=4 14322 B11R0.49 CCS(=O)(=O)CCSCCOC 62a_100000756660_100000233755 [0,2,0,0,0,0|0,2,0]=4 14323 B11R0.49 CCSCCNCC(C)(C)OC 2230a_100000763424_100000757381 [0,2,0,0,0,0|1,1,0]=4 14324 B11R0.49 CCSCCOCC(C)(C)CC 7a_100000765029_100000757381 [0,2,0,0,0,0|1,1,0]=4 14325 B11R0.49 CCSCCOCC(C)(C)OC 34a_100000212035_100000701081 [0,2,0,0,0,0|0,1,0]=3 14326 B11R0.49 CCSCCSCC(C)(C)OC 62a_100000701081_100000757381 [0,2,0,0,0,0|0,2,0]=4 14327 B11R0.49 CCSCCSCC(C)(C)OC 62a_100000757381_100000701081 [0,2,0,0,0,0|0,2,0]=4 14328 B11R0.49 CNCCCOCC(C)(C)OC 34a_100000213112_100000701081 [0,2,0,0,0,0|2,0,0]=4 14329 B11R0.49 COC(C)(C)COCCCCBr 34a_100011216708_100000701081 [0,2,0,0,0,0|2,0,0]=4 14330 B11R0.49 COC(C)(C)COCCCCCl 34a_100000210776_100000701081 [0,2,0,0,0,0|2,0,0]=4 14331 B11R0.49 COC(C)(C)COCCCCF 34a_100011995726_100000701081 [0,2,0,0,0,0|2,0,0]=4 14332 B11R0.49 COC(C)(C)COCCCCI 34a_200012148704_100000701081 [0,2,0,0,0,0|2,0,0]=4 14333 B11R0.49 COC(C)(C)COCCCCN 34a_100000750430_100000701081 [0,2,0,0,0,0|2,0,0]=4 14334 B11R0.49 COC(C)(C)COCCCSC 34a_100000690336_100000701081 [0,2,0,0,0,0|2,0,0]=4 14335 B11R0.49 COCCCOCC(C)(C)OC 34a_100000740835_100000701081 [0,2,0,0,0,0|2,0,0]=4 14336 B11R0.49 COCCOCCC(C)(C)OC 7a_100000699976_100000233755 [0,2,0,0,0,0|2,0,0]=4 14337 B11R0.70 C=CC(O)COC(C)COCC 34a_100000718985_100000730141 [0,2,0,0,0,0|1,0,1]=4 14338 B11R0.70 C=CC(O)COC(C)COCC 7a_100000718985_100000730141 [0,2,0,0,0,0|1,0,1]=4 14339 B11R0.70 CCC(=O)CCN(C)CCOC 1458a_200103286627_100000210202 [0,2,0,0,0,0|2,0,0]=4 14340 B11R0.70 CCC(C)CCC(=O)CCOC 1458a_100000701222_100000233755 [0,2,0,0,0,0|2,0,0]=4 14341 B11R0.70 CCCCC(C)NC[C@@H](C)OC 2230a_100020591295_200011215066 [0,2,0,0,0,0|2,0,0]=4 14342 B11R0.70 CCCCC(C)NC[C@@H](C)OC 270004a_100020591295_100000210087 [0,2,0,0,0,0|2,0,0]=4 14343 B11R0.70 CCCCC(C)OCC(=O)OC 34a_100000687866_100000747449 [0,2,0,0,0,0|1,0,1]=4 14344 B11R0.70 CCCCC(C)OCC(=O)OC 7a_100000687866_100000747449 [0,2,0,0,0,0|1,0,1]=4 14345 B11R0.70 CCCCC(C)OCC(C)CC 34a_100000687866_100000748023 [0,2,0,0,0,0|2,0,0]=4 14346 B11R0.70 CCCCC(C)OCC(C)CC 7a_100000687866_100000748023 [0,2,0,0,0,0|2,0,0]=4 14347 B11R0.70 CCCCC(C)OCC(C)OC 34a_100000690652_200011215066 [0,2,0,0,0,0|1,0,0]=3 14348 B11R0.70 CCCCC(C)OCC(O)CC 34a_100000687866_100011218378 [0,2,0,0,0,0|2,0,0]=4 14349 B11R0.70 CCCCC(C)OCC(O)CC 7a_100000687866_100011218378 [0,2,0,0,0,0|2,0,0]=4 14350 B11R0.70 CCCCC(C)OC[C@@H](C)CC 34a_100000687866_100009816398 [0,2,0,0,0,0|2,0,0]=4 14351 B11R0.70 CCCCC(C)OC[C@@H](C)CC 7a_100000687866_100009816398 [0,2,0,0,0,0|2,0,0]=4 14352 B11R0.70 CCCCC(C)OC[C@@H](C)CC 7a_100009816381_200011215066 [0,2,0,0,0,0|2,0,0]=4 14353 B11R0.70 CCN(C)CCC(=O)CCOC 1458a_100000755305_100000233755 [0,2,0,0,0,0|2,0,0]=4 14354 B11R0.70 CCOCC(=O)NC[C@@H](C)OC 11a_100020591295_100000211967 [0,2,0,0,0,0|1,0,1]=4 14355 B11R0.70 CCOCC(=O)NC[C@@H](C)OC 1626a_100020591295_100000211967 [0,2,0,0,0,0|1,0,1]=4 14356 B11R0.70 CCOCC(=O)NC[C@@H](C)OC 240690a_100020591295_100000211967 [0,2,0,0,0,0|1,0,1]=4 14357 B11R0.70 CCOCC(=O)NC[C@@H](C)OC 527a_100020591295_100000211967 [0,2,0,0,0,0|1,0,1]=4 14358 B11R0.70 CCOCC(C)OCC(=O)CC 7a_100000718985_100000747405 [0,2,0,0,0,0|1,0,1]=4 14359 B11R0.70 CCOCC(C)OCC(=O)NC 34a_100000718985_100000183359 [0,2,0,0,0,0|1,0,1]=4 14360 B11R0.70 CCOCC(C)OCC(=O)NC 7a_100000718985_100000183359 [0,2,0,0,0,0|1,0,1]=4 14361 B11R0.70 CCOCC(C)OCC(=O)OC 34a_100000718985_100000747449 [0,2,0,0,0,0|0,0,1]=3 14362 B11R0.70 CCOCC(C)OCC(=O)OC 7a_100000718985_100000747449 [0,2,0,0,0,0|0,0,1]=3 14363 B11R0.70 CCOCC(C)OCC(C)CC 34a_100000718985_100000748023 [0,2,0,0,0,0|1,0,0]=3 14364 B11R0.70 CCOCC(C)OCC(C)CC 7a_100000718985_100000748023 [0,2,0,0,0,0|1,0,0]=3 14365 B11R0.70 CCOCC(C)OCC(O)CC 34a_100000718985_100011218378 [0,2,0,0,0,0|1,0,0]=3 14366 B11R0.70 CCOCC(C)OCC(O)CC 7a_100000718985_100011218378 [0,2,0,0,0,0|1,0,0]=3 14367 B11R0.70 CCOCC(C)OCC(O)CO 34a_100000718985_100011219619 [0,2,0,0,0,0|2,0,0]=4 14368 B11R0.70 CCOCC(C)OCC(O)CO 7a_100000718985_100011219619 [0,2,0,0,0,0|2,0,0]=4 14369 B11R0.70 CCOCC(C)OC[C@@H](C)CC 34a_100000718985_100009816398 [0,2,0,0,0,0|1,0,0]=3 14370 B11R0.70 CCOCC(C)OC[C@@H](C)CC 7a_100000718985_100009816398 [0,2,0,0,0,0|1,0,0]=3 14371 B11R0.70 CCOCC(C)OC[C@@H](C)CO 34a_100000718985_100000059175 [0,2,0,0,0,0|2,0,0]=4 14372 B11R0.70 CCOCC(C)OC[C@@H](C)CO 7a_100000718985_100000059175 [0,2,0,0,0,0|2,0,0]=4 14373 B11R0.70 CCOCC(C)OC[C@@H](O)CF 34a_100000718985_100015614560 [0,2,0,0,0,0|2,0,0]=4 14374 B11R0.70 CCOCC(C)OC[C@@H](O)CF 7a_100000718985_100015614560 [0,2,0,0,0,0|2,0,0]=4 14375 B11R0.70 CCOCC(C)OC[C@@H](O)CO 34a_100000718985_100009815848 [0,2,0,0,0,0|2,0,0]=4 14376 B11R0.70 CCOCC(C)OC[C@@H](O)CO 7a_100000718985_100009815848 [0,2,0,0,0,0|2,0,0]=4 14377 B11R0.70 CCS(=O)CCC(=O)CCOC 1458a_100011387550_100000233755 [0,2,0,0,0,0|1,1,0]=4 14378 B11R0.70 CCSCC(C)NC[C@@H](C)OC 270004a_100020591295_200011216171 [0,2,0,0,0,0|1,1,0]=4 14379 B11R0.106 CCC(=O)CCOCC(=O)OC 1458a_100000210414_100000090808 [0,2,0,0,0,0|1,0,1]=4 14380 B11R0.106 CCC(C)CCOCC(=O)OC 7a_100011215188_100000747449 [0,2,0,0,0,0|1,0,1]=4 14381 B11R0.106 CCC(C)CCOCC(C)CC 7a_100011215188_100000748023 [0,2,0,0,0,0|2,0,0]=4 14382 B11R0.106 CCC(C)CCOCC(O)CC 7a_100011215188_100011218378 [0,2,0,0,0,0|2,0,0]=4 14383 B11R0.106 CCC(C)CCOC[C@@H](C)CC 7a_100011215188_100009816398 [0,2,0,0,0,0|2,0,0]=4 14384 B11R0.106 CCN(C)CCOCC(=O)OC 2230a_100000225621_100000090808 [0,2,0,0,0,0|1,0,1]=4 14385 B11R0.106 CNC(=O)CCOCC(C)OC 34a_100000690652_100012179268 [0,2,0,0,0,0|2,0,0]=4 14386 B11R0.106 COC(=O)CCOCC(C)OC 34a_100000690652_100000742370 [0,2,0,0,0,0|2,0,0]=4 14387 B11R0.124 C/C=C/CCOCC(OC)OC 34a_100016278192_100000211822 [0,2,0,0,0,0|1,0,1]=4 14388 B11R0.124 C=CC(CCCCCCC)OC 34a_200011934235_200000210301 [0,2,0,0,0,0|2,0,0]=4 14389 B11R0.124 C=CC(CCCCCCC)OC 7a_200011934235_200000210301 [0,2,0,0,0,0|2,0,0]=4 14390 B11R0.124 C=CC(CCCCCCC)O[13CH3] 34a_200011934235_200025704644 [0,2,0,0,0,0|2,0,0]=4 14391 B11R0.124 C=CC(CCCCCCC)O[13CH3] 7a_200011934235_200025704644 [0,2,0,0,0,0|2,0,0]=4 14392 B11R0.124 C=COCCOCC(CC)OC 34a_100011934954_100000039644 [0,2,0,0,0,0|0,0,2]=4 14393 B11R0.124 C=COCCOCC(CC)OC 7a_100011934954_100000039644 [0,2,0,0,0,0|0,0,2]=4 14394 B11R0.124 C=COCCOCC(OC)OC 34a_100000033082_100000211822 [0,2,0,0,0,0|0,0,2]=4 14395 B11R0.124 C=COCCOCC(OC)OC 34a_100011216393_100000039644 [0,2,0,0,0,0|0,0,2]=4 14396 B11R0.124 CC#CCCOCC(OC)OC 34a_100000750427_100000211822 [0,2,0,0,0,0|1,0,1]=4 14397 B11R0.124 CC/C=C\COCC(CC)OC 34a_100011934954_100103147603 [0,2,0,0,0,0|1,0,1]=4 14398 B11R0.124 CC/C=C\COCC(CC)OC 7a_100011934954_100103147603 [0,2,0,0,0,0|1,0,1]=4 14399 B11R0.124 CC/C=C\COCC(OC)OC 34a_100011216393_100103147603 [0,2,0,0,0,0|1,0,1]=4 14400 B11R0.124 CC/C=C\COCC(OC)OC 34a_100016268518_100000211822 [0,2,0,0,0,0|1,0,1]=4 14401 B11R0.124 CCC#CCOCC(CC)OC 34a_100011934954_100009813939 [0,2,0,0,0,0|1,0,1]=4 14402 B11R0.124 CCC#CCOCC(CC)OC 7a_100011934954_100009813939 [0,2,0,0,0,0|1,0,1]=4 14403 B11R0.124 CCC#CCOCC(OC)OC 34a_100000032950_100000211822 [0,2,0,0,0,0|1,0,1]=4 14404 B11R0.124 CCC#CCOCC(OC)OC 34a_100011216393_100009813939 [0,2,0,0,0,0|1,0,1]=4 14405 B11R0.124 CCC(CC)NCOCCOC 2230a_100000199018_100000231047 [0,2,0,0,0,0|2,0,0]=4 14406 B11R0.124 CCC(CC)SCOCCOC 62a_100000210505_100000231047 [0,2,0,0,0,0|2,0,0]=4 14407 B11R0.124 CCC(CC)SCOCCOC 62a_100000231047_100000210505 [0,2,0,0,0,0|2,0,0]=4 14408 B11R0.124 CCC(COCCCCF)OC 34a_100011934954_100000729493 [0,2,0,0,0,0|2,0,0]=4 14409 B11R0.124 CCC(COCCCCF)OC 7a_100011934954_100000729493 [0,2,0,0,0,0|2,0,0]=4 14410 B11R0.124 CCC(COCCCCO)OC 34a_100011934954_100011216708 [0,2,0,0,0,0|2,0,0]=4 14411 B11R0.124 CCC(COCCCCO)OC 7a_100011934954_100000210776 [0,2,0,0,0,0|2,0,0]=4 14412 B11R0.124 CCC(COCCCOC)OC 34a_100011934954_100000740836 [0,2,0,0,0,0|2,0,0]=4 14413 B11R0.124 CCC(COCCCOC)OC 7a_100011934954_100000740836 [0,2,0,0,0,0|2,0,0]=4 14414 B11R0.124 CCCCCCCC(CC)OC 34a_200011217053_200000210301 [0,2,0,0,0,0|2,0,0]=4 14415 B11R0.124 CCCCCCCC(CC)OC 7a_200011217053_200000210301 [0,2,0,0,0,0|2,0,0]=4 14416 B11R0.124 CCCCCCCC(CC)O[13CH3] 34a_200011217053_200025704644 [0,2,0,0,0,0|2,0,0]=4 14417 B11R0.124 CCCCCCCC(CC)O[13CH3] 7a_200011217053_200025704644 [0,2,0,0,0,0|2,0,0]=4 14418 B11R0.124 CCCCCNCC(OC)OC 2230a_100000209983_100000751394 [0,2,0,0,0,0|2,0,0]=4 14419 B11R0.124 CCCCCNCC(OC)OC 270004a_100000209983_100000752162 [0,2,0,0,0,0|2,0,0]=4 14420 B11R0.124 CCCCCOCC(CC)CC 34a_100000210253_100011215472 [0,2,0,0,0,0|2,0,0]=4 14421 B11R0.124 CCCCCOCC(CC)CC 7a_100000210253_100011215472 [0,2,0,0,0,0|2,0,0]=4 14422 B11R0.124 CCCCCOCC(CC)CC 7a_100000703878_100000210326 [0,2,0,0,0,0|2,0,0]=4 14423 B11R0.124 CCCCCOCC(CC)OC 34a_100011934954_100000718602 [0,2,0,0,0,0|1,0,0]=3 14424 B11R0.124 CCCCCOCC(CC)OC 7a_100011934954_100000210326 [0,2,0,0,0,0|1,0,0]=3 14425 B11R0.124 CCCCCOCC(OC)OC 34a_100000210253_100000211822 [0,2,0,0,0,0|1,0,0]=3 14426 B11R0.124 CCCCCOCC(OC)OC 34a_100011216393_100000718602 [0,2,0,0,0,0|1,0,0]=3 14427 B11R0.124 CCCCCOCC(OC)OC 7a_100000210253_100000751394 [0,2,0,0,0,0|1,0,0]=3 14428 B11R0.124 CCCCCSCC(OC)OC 62a_100000210326_100000751394 [0,2,0,0,0,0|1,1,0]=4 14429 B11R0.124 CCCCCSCC(OC)OC 62a_100000751394_100000210326 [0,2,0,0,0,0|1,1,0]=4 14430 B11R0.124 CCCCOCCN(CC)CC 2230a_100000724800_100000743108 [0,2,0,0,0,0|2,0,0]=4 14431 B11R0.124 CCCCOCCN(CC)CC 269956a_100000042499_100000743108 [0,2,0,0,0,0|2,0,0]=4 14432 B11R0.124 CCCCOCCN(CC)CC 269982a_100000724800_100000743108 [0,2,0,0,0,0|2,0,0]=4 14433 B11R0.124 CCCCOCCN(CC)CC 7a_100000210227_100000700428 [0,2,0,0,0,0|2,0,0]=4 14434 B11R0.124 CCCCOCCN(CC)CC 7a_100016990331_100000210211 [0,2,0,0,0,0|2,0,0]=4 14435 B11R0.124 CCN(CC)CCCCCOC 7a_200011629222_200000210301 [0,2,0,0,0,0|2,0,0]=4 14436 B11R0.124 CCN(CC)CCCCCO[13CH3] 7a_200011629222_200025704644 [0,2,0,0,0,0|2,0,0]=4 14437 B11R0.124 CCN(CC)CCNCCOC 2230a_100000209980_100000700428 [0,2,0,0,0,0|2,0,0]=4 14438 B11R0.124 CCN(CC)CCNCCOC 2230a_100015382049_100011201679 [0,2,0,0,0,0|2,0,0]=4 14439 B11R0.124 CCN(CC)CCOCCOC 2230a_100000724800_100000695917 [0,2,0,0,0,0|1,0,0]=3 14440 B11R0.124 CCN(CC)CCOCCOC 269956a_100000042499_100000695917 [0,2,0,0,0,0|1,0,0]=3 14441 B11R0.124 CCN(CC)CCOCCOC 269982a_100000724800_100000695917 [0,2,0,0,0,0|1,0,0]=3 14442 B11R0.124 CCN(CC)CCOCCOC 7a_100011217740_200000210301 [0,2,0,0,0,0|1,0,0]=3 14443 B11R0.124 CCN(CC)CCOCCOC 7a_100016990331_100000233755 [0,2,0,0,0,0|1,0,0]=3 14444 B11R0.124 CCN(CC)CCOCCO[13CH3] 7a_100011217740_200025704644 [0,2,0,0,0,0|1,0,0]=3 14445 B11R0.124 CCN(CC)CCOCCSC 7a_100000230434_100000700428 [0,2,0,0,0,0|1,1,0]=4 14446 B11R0.124 CCN(CC)CCOCCSC 7a_100016990331_100000212216 [0,2,0,0,0,0|1,1,0]=4 14447 B11R0.124 CCN(CC)CCSCCOC 62a_100000233755_100000700428 [0,2,0,0,0,0|1,1,0]=4 14448 B11R0.124 CCOCCNCC(CC)CC 2230a_100102946423_100011215890 [0,2,0,0,0,0|2,0,0]=4 14449 B11R0.124 CCOCCNCC(CC)CC 2230a_102516460346_100011215472 [0,2,0,0,0,0|2,0,0]=4 14450 B11R0.124 CCOCCNCC(CC)CC 269862a_100011200944_100000211137 [0,2,0,0,0,0|2,0,0]=4 14451 B11R0.124 CCOCCNCC(CC)CC 270004a_102516460346_100000211137 [0,2,0,0,0,0|2,0,0]=4 14452 B11R0.124 CCOCCNCC(CC)CC 34a_102516460346_100011215472 [0,2,0,0,0,0|2,0,0]=4 14453 B11R0.124 CCOCCNCC(OC)OC 2230a_102516460346_100000751394 [0,2,0,0,0,0|1,0,0]=3 14454 B11R0.124 CCOCCNCC(OC)OC 270004a_102516460346_100000752162 [0,2,0,0,0,0|1,0,0]=3 14455 B11R0.124 CCOCCNCC(OC)OC 34a_102516460346_100000211822 [0,2,0,0,0,0|1,0,0]=3 14456 B11R0.124 CCOCCOCC(CC)CC 34a_100000210136_100011215472 [0,2,0,0,0,0|1,0,0]=3 14457 B11R0.124 CCOCCOCC(CC)CC 7a_100000210136_100011215472 [0,2,0,0,0,0|1,0,0]=3 14458 B11R0.124 CCOCCOCC(CC)CC 7a_100000703878_100011215890 [0,2,0,0,0,0|1,0,0]=3 14459 B11R0.124 CCOCCOCC(CC)OC 34a_100011934954_100000210147 [0,2,0,0,0,0|0,0,0]=2 14460 B11R0.124 CCOCCOCC(CC)OC 7a_100011934954_100011215890 [0,2,0,0,0,0|0,0,0]=2 14461 B11R0.124 CCOCCOCC(OC)OC 34a_100000210136_100000211822 [0,2,0,0,0,0|0,0,0]=2 14462 B11R0.124 CCOCCOCC(OC)OC 34a_100011216393_100000210147 [0,2,0,0,0,0|0,0,0]=2 14463 B11R0.124 CCOCCOCC(OC)OC 7a_100000210136_100000751394 [0,2,0,0,0,0|0,0,0]=2 14464 B11R0.124 CCOCCOCN(CC)CC 7a_200015374951_100011215890 [0,2,0,0,0,0|2,0,0]=4 14465 B11R0.124 CCOCCSCC(CC)CC 62a_100000210147_100011215472 [0,2,0,0,0,0|1,1,0]=4 14466 B11R0.124 CCOCCSCC(CC)CC 62a_100011215472_100011215890 [0,2,0,0,0,0|1,1,0]=4 14467 B11R0.124 CCOCCSCC(OC)OC 62a_100000210147_100000751394 [0,2,0,0,0,0|0,1,0]=3 14468 B11R0.124 CCOCCSCC(OC)OC 62a_100000751394_100011215890 [0,2,0,0,0,0|0,1,0]=3 14469 B11R0.124 CCOCSCCC(OC)OC 62a_100000139399_100000739092 [0,2,0,0,0,0|2,0,0]=4 14470 B11R0.124 CCOCSCCC(OC)OC 62a_100000739092_100000139399 [0,2,0,0,0,0|2,0,0]=4 14471 B11R0.124 CCSCCNCC(OC)OC 2230a_100000106463_100000751394 [0,2,0,0,0,0|1,1,0]=4 14472 B11R0.124 CCSCCNCC(OC)OC 270004a_100000106463_100000752162 [0,2,0,0,0,0|1,1,0]=4 14473 B11R0.124 CCSCCOCC(CC)CC 34a_100000212035_100011215472 [0,2,0,0,0,0|1,1,0]=4 14474 B11R0.124 CCSCCOCC(CC)CC 7a_100000212035_100011215472 [0,2,0,0,0,0|1,1,0]=4 14475 B11R0.124 CCSCCOCC(CC)CC 7a_100000703878_100000757381 [0,2,0,0,0,0|1,1,0]=4 14476 B11R0.124 CCSCCOCC(CC)OC 34a_100011934954_100000757381 [0,2,0,0,0,0|0,1,0]=3 14477 B11R0.124 CCSCCOCC(CC)OC 7a_100011934954_100000757381 [0,2,0,0,0,0|0,1,0]=3 14478 B11R0.124 CCSCCOCC(OC)OC 34a_100000212035_100000211822 [0,2,0,0,0,0|0,1,0]=3 14479 B11R0.124 CCSCCOCC(OC)OC 34a_100011216393_100000757381 [0,2,0,0,0,0|0,1,0]=3 14480 B11R0.124 CCSCCOCC(OC)OC 7a_100000212035_100000751394 [0,2,0,0,0,0|0,1,0]=3 14481 B11R0.124 CCSCCSCC(OC)OC 62a_100000751394_100000757381 [0,2,0,0,0,0|0,2,0]=4 14482 B11R0.124 CCSCCSCC(OC)OC 62a_100000757381_100000751394 [0,2,0,0,0,0|0,2,0]=4 14483 B11R0.124 CC[C@@H](CO)NCOCCOC 2230a_100000709445_100000231047 [0,2,0,0,0,0|2,0,0]=4 14484 B11R0.124 CNCCCOCC(OC)OC 34a_100000213112_100000211822 [0,2,0,0,0,0|2,0,0]=4 14485 B11R0.124 COC(COCCCCBr)OC 34a_100011216708_100000211822 [0,2,0,0,0,0|2,0,0]=4 14486 B11R0.124 COC(COCCCCCl)OC 34a_100000210776_100000211822 [0,2,0,0,0,0|2,0,0]=4 14487 B11R0.124 COC(COCCCCCl)OC 7a_100000210776_100000751394 [0,2,0,0,0,0|2,0,0]=4 14488 B11R0.124 COC(COCCCCF)OC 34a_100011216393_100000729493 [0,2,0,0,0,0|2,0,0]=4 14489 B11R0.124 COC(COCCCCF)OC 34a_100011995726_100000211822 [0,2,0,0,0,0|2,0,0]=4 14490 B11R0.124 COC(COCCCCF)OC 7a_100011995726_100000751394 [0,2,0,0,0,0|2,0,0]=4 14491 B11R0.124 COC(COCCCCI)OC 34a_200012148704_100000211822 [0,2,0,0,0,0|2,0,0]=4 14492 B11R0.124 COC(COCCCCN)OC 34a_100000750430_100000211822 [0,2,0,0,0,0|2,0,0]=4 14493 B11R0.124 COC(COCCCCO)OC 34a_100011216393_100011216708 [0,2,0,0,0,0|2,0,0]=4 14494 B11R0.124 COC(COCCCSC)OC 34a_100000690336_100000211822 [0,2,0,0,0,0|2,0,0]=4 14495 B11R0.124 COC(COCCCSC)OC 7a_100000690336_100000751394 [0,2,0,0,0,0|2,0,0]=4 14496 B11R0.124 COCCCOCC(OC)OC 34a_100000740835_100000211822 [0,2,0,0,0,0|2,0,0]=4 14497 B11R0.124 COCCCOCC(OC)OC 34a_100011216393_100000740836 [0,2,0,0,0,0|2,0,0]=4 14498 B11R0.124 COCCOCCC(OC)OC 34a_100000210237_100000139399 [0,2,0,0,0,0|2,0,0]=4 14499 B11R0.154 CCC(=O)CC(=O)OCCOC 1458a_100000210414_200000040189 [0,2,0,0,0,0|1,0,1]=4 14500 B11R0.154 CCC(C)CC(C)NCCOC 2230a_100000763565_100011201679 [0,2,0,0,0,0|2,0,0]=4 14501 B11R0.154 CCC(C)CC(C)NCCOC 270004a_100000209980_100011710205 [0,2,0,0,0,0|2,0,0]=4 14502 B11R0.154 CCN(C)CC(=O)OCCOC 2230a_100000225621_200000040189 [0,2,0,0,0,0|1,0,1]=4 14503 B11R0.154 CCN(C)CC(=O)OCCOC 269982a_100000225621_200000040189 [0,2,0,0,0,0|1,0,1]=4 14504 B11R0.154 CCOCCC(=O)CC(=O)OC 1458a_100000211351_100011215890 [0,2,0,0,0,0|1,0,1]=4 14505 B11R0.154 CCOCCC(=O)CC(=O)OC 1458a_100000749530_100000747449 [0,2,0,0,0,0|1,0,1]=4 14506 B11R0.154 CCOCCC(=O)CC(C)CC 1458a_100000708755_100011215890 [0,2,0,0,0,0|2,0,0]=4 14507 B11R0.154 CCOCCC(=O)CC(C)CC 1458a_100000749530_100000748023 [0,2,0,0,0,0|2,0,0]=4 14508 B11R0.154 CCOCCC(=O)CC(O)CC 1458a_100000749530_100011218378 [0,2,0,0,0,0|2,0,0]=4 14509 B11R0.154 CCOCCC(=O)CC(O)CC 1458a_100011667805_100011215890 [0,2,0,0,0,0|2,0,0]=4 14510 B11R0.154 CCOCCC(=O)C[C@@H](C)CC 1458a_100000749530_100009816398 [0,2,0,0,0,0|2,0,0]=4 14511 B11R0.154 CCOCCN(C)CC(=O)OC 2230a_100000198492_100011215890 [0,2,0,0,0,0|1,0,1]=4 14512 B11R0.154 CCOCCN(C)CC(C)CC 2230a_100000753921_100011215890 [0,2,0,0,0,0|2,0,0]=4 14513 B11R0.154 CCOCCN(C)CC(C)CC 269982a_100000753921_100011215890 [0,2,0,0,0,0|2,0,0]=4 14514 B11R0.154 COCCOC(C)CC(=O)OC 34a_100000210237_100009817358 [0,2,0,0,0,0|2,0,0]=4 14515 B11R0.11 CCCCC(C)C(=O)CCOC 1458a_100000725509_100000233755 [0,2,0,0,0,0|2,0,0]=4 14516 B11R0.11 CCCCC(C)C(=O)CCOC 1458a_100000749529_200011215066 [0,2,0,0,0,0|2,0,0]=4 14517 B11R0.11 CCCCC(C)N(C)CCOC 2230a_100000743101_200011215066 [0,2,0,0,0,0|2,0,0]=4 14518 B11R0.11 CCCCC(C)N(C)CCOC 269982a_100000743101_200011215066 [0,2,0,0,0,0|2,0,0]=4 14519 B11R0.11 CCCCC(C)N(C)CCOC 270004a_100000743101_100000210087 [0,2,0,0,0,0|2,0,0]=4 14520 B11R0.11 CCCCC(O)C(=O)CCOC 1458a_100000720857_100000233755 [0,2,0,0,0,0|2,0,0]=4 14521 B11R0.11 CCOCC(=O)N(C)CCOC 11a_100000743101_100000211967 [0,2,0,0,0,0|1,0,1]=4 14522 B11R0.11 CCOCC(=O)N(C)CCOC 1626a_100000743101_100000211967 [0,2,0,0,0,0|1,0,1]=4 14523 B11R0.11 CCOCC(=O)N(C)CCOC 240690a_100000743101_100000211967 [0,2,0,0,0,0|1,0,1]=4 14524 B11R0.11 CCOCC(=O)N(C)CCOC 527a_100000743101_100000211967 [0,2,0,0,0,0|1,0,1]=4 14525 B11R0.11 CCSCC(C)N(C)CCOC 270004a_100000743101_200011216171 [0,2,0,0,0,0|1,1,0]=4 14526 B11R0.152 C#CC(CCCC)OCCCC 34a_200011217967_100000210210 [0,2,0,0,0,0|2,0,0]=4 14527 B11R0.152 C#CC(CCCC)OCCCC 7a_200011217967_100000210211 [0,2,0,0,0,0|2,0,0]=4 14528 B11R0.152 C#CC(CCCC)OCCOC 34a_200011217967_100011201679 [0,2,0,0,0,0|1,0,0]=3 14529 B11R0.152 C#CC(CCCC)OCCOC 7a_200011217967_100000233755 [0,2,0,0,0,0|1,0,0]=3 14530 B11R0.152 C#CC(CCCC)OCCSC 34a_200011217967_100000212216 [0,2,0,0,0,0|1,1,0]=4 14531 B11R0.152 C#CC(CCCC)OCCSC 7a_200011217967_100000212216 [0,2,0,0,0,0|1,1,0]=4 14532 B11R0.152 C#CCCOC(CN)COCC 34a_102515437182_100000688953 [0,2,0,0,0,0|1,0,1]=4 14533 B11R0.152 C/C=C/COC(CN)COCC 34a_102515437182_100102629194 [0,2,0,0,0,0|1,0,1]=4 14534 B11R0.152 C=CC(CCCC)OCCCC 34a_200011215037_100000210210 [0,2,0,0,0,0|2,0,0]=4 14535 B11R0.152 C=CC(CCCC)OCCCC 7a_200011215037_100000210211 [0,2,0,0,0,0|2,0,0]=4 14536 B11R0.152 C=CC(CCCC)OCCOC 34a_200011215037_100011201679 [0,2,0,0,0,0|1,0,0]=3 14537 B11R0.152 C=CC(CCCC)OCCOC 7a_200011215037_100000233755 [0,2,0,0,0,0|1,0,0]=3 14538 B11R0.152 C=CC(CCCC)OCCSC 34a_200011215037_100000212216 [0,2,0,0,0,0|1,1,0]=4 14539 B11R0.152 C=CC(CCCC)OCCSC 7a_200011215037_100000212216 [0,2,0,0,0,0|1,1,0]=4 14540 B11R0.152 C=CCCOC(CN)COCC 34a_102515437182_100000754431 [0,2,0,0,0,0|1,0,1]=4 14541 B11R0.152 CC#CCOC(CN)COCC 34a_102515437182_100000748600 [0,2,0,0,0,0|1,0,1]=4 14542 B11R0.152 CC=CCOC(CN)COCC 34a_102515437182_100000070051 [0,2,0,0,0,0|1,0,1]=4 14543 B11R0.152 CCCCC(CC)NCCOC 270004a_100000209980_100000753412 [0,2,0,0,0,0|2,0,0]=4 14544 B11R0.152 CCCCC(CC)OCCOC 34a_100000210237_200011216223 [0,2,0,0,0,0|1,0,0]=3 14545 B11R0.152 CCCCC(CC)OCCOC 34a_100011215227_100011201679 [0,2,0,0,0,0|1,0,0]=3 14546 B11R0.152 CCCCC(CC)OCCOC 7a_100011215227_100000233755 [0,2,0,0,0,0|1,0,0]=3 14547 B11R0.152 CCCCC(CC)OCCON 34a_100000700252_200011216223 [0,2,0,0,0,0|2,0,0]=4 14548 B11R0.152 CCCCC(CC)OCCSC 34a_100000230434_200011216223 [0,2,0,0,0,0|1,1,0]=4 14549 B11R0.152 CCCCC(CC)OCCSC 34a_100011215227_100000212216 [0,2,0,0,0,0|1,1,0]=4 14550 B11R0.152 CCCCC(CC)OCCSC 7a_100000230434_200011216223 [0,2,0,0,0,0|1,1,0]=4 14551 B11R0.152 CCCCC(CC)OCCSC 7a_100011215227_100000212216 [0,2,0,0,0,0|1,1,0]=4 14552 B11R0.152 CCCCC(CC)SCCOC 62a_100000233755_200011216223 [0,2,0,0,0,0|1,1,0]=4 14553 B11R0.152 CCCCC(CC)SCCOC 62a_200011216223_100000233755 [0,2,0,0,0,0|1,1,0]=4 14554 B11R0.152 CCCCCN(CC)CCOC 2230a_100000731262_100000210326 [0,2,0,0,0,0|2,0,0]=4 14555 B11R0.152 CCCCCN(CC)CCOC 269982a_100000731262_100000210215 [0,2,0,0,0,0|2,0,0]=4 14556 B11R0.152 CCCCN(CC)CCOCC 2230a_100000207695_100011215890 [0,2,0,0,0,0|2,0,0]=4 14557 B11R0.152 CCCCN(CC)CCOCC 269982a_100000207695_100011215890 [0,2,0,0,0,0|2,0,0]=4 14558 B11R0.152 CCCCOC(CC)CCCC 34a_100000210227_200011216223 [0,2,0,0,0,0|2,0,0]=4 14559 B11R0.152 CCCCOC(CC)CCCC 34a_100011215227_100000210210 [0,2,0,0,0,0|2,0,0]=4 14560 B11R0.152 CCCCOC(CC)CCCC 7a_100000210227_200011216223 [0,2,0,0,0,0|2,0,0]=4 14561 B11R0.152 CCCCOC(CC)CCCC 7a_100011215227_100000210211 [0,2,0,0,0,0|2,0,0]=4 14562 B11R0.152 CCCCOC(CN)COCC 34a_102515437182_100000210210 [0,2,0,0,0,0|1,0,0]=3 14563 B11R0.152 CCCC[C@@H](CO)NCCOC 2230a_100011934283_100011201679 [0,2,0,0,0,0|2,0,0]=4 14564 B11R0.152 CCCC[C@@H](CO)NCCOC 34a_100011934283_100011201679 [0,2,0,0,0,0|2,0,0]=4 14565 B11R0.152 CCOCC(CN)OCCCF 34a_102515437182_100011934791 [0,2,0,0,0,0|2,0,0]=4 14566 B11R0.152 CCOCC(CN)OCCCO 34a_102515437182_100000230001 [0,2,0,0,0,0|2,0,0]=4 14567 B11R0.152 CCOCC(CN)OCCOC 34a_102515437182_100011201679 [0,2,0,0,0,0|0,0,0]=2 14568 B11R0.152 CCOCC(CN)OCCSC 34a_102515437182_100000212216 [0,2,0,0,0,0|0,1,0]=3 14569 B11R0.152 CCOCCN(CC)CCOC 2230a_100000731262_100011215890 [0,2,0,0,0,0|1,0,0]=3 14570 B11R0.152 CCOCCN(CC)CCOC 269982a_100000731262_100011215890 [0,2,0,0,0,0|1,0,0]=3 14571 B11R0.152 CCSCCN(CC)CCOC 2230a_100000731262_100000757381 [0,2,0,0,0,0|1,1,0]=4 14572 B11R0.152 CCSCCN(CC)CCOC 269982a_100000731262_100000757381 [0,2,0,0,0,0|1,1,0]=4 14573 B11R0.321 CCCCC(C)(C)OCCOC 7a_100011219641_100000233755 [0,2,0,0,0,0|1,0,0]=3 14574 B11R0.321 CCCCC(C)(C)OCCSC 7a_100011219641_100000212216 [0,2,0,0,0,0|1,1,0]=4 14575 B11R0.321 CCCCOC(C)(C)CCCC 7a_100011219641_100000210211 [0,2,0,0,0,0|2,0,0]=4 14576 B11R0.321 COCCOC(C)(C)CCCBr 7a_100009888830_100000233755 [0,2,0,0,0,0|2,0,0]=4 14577 B9R1.4 CCN1CCC1COC 2230a_100015195929_100000210202 [1,0,0,1,0,0|1,0,0]=3 14578 B9R1.4 CCN1CCC1COC 269982a_100015195929_100000204670 [1,0,0,1,0,0|1,0,0]=3 14579 B9R1.4 CCN1CCC1COC 34a_100015195929_100000210202 [1,0,0,1,0,0|1,0,0]=3 14580 B9R1.4 COCC1CCN1CF 269982a_100015195929_100015361967 [1,0,0,1,0,0|2,0,0]=4 14581 B9R1.4 COCC1CCN1CF 34a_100015195929_100015361967 [1,0,0,1,0,0|2,0,0]=4 14582 B9R1.8 CCCN1CCCOC1 2230a_100000131196_100000210303 [1,0,0,1,0,0|2,0,0]=4 14583 B9R1.8 CCCN1CCCOC1 269982a_100000131196_100000210303 [1,0,0,1,0,0|2,0,0]=4 14584 B9R1.8 CCCN1CCCOC1 34a_100000131196_100000210303 [1,0,0,1,0,0|2,0,0]=4 14585 B9R1.8 CCCN1CCOCC1 2230a_100015191051_100000210303 [1,0,0,1,0,0|1,0,0]=3 14586 B9R1.8 CCCN1CCOCC1 269982a_100015191051_100000210303 [1,0,0,1,0,0|1,0,0]=3 14587 B9R1.8 CCCN1CCOCC1 34a_100015191051_100000210303 [1,0,0,1,0,0|1,0,0]=3 14588 B9R1.8 CCCN1CCSCC1 2230a_100000737611_100000210303 [1,0,0,1,0,0|1,1,0]=4 14589 B9R1.8 CCCN1CCSCC1 269982a_100000737611_100000210303 [1,0,0,1,0,0|1,1,0]=4 14590 B9R1.8 CCNC1CCCCC1 2230a_100000182618_100000210202 [1,0,0,1,0,0|2,0,0]=4 14591 B9R1.8 CCNC1CCCCC1 270004a_100015525214_100000210434 [1,0,0,1,0,0|2,0,0]=4 14592 B9R1.8 CCNC1CCCCC1 34a_100000182618_100000210202 [1,0,0,1,0,0|2,0,0]=4 14593 B9R1.8 CCNC1CCCOC1 2230a_100000719290_100000210202 [1,0,0,1,0,0|1,0,0]=3 14594 B9R1.8 CCNC1CCCOC1 270004a_100015525214_100000753404 [1,0,0,1,0,0|1,0,0]=3 14595 B9R1.8 CCNC1CCCOC1 34a_100000719290_100000210202 [1,0,0,1,0,0|1,0,0]=3 14596 B9R1.8 CCNC1CCCSC1 270004a_100015525214_100000057913 [1,0,0,1,0,0|1,1,0]=4 14597 B9R1.8 CCNC1CCOCC1 2230a_100000741149_100000210202 [1,0,0,1,0,0|2,0,0]=4 14598 B9R1.8 CCNC1CCOCC1 270004a_100015525214_100011217826 [1,0,0,1,0,0|2,0,0]=4 14599 B9R1.8 CCNC1CCOCC1 34a_100000741149_100000210202 [1,0,0,1,0,0|2,0,0]=4 14600 B9R1.8 CCOC1C=CCCC1 34a_100011215024_100000210202 [1,0,0,1,0,0|1,0,1]=4 14601 B9R1.8 CCOC1CC=CCC1 34a_100000073881_100000210202 [1,0,0,1,0,0|1,0,1]=4 14602 B9R1.8 CCOC1CCCCC1 34a_100000210231_100000210202 [1,0,0,1,0,0|1,0,0]=3 14603 B9R1.8 CCOC1CCCCC1 34a_100121572206_100000210327 [1,0,0,1,0,0|1,0,0]=3 14604 B9R1.8 CCOC1CCCCC1 7a_100000210231_100000210202 [1,0,0,1,0,0|1,0,0]=3 14605 B9R1.8 CCOC1CCCCO1 34a_100000033831_100000210202 [1,0,0,1,0,0|1,0,0]=3 14606 B9R1.8 CCOC1CCCOC1 34a_100000754041_100000210202 [1,0,0,1,0,0|0,0,0]=2 14607 B9R1.8 CCOC1CCCOC1 34a_100121572206_100000693364 [1,0,0,1,0,0|0,0,0]=2 14608 B9R1.8 CCOC1CCCSC1 7a_100015962668_100000210202 [1,0,0,1,0,0|0,1,0]=3 14609 B9R1.8 CCOC1CCOCC1 34a_100000744328_100000210202 [1,0,0,1,0,0|2,0,0]=4 14610 B9R1.8 CCOC1CCSCC1 34a_100000731022_100000210202 [1,0,0,1,0,0|2,0,0]=4 14611 B9R1.8 CCOC1CCSCC1 34a_100121572206_100000069128 [1,0,0,1,0,0|2,0,0]=4 14612 B9R1.8 CCOC1CCSCC1 7a_100000731022_100000210202 [1,0,0,1,0,0|2,0,0]=4 14613 B9R1.8 CCSC1CCCCC1 62a_100000210202_100000210327 [1,0,0,1,0,0|1,1,0]=4 14614 B9R1.8 CCSC1CCCCC1 62a_100000210327_100000210202 [1,0,0,1,0,0|1,1,0]=4 14615 B9R1.8 CCSC1CCCOC1 62a_100000210202_100000693364 [1,0,0,1,0,0|0,1,0]=3 14616 B9R1.8 CCSC1CCOCC1 62a_100000210202_100011324220 [1,0,0,1,0,0|2,0,0]=4 14617 B9R1.8 CNCC1CCCCC1 2230a_100000210473_200000210301 [1,0,0,1,0,0|2,0,0]=4 14618 B9R1.8 CNCC1CCCCC1 2230a_106832991635_100000211423 [1,0,0,1,0,0|2,0,0]=4 14619 B9R1.8 CNCC1CCCCC1 269862a_106832991636_100000211278 [1,0,0,1,0,0|2,0,0]=4 14620 B9R1.8 CNCC1CCCCC1 34a_100000210473_200000210301 [1,0,0,1,0,0|2,0,0]=4 14621 B9R1.8 CNCC1CCCCC1 34a_100102657272_100000211423 [1,0,0,1,0,0|2,0,0]=4 14622 B9R1.8 CNCC1CCCCC1 7a_106832991635_100000211423 [1,0,0,1,0,0|2,0,0]=4 14623 B9R1.8 CNCC1CCCCO1 2230a_100000174945_200000210301 [1,0,0,1,0,0|1,0,0]=3 14624 B9R1.8 CNCC1CCCCO1 2230a_106832991635_100000211543 [1,0,0,1,0,0|1,0,0]=3 14625 B9R1.8 CNCC1CCCCO1 34a_100000174945_200000210301 [1,0,0,1,0,0|1,0,0]=3 14626 B9R1.8 CNCC1CCCCO1 34a_100102657272_100000211543 [1,0,0,1,0,0|1,0,0]=3 14627 B9R1.8 CNCC1CCCCO1 7a_106832991635_100000211543 [1,0,0,1,0,0|1,0,0]=3 14628 B9R1.8 CNCC1CCCOC1 2230a_100000720124_200000210301 [1,0,0,1,0,0|2,0,0]=4 14629 B9R1.8 CNCC1CCCOC1 2230a_106832991635_100000741521 [1,0,0,1,0,0|2,0,0]=4 14630 B9R1.8 CNCC1CCCOC1 34a_100000720124_200000210301 [1,0,0,1,0,0|2,0,0]=4 14631 B9R1.8 CNCC1CCCOC1 34a_100102657272_100000741521 [1,0,0,1,0,0|2,0,0]=4 14632 B9R1.8 CNCC1CCCOC1 7a_106832991635_100000741521 [1,0,0,1,0,0|2,0,0]=4 14633 B9R1.8 CNCC1CCOCC1 2230a_100000746373_200000210301 [1,0,0,1,0,0|1,0,0]=3 14634 B9R1.8 CNCC1CCOCC1 2230a_106832991635_100000754603 [1,0,0,1,0,0|1,0,0]=3 14635 B9R1.8 CNCC1CCOCC1 269862a_106832991636_100000749017 [1,0,0,1,0,0|1,0,0]=3 14636 B9R1.8 CNCC1CCOCC1 34a_100000746373_200000210301 [1,0,0,1,0,0|1,0,0]=3 14637 B9R1.8 CNCC1CCOCC1 34a_100102657272_100000754603 [1,0,0,1,0,0|1,0,0]=3 14638 B9R1.8 CNCC1CCOCC1 7a_106832991635_100000754603 [1,0,0,1,0,0|1,0,0]=3 14639 B9R1.8 CNCC1CCSCC1 2230a_100015188806_200000210301 [1,0,0,1,0,0|1,1,0]=4 14640 B9R1.8 CNCC1CCSCC1 269862a_106832991636_100000067145 [1,0,0,1,0,0|1,1,0]=4 14641 B9R1.8 CNCC1CCSCC1 270004a_106832991635_100000067145 [1,0,0,1,0,0|1,1,0]=4 14642 B9R1.8 CNCC1CCSCC1 34a_100015188806_200000210301 [1,0,0,1,0,0|1,1,0]=4 14643 B9R1.8 CNC[C@H]1COCCO1 2230a_100010981119_200000210301 [1,0,0,1,0,0|1,0,0]=3 14644 B9R1.8 CNC[C@H]1COCCO1 34a_100010981119_200000210301 [1,0,0,1,0,0|1,0,0]=3 14645 B9R1.8 COCC1CC=CCC1 34a_100000210713_200000210301 [1,0,0,1,0,0|1,0,1]=4 14646 B9R1.8 COCC1CCC=CO1 34a_100011217868_200000210301 [1,0,0,1,0,0|0,0,2]=4 14647 B9R1.8 COCC1CCCCC1 34a_100000212181_200000210301 [1,0,0,1,0,0|1,0,0]=3 14648 B9R1.8 COCC1CCCCC1 34a_100138415774_100000211423 [1,0,0,1,0,0|1,0,0]=3 14649 B9R1.8 COCC1CCCCC1 7a_100000212181_200000210301 [1,0,0,1,0,0|1,0,0]=3 14650 B9R1.8 COCC1CCCCN1 34a_100000210821_200000210301 [1,0,0,1,0,0|1,0,0]=3 14651 B9R1.8 COCC1CCCCO1 34a_100000211370_200000210301 [1,0,0,1,0,0|0,0,0]=2 14652 B9R1.8 COCC1CCCCO1 34a_100138415774_100000211543 [1,0,0,1,0,0|0,0,0]=2 14653 B9R1.8 COCC1CCCCO1 7a_100000211370_200000210301 [1,0,0,1,0,0|0,0,0]=2 14654 B9R1.8 COCC1CCCNC1 34a_100000211344_200000210301 [1,0,0,1,0,0|2,0,0]=4 14655 B9R1.8 COCC1CCCOC1 34a_100000741520_200000210301 [1,0,0,1,0,0|1,0,0]=3 14656 B9R1.8 COCC1CCCOC1 34a_100138415774_100000741521 [1,0,0,1,0,0|1,0,0]=3 14657 B9R1.8 COCC1CCNCC1 34a_100000738675_200000210301 [1,0,0,1,0,0|1,0,0]=3 14658 B9R1.8 COCC1CCOCC1 34a_100000749013_200000210301 [1,0,0,1,0,0|0,0,0]=2 14659 B9R1.8 COCC1CCOCC1 34a_100138415774_100000754603 [1,0,0,1,0,0|0,0,0]=2 14660 B9R1.8 COCC1CCSCC1 34a_100000070558_200000210301 [1,0,0,1,0,0|0,1,0]=3 14661 B9R1.8 COCC1CCSCC1 7a_100000070558_200000210301 [1,0,0,1,0,0|0,1,0]=3 14662 B9R1.8 COCN1CCCOC1 2230a_100000131196_100000766300 [1,0,0,1,0,0|2,0,0]=4 14663 B9R1.8 COCN1CCCOC1 269982a_100000131196_100000766300 [1,0,0,1,0,0|2,0,0]=4 14664 B9R1.8 COCN1CCOCC1 2230a_100015191051_100000766300 [1,0,0,1,0,0|1,0,0]=3 14665 B9R1.8 COCN1CCOCC1 269982a_100015191051_100000766300 [1,0,0,1,0,0|1,0,0]=3 14666 B9R1.8 COCN1CCSCC1 2230a_100000737611_100000766300 [1,0,0,1,0,0|1,1,0]=4 14667 B9R1.8 COCN1CCSCC1 269982a_100000737611_100000766300 [1,0,0,1,0,0|1,1,0]=4 14668 B9R1.8 COC[C@@H]1CNCCO1 34a_100015189573_200000210301 [1,0,0,1,0,0|1,0,0]=3 14669 B9R1.8 COC[C@@H]1COCCN1 34a_100000717676_200000210301 [1,0,0,1,0,0|1,0,0]=3 14670 B9R1.8 COC[C@H]1COCCO1 34a_100009875890_200000210301 [1,0,0,1,0,0|0,0,0]=2 14671 B9R1.8 CSCC1CCCCC1 62a_100000211423_200000210301 [1,0,0,1,0,0|1,1,0]=4 14672 B9R1.8 CSCC1CCCCC1 62a_200000210301_100000211423 [1,0,0,1,0,0|1,1,0]=4 14673 B9R1.8 CSCC1CCCCO1 62a_100000211543_200000210301 [1,0,0,1,0,0|0,1,0]=3 14674 B9R1.8 CSCC1CCCCO1 62a_200000210301_100000211543 [1,0,0,1,0,0|0,1,0]=3 14675 B9R1.8 CSCC1CCCOC1 62a_100000741521_200000210301 [1,0,0,1,0,0|1,1,0]=4 14676 B9R1.8 CSCC1CCCOC1 62a_200000210301_100000741521 [1,0,0,1,0,0|1,1,0]=4 14677 B9R1.8 CSCC1CCOCC1 62a_100000754603_200000210301 [1,0,0,1,0,0|0,1,0]=3 14678 B9R1.8 CSCC1CCOCC1 62a_200000210301_100000749018 [1,0,0,1,0,0|0,1,0]=3 14679 B9R1.8 CSCN1CCOCC1 2230a_100015191051_100011218213 [1,0,0,1,0,0|1,1,0]=4 14680 B9R1.8 CSCN1CCOCC1 269982a_100015191051_100011218213 [1,0,0,1,0,0|1,1,0]=4 14681 B9R1.8 CSCN1CCOCC1 34a_100015191051_100011218213 [1,0,0,1,0,0|1,1,0]=4 14682 B9R1.8 FCCN1CCOCC1 2230a_100015191051_100011217306 [1,0,0,1,0,0|2,0,0]=4 14683 B9R1.8 FCCN1CCOCC1 269982a_100015191051_100011217306 [1,0,0,1,0,0|2,0,0]=4 14684 B9R1.8 FCCN1CCOCC1 34a_100015191051_100011217306 [1,0,0,1,0,0|2,0,0]=4 14685 B9R1.8 FCNC1CCCOC1 34a_100000719290_100015361967 [1,0,0,1,0,0|2,0,0]=4 14686 B9R1.8 FCOC1CCCCC1 34a_100000210231_100015361967 [1,0,0,1,0,0|2,0,0]=4 14687 B9R1.8 FCOC1CCCCC1 7a_100000210231_100015361967 [1,0,0,1,0,0|2,0,0]=4 14688 B9R1.8 FCOC1CCCCO1 34a_100000033831_100015361967 [1,0,0,1,0,0|2,0,0]=4 14689 B9R1.8 FCOC1CCCOC1 34a_100000754041_100015361967 [1,0,0,1,0,0|1,0,0]=3 14690 B9R1.8 FCOC1CCCSC1 7a_100015962668_100015361967 [1,0,0,1,0,0|1,1,0]=4 14691 B9R1.8 FCSC1CCCOC1 62a_100015361967_100000693364 [1,0,0,1,0,0|1,1,0]=4 14692 B9R1.8 OCCN1CCOCC1 2230a_100015191051_100000211926 [1,0,0,1,0,0|1,0,0]=3 14693 B9R1.8 OCCN1CCOCC1 269982a_100015191051_100000211926 [1,0,0,1,0,0|1,0,0]=3 14694 B9R1.8 OCCN1CCOCC1 34a_100015191051_100000211926 [1,0,0,1,0,0|1,0,0]=3 14695 B9R1.8 OCCN1CCSCC1 2230a_100000737611_100000211926 [1,0,0,1,0,0|1,1,0]=4 14696 B9R1.8 OCCN1CCSCC1 269982a_100000737611_100000211926 [1,0,0,1,0,0|1,1,0]=4 14697 B9R1.8 [13CH3]NCC1CCCCC1 2230a_100000210473_200025704644 [1,0,0,1,0,0|2,0,0]=4 14698 B9R1.8 [13CH3]NCC1CCCCC1 34a_100000210473_200025704644 [1,0,0,1,0,0|2,0,0]=4 14699 B9R1.8 [13CH3]NCC1CCCCO1 2230a_100000174945_200025704644 [1,0,0,1,0,0|1,0,0]=3 14700 B9R1.8 [13CH3]NCC1CCCCO1 34a_100000174945_200025704644 [1,0,0,1,0,0|1,0,0]=3 14701 B9R1.8 [13CH3]NCC1CCCOC1 2230a_100000720124_200025704644 [1,0,0,1,0,0|2,0,0]=4 14702 B9R1.8 [13CH3]NCC1CCCOC1 34a_100000720124_200025704644 [1,0,0,1,0,0|2,0,0]=4 14703 B9R1.8 [13CH3]NCC1CCOCC1 2230a_100000746373_200025704644 [1,0,0,1,0,0|1,0,0]=3 14704 B9R1.8 [13CH3]NCC1CCOCC1 34a_100000746373_200025704644 [1,0,0,1,0,0|1,0,0]=3 14705 B9R1.8 [13CH3]NCC1CCSCC1 2230a_100015188806_200025704644 [1,0,0,1,0,0|1,1,0]=4 14706 B9R1.8 [13CH3]NCC1CCSCC1 34a_100015188806_200025704644 [1,0,0,1,0,0|1,1,0]=4 14707 B9R1.8 [13CH3]NC[C@H]1COCCO1 2230a_100010981119_200025704644 [1,0,0,1,0,0|1,0,0]=3 14708 B9R1.8 [13CH3]NC[C@H]1COCCO1 34a_100010981119_200025704644 [1,0,0,1,0,0|1,0,0]=3 14709 B9R1.8 [13CH3]OCC1CC=CCC1 34a_100000210713_200025704644 [1,0,0,1,0,0|1,0,1]=4 14710 B9R1.8 [13CH3]OCC1CCC=CO1 34a_100011217868_200025704644 [1,0,0,1,0,0|0,0,2]=4 14711 B9R1.8 [13CH3]OCC1CCCCC1 34a_100000212181_200025704644 [1,0,0,1,0,0|1,0,0]=3 14712 B9R1.8 [13CH3]OCC1CCCCC1 7a_100000212181_200025704644 [1,0,0,1,0,0|1,0,0]=3 14713 B9R1.8 [13CH3]OCC1CCCCN1 34a_100000210821_200025704644 [1,0,0,1,0,0|1,0,0]=3 14714 B9R1.8 [13CH3]OCC1CCCCO1 34a_100000211370_200025704644 [1,0,0,1,0,0|0,0,0]=2 14715 B9R1.8 [13CH3]OCC1CCCCO1 7a_100000211370_200025704644 [1,0,0,1,0,0|0,0,0]=2 14716 B9R1.8 [13CH3]OCC1CCCNC1 34a_100000211344_200025704644 [1,0,0,1,0,0|2,0,0]=4 14717 B9R1.8 [13CH3]OCC1CCCOC1 34a_100000741520_200025704644 [1,0,0,1,0,0|1,0,0]=3 14718 B9R1.8 [13CH3]OCC1CCNCC1 34a_100000738675_200025704644 [1,0,0,1,0,0|1,0,0]=3 14719 B9R1.8 [13CH3]OCC1CCOCC1 34a_100000749013_200025704644 [1,0,0,1,0,0|0,0,0]=2 14720 B9R1.8 [13CH3]OCC1CCSCC1 34a_100000070558_200025704644 [1,0,0,1,0,0|0,1,0]=3 14721 B9R1.8 [13CH3]OCC1CCSCC1 7a_100000070558_200025704644 [1,0,0,1,0,0|0,1,0]=3 14722 B9R1.8 [13CH3]OC[C@@H]1CNCCO1 34a_100015189573_200025704644 [1,0,0,1,0,0|1,0,0]=3 14723 B9R1.8 [13CH3]OC[C@@H]1COCCN1 34a_100000717676_200025704644 [1,0,0,1,0,0|1,0,0]=3 14724 B9R1.8 [13CH3]OC[C@H]1COCCO1 34a_100009875890_200025704644 [1,0,0,1,0,0|0,0,0]=2 14725 B9R1.8 [13CH3]SCC1CCCCC1 62a_100000211423_200025704644 [1,0,0,1,0,0|1,1,0]=4 14726 B9R1.8 [13CH3]SCC1CCCCC1 62a_200025704644_100000211423 [1,0,0,1,0,0|1,1,0]=4 14727 B9R1.8 [13CH3]SCC1CCCCO1 62a_100000211543_200025704644 [1,0,0,1,0,0|0,1,0]=3 14728 B9R1.8 [13CH3]SCC1CCCCO1 62a_200025704644_100000211543 [1,0,0,1,0,0|0,1,0]=3 14729 B9R1.8 [13CH3]SCC1CCCOC1 62a_100000741521_200025704644 [1,0,0,1,0,0|1,1,0]=4 14730 B9R1.8 [13CH3]SCC1CCCOC1 62a_200025704644_100000741521 [1,0,0,1,0,0|1,1,0]=4 14731 B9R1.8 [13CH3]SCC1CCOCC1 62a_100000754603_200025704644 [1,0,0,1,0,0|0,1,0]=3 14732 B9R1.8 [13CH3]SCC1CCOCC1 62a_200025704644_100000749018 [1,0,0,1,0,0|0,1,0]=3 14733 B9R1.12 BrCCOC1CCCC1 34a_100000211926_100000179811 [1,0,0,1,0,0|2,0,0]=4 14734 B9R1.12 BrCCOC1CCOC1 34a_100000211926_100000690089 [1,0,0,1,0,0|1,0,0]=3 14735 B9R1.12 C#CCOC1CCOC1 34a_100000210247_100000690089 [1,0,0,1,0,0|0,0,2]=4 14736 B9R1.12 C#CCO[C@H]1CCOC1 34a_100000717292_100000184674 [1,0,0,1,0,0|0,0,2]=4 14737 B9R1.12 C=CCOC1CCOC1 34a_200000210373_100000690089 [1,0,0,1,0,0|0,0,2]=4 14738 B9R1.12 C=CCO[C@H]1CCOC1 34a_100000717292_100015514636 [1,0,0,1,0,0|0,0,2]=4 14739 B9R1.12 CCCCN1CCCC1 2230a_100000188435_100000210211 [1,0,0,1,0,0|2,0,0]=4 14740 B9R1.12 CCCCN1CCCC1 269982a_100000188435_100000210211 [1,0,0,1,0,0|2,0,0]=4 14741 B9R1.12 CCCCN1CCSC1 2230a_100011215254_100000210211 [1,0,0,1,0,0|1,1,0]=4 14742 B9R1.12 CCCCN1CCSC1 269982a_100011215254_100000210211 [1,0,0,1,0,0|1,1,0]=4 14743 B9R1.12 CCCNC1CCCC1 2230a_100000211070_100000210303 [1,0,0,1,0,0|2,0,0]=4 14744 B9R1.12 CCCNC1CCCC1 270004a_100020643023_100000210133 [1,0,0,1,0,0|2,0,0]=4 14745 B9R1.12 CCCNC1CCCC1 34a_100000211070_100000210303 [1,0,0,1,0,0|2,0,0]=4 14746 B9R1.12 CCCNC1CCOC1 270004a_100020643023_100000752484 [1,0,0,1,0,0|1,0,0]=3 14747 B9R1.12 CCCNC1CCSC1 270004a_100020643023_100000212027 [1,0,0,1,0,0|1,1,0]=4 14748 B9R1.12 CCCN[C@@H]1CCOC1 2230a_200015188469_100000210303 [1,0,0,1,0,0|1,0,0]=3 14749 B9R1.12 CCCN[C@H]1CCOC1 2230a_100015188467_100000210303 [1,0,0,1,0,0|1,0,0]=3 14750 B9R1.12 CCCN[C@H]1CCOC1 34a_100015188467_100000210303 [1,0,0,1,0,0|1,0,0]=3 14751 B9R1.12 CCCOC1CCCC1 34a_100000210258_100000179811 [1,0,0,1,0,0|1,0,0]=3 14752 B9R1.12 CCCOC1CCCC1 34a_100000210269_100000210303 [1,0,0,1,0,0|1,0,0]=3 14753 B9R1.12 CCCOC1CCCC1 7a_100000210269_100000210303 [1,0,0,1,0,0|1,0,0]=3 14754 B9R1.12 CCCOC1CCCO1 34a_100000085407_100000210303 [1,0,0,1,0,0|2,0,0]=4 14755 B9R1.12 CCCOC1CCOC1 34a_100000210258_100000690089 [1,0,0,1,0,0|0,0,0]=2 14756 B9R1.12 CCCOC1CCSC1 7a_100011232664_100000210303 [1,0,0,1,0,0|0,1,0]=3 14757 B9R1.12 CCCO[C@H]1CCOC1 34a_100000717292_100000210303 [1,0,0,1,0,0|0,0,0]=2 14758 B9R1.12 CCCSC1CCCC1 62a_100000210303_100000179811 [1,0,0,1,0,0|1,1,0]=4 14759 B9R1.12 CCCSC1CCCC1 62a_100011217020_100000210303 [1,0,0,1,0,0|1,1,0]=4 14760 B9R1.12 CCCSC1CCOC1 62a_100000210303_100000690089 [1,0,0,1,0,0|0,1,0]=3 14761 B9R1.12 CCNCC1CCCC1 2230a_100000737975_100000210202 [1,0,0,1,0,0|2,0,0]=4 14762 B9R1.12 CCNCC1CCCC1 2230a_100015525214_100000740388 [1,0,0,1,0,0|2,0,0]=4 14763 B9R1.12 CCNCC1CCCC1 269862a_100015525214_100000746403 [1,0,0,1,0,0|2,0,0]=4 14764 B9R1.12 CCNCC1CCCC1 34a_100000737975_100000210202 [1,0,0,1,0,0|2,0,0]=4 14765 B9R1.12 CCNCC1CCCO1 2230a_100015525214_100000203698 [1,0,0,1,0,0|1,0,0]=3 14766 B9R1.12 CCNCC1CCOC1 2230a_100000737293_100000210202 [1,0,0,1,0,0|1,0,0]=3 14767 B9R1.12 CCNCC1CCOC1 2230a_100015525214_100000702531 [1,0,0,1,0,0|1,0,0]=3 14768 B9R1.12 CCNCC1CCOC1 34a_100000737293_100000210202 [1,0,0,1,0,0|1,0,0]=3 14769 B9R1.12 CCNCC1OCCO1 2230a_100000036311_100000210202 [1,0,0,1,0,0|1,0,0]=3 14770 B9R1.12 CCNCC1OCCO1 2230a_100015525214_100000755774 [1,0,0,1,0,0|1,0,0]=3 14771 B9R1.12 CCNCC1OCCO1 34a_100000036311_100000210202 [1,0,0,1,0,0|1,0,0]=3 14772 B9R1.12 CCNC[C@@H]1CCCO1 2230a_100020590478_100000210202 [1,0,0,1,0,0|1,0,0]=3 14773 B9R1.12 CCNC[C@@H]1CCCO1 34a_100020590478_100000210202 [1,0,0,1,0,0|1,0,0]=3 14774 B9R1.12 CCOCC1CC=CC1 34a_100000688395_100000210202 [1,0,0,1,0,0|1,0,1]=4 14775 B9R1.12 CCOCC1CCCC1 34a_100000742336_100000210202 [1,0,0,1,0,0|1,0,0]=3 14776 B9R1.12 CCOCC1CCCC1 34a_100121572206_100000740388 [1,0,0,1,0,0|1,0,0]=3 14777 B9R1.12 CCOCC1CCCC1 7a_100000742336_100000210202 [1,0,0,1,0,0|1,0,0]=3 14778 B9R1.12 CCOCC1CCCO1 34a_100000210270_100000210202 [1,0,0,1,0,0|0,0,0]=2 14779 B9R1.12 CCOCC1CCCO1 7a_100000210270_100000210202 [1,0,0,1,0,0|0,0,0]=2 14780 B9R1.12 CCOCC1CCNC1 34a_100000748654_100000210202 [1,0,0,1,0,0|1,0,0]=3 14781 B9R1.12 CCOCC1CCOC1 34a_100000740260_100000210202 [1,0,0,1,0,0|0,0,0]=2 14782 B9R1.12 CCOCC1CCOC1 34a_100121572206_100011261433 [1,0,0,1,0,0|0,0,0]=2 14783 B9R1.12 CCOCC1COCO1 34a_100011216627_100000210202 [1,0,0,1,0,0|0,0,0]=2 14784 B9R1.12 CCOCC1OCCO1 34a_100000087154_100000210202 [1,0,0,1,0,0|0,0,0]=2 14785 B9R1.12 CCOCC1OCCO1 34a_100121572206_100000755774 [1,0,0,1,0,0|0,0,0]=2 14786 B9R1.12 CCOCN1CCCC1 269982a_100000188435_100000739092 [1,0,0,1,0,0|2,0,0]=4 14787 B9R1.12 CCOCN1CCSC1 269982a_100011215254_100000739092 [1,0,0,1,0,0|1,1,0]=4 14788 B9R1.12 CCOC[C@H]1CCCN1 34a_100000745186_100000210202 [1,0,0,1,0,0|1,0,0]=3 14789 B9R1.12 CCSCC1CCCC1 62a_100000210202_100000740388 [1,0,0,1,0,0|1,1,0]=4 14790 B9R1.12 CCSCC1CCCC1 62a_100000740388_100000210202 [1,0,0,1,0,0|1,1,0]=4 14791 B9R1.12 CCSCC1CCCO1 62a_100000203698_100000210202 [1,0,0,1,0,0|0,1,0]=3 14792 B9R1.12 CCSCC1CCCO1 62a_100000210202_100000203698 [1,0,0,1,0,0|0,1,0]=3 14793 B9R1.12 CCSCC1CCOC1 62a_100000210202_100000702531 [1,0,0,1,0,0|0,1,0]=3 14794 B9R1.12 CCSCC1CCOC1 62a_100000702531_100000210202 [1,0,0,1,0,0|0,1,0]=3 14795 B9R1.12 CCSCC1OCCO1 62a_100000210202_100000755774 [1,0,0,1,0,0|0,1,0]=3 14796 B9R1.12 CCSCC1OCCO1 62a_100000755774_100000210202 [1,0,0,1,0,0|0,1,0]=3 14797 B9R1.12 CNCCC1CCCC1 2230a_100000739158_200000210301 [1,0,0,1,0,0|2,0,0]=4 14798 B9R1.12 CNCCC1CCCC1 2230a_106832991635_100000760354 [1,0,0,1,0,0|2,0,0]=4 14799 B9R1.12 CNCCC1CCCC1 34a_100000739158_200000210301 [1,0,0,1,0,0|2,0,0]=4 14800 B9R1.12 CNCCC1CCCC1 34a_100102657272_100000760354 [1,0,0,1,0,0|2,0,0]=4 14801 B9R1.12 CNCCC1CCCC1 7a_106832991635_100000760354 [1,0,0,1,0,0|2,0,0]=4 14802 B9R1.12 CNCCC1OCCO1 2230a_100000034215_200000210301 [1,0,0,1,0,0|2,0,0]=4 14803 B9R1.12 CNCCC1OCCO1 2230a_106832991635_100000740749 [1,0,0,1,0,0|2,0,0]=4 14804 B9R1.12 CNCCC1OCCO1 34a_100000034215_200000210301 [1,0,0,1,0,0|2,0,0]=4 14805 B9R1.12 CNCCC1OCCO1 34a_100102657272_100000740749 [1,0,0,1,0,0|2,0,0]=4 14806 B9R1.12 CNCCC1OCCO1 7a_106832991635_100000740749 [1,0,0,1,0,0|2,0,0]=4 14807 B9R1.12 CNCCN1CCCC1 7a_106832991635_100000004467 [1,0,0,1,0,0|2,0,0]=4 14808 B9R1.12 COCCC1CCCC1 34a_100000749090_200000210301 [1,0,0,1,0,0|1,0,0]=3 14809 B9R1.12 COCCC1CCCC1 34a_100138415774_100000760354 [1,0,0,1,0,0|1,0,0]=3 14810 B9R1.12 COCCC1CCCC1 7a_100000749090_200000210301 [1,0,0,1,0,0|1,0,0]=3 14811 B9R1.12 COCCC1CCNC1 34a_100016987287_200000210301 [1,0,0,1,0,0|1,0,0]=3 14812 B9R1.12 COCCC1CCOC1 34a_100011879284_200000210301 [1,0,0,1,0,0|0,0,0]=2 14813 B9R1.12 COCCC1OCCO1 34a_100138415774_100000740749 [1,0,0,1,0,0|2,0,0]=4 14814 B9R1.12 COCCN1CCCC1 2230a_100000188435_100011201679 [1,0,0,1,0,0|1,0,0]=3 14815 B9R1.12 COCCN1CCCC1 269982a_100000188435_100000233755 [1,0,0,1,0,0|1,0,0]=3 14816 B9R1.12 COCCN1CCSC1 2230a_100011215254_100011201679 [1,0,0,1,0,0|1,1,0]=4 14817 B9R1.12 COCCN1CCSC1 269982a_100011215254_100000233755 [1,0,0,1,0,0|1,1,0]=4 14818 B9R1.12 COCNC1CCCC1 2230a_100000211070_100000766300 [1,0,0,1,0,0|2,0,0]=4 14819 B9R1.12 COCN[C@@H]1CCOC1 2230a_200015188469_100000766300 [1,0,0,1,0,0|1,0,0]=3 14820 B9R1.12 COCN[C@H]1CCOC1 2230a_100015188467_100000766300 [1,0,0,1,0,0|1,0,0]=3 14821 B9R1.12 COCSC1CCCC1 62a_100000766300_100000179811 [1,0,0,1,0,0|1,1,0]=4 14822 B9R1.12 COCSC1CCCC1 62a_100011217020_100000766300 [1,0,0,1,0,0|1,1,0]=4 14823 B9R1.12 COCSC1CCOC1 62a_100000766300_100000690089 [1,0,0,1,0,0|0,1,0]=3 14824 B9R1.12 CSCCC1CCCC1 62a_100000760354_200000210301 [1,0,0,1,0,0|1,1,0]=4 14825 B9R1.12 CSCCC1CCCC1 62a_200000210301_100000760354 [1,0,0,1,0,0|1,1,0]=4 14826 B9R1.12 CSCCC1OCCO1 62a_200000210301_100000740749 [1,0,0,1,0,0|2,0,0]=4 14827 B9R1.12 CSCCN1CCCC1 2230a_100000188435_100000751147 [1,0,0,1,0,0|1,1,0]=4 14828 B9R1.12 CSCCN1CCCC1 269982a_100000188435_100000212216 [1,0,0,1,0,0|1,1,0]=4 14829 B9R1.12 CSCCN1CCCC1 62a_100000700749_200000210301 [1,0,0,1,0,0|1,1,0]=4 14830 B9R1.12 CSCCN1CCCC1 62a_200000210301_100000004467 [1,0,0,1,0,0|1,1,0]=4 14831 B9R1.12 CSCN[C@@H]1CCOC1 2230a_200015188469_100011218213 [1,0,0,1,0,0|1,1,0]=4 14832 B9R1.12 CSCN[C@H]1CCOC1 2230a_100015188467_100011218213 [1,0,0,1,0,0|1,1,0]=4 14833 B9R1.12 CSCN[C@H]1CCOC1 34a_100015188467_100011218213 [1,0,0,1,0,0|1,1,0]=4 14834 B9R1.12 CSCOC1CCCC1 34a_100000210269_100011218213 [1,0,0,1,0,0|1,1,0]=4 14835 B9R1.12 CSCO[C@H]1CCOC1 34a_100000717292_100011218213 [1,0,0,1,0,0|0,1,0]=3 14836 B9R1.12 CSCSC1CCOC1 62a_100011218213_100000690089 [1,0,0,1,0,0|0,2,0]=4 14837 B9R1.12 FCCNC1CCOC1 34a_100000724931_100000690089 [1,0,0,1,0,0|2,0,0]=4 14838 B9R1.12 FCCN[C@@H]1CCOC1 2230a_200015188469_100011217306 [1,0,0,1,0,0|2,0,0]=4 14839 B9R1.12 FCCN[C@H]1CCOC1 2230a_100015188467_100011217306 [1,0,0,1,0,0|2,0,0]=4 14840 B9R1.12 FCCN[C@H]1CCOC1 34a_100015188467_100011217306 [1,0,0,1,0,0|2,0,0]=4 14841 B9R1.12 FCCOC1CCCC1 34a_100000210269_100011217306 [1,0,0,1,0,0|2,0,0]=4 14842 B9R1.12 FCCOC1CCCC1 7a_100000210269_100011217306 [1,0,0,1,0,0|2,0,0]=4 14843 B9R1.12 FCCOC1CCSC1 7a_100011232664_100011217306 [1,0,0,1,0,0|1,1,0]=4 14844 B9R1.12 FCCO[C@H]1CCOC1 34a_100000717292_100011217306 [1,0,0,1,0,0|1,0,0]=3 14845 B9R1.12 FCCSC1CCOC1 62a_100011217306_100000690089 [1,0,0,1,0,0|1,1,0]=4 14846 B9R1.12 FCNCC1CCOC1 34a_100000737293_100015361967 [1,0,0,1,0,0|2,0,0]=4 14847 B9R1.12 FCNCC1OCCO1 34a_100000036311_100015361967 [1,0,0,1,0,0|2,0,0]=4 14848 B9R1.12 FCNC[C@@H]1CCCO1 34a_100020590478_100015361967 [1,0,0,1,0,0|2,0,0]=4 14849 B9R1.12 FCOCC1CCCC1 34a_100000742336_100015361967 [1,0,0,1,0,0|2,0,0]=4 14850 B9R1.12 FCOCC1CCCC1 7a_100000742336_100015361967 [1,0,0,1,0,0|2,0,0]=4 14851 B9R1.12 FCOCC1CCCO1 34a_100000210270_100015361967 [1,0,0,1,0,0|1,0,0]=3 14852 B9R1.12 FCOCC1CCCO1 7a_100000210270_100015361967 [1,0,0,1,0,0|1,0,0]=3 14853 B9R1.12 FCOCC1CCNC1 34a_100000748654_100015361967 [1,0,0,1,0,0|2,0,0]=4 14854 B9R1.12 FCOCC1CCOC1 34a_100000740260_100015361967 [1,0,0,1,0,0|1,0,0]=3 14855 B9R1.12 FCOCC1COCO1 34a_100011216627_100015361967 [1,0,0,1,0,0|1,0,0]=3 14856 B9R1.12 FCOCC1OCCO1 34a_100000087154_100015361967 [1,0,0,1,0,0|1,0,0]=3 14857 B9R1.12 FCOC[C@H]1CCCN1 34a_100000745186_100015361967 [1,0,0,1,0,0|2,0,0]=4 14858 B9R1.12 FCSCC1CCCO1 62a_100000203698_100015361967 [1,0,0,1,0,0|1,1,0]=4 14859 B9R1.12 FCSCC1CCCO1 62a_100015361967_100000203698 [1,0,0,1,0,0|1,1,0]=4 14860 B9R1.12 FCSCC1CCOC1 62a_100000702531_100015361967 [1,0,0,1,0,0|1,1,0]=4 14861 B9R1.12 FCSCC1CCOC1 62a_100015361967_100000702531 [1,0,0,1,0,0|1,1,0]=4 14862 B9R1.12 FCSCC1OCCO1 62a_100000755774_100015361967 [1,0,0,1,0,0|1,1,0]=4 14863 B9R1.12 FCSCC1OCCO1 62a_100015361967_100000755774 [1,0,0,1,0,0|1,1,0]=4 14864 B9R1.12 NCCOC1CCCC1 34a_100000210304_100000179811 [1,0,0,1,0,0|2,0,0]=4 14865 B9R1.12 NCCOC1CCOC1 34a_100000210304_100000690089 [1,0,0,1,0,0|1,0,0]=3 14866 B9R1.12 O=CCO[C@H]1CCOC1 34a_100000717292_200009817547 [1,0,0,1,0,0|0,0,2]=4 14867 B9R1.12 OCCNC1CCCC1 2230a_100000211070_100000211926 [1,0,0,1,0,0|2,0,0]=4 14868 B9R1.12 OCCNC1CCCC1 2230a_100016997473_100000179811 [1,0,0,1,0,0|2,0,0]=4 14869 B9R1.12 OCCNC1CCCC1 270004a_100000210304_100000210133 [1,0,0,1,0,0|2,0,0]=4 14870 B9R1.12 OCCNC1CCCC1 34a_100000211070_100000211926 [1,0,0,1,0,0|2,0,0]=4 14871 B9R1.12 OCCNC1CCCC1 34a_100016990907_100000179811 [1,0,0,1,0,0|2,0,0]=4 14872 B9R1.12 OCCNC1CCOC1 2230a_100016997473_100000731011 [1,0,0,1,0,0|1,0,0]=3 14873 B9R1.12 OCCNC1CCOC1 270004a_100000210304_100000752484 [1,0,0,1,0,0|1,0,0]=3 14874 B9R1.12 OCCNC1CCOC1 34a_100016990907_100000690089 [1,0,0,1,0,0|1,0,0]=3 14875 B9R1.12 OCCNC1CCSC1 270004a_100000210304_100000212027 [1,0,0,1,0,0|1,1,0]=4 14876 B9R1.12 OCCN[C@@H]1CCOC1 2230a_200015188469_100000211926 [1,0,0,1,0,0|1,0,0]=3 14877 B9R1.12 OCCN[C@H]1CCOC1 2230a_100015188467_100000211926 [1,0,0,1,0,0|1,0,0]=3 14878 B9R1.12 OCCN[C@H]1CCOC1 34a_100015188467_100000211926 [1,0,0,1,0,0|1,0,0]=3 14879 B9R1.12 OCCOC1CCCC1 34a_100000210269_100000211926 [1,0,0,1,0,0|1,0,0]=3 14880 B9R1.12 OCCOC1CCCC1 7a_100000210269_100000211926 [1,0,0,1,0,0|1,0,0]=3 14881 B9R1.12 OCCOC1CCCO1 34a_100000085407_100000211926 [1,0,0,1,0,0|2,0,0]=4 14882 B9R1.12 OCCOC1CCSC1 7a_100011232664_100000211926 [1,0,0,1,0,0|0,1,0]=3 14883 B9R1.12 OCCO[C@H]1CCOC1 34a_100000717292_100000211926 [1,0,0,1,0,0|0,0,0]=2 14884 B9R1.12 OCCSC1CCCC1 62a_100000211926_100000179811 [1,0,0,1,0,0|1,1,0]=4 14885 B9R1.12 OCCSC1CCCC1 62a_100011217020_100000211926 [1,0,0,1,0,0|1,1,0]=4 14886 B9R1.12 OCCSC1CCOC1 62a_100000211926_100000690089 [1,0,0,1,0,0|0,1,0]=3 14887 B9R1.12 [13CH3]NCCC1CCCC1 2230a_100000739158_200025704644 [1,0,0,1,0,0|2,0,0]=4 14888 B9R1.12 [13CH3]NCCC1CCCC1 34a_100000739158_200025704644 [1,0,0,1,0,0|2,0,0]=4 14889 B9R1.12 [13CH3]NCCC1OCCO1 2230a_100000034215_200025704644 [1,0,0,1,0,0|2,0,0]=4 14890 B9R1.12 [13CH3]NCCC1OCCO1 34a_100000034215_200025704644 [1,0,0,1,0,0|2,0,0]=4 14891 B9R1.12 [13CH3]OCCC1CCCC1 34a_100000749090_200025704644 [1,0,0,1,0,0|1,0,0]=3 14892 B9R1.12 [13CH3]OCCC1CCCC1 7a_100000749090_200025704644 [1,0,0,1,0,0|1,0,0]=3 14893 B9R1.12 [13CH3]OCCC1CCNC1 34a_100016987287_200025704644 [1,0,0,1,0,0|1,0,0]=3 14894 B9R1.12 [13CH3]OCCC1CCOC1 34a_100011879284_200025704644 [1,0,0,1,0,0|0,0,0]=2 14895 B9R1.12 [13CH3]SCCC1CCCC1 62a_100000760354_200025704644 [1,0,0,1,0,0|1,1,0]=4 14896 B9R1.12 [13CH3]SCCC1CCCC1 62a_200025704644_100000760354 [1,0,0,1,0,0|1,1,0]=4 14897 B9R1.12 [13CH3]SCCC1OCCO1 62a_200025704644_100000740749 [1,0,0,1,0,0|2,0,0]=4 14898 B9R1.12 [13CH3]SCCN1CCCC1 62a_100000700749_200025704644 [1,0,0,1,0,0|1,1,0]=4 14899 B9R1.12 [13CH3]SCCN1CCCC1 62a_200025704644_100000004467 [1,0,0,1,0,0|1,1,0]=4 14900 B9R1.14 CCC1CCCC1NC 269862a_106832991636_100000749056 [1,0,0,1,0,0|2,0,0]=4 14901 B9R1.14 CCC1CCCC1NC 270004a_106832991635_100000749056 [1,0,0,1,0,0|2,0,0]=4 14902 B9R1.14 CCC1CCCN1CC 2230a_100000754278_100000210202 [1,0,0,1,0,0|2,0,0]=4 14903 B9R1.14 CCC1CCCN1CC 269982a_100000754278_100000204670 [1,0,0,1,0,0|2,0,0]=4 14904 B9R1.14 CCC1CCCN1CC 34a_100000754278_100000210202 [1,0,0,1,0,0|2,0,0]=4 14905 B9R1.14 CCN1CCC[C@@H]1CO 2230a_100000745186_100000210202 [1,0,0,1,0,0|2,0,0]=4 14906 B9R1.14 CCN1CCC[C@@H]1CO 269982a_100000745186_100000204670 [1,0,0,1,0,0|2,0,0]=4 14907 B9R1.14 CCN1CCC[C@@H]1CO 34a_100000745186_100000210202 [1,0,0,1,0,0|2,0,0]=4 14908 B9R1.15 CC1CCCCC1N[13CH3] 2230a_100000211402_200025704644 [1,0,0,1,0,0|2,0,0]=4 14909 B9R1.15 CC1CCCCC1N[13CH3] 34a_100000211402_200025704644 [1,0,0,1,0,0|2,0,0]=4 14910 B9R1.15 CC1CCCCC1O[13CH3] 34a_100000211207_200025704644 [1,0,0,1,0,0|1,0,0]=3 14911 B9R1.15 CC1CCCCC1O[13CH3] 7a_100000211207_200025704644 [1,0,0,1,0,0|1,0,0]=3 14912 B9R1.15 CC1CCNCC1O[13CH3] 34a_100000696640_200025704644 [1,0,0,1,0,0|1,0,0]=3 14913 B9R1.15 CC1CNCCC1O[13CH3] 34a_100011998114_200025704644 [1,0,0,1,0,0|2,0,0]=4 14914 B9R1.15 CCC1CCCCN1C 2230a_100000210034_200000210301 [1,0,0,1,0,0|2,0,0]=4 14915 B9R1.15 CCC1CCCCN1C 269982a_100000210034_200000210301 [1,0,0,1,0,0|2,0,0]=4 14916 B9R1.15 CCC1CCCCN1C 34a_100000210034_200000210301 [1,0,0,1,0,0|2,0,0]=4 14917 B9R1.15 CCC1CCCCN1[13CH3] 2230a_100000210034_200025704644 [1,0,0,1,0,0|2,0,0]=4 14918 B9R1.15 CCC1CCCCN1[13CH3] 269982a_100000210034_200025704644 [1,0,0,1,0,0|2,0,0]=4 14919 B9R1.15 CCC1CCCCN1[13CH3] 34a_100000210034_200025704644 [1,0,0,1,0,0|2,0,0]=4 14920 B9R1.15 CCN1CCCCC1C 2230a_100000211376_100000210202 [1,0,0,1,0,0|2,0,0]=4 14921 B9R1.15 CCN1CCCCC1C 269982a_100000211376_100000204670 [1,0,0,1,0,0|2,0,0]=4 14922 B9R1.15 CCN1CCCCC1C 34a_100000211376_100000210202 [1,0,0,1,0,0|2,0,0]=4 14923 B9R1.15 CCN1CCOC[C@@H]1C 2230a_100009815349_100000210202 [1,0,0,1,0,0|1,0,0]=3 14924 B9R1.15 CCN1CCOC[C@@H]1C 269982a_100009815349_100000204670 [1,0,0,1,0,0|1,0,0]=3 14925 B9R1.15 CCN1CCOC[C@@H]1C 34a_100009815349_100000210202 [1,0,0,1,0,0|1,0,0]=3 14926 B9R1.15 CC[C@H]1COCCN1C 2230a_100016988097_200000210301 [1,0,0,1,0,0|1,0,0]=3 14927 B9R1.15 CC[C@H]1COCCN1C 269982a_100016988097_200000210301 [1,0,0,1,0,0|1,0,0]=3 14928 B9R1.15 CC[C@H]1COCCN1C 34a_100016988097_200000210301 [1,0,0,1,0,0|1,0,0]=3 14929 B9R1.15 CC[C@H]1COCCN1[13CH3] 2230a_100016988097_200025704644 [1,0,0,1,0,0|1,0,0]=3 14930 B9R1.15 CC[C@H]1COCCN1[13CH3] 269982a_100016988097_200025704644 [1,0,0,1,0,0|1,0,0]=3 14931 B9R1.15 CC[C@H]1COCCN1[13CH3] 34a_100016988097_200025704644 [1,0,0,1,0,0|1,0,0]=3 14932 B9R1.15 CN1CCOC[C@H]1CO 2230a_100000717676_200000210301 [1,0,0,1,0,0|2,0,0]=4 14933 B9R1.15 CN1CCOC[C@H]1CO 269982a_100000717676_200000210301 [1,0,0,1,0,0|2,0,0]=4 14934 B9R1.15 CN1CCOC[C@H]1CO 34a_100000717676_200000210301 [1,0,0,1,0,0|2,0,0]=4 14935 B9R1.15 CNC1CCCCC1C 2230a_100000211402_200000210301 [1,0,0,1,0,0|2,0,0]=4 14936 B9R1.15 CNC1CCCCC1C 269862a_106832991636_100000210921 [1,0,0,1,0,0|2,0,0]=4 14937 B9R1.15 CNC1CCCCC1C 270004a_106832991635_100000210921 [1,0,0,1,0,0|2,0,0]=4 14938 B9R1.15 CNC1CCCCC1C 34a_100000211402_200000210301 [1,0,0,1,0,0|2,0,0]=4 14939 B9R1.15 CNC1CCOCC1C 270004a_106832991635_100000755695 [1,0,0,1,0,0|2,0,0]=4 14940 B9R1.15 CN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_200000210301 [1,0,0,1,0,0|2,0,0]=4 14941 B9R1.15 CN[C@H]1COCC[C@@H]1O 2230a_100015739063_200000210301 [1,0,0,1,0,0|2,0,0]=4 14942 B9R1.15 COC1CCCCC1C 34a_100000211207_200000210301 [1,0,0,1,0,0|1,0,0]=3 14943 B9R1.15 COC1CCCCC1C 7a_100000211207_200000210301 [1,0,0,1,0,0|1,0,0]=3 14944 B9R1.15 COC1CCCCC1Cl 34a_100000038908_200000210301 [1,0,0,1,0,0|2,0,0]=4 14945 B9R1.15 COC1CCCCC1Cl 7a_100000038908_200000210301 [1,0,0,1,0,0|2,0,0]=4 14946 B9R1.15 COC1CCCCC1F 34a_100138415774_100015423560 [1,0,0,1,0,0|2,0,0]=4 14947 B9R1.15 COC1CCCCC1O 34a_100138415774_100000038908 [1,0,0,1,0,0|2,0,0]=4 14948 B9R1.15 COC1CCNCC1C 34a_100011998114_200000210301 [1,0,0,1,0,0|2,0,0]=4 14949 B9R1.15 COC1CNCCC1C 34a_100000696640_200000210301 [1,0,0,1,0,0|1,0,0]=3 14950 B9R1.15 COC1COCCC1=O 34a_100138415774_100012180262 [1,0,0,1,0,0|1,0,1]=4 14951 B9R1.15 CO[C@@H]1CCCC[C@H]1F 34a_100009816020_200000210301 [1,0,0,1,0,0|2,0,0]=4 14952 B9R1.15 CO[C@@H]1CCCC[C@H]1F 7a_100009816020_200000210301 [1,0,0,1,0,0|2,0,0]=4 14953 B9R1.15 CO[C@H]1CCCC[C@H]1N 34a_100015191688_200000210301 [1,0,0,1,0,0|2,0,0]=4 14954 B9R1.15 CO[C@H]1COCC[C@H]1N 34a_100016994285_200000210301 [1,0,0,1,0,0|1,0,0]=3 14955 B9R1.15 C[C@H]1COCCN1CF 269982a_100009815349_100015361967 [1,0,0,1,0,0|2,0,0]=4 14956 B9R1.15 C[C@H]1COCCN1CF 34a_100009815349_100015361967 [1,0,0,1,0,0|2,0,0]=4 14957 B9R1.15 [13CH3]N1CCOC[C@H]1CO 2230a_100000717676_200025704644 [1,0,0,1,0,0|2,0,0]=4 14958 B9R1.15 [13CH3]N1CCOC[C@H]1CO 269982a_100000717676_200025704644 [1,0,0,1,0,0|2,0,0]=4 14959 B9R1.15 [13CH3]N1CCOC[C@H]1CO 34a_100000717676_200025704644 [1,0,0,1,0,0|2,0,0]=4 14960 B9R1.15 [13CH3]N[C@@H]1CCOC[C@@H]1O 2230a_100016994285_200025704644 [1,0,0,1,0,0|2,0,0]=4 14961 B9R1.15 [13CH3]N[C@H]1COCC[C@@H]1O 2230a_100015739063_200025704644 [1,0,0,1,0,0|2,0,0]=4 14962 B9R1.15 [13CH3]OC1CCCCC1Cl 34a_100000038908_200025704644 [1,0,0,1,0,0|2,0,0]=4 14963 B9R1.15 [13CH3]OC1CCCCC1Cl 7a_100000038908_200025704644 [1,0,0,1,0,0|2,0,0]=4 14964 B9R1.15 [13CH3]O[C@@H]1CCCC[C@H]1F 34a_100009816020_200025704644 [1,0,0,1,0,0|2,0,0]=4 14965 B9R1.15 [13CH3]O[C@@H]1CCCC[C@H]1F 7a_100009816020_200025704644 [1,0,0,1,0,0|2,0,0]=4 14966 B9R1.15 [13CH3]O[C@H]1CCCC[C@H]1N 34a_100015191688_200025704644 [1,0,0,1,0,0|2,0,0]=4 14967 B9R1.15 [13CH3]O[C@H]1COCC[C@H]1N 34a_100016994285_200025704644 [1,0,0,1,0,0|1,0,0]=3 14968 B9R1.16 CC1CC1COCCF 34a_100000744939_100011217306 [1,0,0,1,0,0|2,0,0]=4 14969 B9R1.16 CC1CC1COCCF 7a_100000744939_100011217306 [1,0,0,1,0,0|2,0,0]=4 14970 B9R1.16 CC1CC1COCCO 34a_100000744939_100000211926 [1,0,0,1,0,0|1,0,0]=3 14971 B9R1.16 CC1CC1COCCO 7a_100000744939_100000211926 [1,0,0,1,0,0|1,0,0]=3 14972 B9R1.16 CCCOCC1CC1C 34a_100000744939_100000210303 [1,0,0,1,0,0|1,0,0]=3 14973 B9R1.16 CCCOCC1CC1C 7a_100000744939_100000210303 [1,0,0,1,0,0|1,0,0]=3 14974 B9R1.16 COCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100011201679 [1,0,0,1,0,0|2,0,0]=4 14975 B9R1.16 COCCN[C@@H]1C[C@H]1F 2230a_100025746932_100011201679 [1,0,0,1,0,0|2,0,0]=4 14976 B9R1.16 COCCN[C@@H]1C[C@H]1F 34a_100025746932_100011201679 [1,0,0,1,0,0|2,0,0]=4 14977 B9R1.16 CSCOCC1CC1C 34a_100000744939_100011218213 [1,0,0,1,0,0|1,1,0]=4 14978 B9R1.17 BrCCCOC1CCC1 34a_100011217188_100000749161 [1,0,0,1,0,0|2,0,0]=4 14979 B9R1.17 BrCCCOC1COC1 34a_100011217188_100009818527 [1,0,0,1,0,0|1,0,0]=3 14980 B9R1.17 BrCCOCC1CCC1 34a_100000211926_100000763275 [1,0,0,1,0,0|2,0,0]=4 14981 B9R1.17 BrCCOCC1CCO1 34a_100000211926_100000103362 [1,0,0,1,0,0|1,0,0]=3 14982 B9R1.17 C#CCCOC1CCC1 34a_100000748187_100000688953 [1,0,0,1,0,0|1,0,1]=4 14983 B9R1.17 C#CCCOC1CCC1 34a_100011215631_100000749161 [1,0,0,1,0,0|1,0,1]=4 14984 B9R1.17 C#CCCOC1COC1 34a_100011215631_100009818527 [1,0,0,1,0,0|0,0,2]=4 14985 B9R1.17 C#CCOCC1CCO1 34a_100000039022_100000184674 [1,0,0,1,0,0|0,0,2]=4 14986 B9R1.17 C#CCOCC1CCO1 34a_100000210247_100000103362 [1,0,0,1,0,0|0,0,2]=4 14987 B9R1.17 C/C=C/COC1CCC1 34a_100000748187_100102629194 [1,0,0,1,0,0|1,0,1]=4 14988 B9R1.17 C/C=C/COC1CCC1 34a_100016270725_100000749161 [1,0,0,1,0,0|1,0,1]=4 14989 B9R1.17 C/C=C/COC1COC1 34a_100016270725_100009818527 [1,0,0,1,0,0|0,0,2]=4 14990 B9R1.17 C=CCCOC1CCC1 34a_100000748187_100000754431 [1,0,0,1,0,0|1,0,1]=4 14991 B9R1.17 C=CCCOC1CCC1 34a_100011205117_100000749161 [1,0,0,1,0,0|1,0,1]=4 14992 B9R1.17 C=CCCOC1COC1 34a_100011205117_100009818527 [1,0,0,1,0,0|0,0,2]=4 14993 B9R1.17 C=CCOCC1CCO1 34a_100000039022_100015514636 [1,0,0,1,0,0|0,0,2]=4 14994 B9R1.17 C=CCOCC1CCO1 34a_200000210373_100000103362 [1,0,0,1,0,0|0,0,2]=4 14995 B9R1.17 CC#CCOC1CCC1 34a_100000748187_100000748600 [1,0,0,1,0,0|1,0,1]=4 14996 B9R1.17 CC#CCOC1CCC1 34a_100000761923_100000749161 [1,0,0,1,0,0|1,0,1]=4 14997 B9R1.17 CC#CCOC1COC1 34a_100000761923_100009818527 [1,0,0,1,0,0|0,0,2]=4 14998 B9R1.17 CC=CCOC1CCC1 34a_100000748187_100000070051 [1,0,0,1,0,0|1,0,1]=4 14999 B9R1.17 CCCCCN1CCC1 269982a_100000754969_100000210215 [1,0,0,1,0,0|2,0,0]=4 15000 B9R1.17 CCCCNC1CCC1 2230a_100000749019_100000210211 [1,0,0,1,0,0|2,0,0]=4 15001 B9R1.17 CCCCNC1CCC1 270004a_100000102301_100000241760 [1,0,0,1,0,0|2,0,0]=4 15002 B9R1.17 CCCCNC1CCC1 34a_100000749019_100000210210 [1,0,0,1,0,0|2,0,0]=4 15003 B9R1.17 CCCCNC1COC1 2230a_100016991112_100000210211 [1,0,0,1,0,0|1,0,0]=3 15004 B9R1.17 CCCCNC1COC1 7a_106832991798_100009818527 [1,0,0,1,0,0|1,0,0]=3 15005 B9R1.17 CCCCOC1CCC1 34a_100000210227_100000749161 [1,0,0,1,0,0|1,0,0]=3 15006 B9R1.17 CCCCOC1CCC1 34a_100000748187_100000210210 [1,0,0,1,0,0|1,0,0]=3 15007 B9R1.17 CCCCOC1COC1 34a_100000210227_100009818527 [1,0,0,1,0,0|0,0,0]=2 15008 B9R1.17 CCCCOC1COC1 7a_100000210227_100009818527 [1,0,0,1,0,0|0,0,0]=2 15009 B9R1.17 CCCCOC1CSC1 7a_100000072292_100000210211 [1,0,0,1,0,0|0,1,0]=3 15010 B9R1.17 CCCCSC1CCC1 62a_100000210211_100000749161 [1,0,0,1,0,0|1,1,0]=4 15011 B9R1.17 CCCCSC1COC1 62a_100000210211_100009818527 [1,0,0,1,0,0|0,1,0]=3 15012 B9R1.17 CCCNCC1CCC1 2230a_100000738700_100000210303 [1,0,0,1,0,0|2,0,0]=4 15013 B9R1.17 CCCNCC1CCC1 269862a_100020643023_100000753134 [1,0,0,1,0,0|2,0,0]=4 15014 B9R1.17 CCCNCC1CCC1 34a_100000738700_100000210303 [1,0,0,1,0,0|2,0,0]=4 15015 B9R1.17 CCCNCC1COC1 2230a_100015281925_100000210303 [1,0,0,1,0,0|2,0,0]=4 15016 B9R1.17 CCCNCC1COC1 34a_100015281925_100000210303 [1,0,0,1,0,0|2,0,0]=4 15017 B9R1.17 CCCNC[C@@H]1CCO1 2230a_100020831831_100000210303 [1,0,0,1,0,0|1,0,0]=3 15018 B9R1.17 CCCNC[C@@H]1CCO1 34a_100020831831_100000210303 [1,0,0,1,0,0|1,0,0]=3 15019 B9R1.17 CCCOCC1CCC1 34a_100000210258_100000763275 [1,0,0,1,0,0|1,0,0]=3 15020 B9R1.17 CCCOCC1CCC1 34a_100000760304_100000210303 [1,0,0,1,0,0|1,0,0]=3 15021 B9R1.17 CCCOCC1CCO1 34a_100000039022_100000210303 [1,0,0,1,0,0|0,0,0]=2 15022 B9R1.17 CCCOCC1CCO1 34a_100000210258_100000103362 [1,0,0,1,0,0|0,0,0]=2 15023 B9R1.17 CCCOCC1CNC1 34a_100016987283_100000210303 [1,0,0,1,0,0|2,0,0]=4 15024 B9R1.17 CCCOCC1COC1 34a_100000060846_100000210303 [1,0,0,1,0,0|2,0,0]=4 15025 B9R1.17 CCCOCC1COC1 34a_100000210258_100010264016 [1,0,0,1,0,0|2,0,0]=4 15026 B9R1.17 CCCSCC1CCC1 62a_100000210303_100000763275 [1,0,0,1,0,0|1,1,0]=4 15027 B9R1.17 CCCSCC1CCC1 62a_100000763275_100000210303 [1,0,0,1,0,0|1,1,0]=4 15028 B9R1.17 CCCSCC1CCO1 62a_100000103362_100000210303 [1,0,0,1,0,0|0,1,0]=3 15029 B9R1.17 CCCSCC1CCO1 62a_100000210303_100000103362 [1,0,0,1,0,0|0,1,0]=3 15030 B9R1.17 CCCSCC1COC1 62a_100000210303_100010264016 [1,0,0,1,0,0|2,0,0]=4 15031 B9R1.17 CCCSCC1COC1 62a_100010264016_100000210303 [1,0,0,1,0,0|2,0,0]=4 15032 B9R1.17 CCOCCC1COC1 34a_100009855314_100000210202 [1,0,0,1,0,0|0,0,0]=2 15033 B9R1.17 CCOCCN1CCC1 269982a_100000754969_100011215890 [1,0,0,1,0,0|1,0,0]=3 15034 B9R1.17 CCOCSC1CCC1 62a_100000739092_100000749161 [1,0,0,1,0,0|1,1,0]=4 15035 B9R1.17 CCOCSC1COC1 62a_100000739092_100009818527 [1,0,0,1,0,0|0,1,0]=3 15036 B9R1.17 CCSCCN1CCC1 269982a_100000754969_100000757381 [1,0,0,1,0,0|1,1,0]=4 15037 B9R1.17 COCCCN1CCC1 269982a_100000754969_100000740836 [1,0,0,1,0,0|2,0,0]=4 15038 B9R1.17 COCCNC1CCC1 2230a_100000749019_100011201679 [1,0,0,1,0,0|1,0,0]=3 15039 B9R1.17 COCCNC1CCC1 270004a_100000209980_100000241760 [1,0,0,1,0,0|1,0,0]=3 15040 B9R1.17 COCCNC1CCC1 34a_100000749019_100011201679 [1,0,0,1,0,0|1,0,0]=3 15041 B9R1.17 COCCNC1COC1 2230a_100016991112_100011201679 [1,0,0,1,0,0|1,0,0]=3 15042 B9R1.17 COCCOC1CCC1 34a_100000210237_100000749161 [1,0,0,1,0,0|0,0,0]=2 15043 B9R1.17 COCCOC1CCC1 34a_100000748187_100011201679 [1,0,0,1,0,0|0,0,0]=2 15044 B9R1.17 COCCOC1COC1 34a_100000210237_100009818527 [1,0,0,1,0,0|0,0,0]=2 15045 B9R1.17 COCCOC1CSC1 7a_100000072292_100000233755 [1,0,0,1,0,0|0,1,0]=3 15046 B9R1.17 COCCSC1CCC1 62a_100000233755_100000749161 [1,0,0,1,0,0|0,1,0]=3 15047 B9R1.17 COCCSC1COC1 62a_100000233755_100009818527 [1,0,0,1,0,0|0,1,0]=3 15048 B9R1.17 COCNCC1CCC1 2230a_100000738700_100000766300 [1,0,0,1,0,0|2,0,0]=4 15049 B9R1.17 COCNCC1COC1 2230a_100015281925_100000766300 [1,0,0,1,0,0|2,0,0]=4 15050 B9R1.17 COCNC[C@@H]1CCO1 2230a_100020831831_100000766300 [1,0,0,1,0,0|1,0,0]=3 15051 B9R1.17 COCSCC1CCC1 62a_100000763275_100000766300 [1,0,0,1,0,0|1,1,0]=4 15052 B9R1.17 COCSCC1CCC1 62a_100000766300_100000763275 [1,0,0,1,0,0|1,1,0]=4 15053 B9R1.17 COCSCC1CCO1 62a_100000103362_100000766300 [1,0,0,1,0,0|0,1,0]=3 15054 B9R1.17 COCSCC1CCO1 62a_100000766300_100000103362 [1,0,0,1,0,0|0,1,0]=3 15055 B9R1.17 COCSCC1COC1 62a_100000766300_100010264016 [1,0,0,1,0,0|2,0,0]=4 15056 B9R1.17 COCSCC1COC1 62a_100010264016_100000766300 [1,0,0,1,0,0|2,0,0]=4 15057 B9R1.17 CSCCNC1CCC1 2230a_100000749019_100000751147 [1,0,0,1,0,0|1,1,0]=4 15058 B9R1.17 CSCCNC1CCC1 270004a_100020590264_100000241760 [1,0,0,1,0,0|1,1,0]=4 15059 B9R1.17 CSCCNC1CCC1 34a_100000749019_100000212216 [1,0,0,1,0,0|1,1,0]=4 15060 B9R1.17 CSCCNC1COC1 2230a_100016991112_100000751147 [1,0,0,1,0,0|1,1,0]=4 15061 B9R1.17 CSCCOC1CCC1 34a_100000230434_100000749161 [1,0,0,1,0,0|0,1,0]=3 15062 B9R1.17 CSCCOC1CCC1 34a_100000748187_100000212216 [1,0,0,1,0,0|0,1,0]=3 15063 B9R1.17 CSCCOC1COC1 34a_100000230434_100009818527 [1,0,0,1,0,0|0,1,0]=3 15064 B9R1.17 CSCCOC1COC1 7a_100000230434_100009818527 [1,0,0,1,0,0|0,1,0]=3 15065 B9R1.17 CSCCOC1CSC1 7a_100000072292_100000212216 [1,0,0,1,0,0|0,2,0]=4 15066 B9R1.17 CSCCSC1CCC1 62a_100000212216_100000749161 [1,0,0,1,0,0|0,2,0]=4 15067 B9R1.17 CSCCSC1COC1 62a_100000212216_100009818527 [1,0,0,1,0,0|0,2,0]=4 15068 B9R1.17 CSCNC[C@@H]1CCO1 2230a_100020831831_100011218213 [1,0,0,1,0,0|1,1,0]=4 15069 B9R1.17 CSCNC[C@@H]1CCO1 34a_100020831831_100011218213 [1,0,0,1,0,0|1,1,0]=4 15070 B9R1.17 CSCOCC1CCC1 34a_100000760304_100011218213 [1,0,0,1,0,0|1,1,0]=4 15071 B9R1.17 CSCOCC1CCO1 34a_100000039022_100011218213 [1,0,0,1,0,0|0,1,0]=3 15072 B9R1.17 CSCSCC1CCO1 62a_100000103362_100011218213 [1,0,0,1,0,0|0,2,0]=4 15073 B9R1.17 CSCSCC1CCO1 62a_100011218213_100000103362 [1,0,0,1,0,0|0,2,0]=4 15074 B9R1.17 ClCCCOC1CCC1 34a_100000230001_100000749161 [1,0,0,1,0,0|2,0,0]=4 15075 B9R1.17 ClCCCOC1COC1 34a_100000230001_100009818527 [1,0,0,1,0,0|1,0,0]=3 15076 B9R1.17 FCCCNC1COC1 2230a_100016991112_100011934791 [1,0,0,1,0,0|2,0,0]=4 15077 B9R1.17 FCCCNC1COC1 34a_100015189416_100009818527 [1,0,0,1,0,0|2,0,0]=4 15078 B9R1.17 FCCCOC1CCC1 34a_100000748187_100011934791 [1,0,0,1,0,0|2,0,0]=4 15079 B9R1.17 FCCCOC1CCC1 34a_100000759539_100000749161 [1,0,0,1,0,0|2,0,0]=4 15080 B9R1.17 FCCCOC1COC1 34a_100000759539_100009818527 [1,0,0,1,0,0|1,0,0]=3 15081 B9R1.17 FCCCOC1CSC1 7a_100000072292_100011934791 [1,0,0,1,0,0|1,1,0]=4 15082 B9R1.17 FCCCSC1COC1 62a_100011934791_100009818527 [1,0,0,1,0,0|1,1,0]=4 15083 B9R1.17 FCCNCC1CCO1 34a_100000724931_100000103362 [1,0,0,1,0,0|2,0,0]=4 15084 B9R1.17 FCCNC[C@@H]1CCO1 2230a_100020831831_100011217306 [1,0,0,1,0,0|2,0,0]=4 15085 B9R1.17 FCCNC[C@@H]1CCO1 34a_100020831831_100011217306 [1,0,0,1,0,0|2,0,0]=4 15086 B9R1.17 FCCOCC1CCC1 34a_100000760304_100011217306 [1,0,0,1,0,0|2,0,0]=4 15087 B9R1.17 FCCOCC1CCO1 34a_100000039022_100011217306 [1,0,0,1,0,0|1,0,0]=3 15088 B9R1.17 FCCSCC1CCO1 62a_100000103362_100011217306 [1,0,0,1,0,0|1,1,0]=4 15089 B9R1.17 FCCSCC1CCO1 62a_100011217306_100000103362 [1,0,0,1,0,0|1,1,0]=4 15090 B9R1.17 FCOCCC1COC1 34a_100009855314_100015361967 [1,0,0,1,0,0|1,0,0]=3 15091 B9R1.17 NCCCOC1CCC1 34a_100000182051_100000749161 [1,0,0,1,0,0|2,0,0]=4 15092 B9R1.17 NCCCOC1COC1 34a_100000182051_100009818527 [1,0,0,1,0,0|1,0,0]=3 15093 B9R1.17 NCCOCC1CCC1 34a_100000210304_100000763275 [1,0,0,1,0,0|2,0,0]=4 15094 B9R1.17 NCCOCC1CCO1 34a_100000210304_100000103362 [1,0,0,1,0,0|1,0,0]=3 15095 B9R1.17 NOCCOC1CCC1 34a_100000700252_100000749161 [1,0,0,1,0,0|1,0,0]=3 15096 B9R1.17 NOCCOC1COC1 34a_100000700252_100009818527 [1,0,0,1,0,0|1,0,0]=3 15097 B9R1.17 O=CCOCC1CCO1 34a_100000039022_200009817547 [1,0,0,1,0,0|0,0,2]=4 15098 B9R1.17 OCCCNC1COC1 2230a_100016991112_100000230001 [1,0,0,1,0,0|2,0,0]=4 15099 B9R1.17 OCCCOC1CCC1 34a_100000748187_100000230001 [1,0,0,1,0,0|2,0,0]=4 15100 B9R1.17 OCCCOC1CSC1 7a_100000072292_100011215043 [1,0,0,1,0,0|1,1,0]=4 15101 B9R1.17 OCCCSC1COC1 62a_100011215043_100009818527 [1,0,0,1,0,0|1,1,0]=4 15102 B9R1.17 OCCNCC1CCC1 2230a_100000738700_100000211926 [1,0,0,1,0,0|2,0,0]=4 15103 B9R1.17 OCCNCC1CCC1 2230a_100016997473_100000763275 [1,0,0,1,0,0|2,0,0]=4 15104 B9R1.17 OCCNCC1CCC1 269862a_100000210304_100000753134 [1,0,0,1,0,0|2,0,0]=4 15105 B9R1.17 OCCNCC1CCC1 34a_100000738700_100000211926 [1,0,0,1,0,0|2,0,0]=4 15106 B9R1.17 OCCNCC1CCC1 34a_100016990907_100000763275 [1,0,0,1,0,0|2,0,0]=4 15107 B9R1.17 OCCNCC1CCO1 2230a_100016997473_100000103362 [1,0,0,1,0,0|1,0,0]=3 15108 B9R1.17 OCCNCC1CCO1 34a_100016990907_100000103362 [1,0,0,1,0,0|1,0,0]=3 15109 B9R1.17 OCCNC[C@@H]1CCO1 2230a_100020831831_100000211926 [1,0,0,1,0,0|1,0,0]=3 15110 B9R1.17 OCCNC[C@@H]1CCO1 34a_100020831831_100000211926 [1,0,0,1,0,0|1,0,0]=3 15111 B9R1.17 OCCOCC1CCC1 34a_100000760304_100000211926 [1,0,0,1,0,0|1,0,0]=3 15112 B9R1.17 OCCOCC1CCO1 34a_100000039022_100000211926 [1,0,0,1,0,0|0,0,0]=2 15113 B9R1.17 OCCOCC1CNC1 34a_100016987283_100000211926 [1,0,0,1,0,0|2,0,0]=4 15114 B9R1.17 OCCOCC1COC1 34a_100000060846_100000211926 [1,0,0,1,0,0|2,0,0]=4 15115 B9R1.17 OCCSCC1CCC1 62a_100000211926_100000763275 [1,0,0,1,0,0|1,1,0]=4 15116 B9R1.17 OCCSCC1CCC1 62a_100000763275_100000211926 [1,0,0,1,0,0|1,1,0]=4 15117 B9R1.17 OCCSCC1CCO1 62a_100000103362_100000211926 [1,0,0,1,0,0|0,1,0]=3 15118 B9R1.17 OCCSCC1CCO1 62a_100000211926_100000103362 [1,0,0,1,0,0|0,1,0]=3 15119 B9R1.33 CC1CCCC1OCF 34a_100011216460_100015361967 [1,0,0,1,0,0|2,0,0]=4 15120 B9R1.33 CC1CCCC1OCF 7a_100011216460_100015361967 [1,0,0,1,0,0|2,0,0]=4 15121 B9R1.33 CC1SCCN1CCO 2230a_200011216479_100000211926 [1,0,0,1,0,0|1,1,0]=4 15122 B9R1.33 CC1SCCN1CCO 269982a_200011216479_100000211926 [1,0,0,1,0,0|1,1,0]=4 15123 B9R1.33 CC1SCCN1CCO 34a_200011216479_100000211926 [1,0,0,1,0,0|1,1,0]=4 15124 B9R1.33 CCCN1CCC[C@@H]1C 2230a_100020605311_100000210303 [1,0,0,1,0,0|2,0,0]=4 15125 B9R1.33 CCCN1CCC[C@@H]1C 269982a_100020605311_100000210303 [1,0,0,1,0,0|2,0,0]=4 15126 B9R1.33 CCCN1CCC[C@H]1C 2230a_100015189458_100000210303 [1,0,0,1,0,0|2,0,0]=4 15127 B9R1.33 CCCN1CCC[C@H]1C 269982a_100015189458_100000210303 [1,0,0,1,0,0|2,0,0]=4 15128 B9R1.33 CCCN1CCC[C@H]1C 34a_100015189458_100000210303 [1,0,0,1,0,0|2,0,0]=4 15129 B9R1.33 CCCN1CCSC1C 2230a_200011216479_100000210303 [1,0,0,1,0,0|1,1,0]=4 15130 B9R1.33 CCCN1CCSC1C 269982a_200011216479_100000210303 [1,0,0,1,0,0|1,1,0]=4 15131 B9R1.33 CCCN1CCSC1C 34a_200011216479_100000210303 [1,0,0,1,0,0|1,1,0]=4 15132 B9R1.33 CCNC1CCCC1C 269862a_100015525214_100000752053 [1,0,0,1,0,0|2,0,0]=4 15133 B9R1.33 CCNC1CCOC1C 270004a_100015525214_100000691750 [1,0,0,1,0,0|2,0,0]=4 15134 B9R1.33 CCN[C@H]1COC[C@@H]1O 2230a_100015191717_100000210202 [1,0,0,1,0,0|1,0,0]=3 15135 B9R1.33 CCOC1CCCC1=O 34a_100121572206_100000709159 [1,0,0,1,0,0|2,0,0]=4 15136 B9R1.33 CCOC1CCCC1=O 34a_200000719330_100000210202 [1,0,0,1,0,0|2,0,0]=4 15137 B9R1.33 CCOC1CCCC1C 34a_100011216460_100000210202 [1,0,0,1,0,0|1,0,0]=3 15138 B9R1.33 CCOC1CCCC1C 7a_100011216460_100000210202 [1,0,0,1,0,0|1,0,0]=3 15139 B9R1.33 CCOC1COCC1O 34a_100121572206_200000725654 [1,0,0,1,0,0|0,0,0]=2 15140 B9R1.33 CCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000210202 [1,0,0,1,0,0|2,0,0]=4 15141 B9R1.33 CCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000210202 [1,0,0,1,0,0|2,0,0]=4 15142 B9R1.33 CCO[C@H]1CNC[C@H]1C 34a_200015306588_100000210202 [1,0,0,1,0,0|1,0,0]=3 15143 B9R1.33 CCO[C@H]1COC[C@@H]1N 34a_100015191717_100000210202 [1,0,0,1,0,0|1,0,0]=3 15144 B9R1.33 CCSC1COCC1O 62a_100000210202_200000725654 [1,0,0,1,0,0|0,1,0]=3 15145 B9R1.33 CCSC1COCC1O 62a_200000725654_100000210202 [1,0,0,1,0,0|0,1,0]=3 15146 B9R1.33 CCS[C@@H]1CCC[C@H]1O 62a_100000210202_200016002552 [1,0,0,1,0,0|1,1,0]=4 15147 B9R1.33 CCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000210202 [1,0,0,1,0,0|1,1,0]=4 15148 B9R1.33 CN1CCCC1CO[13CH3] 34a_100000743107_200025704644 [1,0,0,1,0,0|2,0,0]=4 15149 B9R1.33 COCC1CCCN1C 34a_100000743107_200000210301 [1,0,0,1,0,0|2,0,0]=4 15150 B9R1.33 COCN1CCC[C@@H]1C 2230a_100020605311_100000766300 [1,0,0,1,0,0|2,0,0]=4 15151 B9R1.33 COCN1CCC[C@@H]1C 269982a_100020605311_100000766300 [1,0,0,1,0,0|2,0,0]=4 15152 B9R1.33 COCN1CCC[C@H]1C 2230a_100015189458_100000766300 [1,0,0,1,0,0|2,0,0]=4 15153 B9R1.33 COCN1CCC[C@H]1C 269982a_100015189458_100000766300 [1,0,0,1,0,0|2,0,0]=4 15154 B9R1.33 COCN1CCSC1C 2230a_200011216479_100000766300 [1,0,0,1,0,0|1,1,0]=4 15155 B9R1.33 COCN1CCSC1C 269982a_200011216479_100000766300 [1,0,0,1,0,0|1,1,0]=4 15156 B9R1.33 COC[C@@H]1CCCN1C 2230a_100020646714_200000210301 [1,0,0,1,0,0|2,0,0]=4 15157 B9R1.33 COC[C@@H]1CCCN1C 269982a_100020646714_200000210301 [1,0,0,1,0,0|2,0,0]=4 15158 B9R1.33 COC[C@@H]1CCCN1C 34a_100020646714_200000210301 [1,0,0,1,0,0|2,0,0]=4 15159 B9R1.33 COC[C@@H]1CCCN1[13CH3] 2230a_100020646714_200025704644 [1,0,0,1,0,0|2,0,0]=4 15160 B9R1.33 COC[C@@H]1CCCN1[13CH3] 269982a_100020646714_200025704644 [1,0,0,1,0,0|2,0,0]=4 15161 B9R1.33 COC[C@@H]1CCCN1[13CH3] 34a_100020646714_200025704644 [1,0,0,1,0,0|2,0,0]=4 15162 B9R1.33 C[C@@H]1CCCN1CCO 2230a_100015189458_100000211926 [1,0,0,1,0,0|2,0,0]=4 15163 B9R1.33 C[C@@H]1CCCN1CCO 269982a_100015189458_100000211926 [1,0,0,1,0,0|2,0,0]=4 15164 B9R1.33 C[C@@H]1CCCN1CCO 34a_100015189458_100000211926 [1,0,0,1,0,0|2,0,0]=4 15165 B9R1.33 C[C@@H]1CNC[C@@H]1OCF 34a_200015306588_100015361967 [1,0,0,1,0,0|2,0,0]=4 15166 B9R1.33 C[C@H]1CCCN1CCO 2230a_100020605311_100000211926 [1,0,0,1,0,0|2,0,0]=4 15167 B9R1.33 C[C@H]1CCCN1CCO 269982a_100020605311_100000211926 [1,0,0,1,0,0|2,0,0]=4 15168 B9R1.33 N[C@H]1COC[C@@H]1OCF 34a_100015191717_100015361967 [1,0,0,1,0,0|2,0,0]=4 15169 B9R1.33 OC1COCC1SCF 62a_100015361967_200000725654 [1,0,0,1,0,0|1,1,0]=4 15170 B9R1.33 OC1COCC1SCF 62a_200000725654_100015361967 [1,0,0,1,0,0|1,1,0]=4 15171 B9R1.39 CCCCN1CCC1C 269982a_100000755817_100000210211 [1,0,0,1,0,0|2,0,0]=4 15172 B9R1.39 CCCCN1CCC1C 34a_100000755817_100000210210 [1,0,0,1,0,0|2,0,0]=4 15173 B9R1.39 CCOCN1CCC1C 269982a_100000755817_100000739092 [1,0,0,1,0,0|2,0,0]=4 15174 B9R1.39 COCCN1CCC1C 269982a_100000755817_100000233755 [1,0,0,1,0,0|1,0,0]=3 15175 B9R1.39 COCCN1CCC1C 34a_100000755817_100011201679 [1,0,0,1,0,0|1,0,0]=3 15176 B9R1.39 CSCCN1CCC1C 269982a_100000755817_100000212216 [1,0,0,1,0,0|1,1,0]=4 15177 B9R1.39 CSCCN1CCC1C 34a_100000755817_100000212216 [1,0,0,1,0,0|1,1,0]=4 15178 B9R1.50 CN1CCCCCCC1 2230a_100000211400_200000210301 [1,0,0,1,0,0|2,0,0]=4 15179 B9R1.50 CN1CCCCCCC1 269982a_100000211400_200000210301 [1,0,0,1,0,0|2,0,0]=4 15180 B9R1.50 CN1CCCCCCC1 34a_100000211400_200000210301 [1,0,0,1,0,0|2,0,0]=4 15181 B9R1.50 [13CH3]N1CCCCCCC1 2230a_100000211400_200025704644 [1,0,0,1,0,0|2,0,0]=4 15182 B9R1.50 [13CH3]N1CCCCCCC1 269982a_100000211400_200025704644 [1,0,0,1,0,0|2,0,0]=4 15183 B9R1.50 [13CH3]N1CCCCCCC1 34a_100000211400_200025704644 [1,0,0,1,0,0|2,0,0]=4 15184 B9R1.83 BrCCCCOC1CC1 34a_100011216708_100000211595 [1,0,0,1,0,0|2,0,0]=4 15185 B9R1.83 BrCCCOCC1CC1 34a_100011217188_100000742324 [1,0,0,1,0,0|2,0,0]=4 15186 B9R1.83 BrCCCOCC1CO1 34a_100011217188_102125554688 [1,0,0,1,0,0|1,0,0]=3 15187 B9R1.83 BrCCOCCC1CC1 34a_100000211926_100000694398 [1,0,0,1,0,0|2,0,0]=4 15188 B9R1.83 C#CCCOCC1CC1 34a_100000211283_100000688953 [1,0,0,1,0,0|1,0,1]=4 15189 B9R1.83 C#CCCOCC1CC1 34a_100011215631_100000742324 [1,0,0,1,0,0|1,0,1]=4 15190 B9R1.83 C#CCCOCC1CO1 34a_100011215631_102125554688 [1,0,0,1,0,0|0,0,2]=4 15191 B9R1.83 C#CCCOC[C@@H]1CO1 34a_100000757423_100000688953 [1,0,0,1,0,0|0,0,2]=4 15192 B9R1.83 C/C=C/CCOC1CC1 34a_100016278192_100000211595 [1,0,0,1,0,0|1,0,1]=4 15193 B9R1.83 C/C=C/COCC1CC1 34a_100000211283_100102629194 [1,0,0,1,0,0|1,0,1]=4 15194 B9R1.83 C/C=C/COCC1CC1 34a_100016270725_100000742324 [1,0,0,1,0,0|1,0,1]=4 15195 B9R1.83 C/C=C/COCC1CO1 34a_100016270725_102125554688 [1,0,0,1,0,0|0,0,2]=4 15196 B9R1.83 C/C=C/COC[C@@H]1CO1 34a_100000757423_100102629194 [1,0,0,1,0,0|0,0,2]=4 15197 B9R1.83 C=CCCOCC1CC1 34a_100000211283_100000754431 [1,0,0,1,0,0|1,0,1]=4 15198 B9R1.83 C=CCCOCC1CC1 34a_100011205117_100000742324 [1,0,0,1,0,0|1,0,1]=4 15199 B9R1.83 C=CCCOCC1CO1 34a_100011205117_102125554688 [1,0,0,1,0,0|0,0,2]=4 15200 B9R1.83 C=CCCOC[C@@H]1CO1 34a_100000757423_100000754431 [1,0,0,1,0,0|0,0,2]=4 15201 B9R1.83 C=COCCOC1CC1 34a_100000033082_100000211595 [1,0,0,1,0,0|0,0,2]=4 15202 B9R1.83 CC#CCCOC1CC1 34a_100000750427_100000211595 [1,0,0,1,0,0|1,0,1]=4 15203 B9R1.83 CC#CCOCC1CC1 34a_100000211283_100000748600 [1,0,0,1,0,0|1,0,1]=4 15204 B9R1.83 CC#CCOCC1CC1 34a_100000761923_100000742324 [1,0,0,1,0,0|1,0,1]=4 15205 B9R1.83 CC#CCOCC1CO1 34a_100000761923_102125554688 [1,0,0,1,0,0|0,0,2]=4 15206 B9R1.83 CC#CCOC[C@@H]1CO1 34a_100000757423_100000748600 [1,0,0,1,0,0|0,0,2]=4 15207 B9R1.83 CC/C=C\COC1CC1 34a_100016268518_100000211595 [1,0,0,1,0,0|1,0,1]=4 15208 B9R1.83 CC=CCOCC1CC1 34a_100000211283_100000070051 [1,0,0,1,0,0|1,0,1]=4 15209 B9R1.83 CC=CCOC[C@@H]1CO1 34a_100000757423_100000070051 [1,0,0,1,0,0|0,0,2]=4 15210 B9R1.83 CCC#CCOC1CC1 34a_100000032950_100000211595 [1,0,0,1,0,0|1,0,1]=4 15211 B9R1.83 CCCCCNC1CC1 34a_100000212008_100000718602 [1,0,0,1,0,0|2,0,0]=4 15212 B9R1.83 CCCCCOC1CC1 34a_100000210253_100000211595 [1,0,0,1,0,0|1,0,0]=3 15213 B9R1.83 CCCCCSC1CC1 62a_100000210326_100000211595 [1,0,0,1,0,0|1,1,0]=4 15214 B9R1.83 CCCCNCC1CC1 2230a_100000102301_100000742324 [1,0,0,1,0,0|2,0,0]=4 15215 B9R1.83 CCCCNCC1CC1 2230a_100000735609_100000210211 [1,0,0,1,0,0|2,0,0]=4 15216 B9R1.83 CCCCNCC1CC1 269862a_100000102301_100000741477 [1,0,0,1,0,0|2,0,0]=4 15217 B9R1.83 CCCCNCC1CC1 34a_100000735609_100000210210 [1,0,0,1,0,0|2,0,0]=4 15218 B9R1.83 CCCCNCC1CC1 7a_106832991798_100000742324 [1,0,0,1,0,0|2,0,0]=4 15219 B9R1.83 CCCCNCC1CO1 2230a_100000102301_100011216344 [1,0,0,1,0,0|1,0,0]=3 15220 B9R1.83 CCCCNCC1CO1 7a_106832991798_102125554688 [1,0,0,1,0,0|1,0,0]=3 15221 B9R1.83 CCCCNCC1CS1 7a_106832991798_100000031435 [1,0,0,1,0,0|1,1,0]=4 15222 B9R1.83 CCCCNC[C@@H]1CO1 7a_106832991798_100000745022 [1,0,0,1,0,0|1,0,0]=3 15223 B9R1.83 CCCCOCC1CC1 34a_100000210227_100000742324 [1,0,0,1,0,0|1,0,0]=3 15224 B9R1.83 CCCCOCC1CC1 34a_100000211283_100000210210 [1,0,0,1,0,0|1,0,0]=3 15225 B9R1.83 CCCCOCC1CC1 7a_100000210227_100000742324 [1,0,0,1,0,0|1,0,0]=3 15226 B9R1.83 CCCCOCC1CO1 34a_100000210227_102125554688 [1,0,0,1,0,0|0,0,0]=2 15227 B9R1.83 CCCCOCC1CO1 7a_100000210227_102125554688 [1,0,0,1,0,0|0,0,0]=2 15228 B9R1.83 CCCCOCC1CS1 7a_100000210227_100000031435 [1,0,0,1,0,0|0,1,0]=3 15229 B9R1.83 CCCCOC[C@@H]1CO1 34a_100000757423_100000210210 [1,0,0,1,0,0|0,0,0]=2 15230 B9R1.83 CCCCOC[C@@H]1CO1 7a_100000210227_100000745022 [1,0,0,1,0,0|0,0,0]=2 15231 B9R1.83 CCCCSCC1CC1 62a_100000210211_100000742324 [1,0,0,1,0,0|1,1,0]=4 15232 B9R1.83 CCCCSCC1CC1 62a_100000756562_100000210210 [1,0,0,1,0,0|1,1,0]=4 15233 B9R1.83 CCCCSCC1CO1 62a_100000210211_102125554688 [1,0,0,1,0,0|0,1,0]=3 15234 B9R1.83 CCCCSCC1CO1 62a_102125554688_100000210210 [1,0,0,1,0,0|0,1,0]=3 15235 B9R1.83 CCCCSCC1CS1 62a_100000031435_100000210210 [1,0,0,1,0,0|0,2,0]=4 15236 B9R1.83 CCCCSCC1CS1 62a_100000210211_100000031435 [1,0,0,1,0,0|0,2,0]=4 15237 B9R1.83 CCCCSC[C@@H]1CO1 62a_100000210211_100000745022 [1,0,0,1,0,0|0,1,0]=3 15238 B9R1.83 CCCCSC[C@@H]1CO1 62a_100000745022_100000210210 [1,0,0,1,0,0|0,1,0]=3 15239 B9R1.83 CCCNCCC1CC1 34a_100000764129_100000210303 [1,0,0,1,0,0|2,0,0]=4 15240 B9R1.83 CCCOCCC1CC1 34a_100000210258_100000694398 [1,0,0,1,0,0|1,0,0]=3 15241 B9R1.83 CCCOCCC1CC1 34a_100000754188_100000210303 [1,0,0,1,0,0|1,0,0]=3 15242 B9R1.83 CCCOCCC1CC1 7a_100000754188_100000210303 [1,0,0,1,0,0|1,0,0]=3 15243 B9R1.83 CCCOCCC1CO1 34a_100000210258_100000732470 [1,0,0,1,0,0|2,0,0]=4 15244 B9R1.83 CCCOCC[C@@H]1CO1 34a_100009820653_100000210303 [1,0,0,1,0,0|2,0,0]=4 15245 B9R1.83 CCCSCCC1CC1 62a_100000210303_100000764125 [1,0,0,1,0,0|1,1,0]=4 15246 B9R1.83 CCCSCCC1CC1 62a_100000764125_100000210303 [1,0,0,1,0,0|1,1,0]=4 15247 B9R1.83 CCCSCCC1CO1 62a_100000210303_100000732470 [1,0,0,1,0,0|2,0,0]=4 15248 B9R1.83 CCCSCCC1CO1 62a_100000732470_100000210303 [1,0,0,1,0,0|2,0,0]=4 15249 B9R1.83 CCNCCCC1CO1 2230a_100015525214_100000733510 [1,0,0,1,0,0|1,0,0]=3 15250 B9R1.83 CCOCC#CC1CC1 34a_100000083941_100000210202 [1,0,0,1,0,0|1,0,1]=4 15251 B9R1.83 CCOCC#CC1CC1 34a_100121572206_100009895102 [1,0,0,1,0,0|1,0,1]=4 15252 B9R1.83 CCOCC#CC1CC1 7a_100000083941_100000210202 [1,0,0,1,0,0|1,0,1]=4 15253 B9R1.83 CCOCCCC1CO1 34a_100121572206_100000733510 [1,0,0,1,0,0|0,0,0]=2 15254 B9R1.83 CCOCCNC1CC1 34a_100000212008_100000210147 [1,0,0,1,0,0|1,0,0]=3 15255 B9R1.83 CCOCCNC1CC1 34a_100000738766_100000210202 [1,0,0,1,0,0|1,0,0]=3 15256 B9R1.83 CCOCCNC1CC1 34a_102516460346_100000211595 [1,0,0,1,0,0|1,0,0]=3 15257 B9R1.83 CCOCCOC1CC1 34a_100000210136_100000211595 [1,0,0,1,0,0|0,0,0]=2 15258 B9R1.83 CCOCCSC1CC1 62a_100000210147_100000211595 [1,0,0,1,0,0|0,1,0]=3 15259 B9R1.83 CCOCSCC1CC1 62a_100000739092_100000742324 [1,0,0,1,0,0|1,1,0]=4 15260 B9R1.83 CCOCSCC1CC1 62a_100000756562_100000739092 [1,0,0,1,0,0|1,1,0]=4 15261 B9R1.83 CCOCSCC1CO1 62a_100000739092_102125554688 [1,0,0,1,0,0|0,1,0]=3 15262 B9R1.83 CCOCSCC1CO1 62a_102125554688_100000739092 [1,0,0,1,0,0|0,1,0]=3 15263 B9R1.83 CCOCSCC1CS1 62a_100000031435_100000739092 [1,0,0,1,0,0|0,2,0]=4 15264 B9R1.83 CCOCSCC1CS1 62a_100000739092_100000031435 [1,0,0,1,0,0|0,2,0]=4 15265 B9R1.83 CCOCSC[C@@H]1CO1 62a_100000739092_100000745022 [1,0,0,1,0,0|0,1,0]=3 15266 B9R1.83 CCOCSC[C@@H]1CO1 62a_100000745022_100000739092 [1,0,0,1,0,0|0,1,0]=3 15267 B9R1.83 CCSCCCC1CO1 62a_100000210202_100000733510 [1,0,0,1,0,0|0,1,0]=3 15268 B9R1.83 CCSCCCC1CO1 62a_100000733510_100000210202 [1,0,0,1,0,0|0,1,0]=3 15269 B9R1.83 CCSCCNC1CC1 34a_100000212008_100000757381 [1,0,0,1,0,0|1,1,0]=4 15270 B9R1.83 CCSCCOC1CC1 34a_100000212035_100000211595 [1,0,0,1,0,0|0,1,0]=3 15271 B9R1.83 CCSCCSC1CC1 62a_100000757381_100000211595 [1,0,0,1,0,0|0,2,0]=4 15272 B9R1.83 CNCCCOC1CC1 34a_100000213112_100000211595 [1,0,0,1,0,0|2,0,0]=4 15273 B9R1.83 COCCCNC1CC1 34a_100000212008_100000740836 [1,0,0,1,0,0|2,0,0]=4 15274 B9R1.83 COCCCNC1CC1 34a_100150723488_100000211595 [1,0,0,1,0,0|2,0,0]=4 15275 B9R1.83 COCCCOC1CC1 34a_100000740835_100000211595 [1,0,0,1,0,0|2,0,0]=4 15276 B9R1.83 COCCCSC1CC1 62a_100000709357_100000211595 [1,0,0,1,0,0|2,0,0]=4 15277 B9R1.83 COCCNCC1CC1 2230a_100000209980_100000742324 [1,0,0,1,0,0|1,0,0]=3 15278 B9R1.83 COCCNCC1CC1 2230a_100000735609_100011201679 [1,0,0,1,0,0|1,0,0]=3 15279 B9R1.83 COCCNCC1CC1 269862a_100000209980_100000741477 [1,0,0,1,0,0|1,0,0]=3 15280 B9R1.83 COCCNCC1CC1 34a_100000735609_100011201679 [1,0,0,1,0,0|1,0,0]=3 15281 B9R1.83 COCCNCC1CO1 2230a_100000209980_100011216344 [1,0,0,1,0,0|1,0,0]=3 15282 B9R1.83 COCCOCC1CC1 34a_100000210237_100000742324 [1,0,0,1,0,0|0,0,0]=2 15283 B9R1.83 COCCOCC1CC1 34a_100000211283_100011201679 [1,0,0,1,0,0|0,0,0]=2 15284 B9R1.83 COCCOCC1CO1 34a_100000210237_102125554688 [1,0,0,1,0,0|0,0,0]=2 15285 B9R1.83 COCCOC[C@@H]1CO1 34a_100000757423_100011201679 [1,0,0,1,0,0|0,0,0]=2 15286 B9R1.83 COCCSCC1CC1 62a_100000233755_100000742324 [1,0,0,1,0,0|0,1,0]=3 15287 B9R1.83 COCCSCC1CC1 62a_100000756562_100000233755 [1,0,0,1,0,0|0,1,0]=3 15288 B9R1.83 COCCSCC1CO1 62a_100000233755_102125554688 [1,0,0,1,0,0|0,1,0]=3 15289 B9R1.83 COCCSCC1CO1 62a_102125554688_100000233755 [1,0,0,1,0,0|0,1,0]=3 15290 B9R1.83 COCCSCC1CS1 62a_100000031435_100000233755 [1,0,0,1,0,0|0,2,0]=4 15291 B9R1.83 COCCSCC1CS1 62a_100000233755_100000031435 [1,0,0,1,0,0|0,2,0]=4 15292 B9R1.83 COCCSC[C@@H]1CO1 62a_100000233755_100000745022 [1,0,0,1,0,0|0,1,0]=3 15293 B9R1.83 COCCSC[C@@H]1CO1 62a_100000745022_100000233755 [1,0,0,1,0,0|0,1,0]=3 15294 B9R1.83 COCSCCC1CC1 62a_100000764125_100000766300 [1,0,0,1,0,0|1,1,0]=4 15295 B9R1.83 COCSCCC1CC1 62a_100000766300_100000764125 [1,0,0,1,0,0|1,1,0]=4 15296 B9R1.83 COCSCCC1CO1 62a_100000732470_100000766300 [1,0,0,1,0,0|2,0,0]=4 15297 B9R1.83 COCSCCC1CO1 62a_100000766300_100000732470 [1,0,0,1,0,0|2,0,0]=4 15298 B9R1.83 CSCCCOC1CC1 34a_100000690336_100000211595 [1,0,0,1,0,0|2,0,0]=4 15299 B9R1.83 CSCCNCC1CC1 2230a_100000735609_100000751147 [1,0,0,1,0,0|1,1,0]=4 15300 B9R1.83 CSCCNCC1CC1 2230a_100020590264_100000742324 [1,0,0,1,0,0|1,1,0]=4 15301 B9R1.83 CSCCNCC1CC1 269862a_100020590264_100000741477 [1,0,0,1,0,0|1,1,0]=4 15302 B9R1.83 CSCCNCC1CC1 34a_100000735609_100000212216 [1,0,0,1,0,0|1,1,0]=4 15303 B9R1.83 CSCCNCC1CO1 2230a_100020590264_100011216344 [1,0,0,1,0,0|1,1,0]=4 15304 B9R1.83 CSCCOCC1CC1 34a_100000211283_100000212216 [1,0,0,1,0,0|0,1,0]=3 15305 B9R1.83 CSCCOCC1CC1 34a_100000230434_100000742324 [1,0,0,1,0,0|0,1,0]=3 15306 B9R1.83 CSCCOCC1CC1 7a_100000230434_100000742324 [1,0,0,1,0,0|0,1,0]=3 15307 B9R1.83 CSCCOCC1CO1 34a_100000230434_102125554688 [1,0,0,1,0,0|0,1,0]=3 15308 B9R1.83 CSCCOCC1CO1 7a_100000230434_102125554688 [1,0,0,1,0,0|0,1,0]=3 15309 B9R1.83 CSCCOCC1CS1 7a_100000230434_100000031435 [1,0,0,1,0,0|0,2,0]=4 15310 B9R1.83 CSCCOC[C@@H]1CO1 34a_100000757423_100000212216 [1,0,0,1,0,0|0,1,0]=3 15311 B9R1.83 CSCCOC[C@@H]1CO1 7a_100000230434_100000745022 [1,0,0,1,0,0|0,1,0]=3 15312 B9R1.83 CSCCSCC1CC1 62a_100000212216_100000742324 [1,0,0,1,0,0|0,2,0]=4 15313 B9R1.83 CSCCSCC1CC1 62a_100000756562_100000751147 [1,0,0,1,0,0|0,2,0]=4 15314 B9R1.83 CSCCSCC1CO1 62a_100000212216_102125554688 [1,0,0,1,0,0|0,2,0]=4 15315 B9R1.83 CSCCSCC1CO1 62a_102125554688_100000751147 [1,0,0,1,0,0|0,2,0]=4 15316 B9R1.83 CSCCSC[C@@H]1CO1 62a_100000212216_100000745022 [1,0,0,1,0,0|0,2,0]=4 15317 B9R1.83 CSCCSC[C@@H]1CO1 62a_100000745022_100000751147 [1,0,0,1,0,0|0,2,0]=4 15318 B9R1.83 CSCOCCC1CC1 34a_100000754188_100011218213 [1,0,0,1,0,0|1,1,0]=4 15319 B9R1.83 ClCCCCOC1CC1 34a_100000210776_100000211595 [1,0,0,1,0,0|2,0,0]=4 15320 B9R1.83 ClCCCOCC1CC1 34a_100000230001_100000742324 [1,0,0,1,0,0|2,0,0]=4 15321 B9R1.83 ClCCCOCC1CO1 34a_100000230001_102125554688 [1,0,0,1,0,0|1,0,0]=3 15322 B9R1.83 FCCCCOC1CC1 34a_100011995726_100000211595 [1,0,0,1,0,0|2,0,0]=4 15323 B9R1.83 FCCCNCC1CO1 2230a_100015189416_100011216344 [1,0,0,1,0,0|2,0,0]=4 15324 B9R1.83 FCCCNCC1CO1 34a_100015189416_102125554688 [1,0,0,1,0,0|2,0,0]=4 15325 B9R1.83 FCCCOCC1CC1 34a_100000211283_100011934791 [1,0,0,1,0,0|2,0,0]=4 15326 B9R1.83 FCCCOCC1CC1 34a_100000759539_100000742324 [1,0,0,1,0,0|2,0,0]=4 15327 B9R1.83 FCCCOCC1CO1 34a_100000759539_102125554688 [1,0,0,1,0,0|1,0,0]=3 15328 B9R1.83 FCCCOC[C@@H]1CO1 34a_100000757423_100011934791 [1,0,0,1,0,0|1,0,0]=3 15329 B9R1.83 FCCCSCC1CO1 62a_100011934791_102125554688 [1,0,0,1,0,0|1,1,0]=4 15330 B9R1.83 FCCCSCC1CO1 62a_102125554688_100011934791 [1,0,0,1,0,0|1,1,0]=4 15331 B9R1.83 FCCCSC[C@@H]1CO1 62a_100000745022_100011934791 [1,0,0,1,0,0|1,1,0]=4 15332 B9R1.83 FCCCSC[C@@H]1CO1 62a_100011934791_100000745022 [1,0,0,1,0,0|1,1,0]=4 15333 B9R1.83 FCCOCCC1CC1 34a_100000754188_100011217306 [1,0,0,1,0,0|2,0,0]=4 15334 B9R1.83 FCCOCCC1CC1 7a_100000754188_100011217306 [1,0,0,1,0,0|2,0,0]=4 15335 B9R1.83 FCOCCNC1CC1 34a_100000738766_100015361967 [1,0,0,1,0,0|2,0,0]=4 15336 B9R1.83 FCSCCCC1CO1 62a_100000733510_100015361967 [1,0,0,1,0,0|1,1,0]=4 15337 B9R1.83 FCSCCCC1CO1 62a_100015361967_100000733510 [1,0,0,1,0,0|1,1,0]=4 15338 B9R1.83 ICCCCOC1CC1 34a_200012148704_100000211595 [1,0,0,1,0,0|2,0,0]=4 15339 B9R1.83 NCCCCOC1CC1 34a_100000750430_100000211595 [1,0,0,1,0,0|2,0,0]=4 15340 B9R1.83 NCCCOCC1CC1 34a_100000182051_100000742324 [1,0,0,1,0,0|2,0,0]=4 15341 B9R1.83 NCCCOCC1CO1 34a_100000182051_102125554688 [1,0,0,1,0,0|1,0,0]=3 15342 B9R1.83 NCCOCCC1CC1 34a_100000210304_100000694398 [1,0,0,1,0,0|2,0,0]=4 15343 B9R1.83 NOCCOCC1CC1 34a_100000700252_100000742324 [1,0,0,1,0,0|1,0,0]=3 15344 B9R1.83 NOCCOCC1CO1 34a_100000700252_102125554688 [1,0,0,1,0,0|1,0,0]=3 15345 B9R1.83 OCCCOCC1CC1 34a_100000211283_100000230001 [1,0,0,1,0,0|2,0,0]=4 15346 B9R1.83 OCCCOC[C@@H]1CO1 34a_100000757423_100000230001 [1,0,0,1,0,0|1,0,0]=3 15347 B9R1.83 OCCCSCC1CO1 62a_100011215043_102125554688 [1,0,0,1,0,0|1,1,0]=4 15348 B9R1.83 OCCCSCC1CO1 62a_102125554688_100011215043 [1,0,0,1,0,0|1,1,0]=4 15349 B9R1.83 OCCCSC[C@@H]1CO1 62a_100000745022_100011215043 [1,0,0,1,0,0|1,1,0]=4 15350 B9R1.83 OCCCSC[C@@H]1CO1 62a_100011215043_100000745022 [1,0,0,1,0,0|1,1,0]=4 15351 B9R1.83 OCCNCCC1CC1 2230a_100016997473_100000694398 [1,0,0,1,0,0|2,0,0]=4 15352 B9R1.83 OCCNCCC1CC1 34a_100000764129_100000211926 [1,0,0,1,0,0|2,0,0]=4 15353 B9R1.83 OCCNCCC1CC1 34a_100016990907_100000694398 [1,0,0,1,0,0|2,0,0]=4 15354 B9R1.83 OCCOCCC1CC1 34a_100000754188_100000211926 [1,0,0,1,0,0|1,0,0]=3 15355 B9R1.83 OCCOCCC1CC1 7a_100000754188_100000211926 [1,0,0,1,0,0|1,0,0]=3 15356 B9R1.83 OCCOCC[C@@H]1CO1 34a_100009820653_100000211926 [1,0,0,1,0,0|2,0,0]=4 15357 B9R1.83 OCCSCCC1CC1 62a_100000211926_100000764125 [1,0,0,1,0,0|1,1,0]=4 15358 B9R1.83 OCCSCCC1CC1 62a_100000764125_100000211926 [1,0,0,1,0,0|1,1,0]=4 15359 B9R1.89 CCN1CCCCCC1 2230a_100000185865_100000210202 [1,0,0,1,0,0|2,0,0]=4 15360 B9R1.89 CCN1CCCCCC1 269982a_100000185865_100000204670 [1,0,0,1,0,0|2,0,0]=4 15361 B9R1.89 CCN1CCCCCC1 34a_100000185865_100000210202 [1,0,0,1,0,0|2,0,0]=4 15362 B9R1.89 CCN1CCCOCC1 2230a_100000685342_100000210202 [1,0,0,1,0,0|1,0,0]=3 15363 B9R1.89 CCN1CCCOCC1 269982a_100000685342_100000204670 [1,0,0,1,0,0|1,0,0]=3 15364 B9R1.89 CCN1CCCOCC1 34a_100000685342_100000210202 [1,0,0,1,0,0|1,0,0]=3 15365 B9R1.89 CNC1CCCCCC1 2230a_100000210984_200000210301 [1,0,0,1,0,0|2,0,0]=4 15366 B9R1.89 CNC1CCCCCC1 270004a_106832991635_100000210131 [1,0,0,1,0,0|2,0,0]=4 15367 B9R1.89 CNC1CCCCCC1 34a_100000210984_200000210301 [1,0,0,1,0,0|2,0,0]=4 15368 B9R1.89 CNC1CCCCCC1 34a_100102657272_100011217769 [1,0,0,1,0,0|2,0,0]=4 15369 B9R1.89 CNC1CCCNCC1 270004a_106832991635_100015187895 [1,0,0,1,0,0|2,0,0]=4 15370 B9R1.89 COC1CCCCCC1 34a_100000210887_200000210301 [1,0,0,1,0,0|1,0,0]=3 15371 B9R1.89 COC1CCCCCC1 34a_100138415774_100011217769 [1,0,0,1,0,0|1,0,0]=3 15372 B9R1.89 COC1CCCCCC1 7a_100000210887_200000210301 [1,0,0,1,0,0|1,0,0]=3 15373 B9R1.89 CSC1CCCCCC1 62a_100011217769_200000210301 [1,0,0,1,0,0|1,1,0]=4 15374 B9R1.89 CSC1CCCCCC1 62a_200000210301_100011217769 [1,0,0,1,0,0|1,1,0]=4 15375 B9R1.89 FCN1CCCOCC1 269982a_100000685342_100015361967 [1,0,0,1,0,0|2,0,0]=4 15376 B9R1.89 FCN1CCCOCC1 34a_100000685342_100015361967 [1,0,0,1,0,0|2,0,0]=4 15377 B9R1.89 [13CH3]NC1CCCCCC1 2230a_100000210984_200025704644 [1,0,0,1,0,0|2,0,0]=4 15378 B9R1.89 [13CH3]NC1CCCCCC1 34a_100000210984_200025704644 [1,0,0,1,0,0|2,0,0]=4 15379 B9R1.89 [13CH3]OC1CCCCCC1 34a_100000210887_200025704644 [1,0,0,1,0,0|1,0,0]=3 15380 B9R1.89 [13CH3]OC1CCCCCC1 7a_100000210887_200025704644 [1,0,0,1,0,0|1,0,0]=3 15381 B9R1.89 [13CH3]SC1CCCCCC1 62a_100011217769_200025704644 [1,0,0,1,0,0|1,1,0]=4 15382 B9R1.89 [13CH3]SC1CCCCCC1 62a_200025704644_100011217769 [1,0,0,1,0,0|1,1,0]=4 15383 B11R1.4 BrCCCCOC1CCCC1 34a_100011216708_100000179811 [0,1,0,1,0,0|2,0,0]=4 15384 B11R1.4 BrCCCCOC1CCOC1 34a_100011216708_100000690089 [0,1,0,1,0,0|1,0,0]=3 15385 B11R1.4 BrCCCOCC1CCOC1 34a_100011217188_100011261433 [0,1,0,1,0,0|2,0,0]=4 15386 B11R1.4 BrCCCOCC1OCCO1 34a_100011217188_100000755774 [0,1,0,1,0,0|2,0,0]=4 15387 B11R1.4 BrCCOCCC1CCCC1 34a_100000211926_100000760354 [0,1,0,1,0,0|2,0,0]=4 15388 B11R1.4 C#CCCCOC1CCOC1 34a_100000215630_100000690089 [0,1,0,1,0,0|1,0,1]=4 15389 B11R1.4 C#CCCCOC1CCOC1 7a_100000215630_100000731011 [0,1,0,1,0,0|1,0,1]=4 15390 B11R1.4 C#CCCCO[C@H]1CCOC1 34a_100000717292_100000695029 [0,1,0,1,0,0|1,0,1]=4 15391 B11R1.4 C#CCCOCC1CCCO1 34a_100000210270_100000688953 [0,1,0,1,0,0|1,0,1]=4 15392 B11R1.4 C#CCCOCC1CCCO1 7a_100000210270_100000688953 [0,1,0,1,0,0|1,0,1]=4 15393 B11R1.4 C#CCCOCC1CCOC1 34a_100000740260_100000688953 [0,1,0,1,0,0|1,0,1]=4 15394 B11R1.4 C#CCCOCC1CCOC1 34a_100011215631_100011261433 [0,1,0,1,0,0|1,0,1]=4 15395 B11R1.4 C#CCCOCC1COCO1 34a_100011216627_100000688953 [0,1,0,1,0,0|1,0,1]=4 15396 B11R1.4 C#CCCOCC1OCCO1 34a_100000087154_100000688953 [0,1,0,1,0,0|1,0,1]=4 15397 B11R1.4 C#CCCOCC1OCCO1 34a_100011215631_100000755774 [0,1,0,1,0,0|1,0,1]=4 15398 B11R1.4 C#CCOCCC1CCOC1 34a_100011879284_100000184674 [0,1,0,1,0,0|1,0,1]=4 15399 B11R1.4 C/C=C/CCOC1CCCC1 34a_100016278192_100000179811 [0,1,0,1,0,0|2,0,0]=4 15400 B11R1.4 C/C=C/CCOC1CCOC1 34a_100016278192_100000690089 [0,1,0,1,0,0|1,0,0]=3 15401 B11R1.4 C/C=C/COCC1CCCO1 34a_100000210270_100102629194 [0,1,0,1,0,0|1,0,1]=4 15402 B11R1.4 C/C=C/COCC1CCCO1 7a_100000210270_100102629194 [0,1,0,1,0,0|1,0,1]=4 15403 B11R1.4 C/C=C/COCC1CCOC1 34a_100000740260_100102629194 [0,1,0,1,0,0|1,0,1]=4 15404 B11R1.4 C/C=C/COCC1CCOC1 34a_100016270725_100011261433 [0,1,0,1,0,0|1,0,1]=4 15405 B11R1.4 C/C=C/COCC1COCO1 34a_100011216627_100102629194 [0,1,0,1,0,0|1,0,1]=4 15406 B11R1.4 C/C=C/COCC1OCCO1 34a_100000087154_100102629194 [0,1,0,1,0,0|1,0,1]=4 15407 B11R1.4 C/C=C/COCC1OCCO1 34a_100016270725_100000755774 [0,1,0,1,0,0|1,0,1]=4 15408 B11R1.4 C=CCCCOC1CCOC1 34a_100000758997_100000690089 [0,1,0,1,0,0|1,0,1]=4 15409 B11R1.4 C=CCCCOC1CCOC1 7a_100000758997_100000731011 [0,1,0,1,0,0|1,0,1]=4 15410 B11R1.4 C=CCCCO[C@H]1CCOC1 34a_100000717292_100000757094 [0,1,0,1,0,0|1,0,1]=4 15411 B11R1.4 C=CCCOCC1CCCO1 34a_100000210270_100000754431 [0,1,0,1,0,0|1,0,1]=4 15412 B11R1.4 C=CCCOCC1CCCO1 7a_100000210270_100000754431 [0,1,0,1,0,0|1,0,1]=4 15413 B11R1.4 C=CCCOCC1CCOC1 34a_100000740260_100000754431 [0,1,0,1,0,0|1,0,1]=4 15414 B11R1.4 C=CCCOCC1CCOC1 34a_100011205117_100011261433 [0,1,0,1,0,0|1,0,1]=4 15415 B11R1.4 C=CCCOCC1COCO1 34a_100011216627_100000754431 [0,1,0,1,0,0|1,0,1]=4 15416 B11R1.4 C=CCCOCC1OCCO1 34a_100000087154_100000754431 [0,1,0,1,0,0|1,0,1]=4 15417 B11R1.4 C=CCCOCC1OCCO1 34a_100011205117_100000755774 [0,1,0,1,0,0|1,0,1]=4 15418 B11R1.4 C=CCOCCC1CCOC1 34a_100011879284_100015514636 [0,1,0,1,0,0|1,0,1]=4 15419 B11R1.4 C=COCCN[C@@H]1CCOC1 2230a_200015188469_100000039644 [0,1,0,1,0,0|1,0,1]=4 15420 B11R1.4 C=COCCN[C@H]1CCOC1 2230a_100015188467_100000039644 [0,1,0,1,0,0|1,0,1]=4 15421 B11R1.4 C=COCCN[C@H]1CCOC1 34a_100015188467_100000039644 [0,1,0,1,0,0|1,0,1]=4 15422 B11R1.4 C=COCCOC1CCCC1 34a_100000033082_100000179811 [0,1,0,1,0,0|1,0,1]=4 15423 B11R1.4 C=COCCOC1CCCC1 34a_100000210269_100000039644 [0,1,0,1,0,0|1,0,1]=4 15424 B11R1.4 C=COCCOC1CCCC1 7a_100000210269_100000039644 [0,1,0,1,0,0|1,0,1]=4 15425 B11R1.4 C=COCCOC1CCOC1 34a_100000033082_100000690089 [0,1,0,1,0,0|0,0,1]=3 15426 B11R1.4 C=COCCOC1CCSC1 7a_100011232664_100000039644 [0,1,0,1,0,0|0,1,1]=4 15427 B11R1.4 C=COCCO[C@H]1CCOC1 34a_100000717292_100000039644 [0,1,0,1,0,0|0,0,1]=3 15428 B11R1.4 C=COCCSC1CCOC1 62a_100000039644_100000690089 [0,1,0,1,0,0|0,1,1]=4 15429 B11R1.4 CC#CCCOC1CCCC1 34a_100000750427_100000179811 [0,1,0,1,0,0|2,0,0]=4 15430 B11R1.4 CC#CCCOC1CCOC1 34a_100000750427_100000690089 [0,1,0,1,0,0|1,0,0]=3 15431 B11R1.4 CC#CCOCC1CCCO1 34a_100000210270_100000748600 [0,1,0,1,0,0|1,0,1]=4 15432 B11R1.4 CC#CCOCC1CCCO1 7a_100000210270_100000748600 [0,1,0,1,0,0|1,0,1]=4 15433 B11R1.4 CC#CCOCC1CCOC1 34a_100000740260_100000748600 [0,1,0,1,0,0|1,0,1]=4 15434 B11R1.4 CC#CCOCC1CCOC1 34a_100000761923_100011261433 [0,1,0,1,0,0|1,0,1]=4 15435 B11R1.4 CC#CCOCC1COCO1 34a_100011216627_100000748600 [0,1,0,1,0,0|1,0,1]=4 15436 B11R1.4 CC#CCOCC1OCCO1 34a_100000087154_100000748600 [0,1,0,1,0,0|1,0,1]=4 15437 B11R1.4 CC#CCOCC1OCCO1 34a_100000761923_100000755774 [0,1,0,1,0,0|1,0,1]=4 15438 B11R1.4 CC/C=C\COC1CCOC1 34a_100016268518_100000690089 [0,1,0,1,0,0|1,0,1]=4 15439 B11R1.4 CC/C=C\CO[C@H]1CCOC1 34a_100000717292_100103147603 [0,1,0,1,0,0|1,0,1]=4 15440 B11R1.4 CC=CCOCC1CCCO1 34a_100000210270_100000070051 [0,1,0,1,0,0|1,0,1]=4 15441 B11R1.4 CC=CCOCC1CCCO1 7a_100000210270_100000070051 [0,1,0,1,0,0|1,0,1]=4 15442 B11R1.4 CC=CCOCC1CCOC1 34a_100000740260_100000070051 [0,1,0,1,0,0|1,0,1]=4 15443 B11R1.4 CC=CCOCC1COCO1 34a_100011216627_100000070051 [0,1,0,1,0,0|1,0,1]=4 15444 B11R1.4 CC=CCOCC1OCCO1 34a_100000087154_100000070051 [0,1,0,1,0,0|1,0,1]=4 15445 B11R1.4 CCC#CCOC1CCOC1 34a_100000032950_100000690089 [0,1,0,1,0,0|1,0,1]=4 15446 B11R1.4 CCC#CCO[C@H]1CCOC1 34a_100000717292_100009813939 [0,1,0,1,0,0|1,0,1]=4 15447 B11R1.4 CCCCCNC1CCOC1 2230a_100000209983_100000731011 [0,1,0,1,0,0|2,0,0]=4 15448 B11R1.4 CCCCCNC1CCOC1 270004a_100000209983_100000752484 [0,1,0,1,0,0|2,0,0]=4 15449 B11R1.4 CCCCCN[C@@H]1CCOC1 2230a_200015188469_100000210326 [0,1,0,1,0,0|2,0,0]=4 15450 B11R1.4 CCCCCN[C@H]1CCOC1 2230a_100015188467_100000210326 [0,1,0,1,0,0|2,0,0]=4 15451 B11R1.4 CCCCCN[C@H]1CCOC1 34a_100015188467_100000718602 [0,1,0,1,0,0|2,0,0]=4 15452 B11R1.4 CCCCCOC1CCCC1 34a_100000210253_100000179811 [0,1,0,1,0,0|2,0,0]=4 15453 B11R1.4 CCCCCOC1CCCC1 34a_100000210269_100000718602 [0,1,0,1,0,0|2,0,0]=4 15454 B11R1.4 CCCCCOC1CCCC1 7a_100000210253_100000179811 [0,1,0,1,0,0|2,0,0]=4 15455 B11R1.4 CCCCCOC1CCCC1 7a_100000210269_100000210326 [0,1,0,1,0,0|2,0,0]=4 15456 B11R1.4 CCCCCOC1CCCO1 34a_100000085407_100000718602 [0,1,0,1,0,0|2,0,0]=4 15457 B11R1.4 CCCCCOC1CCOC1 34a_100000210253_100000690089 [0,1,0,1,0,0|1,0,0]=3 15458 B11R1.4 CCCCCOC1CCOC1 7a_100000210253_100000731011 [0,1,0,1,0,0|1,0,0]=3 15459 B11R1.4 CCCCCOC1CCSC1 7a_100011232664_100000210326 [0,1,0,1,0,0|1,1,0]=4 15460 B11R1.4 CCCCCO[C@H]1CCOC1 34a_100000717292_100000718602 [0,1,0,1,0,0|1,0,0]=3 15461 B11R1.4 CCCCCSC1CCOC1 62a_100000210326_100000690089 [0,1,0,1,0,0|1,1,0]=4 15462 B11R1.4 CCCCNCC1CCCO1 2230a_100000102301_100000203698 [0,1,0,1,0,0|2,0,0]=4 15463 B11R1.4 CCCCNCC1CCCO1 7a_106832991798_100000203698 [0,1,0,1,0,0|2,0,0]=4 15464 B11R1.4 CCCCNCC1CCOC1 2230a_100000102301_100000702531 [0,1,0,1,0,0|2,0,0]=4 15465 B11R1.4 CCCCNCC1CCOC1 2230a_100000737293_100000210211 [0,1,0,1,0,0|2,0,0]=4 15466 B11R1.4 CCCCNCC1CCOC1 34a_100000737293_100000210210 [0,1,0,1,0,0|2,0,0]=4 15467 B11R1.4 CCCCNCC1CCOC1 7a_106832991798_100000702531 [0,1,0,1,0,0|2,0,0]=4 15468 B11R1.4 CCCCNCC1OCCO1 2230a_100000036311_100000210211 [0,1,0,1,0,0|2,0,0]=4 15469 B11R1.4 CCCCNCC1OCCO1 2230a_100000102301_100000755774 [0,1,0,1,0,0|2,0,0]=4 15470 B11R1.4 CCCCNCC1OCCO1 34a_100000036311_100000210210 [0,1,0,1,0,0|2,0,0]=4 15471 B11R1.4 CCCCNCC1OCCO1 7a_106832991798_100000755774 [0,1,0,1,0,0|2,0,0]=4 15472 B11R1.4 CCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210211 [0,1,0,1,0,0|2,0,0]=4 15473 B11R1.4 CCCCNC[C@@H]1CCCO1 34a_100020590478_100000210210 [0,1,0,1,0,0|2,0,0]=4 15474 B11R1.4 CCCCOCC1CCCC1 34a_100000210227_100000740388 [0,1,0,1,0,0|2,0,0]=4 15475 B11R1.4 CCCCOCC1CCCC1 34a_100000742336_100000210210 [0,1,0,1,0,0|2,0,0]=4 15476 B11R1.4 CCCCOCC1CCCC1 7a_100000210227_100000740388 [0,1,0,1,0,0|2,0,0]=4 15477 B11R1.4 CCCCOCC1CCCC1 7a_100000742336_100000210211 [0,1,0,1,0,0|2,0,0]=4 15478 B11R1.4 CCCCOCC1CCCO1 34a_100000210270_100000210210 [0,1,0,1,0,0|1,0,0]=3 15479 B11R1.4 CCCCOCC1CCCO1 7a_100000210227_100000203698 [0,1,0,1,0,0|1,0,0]=3 15480 B11R1.4 CCCCOCC1CCCO1 7a_100000210270_100000210211 [0,1,0,1,0,0|1,0,0]=3 15481 B11R1.4 CCCCOCC1CCNC1 34a_100000748654_100000210210 [0,1,0,1,0,0|2,0,0]=4 15482 B11R1.4 CCCCOCC1CCOC1 34a_100000210227_100011261433 [0,1,0,1,0,0|1,0,0]=3 15483 B11R1.4 CCCCOCC1CCOC1 34a_100000740260_100000210210 [0,1,0,1,0,0|1,0,0]=3 15484 B11R1.4 CCCCOCC1CCOC1 7a_100000210227_100000702531 [0,1,0,1,0,0|1,0,0]=3 15485 B11R1.4 CCCCOCC1COCO1 34a_100011216627_100000210210 [0,1,0,1,0,0|1,0,0]=3 15486 B11R1.4 CCCCOCC1OCCO1 34a_100000087154_100000210210 [0,1,0,1,0,0|1,0,0]=3 15487 B11R1.4 CCCCOCC1OCCO1 34a_100000210227_100000755774 [0,1,0,1,0,0|1,0,0]=3 15488 B11R1.4 CCCCOCC1OCCO1 7a_100000210227_100000755774 [0,1,0,1,0,0|1,0,0]=3 15489 B11R1.4 CCCCOCN1CCCC1 2230a_100000188435_100011995733 [0,1,0,1,0,0|2,0,0]=4 15490 B11R1.4 CCCCOCN1CCCC1 269982a_100000188435_100011995733 [0,1,0,1,0,0|2,0,0]=4 15491 B11R1.4 CCCCOCN1CCSC1 2230a_100011215254_100011995733 [0,1,0,1,0,0|1,1,0]=4 15492 B11R1.4 CCCCOCN1CCSC1 269982a_100011215254_100011995733 [0,1,0,1,0,0|1,1,0]=4 15493 B11R1.4 CCCCOC[C@H]1CCCN1 34a_100000745186_100000210210 [0,1,0,1,0,0|2,0,0]=4 15494 B11R1.4 CCCCSCC1CCCO1 62a_100000203698_100000210210 [0,1,0,1,0,0|1,1,0]=4 15495 B11R1.4 CCCCSCC1CCCO1 62a_100000210211_100000203698 [0,1,0,1,0,0|1,1,0]=4 15496 B11R1.4 CCCCSCC1CCOC1 62a_100000210211_100000702531 [0,1,0,1,0,0|1,1,0]=4 15497 B11R1.4 CCCCSCC1CCOC1 62a_100000702531_100000210210 [0,1,0,1,0,0|1,1,0]=4 15498 B11R1.4 CCCCSCC1OCCO1 62a_100000210211_100000755774 [0,1,0,1,0,0|1,1,0]=4 15499 B11R1.4 CCCCSCC1OCCO1 62a_100000755774_100000210210 [0,1,0,1,0,0|1,1,0]=4 15500 B11R1.4 CCCOCCC1CCCC1 34a_100000210258_100000760354 [0,1,0,1,0,0|2,0,0]=4 15501 B11R1.4 CCCOCCC1CCCC1 34a_100000749090_100000210303 [0,1,0,1,0,0|2,0,0]=4 15502 B11R1.4 CCCOCCC1CCCC1 7a_100000749090_100000210303 [0,1,0,1,0,0|2,0,0]=4 15503 B11R1.4 CCCOCCC1CCNC1 34a_100016987287_100000210303 [0,1,0,1,0,0|2,0,0]=4 15504 B11R1.4 CCCOCCC1CCOC1 34a_100011879284_100000210303 [0,1,0,1,0,0|1,0,0]=3 15505 B11R1.4 CCCOCCN1CCCC1 2230a_100000188435_100011215938 [0,1,0,1,0,0|2,0,0]=4 15506 B11R1.4 CCCOCCN1CCCC1 269982a_100000188435_100011215938 [0,1,0,1,0,0|2,0,0]=4 15507 B11R1.4 CCCOCCN1CCSC1 2230a_100011215254_100011215938 [0,1,0,1,0,0|1,1,0]=4 15508 B11R1.4 CCCOCCN1CCSC1 269982a_100011215254_100011215938 [0,1,0,1,0,0|1,1,0]=4 15509 B11R1.4 CCNCCOC1CCCC1 34a_100000741755_100000210202 [0,1,0,1,0,0|2,0,0]=4 15510 B11R1.4 CCOCCCC1CCCC1 34a_100011215328_100000210202 [0,1,0,1,0,0|2,0,0]=4 15511 B11R1.4 CCOCCCC1CCCC1 34a_100121572206_100011713738 [0,1,0,1,0,0|2,0,0]=4 15512 B11R1.4 CCOCCCC1CCCC1 7a_100011215328_100000210202 [0,1,0,1,0,0|2,0,0]=4 15513 B11R1.4 CCOCCCN1CCCC1 2230a_100000188435_100012232248 [0,1,0,1,0,0|2,0,0]=4 15514 B11R1.4 CCOCCCN1CCCC1 269982a_100000188435_100012232248 [0,1,0,1,0,0|2,0,0]=4 15515 B11R1.4 CCOCCCN1CCCC1 34a_100121572206_100016991639 [0,1,0,1,0,0|2,0,0]=4 15516 B11R1.4 CCOCCCN1CCSC1 2230a_100011215254_100012232248 [0,1,0,1,0,0|1,1,0]=4 15517 B11R1.4 CCOCCCN1CCSC1 269982a_100011215254_100012232248 [0,1,0,1,0,0|1,1,0]=4 15518 B11R1.4 CCOCCNC1CC=CC1 2230a_100015188752_100011215890 [0,1,0,1,0,0|2,0,0]=4 15519 B11R1.4 CCOCCNC1CCCC1 2230a_100000211070_100011215890 [0,1,0,1,0,0|2,0,0]=4 15520 B11R1.4 CCOCCNC1CCCC1 2230a_102516460346_100000179811 [0,1,0,1,0,0|2,0,0]=4 15521 B11R1.4 CCOCCNC1CCCC1 270004a_102516460346_100000210133 [0,1,0,1,0,0|2,0,0]=4 15522 B11R1.4 CCOCCNC1CCCC1 34a_100000211070_100000210147 [0,1,0,1,0,0|2,0,0]=4 15523 B11R1.4 CCOCCNC1CCCC1 34a_102516460346_100000179811 [0,1,0,1,0,0|2,0,0]=4 15524 B11R1.4 CCOCCNC1CCCC1 34a_200000200444_100000210202 [0,1,0,1,0,0|2,0,0]=4 15525 B11R1.4 CCOCCNC1CCOC1 2230a_102516460346_100000731011 [0,1,0,1,0,0|1,0,0]=3 15526 B11R1.4 CCOCCNC1CCOC1 270004a_102516460346_100000752484 [0,1,0,1,0,0|1,0,0]=3 15527 B11R1.4 CCOCCNC1CCOC1 34a_102516460346_100000690089 [0,1,0,1,0,0|1,0,0]=3 15528 B11R1.4 CCOCCNC1CCSC1 270004a_102516460346_100000212027 [0,1,0,1,0,0|1,1,0]=4 15529 B11R1.4 CCOCCN[C@@H]1CCOC1 2230a_200015188469_100011215890 [0,1,0,1,0,0|1,0,0]=3 15530 B11R1.4 CCOCCN[C@H]1CCOC1 2230a_100015188467_100011215890 [0,1,0,1,0,0|1,0,0]=3 15531 B11R1.4 CCOCCN[C@H]1CCOC1 34a_100015188467_100000210147 [0,1,0,1,0,0|1,0,0]=3 15532 B11R1.4 CCOCCOC1CCCC1 34a_100000210136_100000179811 [0,1,0,1,0,0|1,0,0]=3 15533 B11R1.4 CCOCCOC1CCCC1 34a_100000210269_100000210147 [0,1,0,1,0,0|1,0,0]=3 15534 B11R1.4 CCOCCOC1CCCC1 34a_100000738311_100000210202 [0,1,0,1,0,0|1,0,0]=3 15535 B11R1.4 CCOCCOC1CCCC1 7a_100000210136_100000179811 [0,1,0,1,0,0|1,0,0]=3 15536 B11R1.4 CCOCCOC1CCCC1 7a_100000210269_100011215890 [0,1,0,1,0,0|1,0,0]=3 15537 B11R1.4 CCOCCOC1CCCC1 7a_100000738311_100000210202 [0,1,0,1,0,0|1,0,0]=3 15538 B11R1.4 CCOCCOC1CCCO1 34a_100000085407_100000210147 [0,1,0,1,0,0|1,0,0]=3 15539 B11R1.4 CCOCCOC1CCOC1 34a_100000210136_100000690089 [0,1,0,1,0,0|0,0,0]=2 15540 B11R1.4 CCOCCOC1CCOC1 7a_100000210136_100000731011 [0,1,0,1,0,0|0,0,0]=2 15541 B11R1.4 CCOCCOC1CCSC1 7a_100011232664_100011215890 [0,1,0,1,0,0|0,1,0]=3 15542 B11R1.4 CCOCCO[C@H]1CCOC1 34a_100000717292_100000210147 [0,1,0,1,0,0|0,0,0]=2 15543 B11R1.4 CCOCCSC1CCCC1 62a_100000210147_100000179811 [0,1,0,1,0,0|1,1,0]=4 15544 B11R1.4 CCOCCSC1CCCC1 62a_100011217020_100011215890 [0,1,0,1,0,0|1,1,0]=4 15545 B11R1.4 CCOCCSC1CCOC1 62a_100000210147_100000690089 [0,1,0,1,0,0|0,1,0]=3 15546 B11R1.4 CCOCSCC1CCCC1 62a_100000739092_100000740388 [0,1,0,1,0,0|2,0,0]=4 15547 B11R1.4 CCOCSCC1CCCC1 62a_100000740388_100000739092 [0,1,0,1,0,0|2,0,0]=4 15548 B11R1.4 CCOCSCC1CCOC1 62a_100000702531_100000739092 [0,1,0,1,0,0|1,0,0]=3 15549 B11R1.4 CCOCSCC1CCOC1 62a_100000739092_100000702531 [0,1,0,1,0,0|1,0,0]=3 15550 B11R1.4 CCSCCNC1CCOC1 2230a_100000106463_100000731011 [0,1,0,1,0,0|1,1,0]=4 15551 B11R1.4 CCSCCNC1CCOC1 270004a_100000106463_100000752484 [0,1,0,1,0,0|1,1,0]=4 15552 B11R1.4 CCSCCN[C@@H]1CCOC1 2230a_200015188469_100000757381 [0,1,0,1,0,0|1,1,0]=4 15553 B11R1.4 CCSCCN[C@H]1CCOC1 2230a_100015188467_100000757381 [0,1,0,1,0,0|1,1,0]=4 15554 B11R1.4 CCSCCN[C@H]1CCOC1 34a_100015188467_100000757381 [0,1,0,1,0,0|1,1,0]=4 15555 B11R1.4 CCSCCOC1CCCC1 34a_100000210269_100000757381 [0,1,0,1,0,0|1,1,0]=4 15556 B11R1.4 CCSCCOC1CCCC1 34a_100000212035_100000179811 [0,1,0,1,0,0|1,1,0]=4 15557 B11R1.4 CCSCCOC1CCCC1 7a_100000210269_100000757381 [0,1,0,1,0,0|1,1,0]=4 15558 B11R1.4 CCSCCOC1CCCC1 7a_100000212035_100000179811 [0,1,0,1,0,0|1,1,0]=4 15559 B11R1.4 CCSCCOC1CCCO1 34a_100000085407_100000757381 [0,1,0,1,0,0|1,1,0]=4 15560 B11R1.4 CCSCCOC1CCOC1 34a_100000212035_100000690089 [0,1,0,1,0,0|0,1,0]=3 15561 B11R1.4 CCSCCOC1CCOC1 7a_100000212035_100000731011 [0,1,0,1,0,0|0,1,0]=3 15562 B11R1.4 CCSCCOC1CCSC1 7a_100011232664_100000757381 [0,1,0,1,0,0|0,2,0]=4 15563 B11R1.4 CCSCCO[C@H]1CCOC1 34a_100000717292_100000757381 [0,1,0,1,0,0|0,1,0]=3 15564 B11R1.4 CCSCCSC1CCOC1 62a_100000757381_100000690089 [0,1,0,1,0,0|0,2,0]=4 15565 B11R1.4 CNCCCCC1OCCO1 2230a_106832991635_100000034956 [0,1,0,1,0,0|2,0,0]=4 15566 B11R1.4 CNCCCCC1OCCO1 34a_100102657272_200009813554 [0,1,0,1,0,0|2,0,0]=4 15567 B11R1.4 CNCCCCC1OCCO1 7a_106832991635_100000034956 [0,1,0,1,0,0|2,0,0]=4 15568 B11R1.4 CNCCCOC1CCCC1 34a_100000213112_100000179811 [0,1,0,1,0,0|2,0,0]=4 15569 B11R1.4 CNCCCOC1CCCC1 34a_100000747560_200000210301 [0,1,0,1,0,0|2,0,0]=4 15570 B11R1.4 CNCCCOC1CCOC1 34a_100000213112_100000690089 [0,1,0,1,0,0|1,0,0]=3 15571 B11R1.4 COCCCCC1OCCO1 34a_100138415774_200009813554 [0,1,0,1,0,0|1,0,0]=3 15572 B11R1.4 COCCCCN1CCCC1 2230a_100000188435_100000730899 [0,1,0,1,0,0|2,0,0]=4 15573 B11R1.4 COCCCCN1CCCC1 269982a_100000188435_100000730899 [0,1,0,1,0,0|2,0,0]=4 15574 B11R1.4 COCCCCN1CCSC1 2230a_100011215254_100000730899 [0,1,0,1,0,0|1,1,0]=4 15575 B11R1.4 COCCCCN1CCSC1 269982a_100011215254_100000730899 [0,1,0,1,0,0|1,1,0]=4 15576 B11R1.4 COCCCNC1CCCC1 2230a_100000211070_100000740836 [0,1,0,1,0,0|2,0,0]=4 15577 B11R1.4 COCCCNC1CCCC1 270004a_100150723488_100000210133 [0,1,0,1,0,0|2,0,0]=4 15578 B11R1.4 COCCCNC1CCCC1 34a_100000211070_100000740836 [0,1,0,1,0,0|2,0,0]=4 15579 B11R1.4 COCCCNC1CCCC1 34a_100150723488_100000179811 [0,1,0,1,0,0|2,0,0]=4 15580 B11R1.4 COCCCNC1CCOC1 270004a_100150723488_100000752484 [0,1,0,1,0,0|1,0,0]=3 15581 B11R1.4 COCCCNC1CCOC1 34a_100150723488_100000690089 [0,1,0,1,0,0|1,0,0]=3 15582 B11R1.4 COCCCNC1CCSC1 270004a_100150723488_100000212027 [0,1,0,1,0,0|1,1,0]=4 15583 B11R1.4 COCCCN[C@@H]1CCOC1 2230a_200015188469_100000740836 [0,1,0,1,0,0|1,0,0]=3 15584 B11R1.4 COCCCN[C@H]1CCOC1 2230a_100015188467_100000740836 [0,1,0,1,0,0|1,0,0]=3 15585 B11R1.4 COCCCN[C@H]1CCOC1 34a_100015188467_100000740836 [0,1,0,1,0,0|1,0,0]=3 15586 B11R1.4 COCCCOC1CCCC1 34a_100000210269_100000740836 [0,1,0,1,0,0|1,0,0]=3 15587 B11R1.4 COCCCOC1CCCC1 34a_100000740835_100000179811 [0,1,0,1,0,0|1,0,0]=3 15588 B11R1.4 COCCCOC1CCCC1 7a_100000210269_100000740836 [0,1,0,1,0,0|1,0,0]=3 15589 B11R1.4 COCCCOC1CCCO1 34a_100000085407_100000740836 [0,1,0,1,0,0|2,0,0]=4 15590 B11R1.4 COCCCOC1CCOC1 34a_100000740835_100000690089 [0,1,0,1,0,0|0,0,0]=2 15591 B11R1.4 COCCCOC1CCSC1 7a_100011232664_100000740836 [0,1,0,1,0,0|0,1,0]=3 15592 B11R1.4 COCCCO[C@H]1CCOC1 34a_100000717292_100000740836 [0,1,0,1,0,0|0,0,0]=2 15593 B11R1.4 COCCCSC1CCCC1 62a_100000709357_100000179811 [0,1,0,1,0,0|1,1,0]=4 15594 B11R1.4 COCCCSC1CCCC1 62a_100011217020_100000709357 [0,1,0,1,0,0|1,1,0]=4 15595 B11R1.4 COCCCSC1CCOC1 62a_100000709357_100000690089 [0,1,0,1,0,0|0,1,0]=3 15596 B11R1.4 COCCNCC1CCCC1 2230a_100000209980_100000740388 [0,1,0,1,0,0|2,0,0]=4 15597 B11R1.4 COCCNCC1CCCC1 2230a_100000737975_100011201679 [0,1,0,1,0,0|2,0,0]=4 15598 B11R1.4 COCCNCC1CCCC1 269862a_100000209980_100000746403 [0,1,0,1,0,0|2,0,0]=4 15599 B11R1.4 COCCNCC1CCCC1 34a_100000737975_100011201679 [0,1,0,1,0,0|2,0,0]=4 15600 B11R1.4 COCCNCC1CCCO1 2230a_100000209980_100000203698 [0,1,0,1,0,0|1,0,0]=3 15601 B11R1.4 COCCNCC1CCOC1 2230a_100000209980_100000702531 [0,1,0,1,0,0|1,0,0]=3 15602 B11R1.4 COCCNCC1CCOC1 2230a_100000737293_100011201679 [0,1,0,1,0,0|1,0,0]=3 15603 B11R1.4 COCCNCC1CCOC1 34a_100000737293_100011201679 [0,1,0,1,0,0|1,0,0]=3 15604 B11R1.4 COCCNCC1OCCO1 2230a_100000036311_100011201679 [0,1,0,1,0,0|1,0,0]=3 15605 B11R1.4 COCCNCC1OCCO1 2230a_100000209980_100000755774 [0,1,0,1,0,0|1,0,0]=3 15606 B11R1.4 COCCNCC1OCCO1 34a_100000036311_100011201679 [0,1,0,1,0,0|1,0,0]=3 15607 B11R1.4 COCCNC[C@@H]1CCCO1 2230a_100020590478_100011201679 [0,1,0,1,0,0|1,0,0]=3 15608 B11R1.4 COCCNC[C@@H]1CCCO1 34a_100020590478_100011201679 [0,1,0,1,0,0|1,0,0]=3 15609 B11R1.4 COCCOCC1=NCCN1 34a_100000210237_100000737910 [0,1,0,1,0,0|1,0,1]=4 15610 B11R1.4 COCCOCC1CC=CC1 34a_100000688395_100011201679 [0,1,0,1,0,0|1,0,1]=4 15611 B11R1.4 COCCOCC1CCCC1 34a_100000210237_100000740388 [0,1,0,1,0,0|1,0,0]=3 15612 B11R1.4 COCCOCC1CCCC1 34a_100000742336_100011201679 [0,1,0,1,0,0|1,0,0]=3 15613 B11R1.4 COCCOCC1CCCC1 7a_100000742336_100000233755 [0,1,0,1,0,0|1,0,0]=3 15614 B11R1.4 COCCOCC1CCCO1 34a_100000210270_100011201679 [0,1,0,1,0,0|0,0,0]=2 15615 B11R1.4 COCCOCC1CCCO1 7a_100000210270_100000233755 [0,1,0,1,0,0|0,0,0]=2 15616 B11R1.4 COCCOCC1CCNC1 34a_100000748654_100011201679 [0,1,0,1,0,0|1,0,0]=3 15617 B11R1.4 COCCOCC1CCOC1 34a_100000210237_100011261433 [0,1,0,1,0,0|0,0,0]=2 15618 B11R1.4 COCCOCC1CCOC1 34a_100000740260_100011201679 [0,1,0,1,0,0|0,0,0]=2 15619 B11R1.4 COCCOCC1COCO1 34a_100011216627_100011201679 [0,1,0,1,0,0|0,0,0]=2 15620 B11R1.4 COCCOCC1OCCO1 34a_100000087154_100011201679 [0,1,0,1,0,0|0,0,0]=2 15621 B11R1.4 COCCOCC1OCCO1 34a_100000210237_100000755774 [0,1,0,1,0,0|0,0,0]=2 15622 B11R1.4 COCCOCN1CC=CC1 269982a_100015195280_100000231047 [0,1,0,1,0,0|1,0,1]=4 15623 B11R1.4 COCCOCN1CCCC1 2230a_100000188435_100000231047 [0,1,0,1,0,0|1,0,0]=3 15624 B11R1.4 COCCOCN1CCCC1 269982a_100000188435_100000231047 [0,1,0,1,0,0|1,0,0]=3 15625 B11R1.4 COCCOCN1CCSC1 2230a_100011215254_100000231047 [0,1,0,1,0,0|0,1,0]=3 15626 B11R1.4 COCCOCN1CCSC1 269982a_100011215254_100000231047 [0,1,0,1,0,0|0,1,0]=3 15627 B11R1.4 COCCOC[C@H]1CCCN1 34a_100000745186_100011201679 [0,1,0,1,0,0|1,0,0]=3 15628 B11R1.4 COCCSCC1CCCC1 62a_100000233755_100000740388 [0,1,0,1,0,0|1,1,0]=4 15629 B11R1.4 COCCSCC1CCCC1 62a_100000740388_100000233755 [0,1,0,1,0,0|1,1,0]=4 15630 B11R1.4 COCCSCC1CCCO1 62a_100000203698_100000233755 [0,1,0,1,0,0|0,1,0]=3 15631 B11R1.4 COCCSCC1CCCO1 62a_100000233755_100000203698 [0,1,0,1,0,0|0,1,0]=3 15632 B11R1.4 COCCSCC1CCOC1 62a_100000233755_100000702531 [0,1,0,1,0,0|0,1,0]=3 15633 B11R1.4 COCCSCC1CCOC1 62a_100000702531_100000233755 [0,1,0,1,0,0|0,1,0]=3 15634 B11R1.4 COCCSCC1OCCO1 62a_100000233755_100000755774 [0,1,0,1,0,0|0,1,0]=3 15635 B11R1.4 COCCSCC1OCCO1 62a_100000755774_100000233755 [0,1,0,1,0,0|0,1,0]=3 15636 B11R1.4 COCNCCC1CCCC1 2230a_100000739158_100000766300 [0,1,0,1,0,0|2,0,0]=4 15637 B11R1.4 COCNCCC1OCCO1 2230a_100000034215_100000766300 [0,1,0,1,0,0|2,0,0]=4 15638 B11R1.4 COCSCCC1CCCC1 62a_100000760354_100000766300 [0,1,0,1,0,0|2,0,0]=4 15639 B11R1.4 COCSCCC1CCCC1 62a_100000766300_100000760354 [0,1,0,1,0,0|2,0,0]=4 15640 B11R1.4 COCSCCC1OCCO1 62a_100000766300_100000740749 [0,1,0,1,0,0|2,0,0]=4 15641 B11R1.4 CSCCCCC1OCCO1 62a_200000210301_100000034956 [0,1,0,1,0,0|1,1,0]=4 15642 B11R1.4 CSCCCNC1CCOC1 2230a_100000749238_100000731011 [0,1,0,1,0,0|1,1,0]=4 15643 B11R1.4 CSCCCNC1CCOC1 270004a_100000749238_100000752484 [0,1,0,1,0,0|1,1,0]=4 15644 B11R1.4 CSCCCOC1CCCC1 34a_100000690336_100000179811 [0,1,0,1,0,0|1,1,0]=4 15645 B11R1.4 CSCCCOC1CCCC1 7a_100000690336_100000179811 [0,1,0,1,0,0|1,1,0]=4 15646 B11R1.4 CSCCCOC1CCOC1 34a_100000690336_100000690089 [0,1,0,1,0,0|0,1,0]=3 15647 B11R1.4 CSCCCOC1CCOC1 7a_100000690336_100000731011 [0,1,0,1,0,0|0,1,0]=3 15648 B11R1.4 CSCCNCC1CCCO1 2230a_100020590264_100000203698 [0,1,0,1,0,0|1,1,0]=4 15649 B11R1.4 CSCCNCC1CCOC1 2230a_100000737293_100000751147 [0,1,0,1,0,0|1,1,0]=4 15650 B11R1.4 CSCCNCC1CCOC1 2230a_100020590264_100000702531 [0,1,0,1,0,0|1,1,0]=4 15651 B11R1.4 CSCCNCC1CCOC1 34a_100000737293_100000212216 [0,1,0,1,0,0|1,1,0]=4 15652 B11R1.4 CSCCNCC1OCCO1 2230a_100000036311_100000751147 [0,1,0,1,0,0|1,1,0]=4 15653 B11R1.4 CSCCNCC1OCCO1 2230a_100020590264_100000755774 [0,1,0,1,0,0|1,1,0]=4 15654 B11R1.4 CSCCNCC1OCCO1 34a_100000036311_100000212216 [0,1,0,1,0,0|1,1,0]=4 15655 B11R1.4 CSCCNC[C@@H]1CCCO1 2230a_100020590478_100000751147 [0,1,0,1,0,0|1,1,0]=4 15656 B11R1.4 CSCCNC[C@@H]1CCCO1 34a_100020590478_100000212216 [0,1,0,1,0,0|1,1,0]=4 15657 B11R1.4 CSCCOCC1CCCC1 34a_100000230434_100000740388 [0,1,0,1,0,0|1,1,0]=4 15658 B11R1.4 CSCCOCC1CCCC1 34a_100000742336_100000212216 [0,1,0,1,0,0|1,1,0]=4 15659 B11R1.4 CSCCOCC1CCCC1 7a_100000230434_100000740388 [0,1,0,1,0,0|1,1,0]=4 15660 B11R1.4 CSCCOCC1CCCC1 7a_100000742336_100000212216 [0,1,0,1,0,0|1,1,0]=4 15661 B11R1.4 CSCCOCC1CCCO1 34a_100000210270_100000212216 [0,1,0,1,0,0|0,1,0]=3 15662 B11R1.4 CSCCOCC1CCCO1 7a_100000210270_100000212216 [0,1,0,1,0,0|0,1,0]=3 15663 B11R1.4 CSCCOCC1CCCO1 7a_100000230434_100000203698 [0,1,0,1,0,0|0,1,0]=3 15664 B11R1.4 CSCCOCC1CCNC1 34a_100000748654_100000212216 [0,1,0,1,0,0|1,1,0]=4 15665 B11R1.4 CSCCOCC1CCOC1 34a_100000230434_100011261433 [0,1,0,1,0,0|0,1,0]=3 15666 B11R1.4 CSCCOCC1CCOC1 34a_100000740260_100000212216 [0,1,0,1,0,0|0,1,0]=3 15667 B11R1.4 CSCCOCC1CCOC1 7a_100000230434_100000702531 [0,1,0,1,0,0|0,1,0]=3 15668 B11R1.4 CSCCOCC1COCO1 34a_100011216627_100000212216 [0,1,0,1,0,0|0,1,0]=3 15669 B11R1.4 CSCCOCC1OCCO1 34a_100000087154_100000212216 [0,1,0,1,0,0|0,1,0]=3 15670 B11R1.4 CSCCOCC1OCCO1 34a_100000230434_100000755774 [0,1,0,1,0,0|0,1,0]=3 15671 B11R1.4 CSCCOCC1OCCO1 7a_100000230434_100000755774 [0,1,0,1,0,0|0,1,0]=3 15672 B11R1.4 CSCCOC[C@H]1CCCN1 34a_100000745186_100000212216 [0,1,0,1,0,0|1,1,0]=4 15673 B11R1.4 CSCCSCC1CCCO1 62a_100000203698_100000751147 [0,1,0,1,0,0|0,2,0]=4 15674 B11R1.4 CSCCSCC1CCCO1 62a_100000212216_100000203698 [0,1,0,1,0,0|0,2,0]=4 15675 B11R1.4 CSCCSCC1CCOC1 62a_100000212216_100000702531 [0,1,0,1,0,0|0,2,0]=4 15676 B11R1.4 CSCCSCC1CCOC1 62a_100000702531_100000751147 [0,1,0,1,0,0|0,2,0]=4 15677 B11R1.4 CSCCSCC1OCCO1 62a_100000212216_100000755774 [0,1,0,1,0,0|0,2,0]=4 15678 B11R1.4 CSCCSCC1OCCO1 62a_100000755774_100000751147 [0,1,0,1,0,0|0,2,0]=4 15679 B11R1.4 CSCOCCC1CCCC1 34a_100000749090_100011218213 [0,1,0,1,0,0|2,0,0]=4 15680 B11R1.4 CSCOCCC1CCNC1 34a_100016987287_100011218213 [0,1,0,1,0,0|2,0,0]=4 15681 B11R1.4 CSCOCCC1CCOC1 34a_100011879284_100011218213 [0,1,0,1,0,0|1,0,0]=3 15682 B11R1.4 ClCC#CCOC1CCOC1 34a_200000047223_100000690089 [0,1,0,1,0,0|1,0,1]=4 15683 B11R1.4 ClCCCCOC1CCCC1 34a_100000210776_100000179811 [0,1,0,1,0,0|2,0,0]=4 15684 B11R1.4 ClCCCCOC1CCCC1 7a_100000210776_100000179811 [0,1,0,1,0,0|2,0,0]=4 15685 B11R1.4 ClCCCCOC1CCOC1 34a_100000210776_100000690089 [0,1,0,1,0,0|1,0,0]=3 15686 B11R1.4 ClCCCCOC1CCOC1 7a_100000210776_100000731011 [0,1,0,1,0,0|1,0,0]=3 15687 B11R1.4 ClCCCOCC1CCOC1 34a_100000230001_100011261433 [0,1,0,1,0,0|2,0,0]=4 15688 B11R1.4 ClCCCOCC1OCCO1 34a_100000230001_100000755774 [0,1,0,1,0,0|2,0,0]=4 15689 B11R1.4 FCCCCN[C@@H]1CCOC1 2230a_200015188469_100000729493 [0,1,0,1,0,0|2,0,0]=4 15690 B11R1.4 FCCCCN[C@H]1CCOC1 2230a_100015188467_100000729493 [0,1,0,1,0,0|2,0,0]=4 15691 B11R1.4 FCCCCN[C@H]1CCOC1 34a_100015188467_100000729493 [0,1,0,1,0,0|2,0,0]=4 15692 B11R1.4 FCCCCOC1CCCC1 34a_100000210269_100000729493 [0,1,0,1,0,0|2,0,0]=4 15693 B11R1.4 FCCCCOC1CCCC1 34a_100011995726_100000179811 [0,1,0,1,0,0|2,0,0]=4 15694 B11R1.4 FCCCCOC1CCCC1 7a_100000210269_100000729493 [0,1,0,1,0,0|2,0,0]=4 15695 B11R1.4 FCCCCOC1CCCC1 7a_100011995726_100000179811 [0,1,0,1,0,0|2,0,0]=4 15696 B11R1.4 FCCCCOC1CCOC1 34a_100011995726_100000690089 [0,1,0,1,0,0|1,0,0]=3 15697 B11R1.4 FCCCCOC1CCOC1 7a_100011995726_100000731011 [0,1,0,1,0,0|1,0,0]=3 15698 B11R1.4 FCCCCOC1CCSC1 7a_100011232664_100000729493 [0,1,0,1,0,0|1,1,0]=4 15699 B11R1.4 FCCCCO[C@H]1CCOC1 34a_100000717292_100000729493 [0,1,0,1,0,0|1,0,0]=3 15700 B11R1.4 FCCCCSC1CCOC1 62a_100000729493_100000690089 [0,1,0,1,0,0|1,1,0]=4 15701 B11R1.4 FCCCOCC1CCCO1 34a_100000210270_100011934791 [0,1,0,1,0,0|2,0,0]=4 15702 B11R1.4 FCCCOCC1CCCO1 7a_100000210270_100011934791 [0,1,0,1,0,0|2,0,0]=4 15703 B11R1.4 FCCCOCC1CCOC1 34a_100000740260_100011934791 [0,1,0,1,0,0|2,0,0]=4 15704 B11R1.4 FCCCOCC1CCOC1 34a_100000759539_100011261433 [0,1,0,1,0,0|2,0,0]=4 15705 B11R1.4 FCCCOCC1COCO1 34a_100011216627_100011934791 [0,1,0,1,0,0|2,0,0]=4 15706 B11R1.4 FCCCOCC1OCCO1 34a_100000087154_100011934791 [0,1,0,1,0,0|2,0,0]=4 15707 B11R1.4 FCCCOCC1OCCO1 34a_100000759539_100000755774 [0,1,0,1,0,0|2,0,0]=4 15708 B11R1.4 FCCOCCC1CCCC1 34a_100000749090_100011217306 [0,1,0,1,0,0|2,0,0]=4 15709 B11R1.4 FCCOCCC1CCCC1 7a_100000749090_100011217306 [0,1,0,1,0,0|2,0,0]=4 15710 B11R1.4 FCCOCCC1CCNC1 34a_100016987287_100011217306 [0,1,0,1,0,0|2,0,0]=4 15711 B11R1.4 FCCOCCC1CCOC1 34a_100011879284_100011217306 [0,1,0,1,0,0|1,0,0]=3 15712 B11R1.4 FCNCCOC1CCCC1 34a_100000741755_100015361967 [0,1,0,1,0,0|2,0,0]=4 15713 B11R1.4 FCOCCCC1CCCC1 34a_100011215328_100015361967 [0,1,0,1,0,0|2,0,0]=4 15714 B11R1.4 FCOCCCC1CCCC1 7a_100011215328_100015361967 [0,1,0,1,0,0|2,0,0]=4 15715 B11R1.4 FCOCCNC1CCCC1 34a_200000200444_100015361967 [0,1,0,1,0,0|2,0,0]=4 15716 B11R1.4 FCOCCOC1CCCC1 34a_100000738311_100015361967 [0,1,0,1,0,0|1,0,0]=3 15717 B11R1.4 FCOCCOC1CCCC1 7a_100000738311_100015361967 [0,1,0,1,0,0|1,0,0]=3 15718 B11R1.4 ICCCCOC1CCCC1 34a_200012148704_100000179811 [0,1,0,1,0,0|2,0,0]=4 15719 B11R1.4 ICCCCOC1CCOC1 34a_200012148704_100000690089 [0,1,0,1,0,0|1,0,0]=3 15720 B11R1.4 N#CCCOCC1CCCO1 7a_100000210270_100000184422 [0,1,0,1,0,0|2,0,0]=4 15721 B11R1.4 NCCCCOC1CCCC1 34a_100000750430_100000179811 [0,1,0,1,0,0|2,0,0]=4 15722 B11R1.4 NCCCCOC1CCOC1 34a_100000750430_100000690089 [0,1,0,1,0,0|1,0,0]=3 15723 B11R1.4 NCCCOCC1CCOC1 34a_100000182051_100011261433 [0,1,0,1,0,0|2,0,0]=4 15724 B11R1.4 NCCCOCC1OCCO1 34a_100000182051_100000755774 [0,1,0,1,0,0|2,0,0]=4 15725 B11R1.4 NCCOCCC1CCCC1 34a_100000210304_100000760354 [0,1,0,1,0,0|2,0,0]=4 15726 B11R1.4 NOCCOCC1CCCC1 34a_100000700252_100000740388 [0,1,0,1,0,0|2,0,0]=4 15727 B11R1.4 NOCCOCC1CCOC1 34a_100000700252_100011261433 [0,1,0,1,0,0|1,0,0]=3 15728 B11R1.4 NOCCOCC1OCCO1 34a_100000700252_100000755774 [0,1,0,1,0,0|1,0,0]=3 15729 B11R1.4 O=CCOCCC1CCOC1 34a_100011879284_200009817547 [0,1,0,1,0,0|1,0,1]=4 15730 B11R1.4 OCC#CCO[C@H]1CCOC1 34a_100000717292_200000047223 [0,1,0,1,0,0|1,0,1]=4 15731 B11R1.4 OCCCCNC1CCOC1 2230a_100000750430_100000731011 [0,1,0,1,0,0|2,0,0]=4 15732 B11R1.4 OCCCCNC1CCOC1 270004a_100000750430_100000752484 [0,1,0,1,0,0|2,0,0]=4 15733 B11R1.4 OCCCCNC1CCOC1 34a_100000750430_100000690089 [0,1,0,1,0,0|2,0,0]=4 15734 B11R1.4 OCCCCN[C@@H]1CCOC1 2230a_200015188469_100000210776 [0,1,0,1,0,0|2,0,0]=4 15735 B11R1.4 OCCCCN[C@H]1CCOC1 2230a_100015188467_100000210776 [0,1,0,1,0,0|2,0,0]=4 15736 B11R1.4 OCCCCN[C@H]1CCOC1 34a_100015188467_100011216708 [0,1,0,1,0,0|2,0,0]=4 15737 B11R1.4 OCCCCOC1CCCC1 34a_100000210269_100011216708 [0,1,0,1,0,0|2,0,0]=4 15738 B11R1.4 OCCCCOC1CCCC1 7a_100000210269_100000210776 [0,1,0,1,0,0|2,0,0]=4 15739 B11R1.4 OCCCCOC1CCSC1 7a_100011232664_100000210776 [0,1,0,1,0,0|1,1,0]=4 15740 B11R1.4 OCCCCO[C@H]1CCOC1 34a_100000717292_100011216708 [0,1,0,1,0,0|1,0,0]=3 15741 B11R1.4 OCCCCSC1CCOC1 62a_100000210776_100000690089 [0,1,0,1,0,0|1,1,0]=4 15742 B11R1.4 OCCCOCC1CCCO1 34a_100000210270_100000230001 [0,1,0,1,0,0|2,0,0]=4 15743 B11R1.4 OCCCOCC1CCCO1 7a_100000210270_100011215043 [0,1,0,1,0,0|2,0,0]=4 15744 B11R1.4 OCCCOCC1CCOC1 34a_100000740260_100000230001 [0,1,0,1,0,0|2,0,0]=4 15745 B11R1.4 OCCCOCC1COCO1 34a_100011216627_100000230001 [0,1,0,1,0,0|2,0,0]=4 15746 B11R1.4 OCCCOCC1OCCO1 34a_100000087154_100000230001 [0,1,0,1,0,0|2,0,0]=4 15747 B11R1.4 OCCOCCC1CCCC1 34a_100000749090_100000211926 [0,1,0,1,0,0|2,0,0]=4 15748 B11R1.4 OCCOCCC1CCCC1 7a_100000749090_100000211926 [0,1,0,1,0,0|2,0,0]=4 15749 B11R1.4 OCCOCCC1CCNC1 34a_100016987287_100000211926 [0,1,0,1,0,0|2,0,0]=4 15750 B11R1.4 OCCOCCC1CCOC1 34a_100011879284_100000211926 [0,1,0,1,0,0|1,0,0]=3 15751 B11R1.4 OCCOCCN1CCCC1 2230a_100000188435_100011215305 [0,1,0,1,0,0|2,0,0]=4 15752 B11R1.4 OCCOCCN1CCCC1 269982a_100000188435_100011215305 [0,1,0,1,0,0|2,0,0]=4 15753 B11R1.4 OCCOCCN1CCSC1 2230a_100011215254_100011215305 [0,1,0,1,0,0|1,1,0]=4 15754 B11R1.4 OCCOCCN1CCSC1 269982a_100011215254_100011215305 [0,1,0,1,0,0|1,1,0]=4 15755 B11R1.4 [13CH3]NCCCOC1CCCC1 34a_100000747560_200025704644 [0,1,0,1,0,0|2,0,0]=4 15756 B11R1.4 [13CH3]SCCCCC1OCCO1 62a_200025704644_100000034956 [0,1,0,1,0,0|1,1,0]=4 15757 B11R1.16 CC(CO[13CH3])N1CCNCC1 34a_100000751876_200025704644 [0,1,0,1,0,0|2,0,0]=4 15758 B11R1.16 CCCC(=O)C1COCCO1 1458a_100000045528_100000210303 [0,1,0,1,0,0|1,0,1]=4 15759 B11R1.16 CCCC(C)N1CCOCC1 2230a_100015191051_100000766640 [0,1,0,1,0,0|2,0,0]=4 15760 B11R1.16 CCCC(C)N1CCOCC1 269982a_100015191051_100000766640 [0,1,0,1,0,0|2,0,0]=4 15761 B11R1.16 CCCC(C)N1CCOCC1 270004a_100015191051_100000211909 [0,1,0,1,0,0|2,0,0]=4 15762 B11R1.16 CCCC(C)N1CCOCC1 34a_100015191051_100000766640 [0,1,0,1,0,0|2,0,0]=4 15763 B11R1.16 CCNC(=O)C1COCCO1 11a_100015525214_100000045528 [0,1,0,1,0,0|1,0,1]=4 15764 B11R1.16 CCNC(=O)C1COCCO1 240690a_100015525214_100000045528 [0,1,0,1,0,0|1,0,1]=4 15765 B11R1.16 CCNC(=O)C1COCCO1 527a_100015525214_100000045528 [0,1,0,1,0,0|1,0,1]=4 15766 B11R1.16 CCOC(C)C1CCCCC1 34a_100011216961_100000210202 [0,1,0,1,0,0|2,0,0]=4 15767 B11R1.16 CCOC(C)C1CCCCC1 7a_100011216961_100000210202 [0,1,0,1,0,0|2,0,0]=4 15768 B11R1.16 CCOC(C)C1CCCNC1 34a_100000740858_100000210202 [0,1,0,1,0,0|2,0,0]=4 15769 B11R1.16 COCC(=O)C1CCOCC1 1458a_100000210968_100011324220 [0,1,0,1,0,0|1,0,1]=4 15770 B11R1.16 COCC(=O)C1CCOCC1 34a_100138415774_100000689883 [0,1,0,1,0,0|1,0,1]=4 15771 B11R1.16 COCC(=O)N1CCOCC1 11a_100015191051_100000210968 [0,1,0,1,0,0|1,0,1]=4 15772 B11R1.16 COCC(=O)N1CCOCC1 1626a_100015191051_100000210968 [0,1,0,1,0,0|1,0,1]=4 15773 B11R1.16 COCC(=O)N1CCOCC1 240690a_100015191051_100000210968 [0,1,0,1,0,0|1,0,1]=4 15774 B11R1.16 COCC(=O)N1CCOCC1 34a_100138415774_100000183410 [0,1,0,1,0,0|1,0,1]=4 15775 B11R1.16 COCC(=O)N1CCOCC1 527a_100015191051_100000210968 [0,1,0,1,0,0|1,0,1]=4 15776 B11R1.16 COCC(=O)N1CCOCC1 7a_100000752472_200000210301 [0,1,0,1,0,0|1,0,1]=4 15777 B11R1.16 COCC(C)N1CCNCC1 34a_100000751876_200000210301 [0,1,0,1,0,0|2,0,0]=4 15778 B11R1.16 COCC(C)N1CCOCC1 2230a_100015191051_100000765312 [0,1,0,1,0,0|1,0,0]=3 15779 B11R1.16 COCC(C)N1CCOCC1 269982a_100015191051_100000765312 [0,1,0,1,0,0|1,0,0]=3 15780 B11R1.16 COCC(C)N1CCOCC1 270004a_100015191051_100000749346 [0,1,0,1,0,0|1,0,0]=3 15781 B11R1.16 COCC(C)N1CCOCC1 34a_100015191051_100000765312 [0,1,0,1,0,0|1,0,0]=3 15782 B11R1.16 COCC(C)N1CCSCC1 2230a_100000737611_100000765312 [0,1,0,1,0,0|1,1,0]=4 15783 B11R1.16 COCC(C)N1CCSCC1 269982a_100000737611_100000765312 [0,1,0,1,0,0|1,1,0]=4 15784 B11R1.16 COCC(C)N1CCSCC1 270004a_100000737611_100000749346 [0,1,0,1,0,0|1,1,0]=4 15785 B11R1.16 COCN(C)C1CCOCC1 2230a_100020587155_100000766300 [0,1,0,1,0,0|2,0,0]=4 15786 B11R1.16 COCN(C)C1CCOCC1 269982a_100020587155_100000766300 [0,1,0,1,0,0|2,0,0]=4 15787 B11R1.16 COC[C@H](N)C1CCCCC1 34a_100009817630_200000210301 [0,1,0,1,0,0|2,0,0]=4 15788 B11R1.16 CSCC(C)N1CCOCC1 270004a_100015191051_100011216314 [0,1,0,1,0,0|1,1,0]=4 15789 B11R1.16 [13CH3]OCC(=O)N1CCOCC1 7a_100000752472_200025704644 [0,1,0,1,0,0|1,0,1]=4 15790 B11R1.16 [13CH3]OC[C@H](N)C1CCCCC1 34a_100009817630_200025704644 [0,1,0,1,0,0|2,0,0]=4 15791 B11R1.24 CCCCN1CCOC(C1)C 2230a_100000729577_100000210211 [0,1,0,1,0,0|2,0,0]=4 15792 B11R1.24 CCCCN1CCOC(C1)C 269982a_100000729577_100000210211 [0,1,0,1,0,0|2,0,0]=4 15793 B11R1.24 CCCCN1CCOC(C1)C 34a_100000729577_100000210210 [0,1,0,1,0,0|2,0,0]=4 15794 B11R1.24 CCCCN1CCOC(C1)O 2230a_100000688207_100000210211 [0,1,0,1,0,0|2,0,0]=4 15795 B11R1.24 CCCCN1CCOC(C1)O 269982a_100000688207_100000210211 [0,1,0,1,0,0|2,0,0]=4 15796 B11R1.24 CCOCC1CCCN(C1)C 34a_100121572206_100015183302 [0,1,0,1,0,0|2,0,0]=4 15797 B11R1.24 CCOCC1CNCC(C1)C 34a_200012821172_100000210202 [0,1,0,1,0,0|2,0,0]=4 15798 B11R1.24 CCOCC1COCC(=O)N1 34a_200000101122_100000210202 [0,1,0,1,0,0|1,0,1]=4 15799 B11R1.24 COCCN1CCCC(C1)C 34a_100138415774_100000766211 [0,1,0,1,0,0|2,0,0]=4 15800 B11R1.24 COCCN1CCCC(C1)F 2230a_100000697950_100011201679 [0,1,0,1,0,0|2,0,0]=4 15801 B11R1.24 COCCN1CCCC(C1)F 269982a_100000697950_100000233755 [0,1,0,1,0,0|2,0,0]=4 15802 B11R1.24 COCCN1CCCC(C1)F 34a_100000697950_100011201679 [0,1,0,1,0,0|2,0,0]=4 15803 B11R1.24 COCCN1CCCC(C1)O 2230a_100000211013_100011201679 [0,1,0,1,0,0|2,0,0]=4 15804 B11R1.24 COCCN1CCCC(C1)O 269982a_100000211013_100000233755 [0,1,0,1,0,0|2,0,0]=4 15805 B11R1.24 COCCN1CCC[C@@H](C1)C 2230a_100000717927_100011201679 [0,1,0,1,0,0|2,0,0]=4 15806 B11R1.24 COCCN1CCC[C@@H](C1)C 269982a_100000717927_100000233755 [0,1,0,1,0,0|2,0,0]=4 15807 B11R1.24 COCCN1CCC[C@@H](C1)C 34a_100000717927_100011201679 [0,1,0,1,0,0|2,0,0]=4 15808 B11R1.24 COCCN1CCOC(=O)C1 2230a_100000131268_100011201679 [0,1,0,1,0,0|1,0,1]=4 15809 B11R1.24 COCCN1CCOC(C1)C 2230a_100000729577_100011201679 [0,1,0,1,0,0|1,0,0]=3 15810 B11R1.24 COCCN1CCOC(C1)C 269982a_100000729577_100000233755 [0,1,0,1,0,0|1,0,0]=3 15811 B11R1.24 COCCN1CCOC(C1)C 34a_100000729577_100011201679 [0,1,0,1,0,0|1,0,0]=3 15812 B11R1.24 COCCN1CCOC(C1)O 2230a_100000688207_100011201679 [0,1,0,1,0,0|1,0,0]=3 15813 B11R1.24 COCCN1CCOC(C1)O 269982a_100000688207_100000233755 [0,1,0,1,0,0|1,0,0]=3 15814 B11R1.24 CSCCN1CCOC(C1)C 2230a_100000729577_100000751147 [0,1,0,1,0,0|1,1,0]=4 15815 B11R1.24 CSCCN1CCOC(C1)C 269982a_100000729577_100000212216 [0,1,0,1,0,0|1,1,0]=4 15816 B11R1.24 CSCCN1CCOC(C1)C 34a_100000729577_100000212216 [0,1,0,1,0,0|1,1,0]=4 15817 B11R1.24 CSCCN1CCOC(C1)O 2230a_100000688207_100000751147 [0,1,0,1,0,0|1,1,0]=4 15818 B11R1.24 CSCCN1CCOC(C1)O 269982a_100000688207_100000212216 [0,1,0,1,0,0|1,1,0]=4 15819 B11R1.30 C#CCC(C)OC1CCOC1 34a_100000685586_100000690089 [0,1,0,1,0,0|1,0,1]=4 15820 B11R1.30 C#CCC(C)OC1CCOC1 7a_100000685586_100000731011 [0,1,0,1,0,0|1,0,1]=4 15821 B11R1.30 C/C=C/C(C)OC1CCOC1 34a_200102604097_100000690089 [0,1,0,1,0,0|1,0,1]=4 15822 B11R1.30 C=CC[C@@H](C)OC1CCOC1 34a_100000731007_100000690089 [0,1,0,1,0,0|1,0,1]=4 15823 B11R1.30 C=CC[C@@H](C)OC1CCOC1 7a_100000731007_100000731011 [0,1,0,1,0,0|1,0,1]=4 15824 B11R1.30 CC#CC(C)OC1CCOC1 34a_100011216543_100000690089 [0,1,0,1,0,0|1,0,1]=4 15825 B11R1.30 CC(CCBr)OC1CCOC1 34a_100012276601_100000690089 [0,1,0,1,0,0|2,0,0]=4 15826 B11R1.30 CC(CCO)O[C@H]1CCOC1 34a_100000717292_100009893172 [0,1,0,1,0,0|2,0,0]=4 15827 B11R1.30 CCCC(C)NC1CCOC1 2230a_100000741246_100000731011 [0,1,0,1,0,0|2,0,0]=4 15828 B11R1.30 CCCC(C)NC1CCOC1 270004a_100000741246_100000752484 [0,1,0,1,0,0|2,0,0]=4 15829 B11R1.30 CCCC(C)N[C@@H]1CCOC1 2230a_200015188469_100000766640 [0,1,0,1,0,0|2,0,0]=4 15830 B11R1.30 CCCC(C)N[C@@H]1CCOC1 270004a_200015188469_100000211909 [0,1,0,1,0,0|2,0,0]=4 15831 B11R1.30 CCCC(C)N[C@H]1CCOC1 2230a_100015188467_100000766640 [0,1,0,1,0,0|2,0,0]=4 15832 B11R1.30 CCCC(C)N[C@H]1CCOC1 270004a_100015188467_100000211909 [0,1,0,1,0,0|2,0,0]=4 15833 B11R1.30 CCCC(C)N[C@H]1CCOC1 34a_100015188467_100000766640 [0,1,0,1,0,0|2,0,0]=4 15834 B11R1.30 CCCC(C)OC1CCCC1 34a_100000210269_100000766640 [0,1,0,1,0,0|2,0,0]=4 15835 B11R1.30 CCCC(C)OC1CCCC1 34a_100000764384_100000179811 [0,1,0,1,0,0|2,0,0]=4 15836 B11R1.30 CCCC(C)OC1CCCC1 7a_100000210269_100000766640 [0,1,0,1,0,0|2,0,0]=4 15837 B11R1.30 CCCC(C)OC1CCCC1 7a_100000764384_100000179811 [0,1,0,1,0,0|2,0,0]=4 15838 B11R1.30 CCCC(C)OC1CCOC1 34a_100000764384_100000690089 [0,1,0,1,0,0|1,0,0]=3 15839 B11R1.30 CCCC(C)OC1CCOC1 7a_100000764384_100000731011 [0,1,0,1,0,0|1,0,0]=3 15840 B11R1.30 CCCC(C)OC1CCSC1 7a_100011232664_100000766640 [0,1,0,1,0,0|1,1,0]=4 15841 B11R1.30 CCCC(C)O[C@H]1CCOC1 34a_100000717292_100000766640 [0,1,0,1,0,0|1,0,0]=3 15842 B11R1.30 CCCC(C)SC1CCOC1 62a_100000766640_100000690089 [0,1,0,1,0,0|1,1,0]=4 15843 B11R1.30 COCC(=O)CC1CCOC1 1458a_100000210968_100000702531 [0,1,0,1,0,0|1,0,1]=4 15844 B11R1.30 COCC(=O)N[C@@H]1CCOC1 240690a_200015188469_100000210968 [0,1,0,1,0,0|1,0,1]=4 15845 B11R1.30 COCC(=O)N[C@@H]1CCOC1 527a_200015188469_100000210968 [0,1,0,1,0,0|1,0,1]=4 15846 B11R1.30 COCC(=O)N[C@H]1CCOC1 11a_100015188467_100000210968 [0,1,0,1,0,0|1,0,1]=4 15847 B11R1.30 COCC(=O)N[C@H]1CCOC1 1626a_100015188467_100000210968 [0,1,0,1,0,0|1,0,1]=4 15848 B11R1.30 COCC(=O)N[C@H]1CCOC1 240690a_100015188467_100000210968 [0,1,0,1,0,0|1,0,1]=4 15849 B11R1.30 COCC(=O)N[C@H]1CCOC1 527a_100015188467_100000210968 [0,1,0,1,0,0|1,0,1]=4 15850 B11R1.30 COCC(C)NC1CCCC1 2230a_100000211070_100000765312 [0,1,0,1,0,0|2,0,0]=4 15851 B11R1.30 COCC(C)NC1CCCC1 270004a_100000211070_100000749346 [0,1,0,1,0,0|2,0,0]=4 15852 B11R1.30 COCC(C)NC1CCCC1 34a_100000211070_100000765312 [0,1,0,1,0,0|2,0,0]=4 15853 B11R1.30 COCC(C)N[C@@H]1CCOC1 2230a_200015188469_100000765312 [0,1,0,1,0,0|1,0,0]=3 15854 B11R1.30 COCC(C)N[C@@H]1CCOC1 270004a_200015188469_100000749346 [0,1,0,1,0,0|1,0,0]=3 15855 B11R1.30 COCC(C)N[C@H]1CCOC1 2230a_100015188467_100000765312 [0,1,0,1,0,0|1,0,0]=3 15856 B11R1.30 COCC(C)N[C@H]1CCOC1 270004a_100015188467_100000749346 [0,1,0,1,0,0|1,0,0]=3 15857 B11R1.30 COCC(C)N[C@H]1CCOC1 34a_100015188467_100000765312 [0,1,0,1,0,0|1,0,0]=3 15858 B11R1.30 COCC(C)OC1CCCC1 34a_100000210269_100000765312 [0,1,0,1,0,0|1,0,0]=3 15859 B11R1.30 COCC(C)OC1CCCC1 7a_100000210269_100000765312 [0,1,0,1,0,0|1,0,0]=3 15860 B11R1.30 COCC(C)OC1CCCO1 34a_100000085407_100000765312 [0,1,0,1,0,0|2,0,0]=4 15861 B11R1.30 COCC(C)OC1CCSC1 7a_100011232664_100000765312 [0,1,0,1,0,0|0,1,0]=3 15862 B11R1.30 COCC(C)O[C@H]1CCOC1 34a_100000717292_100000765312 [0,1,0,1,0,0|0,0,0]=2 15863 B11R1.30 COCC(C)SC1CCCC1 62a_100000765312_100000179811 [0,1,0,1,0,0|1,1,0]=4 15864 B11R1.30 COCC(C)SC1CCCC1 62a_100011217020_100000765312 [0,1,0,1,0,0|1,1,0]=4 15865 B11R1.30 COCC(C)SC1CCOC1 62a_100000765312_100000690089 [0,1,0,1,0,0|0,1,0]=3 15866 B11R1.30 COCN(C)CC1CCOC1 2230a_100000684583_100000766300 [0,1,0,1,0,0|2,0,0]=4 15867 B11R1.30 COCN(C)CC1CCOC1 269982a_100000684583_100000766300 [0,1,0,1,0,0|2,0,0]=4 15868 B11R1.30 COC[C@@H](C)NC1CCCC1 2230a_100000764878_100000179811 [0,1,0,1,0,0|2,0,0]=4 15869 B11R1.30 COC[C@@H](C)NC1CCCC1 270004a_100000764878_100000210133 [0,1,0,1,0,0|2,0,0]=4 15870 B11R1.30 COC[C@@H](C)NC1CCOC1 2230a_100000764878_100000731011 [0,1,0,1,0,0|1,0,0]=3 15871 B11R1.30 COC[C@@H](C)NC1CCOC1 270004a_100000764878_100000752484 [0,1,0,1,0,0|1,0,0]=3 15872 B11R1.30 COC[C@@H](C)NC1CCSC1 270004a_100000764878_100000212027 [0,1,0,1,0,0|1,1,0]=4 15873 B11R1.30 COC[C@@H](C)OC1CCCC1 34a_100011934205_100000179811 [0,1,0,1,0,0|1,0,0]=3 15874 B11R1.30 COC[C@@H](C)OC1CCOC1 34a_100011934205_100000690089 [0,1,0,1,0,0|0,0,0]=2 15875 B11R1.30 CSCC(C)N[C@@H]1CCOC1 270004a_200015188469_100011216314 [0,1,0,1,0,0|1,1,0]=4 15876 B11R1.30 CSCC(C)N[C@H]1CCOC1 270004a_100015188467_100011216314 [0,1,0,1,0,0|1,1,0]=4 15877 B11R1.78 C=C1CC(C1)COCCOC 34a_100011011225_100011201679 [0,1,0,1,0,0|1,0,1]=4 15878 B11R1.78 C=C1CC(C1)NCCOCC 2230a_100132301982_100011215890 [0,1,0,1,0,0|2,0,0]=4 15879 B11R1.78 CCCCOCC1CC(C1)Cl 34a_100009874164_100000210210 [0,1,0,1,0,0|2,0,0]=4 15880 B11R1.78 CCOCCNC1CC(C1)F 2230a_100016993743_100011215890 [0,1,0,1,0,0|2,0,0]=4 15881 B11R1.78 CCOCCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100011215890 [0,1,0,1,0,0|2,0,0]=4 15882 B11R1.78 CCOCCSC1CC(=O)C1 62a_100009894365_100011215890 [0,1,0,1,0,0|1,1,0]=4 15883 B11R1.78 COCCNCC1CC(C1)O 2230a_100016992100_100011201679 [0,1,0,1,0,0|2,0,0]=4 15884 B11R1.78 COCCOCC1CC(=O)C1 34a_100000101936_100011201679 [0,1,0,1,0,0|1,0,1]=4 15885 B11R1.78 COCCOCC1CC(C1)Cl 34a_100009874164_100011201679 [0,1,0,1,0,0|1,0,0]=3 15886 B11R1.78 COCCOCN1CC(C1)C 2230a_100000702820_100000231047 [0,1,0,1,0,0|2,0,0]=4 15887 B11R1.78 COCCOCN1CC(C1)C 269982a_100000702820_100000231047 [0,1,0,1,0,0|2,0,0]=4 15888 B11R1.78 COCCOCN1CC(C1)F 2230a_100000690557_100000231047 [0,1,0,1,0,0|2,0,0]=4 15889 B11R1.78 COCCOCN1CC(C1)F 269982a_100000690557_100000231047 [0,1,0,1,0,0|2,0,0]=4 15890 B11R1.78 COCCOCN1CC(C1)O 269982a_100000749847_100000231047 [0,1,0,1,0,0|2,0,0]=4 15891 B11R1.78 CSCCOCC1CC(C1)Cl 34a_100009874164_100000212216 [0,1,0,1,0,0|1,1,0]=4 15892 B11R1.81 CCOC1CCC(CC1C)C 34a_100011539931_100000210202 [0,1,0,1,0,0|2,0,0]=4 15893 B11R1.81 CCOC1CCC(CC1C)C 7a_100011539931_100000210202 [0,1,0,1,0,0|2,0,0]=4 15894 B11R1.110 COCN1CCOC[C@@H](C1)O 2230a_100016073750_100000766300 [0,1,0,1,0,0|2,0,0]=4 15895 B11R1.110 COCN1CCOC[C@@H](C1)O 269982a_100016073750_100000766300 [0,1,0,1,0,0|2,0,0]=4 15896 B11R1.117 CCOC1CCCCCCC1 34a_100000210054_100000210202 [0,1,0,1,0,0|2,0,0]=4 15897 B11R1.117 CCOC1CCCCCCC1 7a_100000210054_100000210202 [0,1,0,1,0,0|2,0,0]=4 15898 B11R1.117 COCC1CCCCCCC1 34a_100011216312_200000210301 [0,1,0,1,0,0|2,0,0]=4 15899 B11R1.117 COCC1CCCCCCC1 7a_100011216312_200000210301 [0,1,0,1,0,0|2,0,0]=4 15900 B11R1.117 COCN1CCCCCCC1 2230a_100000211400_100000766300 [0,1,0,1,0,0|2,0,0]=4 15901 B11R1.117 COCN1CCCCCCC1 269982a_100000211400_100000766300 [0,1,0,1,0,0|2,0,0]=4 15902 B11R1.117 FCOC1CCCCCCC1 34a_100000210054_100015361967 [0,1,0,1,0,0|2,0,0]=4 15903 B11R1.117 FCOC1CCCCCCC1 7a_100000210054_100015361967 [0,1,0,1,0,0|2,0,0]=4 15904 B11R1.117 [13CH3]OCC1CCCCCCC1 34a_100011216312_200025704644 [0,1,0,1,0,0|2,0,0]=4 15905 B11R1.117 [13CH3]OCC1CCCCCCC1 7a_100011216312_200025704644 [0,1,0,1,0,0|2,0,0]=4 15906 B11R1.127 CCO[C@H]1CCN(C1)COC 2230a_100011787710_100000766300 [0,1,0,1,0,0|2,0,0]=4 15907 B11R1.127 CCO[C@H]1CCN(C1)COC 269982a_100011787710_100000766300 [0,1,0,1,0,0|2,0,0]=4 15908 B11R1.180 C#CCCOC1COCC1O 34a_100011215631_200000725654 [0,1,0,1,0,0|1,0,1]=4 15909 B11R1.180 C#CCCO[C@H]1COC[C@@H]1N 34a_100015191717_100000688953 [0,1,0,1,0,0|1,0,1]=4 15910 B11R1.180 C/C=C/COC1COCC1O 34a_100016270725_200000725654 [0,1,0,1,0,0|1,0,1]=4 15911 B11R1.180 C/C=C/CO[C@H]1COC[C@@H]1N 34a_100015191717_100102629194 [0,1,0,1,0,0|1,0,1]=4 15912 B11R1.180 C=CCCOC1COCC1O 34a_100011205117_200000725654 [0,1,0,1,0,0|1,0,1]=4 15913 B11R1.180 C=CCCO[C@H]1COC[C@@H]1N 34a_100015191717_100000754431 [0,1,0,1,0,0|1,0,1]=4 15914 B11R1.180 CC#CCOC1COCC1O 34a_100000761923_200000725654 [0,1,0,1,0,0|1,0,1]=4 15915 B11R1.180 CC#CCO[C@H]1COC[C@@H]1N 34a_100015191717_100000748600 [0,1,0,1,0,0|1,0,1]=4 15916 B11R1.180 CC=CCO[C@H]1COC[C@@H]1N 34a_100015191717_100000070051 [0,1,0,1,0,0|1,0,1]=4 15917 B11R1.180 CCCCNC1CCOC1C 270004a_100000102301_100000691750 [0,1,0,1,0,0|2,0,0]=4 15918 B11R1.180 CCCCNC1COCC1O 7a_106832991798_200000725654 [0,1,0,1,0,0|2,0,0]=4 15919 B11R1.180 CCCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100000210211 [0,1,0,1,0,0|2,0,0]=4 15920 B11R1.180 CCCCOC1CCCC1C 34a_100011216460_100000210210 [0,1,0,1,0,0|2,0,0]=4 15921 B11R1.180 CCCCOC1CCCC1C 7a_100011216460_100000210211 [0,1,0,1,0,0|2,0,0]=4 15922 B11R1.180 CCCCOC1CCOC1=O 34a_100000210227_100000211211 [0,1,0,1,0,0|1,0,1]=4 15923 B11R1.180 CCCCOC1CCOC1=O 7a_100000210227_100000211211 [0,1,0,1,0,0|1,0,1]=4 15924 B11R1.180 CCCCOC1COCC1O 34a_100000210227_200000725654 [0,1,0,1,0,0|1,0,0]=3 15925 B11R1.180 CCCCOC1COCC1O 7a_100000210227_200000725654 [0,1,0,1,0,0|1,0,0]=3 15926 B11R1.180 CCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000210210 [0,1,0,1,0,0|2,0,0]=4 15927 B11R1.180 CCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000210210 [0,1,0,1,0,0|2,0,0]=4 15928 B11R1.180 CCCCO[C@H]1CNC[C@H]1C 34a_200015306588_100000210210 [0,1,0,1,0,0|2,0,0]=4 15929 B11R1.180 CCCCO[C@H]1COC[C@@H]1N 34a_100015191717_100000210210 [0,1,0,1,0,0|1,0,0]=3 15930 B11R1.180 CCCCSC1COCC1O 62a_100000210211_200000725654 [0,1,0,1,0,0|1,1,0]=4 15931 B11R1.180 CCCCSC1COCC1O 62a_200000725654_100000210210 [0,1,0,1,0,0|1,1,0]=4 15932 B11R1.180 CCCOCC1CCCN1C 34a_100000743107_100000210303 [0,1,0,1,0,0|2,0,0]=4 15933 B11R1.180 CCOCCC1CCCN1C 34a_100011215177_100000210202 [0,1,0,1,0,0|2,0,0]=4 15934 B11R1.180 CCOCCC1CCCN1C 34a_100121572206_100000005710 [0,1,0,1,0,0|2,0,0]=4 15935 B11R1.180 CCOCCC1CCCN1C 7a_100011215177_100000210202 [0,1,0,1,0,0|2,0,0]=4 15936 B11R1.180 CCOCCN1CCC[C@@H]1C 2230a_100020605311_100011215890 [0,1,0,1,0,0|2,0,0]=4 15937 B11R1.180 CCOCCN1CCC[C@@H]1C 269982a_100020605311_100011215890 [0,1,0,1,0,0|2,0,0]=4 15938 B11R1.180 CCOCCN1CCC[C@H]1C 2230a_100015189458_100011215890 [0,1,0,1,0,0|2,0,0]=4 15939 B11R1.180 CCOCCN1CCC[C@H]1C 269982a_100015189458_100011215890 [0,1,0,1,0,0|2,0,0]=4 15940 B11R1.180 CCOCCN1CCC[C@H]1C 34a_100015189458_100000210147 [0,1,0,1,0,0|2,0,0]=4 15941 B11R1.180 CCOCCN1CCSC1C 2230a_200011216479_100011215890 [0,1,0,1,0,0|1,1,0]=4 15942 B11R1.180 CCOCCN1CCSC1C 269982a_200011216479_100011215890 [0,1,0,1,0,0|1,1,0]=4 15943 B11R1.180 CCOCCN1CCSC1C 34a_200011216479_100000210147 [0,1,0,1,0,0|1,1,0]=4 15944 B11R1.180 CCOCSC1COCC1O 62a_100000739092_200000725654 [0,1,0,1,0,0|2,0,0]=4 15945 B11R1.180 CCOCSC1COCC1O 62a_200000725654_100000739092 [0,1,0,1,0,0|2,0,0]=4 15946 B11R1.180 CN1CCCC1COCCF 34a_100000743107_100011217306 [0,1,0,1,0,0|2,0,0]=4 15947 B11R1.180 CN1CCCC1COCCO 34a_100000743107_100000211926 [0,1,0,1,0,0|2,0,0]=4 15948 B11R1.180 COCCCN1CCC[C@@H]1C 2230a_100020605311_100000740836 [0,1,0,1,0,0|2,0,0]=4 15949 B11R1.180 COCCCN1CCC[C@@H]1C 269982a_100020605311_100000740836 [0,1,0,1,0,0|2,0,0]=4 15950 B11R1.180 COCCCN1CCC[C@H]1C 2230a_100015189458_100000740836 [0,1,0,1,0,0|2,0,0]=4 15951 B11R1.180 COCCCN1CCC[C@H]1C 269982a_100015189458_100000740836 [0,1,0,1,0,0|2,0,0]=4 15952 B11R1.180 COCCCN1CCC[C@H]1C 34a_100015189458_100000740836 [0,1,0,1,0,0|2,0,0]=4 15953 B11R1.180 COCCCN1CCSC1C 2230a_200011216479_100000740836 [0,1,0,1,0,0|1,1,0]=4 15954 B11R1.180 COCCCN1CCSC1C 269982a_200011216479_100000740836 [0,1,0,1,0,0|1,1,0]=4 15955 B11R1.180 COCCCN1CCSC1C 34a_200011216479_100000740836 [0,1,0,1,0,0|1,1,0]=4 15956 B11R1.180 COCCNC1CCCC1C 269862a_100000209980_100000752053 [0,1,0,1,0,0|2,0,0]=4 15957 B11R1.180 COCCNC1CCOC1=O 2230a_100000209980_100000211211 [0,1,0,1,0,0|1,0,1]=4 15958 B11R1.180 COCCNC1CCOC1C 270004a_100000209980_100000691750 [0,1,0,1,0,0|1,0,0]=3 15959 B11R1.180 COCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100011201679 [0,1,0,1,0,0|1,0,0]=3 15960 B11R1.180 COCCOC1CCCC1=O 34a_100000210237_100000709159 [0,1,0,1,0,0|1,0,1]=4 15961 B11R1.180 COCCOC1CCCC1=O 34a_200000719330_100011201679 [0,1,0,1,0,0|1,0,1]=4 15962 B11R1.180 COCCOC1CCCC1C 34a_100011216460_100011201679 [0,1,0,1,0,0|1,0,0]=3 15963 B11R1.180 COCCOC1CCCC1C 7a_100011216460_100000233755 [0,1,0,1,0,0|1,0,0]=3 15964 B11R1.180 COCCOC1CCOC1=O 34a_100000210237_100000211211 [0,1,0,1,0,0|0,0,1]=3 15965 B11R1.180 COCCOC1COCC1O 34a_100000210237_200000725654 [0,1,0,1,0,0|0,0,0]=2 15966 B11R1.180 COCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100011201679 [0,1,0,1,0,0|1,0,0]=3 15967 B11R1.180 COCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100011201679 [0,1,0,1,0,0|1,0,0]=3 15968 B11R1.180 COCCO[C@H]1CCNC1=O 34a_100000688343_100011201679 [0,1,0,1,0,0|1,0,1]=4 15969 B11R1.180 COCCO[C@H]1CNC[C@H]1C 34a_200015306588_100011201679 [0,1,0,1,0,0|1,0,0]=3 15970 B11R1.180 COCCO[C@H]1COC[C@@H]1N 34a_100015191717_100011201679 [0,1,0,1,0,0|0,0,0]=2 15971 B11R1.180 COCCSC1CCOC1=O 62a_100000211211_100000233755 [0,1,0,1,0,0|0,1,1]=4 15972 B11R1.180 COCCSC1CCOC1=O 62a_100000233755_100000211211 [0,1,0,1,0,0|0,1,1]=4 15973 B11R1.180 COCCSC1COCC1O 62a_100000233755_200000725654 [0,1,0,1,0,0|0,1,0]=3 15974 B11R1.180 COCCSC1COCC1O 62a_200000725654_100000233755 [0,1,0,1,0,0|0,1,0]=3 15975 B11R1.180 COCCS[C@@H]1CCC[C@H]1O 62a_100000233755_200016002552 [0,1,0,1,0,0|1,1,0]=4 15976 B11R1.180 COCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000233755 [0,1,0,1,0,0|1,1,0]=4 15977 B11R1.180 CSCCNC1CCOC1C 270004a_100020590264_100000691750 [0,1,0,1,0,0|1,1,0]=4 15978 B11R1.180 CSCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100000751147 [0,1,0,1,0,0|1,1,0]=4 15979 B11R1.180 CSCCOC1CCCC1C 34a_100011216460_100000212216 [0,1,0,1,0,0|1,1,0]=4 15980 B11R1.180 CSCCOC1CCCC1C 7a_100011216460_100000212216 [0,1,0,1,0,0|1,1,0]=4 15981 B11R1.180 CSCCOC1CCOC1=O 34a_100000230434_100000211211 [0,1,0,1,0,0|0,1,1]=4 15982 B11R1.180 CSCCOC1CCOC1=O 7a_100000230434_100000211211 [0,1,0,1,0,0|0,1,1]=4 15983 B11R1.180 CSCCOC1COCC1O 34a_100000230434_200000725654 [0,1,0,1,0,0|0,1,0]=3 15984 B11R1.180 CSCCOC1COCC1O 7a_100000230434_200000725654 [0,1,0,1,0,0|0,1,0]=3 15985 B11R1.180 CSCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000212216 [0,1,0,1,0,0|1,1,0]=4 15986 B11R1.180 CSCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000212216 [0,1,0,1,0,0|1,1,0]=4 15987 B11R1.180 CSCCO[C@H]1CNC[C@H]1C 34a_200015306588_100000212216 [0,1,0,1,0,0|1,1,0]=4 15988 B11R1.180 CSCCO[C@H]1COC[C@@H]1N 34a_100015191717_100000212216 [0,1,0,1,0,0|0,1,0]=3 15989 B11R1.180 CSCCSC1COCC1O 62a_100000212216_200000725654 [0,1,0,1,0,0|0,2,0]=4 15990 B11R1.180 CSCCSC1COCC1O 62a_200000725654_100000751147 [0,1,0,1,0,0|0,2,0]=4 15991 B11R1.180 CSCOCC1CCCN1C 34a_100000743107_100011218213 [0,1,0,1,0,0|2,0,0]=4 15992 B11R1.180 NCCCOC1COCC1O 34a_100000182051_200000725654 [0,1,0,1,0,0|2,0,0]=4 15993 B11R1.180 NOCCOC1CCOC1=O 34a_100000700252_100000211211 [0,1,0,1,0,0|1,0,1]=4 15994 B11R1.180 NOCCOC1COCC1O 34a_100000700252_200000725654 [0,1,0,1,0,0|1,0,0]=3 15995 B11R1.180 N[C@H]1COC[C@@H]1OCCCF 34a_100015191717_100011934791 [0,1,0,1,0,0|2,0,0]=4 15996 B11R1.180 N[C@H]1COC[C@@H]1OCCCO 34a_100015191717_100000230001 [0,1,0,1,0,0|2,0,0]=4 15997 B11R1.180 OC1COCC1OCCCBr 34a_100011217188_200000725654 [0,1,0,1,0,0|2,0,0]=4 15998 B11R1.180 OC1COCC1OCCCCl 34a_100000230001_200000725654 [0,1,0,1,0,0|2,0,0]=4 15999 B11R1.180 OC1COCC1OCCCF 34a_100000759539_200000725654 [0,1,0,1,0,0|2,0,0]=4 16000 B11R1.189 CCN1CCCC(C1)COC 2230a_100000755410_100000210202 [0,1,0,1,0,0|2,0,0]=4 16001 B11R1.189 CCN1CCCC(C1)COC 269982a_100000755410_100000204670 [0,1,0,1,0,0|2,0,0]=4 16002 B11R1.189 CCN1CCCC(C1)COC 34a_100000755410_100000210202 [0,1,0,1,0,0|2,0,0]=4 16003 B11R1.189 CCN1CCCC(C1)COC 7a_200000227639_200000210301 [0,1,0,1,0,0|2,0,0]=4 16004 B11R1.189 CCN1CCCC(C1)CO[13CH3] 7a_200000227639_200025704644 [0,1,0,1,0,0|2,0,0]=4 16005 B11R1.189 CCN1CCOC(C1)COC 2230a_100000760289_100000210202 [0,1,0,1,0,0|1,0,0]=3 16006 B11R1.189 CCN1CCOC(C1)COC 269982a_100000760289_100000204670 [0,1,0,1,0,0|1,0,0]=3 16007 B11R1.189 CCN1CCOC(C1)COC 34a_100000760289_100000210202 [0,1,0,1,0,0|1,0,0]=3 16008 B11R1.189 CCOC1CCCC(C1)CC 7a_100011985506_100000210202 [0,1,0,1,0,0|2,0,0]=4 16009 B11R1.189 COCC1CN(CCO1)CF 269982a_100000760289_100015361967 [0,1,0,1,0,0|2,0,0]=4 16010 B11R1.189 COCC1CN(CCO1)CF 34a_100000760289_100015361967 [0,1,0,1,0,0|2,0,0]=4 16011 B11R1.199 CCO[C@@H](C)[C@@H]1CCCN1C 34a_100160487421_100000210202 [0,1,0,1,0,0|2,0,0]=4 16012 B11R1.199 COCC(C)N1CCC[C@@H]1C 2230a_100020605311_100000765312 [0,1,0,1,0,0|2,0,0]=4 16013 B11R1.199 COCC(C)N1CCC[C@@H]1C 269982a_100020605311_100000765312 [0,1,0,1,0,0|2,0,0]=4 16014 B11R1.199 COCC(C)N1CCC[C@@H]1C 270004a_100020605311_100000749346 [0,1,0,1,0,0|2,0,0]=4 16015 B11R1.199 COCC(C)N1CCC[C@H]1C 2230a_100015189458_100000765312 [0,1,0,1,0,0|2,0,0]=4 16016 B11R1.199 COCC(C)N1CCC[C@H]1C 269982a_100015189458_100000765312 [0,1,0,1,0,0|2,0,0]=4 16017 B11R1.199 COCC(C)N1CCC[C@H]1C 270004a_100015189458_100000749346 [0,1,0,1,0,0|2,0,0]=4 16018 B11R1.199 COCC(C)N1CCC[C@H]1C 34a_100015189458_100000765312 [0,1,0,1,0,0|2,0,0]=4 16019 B11R1.199 COCC(C)N1CCSC1C 2230a_200011216479_100000765312 [0,1,0,1,0,0|1,1,0]=4 16020 B11R1.199 COCC(C)N1CCSC1C 269982a_200011216479_100000765312 [0,1,0,1,0,0|1,1,0]=4 16021 B11R1.199 COCC(C)N1CCSC1C 270004a_200011216479_100000749346 [0,1,0,1,0,0|1,1,0]=4 16022 B11R1.199 COCC(C)N1CCSC1C 34a_200011216479_100000765312 [0,1,0,1,0,0|1,1,0]=4 16023 B11R1.210 CCCCN1CC(C1)OCC 269982a_100000732654_100000210211 [0,1,0,1,0,0|2,0,0]=4 16024 B11R1.210 CCCCN1CC(C1)OCC 34a_100000732654_100000210210 [0,1,0,1,0,0|2,0,0]=4 16025 B11R1.210 CCOC1CN(C1)CCOC 269982a_100000732654_100000233755 [0,1,0,1,0,0|1,0,0]=3 16026 B11R1.210 CCOC1CN(C1)CCOC 34a_100000732654_100011201679 [0,1,0,1,0,0|1,0,0]=3 16027 B11R1.210 CCOC1CN(C1)CCSC 269982a_100000732654_100000212216 [0,1,0,1,0,0|1,1,0]=4 16028 B11R1.210 CCOC1CN(C1)CCSC 34a_100000732654_100000212216 [0,1,0,1,0,0|1,1,0]=4 16029 B11R1.210 CCOCN1CC(C1)COC 269982a_100016993750_100000739092 [0,1,0,1,0,0|2,0,0]=4 16030 B11R1.288 CCCC(C)OCC1CC1C 34a_100000744939_100000766640 [0,1,0,1,0,0|2,0,0]=4 16031 B11R1.288 CCCC(C)OCC1CC1C 7a_100000744939_100000766640 [0,1,0,1,0,0|2,0,0]=4 16032 B11R1.288 COCC(C)OCC1CC1C 34a_100000744939_100000765312 [0,1,0,1,0,0|1,0,0]=3 16033 B11R1.288 COCC(C)OCC1CC1C 7a_100000744939_100000765312 [0,1,0,1,0,0|1,0,0]=3 16034 B11R1.289 C#CCC(C)OCC1CCO1 34a_100000685586_100000103362 [0,1,0,1,0,0|1,0,1]=4 16035 B11R1.289 C#CCC(C)OCC1CCO1 7a_100000685586_100000103362 [0,1,0,1,0,0|1,0,1]=4 16036 B11R1.289 C/C=C/C(C)OCC1CCO1 34a_200102604097_100000103362 [0,1,0,1,0,0|1,0,1]=4 16037 B11R1.289 C=CC[C@@H](C)OCC1CCO1 34a_100000731007_100000103362 [0,1,0,1,0,0|1,0,1]=4 16038 B11R1.289 C=CC[C@@H](C)OCC1CCO1 7a_100000731007_100000103362 [0,1,0,1,0,0|1,0,1]=4 16039 B11R1.289 CC#CC(C)OCC1CCO1 34a_100011216543_100000103362 [0,1,0,1,0,0|1,0,1]=4 16040 B11R1.289 CC(CCBr)OCC1CCO1 34a_100012276601_100000103362 [0,1,0,1,0,0|2,0,0]=4 16041 B11R1.289 CC(CCN)COC1COC1 34a_106354213184_100009818527 [0,1,0,1,0,0|2,0,0]=4 16042 B11R1.289 CC(CCO)OCC1CCO1 34a_100000039022_100009893172 [0,1,0,1,0,0|2,0,0]=4 16043 B11R1.289 CCCC(C)CNC1COC1 2230a_100016991112_100011216630 [0,1,0,1,0,0|2,0,0]=4 16044 B11R1.289 CCCC(C)CNC1COC1 270004a_100016991112_100000243154 [0,1,0,1,0,0|2,0,0]=4 16045 B11R1.289 CCCC(C)COC1CCC1 34a_100000688023_100000749161 [0,1,0,1,0,0|2,0,0]=4 16046 B11R1.289 CCCC(C)COC1CCC1 34a_100000748187_100011216630 [0,1,0,1,0,0|2,0,0]=4 16047 B11R1.289 CCCC(C)COC1COC1 34a_100000688023_100009818527 [0,1,0,1,0,0|1,0,0]=3 16048 B11R1.289 CCCC(C)COC1COC1 7a_100000688023_100009818527 [0,1,0,1,0,0|1,0,0]=3 16049 B11R1.289 CCCC(C)COC1CSC1 7a_100000072292_100011216630 [0,1,0,1,0,0|1,1,0]=4 16050 B11R1.289 CCCC(C)CSC1COC1 62a_100011216630_100009818527 [0,1,0,1,0,0|1,1,0]=4 16051 B11R1.289 CCCC(C)NCC1CCO1 2230a_100000741246_100000103362 [0,1,0,1,0,0|2,0,0]=4 16052 B11R1.289 CCCC(C)NC[C@@H]1CCO1 2230a_100020831831_100000766640 [0,1,0,1,0,0|2,0,0]=4 16053 B11R1.289 CCCC(C)NC[C@@H]1CCO1 270004a_100020831831_100000211909 [0,1,0,1,0,0|2,0,0]=4 16054 B11R1.289 CCCC(C)NC[C@@H]1CCO1 34a_100020831831_100000766640 [0,1,0,1,0,0|2,0,0]=4 16055 B11R1.289 CCCC(C)OCC1CCC1 34a_100000760304_100000766640 [0,1,0,1,0,0|2,0,0]=4 16056 B11R1.289 CCCC(C)OCC1CCC1 34a_100000764384_100000763275 [0,1,0,1,0,0|2,0,0]=4 16057 B11R1.289 CCCC(C)OCC1CCC1 7a_100000764384_100000763275 [0,1,0,1,0,0|2,0,0]=4 16058 B11R1.289 CCCC(C)OCC1CCO1 34a_100000039022_100000766640 [0,1,0,1,0,0|1,0,0]=3 16059 B11R1.289 CCCC(C)OCC1CCO1 34a_100000764384_100000103362 [0,1,0,1,0,0|1,0,0]=3 16060 B11R1.289 CCCC(C)OCC1CCO1 7a_100000764384_100000103362 [0,1,0,1,0,0|1,0,0]=3 16061 B11R1.289 CCCC(C)SCC1CCO1 62a_100000103362_100000766640 [0,1,0,1,0,0|1,1,0]=4 16062 B11R1.289 CCCC(C)SCC1CCO1 62a_100000766640_100000103362 [0,1,0,1,0,0|1,1,0]=4 16063 B11R1.289 CCC[C@H](N)COC1CCC1 34a_100000732646_100000749161 [0,1,0,1,0,0|2,0,0]=4 16064 B11R1.289 CCC[C@H](N)COC1COC1 34a_100000732646_100009818527 [0,1,0,1,0,0|1,0,0]=3 16065 B11R1.289 CCOC(=O)CNC1COC1 2230a_100016991112_100000188475 [0,1,0,1,0,0|1,0,1]=4 16066 B11R1.289 CCOC(=O)COC1CCC1 34a_100000748187_100000188475 [0,1,0,1,0,0|1,0,1]=4 16067 B11R1.289 CCOC(=O)COC1CSC1 7a_100000072292_100000188475 [0,1,0,1,0,0|0,1,1]=4 16068 B11R1.289 CCOC(=O)CSC1COC1 62a_100000188475_100009818527 [0,1,0,1,0,0|0,1,1]=4 16069 B11R1.289 COCC(=O)NC[C@@H]1CCO1 11a_100020831831_100000210968 [0,1,0,1,0,0|1,0,1]=4 16070 B11R1.289 COCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000210968 [0,1,0,1,0,0|1,0,1]=4 16071 B11R1.289 COCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000210968 [0,1,0,1,0,0|1,0,1]=4 16072 B11R1.289 COCC(=O)NC[C@@H]1CCO1 527a_100020831831_100000210968 [0,1,0,1,0,0|1,0,1]=4 16073 B11R1.289 COCC(C)NCC1CCC1 2230a_100000738700_100000765312 [0,1,0,1,0,0|2,0,0]=4 16074 B11R1.289 COCC(C)NCC1CCC1 270004a_100000738700_100000749346 [0,1,0,1,0,0|2,0,0]=4 16075 B11R1.289 COCC(C)NCC1CCC1 34a_100000738700_100000765312 [0,1,0,1,0,0|2,0,0]=4 16076 B11R1.289 COCC(C)NC[C@@H]1CCO1 2230a_100020831831_100000765312 [0,1,0,1,0,0|1,0,0]=3 16077 B11R1.289 COCC(C)NC[C@@H]1CCO1 270004a_100020831831_100000749346 [0,1,0,1,0,0|1,0,0]=3 16078 B11R1.289 COCC(C)NC[C@@H]1CCO1 34a_100020831831_100000765312 [0,1,0,1,0,0|1,0,0]=3 16079 B11R1.289 COCC(C)OCC1CCC1 34a_100000760304_100000765312 [0,1,0,1,0,0|1,0,0]=3 16080 B11R1.289 COCC(C)OCC1CCO1 34a_100000039022_100000765312 [0,1,0,1,0,0|0,0,0]=2 16081 B11R1.289 COCC(C)OCC1CNC1 34a_100016987283_100000765312 [0,1,0,1,0,0|2,0,0]=4 16082 B11R1.289 COCC(C)OCC1COC1 34a_100000060846_100000765312 [0,1,0,1,0,0|2,0,0]=4 16083 B11R1.289 COCC(C)SCC1CCC1 62a_100000763275_100000765312 [0,1,0,1,0,0|1,1,0]=4 16084 B11R1.289 COCC(C)SCC1CCC1 62a_100000765312_100000763275 [0,1,0,1,0,0|1,1,0]=4 16085 B11R1.289 COCC(C)SCC1CCO1 62a_100000103362_100000765312 [0,1,0,1,0,0|0,1,0]=3 16086 B11R1.289 COCC(C)SCC1CCO1 62a_100000765312_100000103362 [0,1,0,1,0,0|0,1,0]=3 16087 B11R1.289 COCC(N)COC1COC1 34a_100000724102_100009818527 [0,1,0,1,0,0|2,0,0]=4 16088 B11R1.289 COC[C@@H](C)NCC1CCC1 2230a_100000764878_100000763275 [0,1,0,1,0,0|2,0,0]=4 16089 B11R1.289 COC[C@@H](C)NCC1CCC1 269862a_100000764878_100000753134 [0,1,0,1,0,0|2,0,0]=4 16090 B11R1.289 COC[C@@H](C)NCC1CCO1 2230a_100000764878_100000103362 [0,1,0,1,0,0|1,0,0]=3 16091 B11R1.289 COC[C@@H](C)OCC1CCC1 34a_100011934205_100000763275 [0,1,0,1,0,0|1,0,0]=3 16092 B11R1.289 COC[C@@H](C)OCC1CCO1 34a_100011934205_100000103362 [0,1,0,1,0,0|0,0,0]=2 16093 B11R1.289 COC[C@@H](C)OCC1COC1 34a_100011934205_100010264016 [0,1,0,1,0,0|2,0,0]=4 16094 B11R1.289 CSCC(C)NC[C@@H]1CCO1 270004a_100020831831_100011216314 [0,1,0,1,0,0|1,1,0]=4 16095 B11R1.290 CC(CCN)COCC1CO1 34a_106354213184_102125554688 [0,1,0,1,0,0|2,0,0]=4 16096 B11R1.290 CCCC(C)COCC1CC1 34a_100000211283_100011216630 [0,1,0,1,0,0|2,0,0]=4 16097 B11R1.290 CCCC(C)COCC1CC1 34a_100000688023_100000742324 [0,1,0,1,0,0|2,0,0]=4 16098 B11R1.290 CCCC(C)COCC1CC1 7a_100000688023_100000742324 [0,1,0,1,0,0|2,0,0]=4 16099 B11R1.290 CCCC(C)COCC1CO1 34a_100000688023_102125554688 [0,1,0,1,0,0|1,0,0]=3 16100 B11R1.290 CCCC(C)COCC1CO1 7a_100000688023_102125554688 [0,1,0,1,0,0|1,0,0]=3 16101 B11R1.290 CCCC(C)COCC1CS1 7a_100000688023_100000031435 [0,1,0,1,0,0|1,1,0]=4 16102 B11R1.290 CCCC(C)COC[C@@H]1CO1 34a_100000757423_100011216630 [0,1,0,1,0,0|1,0,0]=3 16103 B11R1.290 CCCC(C)COC[C@@H]1CO1 7a_100000688023_100000745022 [0,1,0,1,0,0|1,0,0]=3 16104 B11R1.290 CCCC(C)CSCC1CO1 62a_100011216630_102125554688 [0,1,0,1,0,0|1,1,0]=4 16105 B11R1.290 CCCC(C)CSCC1CO1 62a_102125554688_100011216630 [0,1,0,1,0,0|1,1,0]=4 16106 B11R1.290 CCCC(C)CSC[C@@H]1CO1 62a_100000745022_100011216630 [0,1,0,1,0,0|1,1,0]=4 16107 B11R1.290 CCCC(C)CSC[C@@H]1CO1 62a_100011216630_100000745022 [0,1,0,1,0,0|1,1,0]=4 16108 B11R1.290 CCCC(C)OCCC1CC1 34a_100000754188_100000766640 [0,1,0,1,0,0|2,0,0]=4 16109 B11R1.290 CCCC(C)OCCC1CC1 34a_100000764384_100000694398 [0,1,0,1,0,0|2,0,0]=4 16110 B11R1.290 CCCC(C)OCCC1CC1 7a_100000754188_100000766640 [0,1,0,1,0,0|2,0,0]=4 16111 B11R1.290 CCCC(C)OCCC1CC1 7a_100000764384_100000764125 [0,1,0,1,0,0|2,0,0]=4 16112 B11R1.290 CCC[C@H](N)COCC1CC1 34a_100000732646_100000742324 [0,1,0,1,0,0|2,0,0]=4 16113 B11R1.290 CCC[C@H](N)COCC1CO1 34a_100000732646_102125554688 [0,1,0,1,0,0|1,0,0]=3 16114 B11R1.290 CCNC(=O)COC[C@@H]1CO1 34a_100000757423_100000183381 [0,1,0,1,0,0|1,0,1]=4 16115 B11R1.290 CCOC(=O)COCC1CC1 34a_100000211283_100000188475 [0,1,0,1,0,0|1,0,1]=4 16116 B11R1.290 CCOC(=O)COC[C@@H]1CO1 34a_100000757423_100000188475 [0,1,0,1,0,0|0,0,1]=3 16117 B11R1.290 CCOC(=O)CSCC1CO1 62a_100000188475_102125554688 [0,1,0,1,0,0|0,1,1]=4 16118 B11R1.290 CCOC(=O)CSCC1CO1 62a_102125554688_100000188475 [0,1,0,1,0,0|0,1,1]=4 16119 B11R1.290 CCOC(=O)CSC[C@@H]1CO1 62a_100000188475_100000745022 [0,1,0,1,0,0|0,1,1]=4 16120 B11R1.290 CCOC(=O)CSC[C@@H]1CO1 62a_100000745022_100000188475 [0,1,0,1,0,0|0,1,1]=4 16121 B11R1.290 COCC(C)NCCC1CC1 270004a_100000764129_100000749346 [0,1,0,1,0,0|2,0,0]=4 16122 B11R1.290 COCC(C)NCCC1CC1 34a_100000764129_100000765312 [0,1,0,1,0,0|2,0,0]=4 16123 B11R1.290 COCC(C)OCCC1CC1 34a_100000754188_100000765312 [0,1,0,1,0,0|1,0,0]=3 16124 B11R1.290 COCC(C)OCCC1CC1 7a_100000754188_100000765312 [0,1,0,1,0,0|1,0,0]=3 16125 B11R1.290 COCC(C)OCC[C@@H]1CO1 34a_100009820653_100000765312 [0,1,0,1,0,0|2,0,0]=4 16126 B11R1.290 COCC(C)SCCC1CC1 62a_100000764125_100000765312 [0,1,0,1,0,0|1,1,0]=4 16127 B11R1.290 COCC(C)SCCC1CC1 62a_100000765312_100000764125 [0,1,0,1,0,0|1,1,0]=4 16128 B11R1.290 COCC(N)COCC1CO1 34a_100000724102_102125554688 [0,1,0,1,0,0|2,0,0]=4 16129 B11R1.290 COCC(O)COC[C@@H]1CO1 34a_100000757423_100011215053 [0,1,0,1,0,0|2,0,0]=4 16130 B11R1.290 COC[C@@H](C)NCCC1CC1 2230a_100000764878_100000694398 [0,1,0,1,0,0|2,0,0]=4 16131 B11R1.290 COC[C@@H](C)OCCC1CC1 34a_100011934205_100000694398 [0,1,0,1,0,0|1,0,0]=3 16132 B11R1.290 COC[C@@H](C)OCCC1CO1 34a_100011934205_100000732470 [0,1,0,1,0,0|2,0,0]=4 16133 B11R1.356 CCCCCNC(C)C1CO1 270004a_100000209983_100000031964 [0,1,0,1,0,0|2,0,0]=4 16134 B11R1.356 CCCCCOC(C)C1CC1 34a_100000744524_100000718602 [0,1,0,1,0,0|2,0,0]=4 16135 B11R1.356 CCCCCOC(C)C1CC1 7a_100000744524_100000210326 [0,1,0,1,0,0|2,0,0]=4 16136 B11R1.356 CCCCOC[C@H](N)C1CC1 34a_100020623730_100000210210 [0,1,0,1,0,0|2,0,0]=4 16137 B11R1.356 CCOCCCC(=O)C1CO1 1458a_100000701028_100012232248 [0,1,0,1,0,0|1,0,1]=4 16138 B11R1.356 CCOCCNC(=O)C1CO1 11a_100011200944_100000701028 [0,1,0,1,0,0|1,0,1]=4 16139 B11R1.356 CCOCCNC(=O)C1CO1 1626a_102516460346_100000701028 [0,1,0,1,0,0|1,0,1]=4 16140 B11R1.356 CCOCCNC(=O)C1CO1 240690a_100011200944_100000701028 [0,1,0,1,0,0|1,0,1]=4 16141 B11R1.356 CCOCCNC(=O)C1CO1 527a_100011200944_100000701028 [0,1,0,1,0,0|1,0,1]=4 16142 B11R1.356 CCOCCNC(C)C1CC1 2230a_100000700016_100011215890 [0,1,0,1,0,0|2,0,0]=4 16143 B11R1.356 CCOCCNC(C)C1CC1 269862a_100011200944_100000210639 [0,1,0,1,0,0|2,0,0]=4 16144 B11R1.356 CCOCCNC(C)C1CC1 34a_100000700016_100000210147 [0,1,0,1,0,0|2,0,0]=4 16145 B11R1.356 CCOCCNC(C)C1CO1 270004a_102516460346_100000031964 [0,1,0,1,0,0|1,0,0]=3 16146 B11R1.356 CCOCCOC(C)C1CC1 34a_100000744524_100000210147 [0,1,0,1,0,0|1,0,0]=3 16147 B11R1.356 CCOCCOC(C)C1CC1 7a_100000744524_100011215890 [0,1,0,1,0,0|1,0,0]=3 16148 B11R1.356 CCSCCNC(C)C1CO1 270004a_100000106463_100000031964 [0,1,0,1,0,0|1,1,0]=4 16149 B11R1.356 CCSCCOC(C)C1CC1 34a_100000744524_100000757381 [0,1,0,1,0,0|1,1,0]=4 16150 B11R1.356 CCSCCOC(C)C1CC1 7a_100000744524_100000757381 [0,1,0,1,0,0|1,1,0]=4 16151 B11R1.356 COCCNCC(O)C1CC1 2230a_100000751198_100011201679 [0,1,0,1,0,0|2,0,0]=4 16152 B11R1.356 COCCNCC(O)C1CC1 34a_100000751198_100011201679 [0,1,0,1,0,0|2,0,0]=4 16153 B11R1.356 COCCOCC(=O)C1CC1 34a_100000210237_100000746382 [0,1,0,1,0,0|1,0,1]=4 16154 B11R1.356 COCCOCC(=O)C1CC1 34a_100000686663_100011201679 [0,1,0,1,0,0|1,0,1]=4 16155 B11R1.356 COCCOCN(C)C1CC1 2230a_100000226674_100000231047 [0,1,0,1,0,0|2,0,0]=4 16156 B11R1.356 COCCOCN(C)C1CC1 269982a_100000226674_100000231047 [0,1,0,1,0,0|2,0,0]=4 16157 B11R1.356 COCCOC[C@H](N)C1CC1 34a_100020623730_100011201679 [0,1,0,1,0,0|1,0,0]=3 16158 B11R1.356 CSCCOC[C@H](N)C1CC1 34a_100020623730_100000212216 [0,1,0,1,0,0|1,1,0]=4 16159 B11R1.779 CCOC1(CCCCCC1)C 34a_100000708895_100000210202 [0,1,0,1,0,0|2,0,0]=4 16160 B11R1.779 CCOC1(CCCCCC1)C 7a_100000708895_100000210202 [0,1,0,1,0,0|2,0,0]=4 16161 B11R1.899 CC1(CCC1)COCCON 34a_100000700252_100000726658 [0,1,0,1,0,0|2,0,0]=4 16162 B11R1.899 CCCCCNC1(COC1)C 2230a_100000732644_100000210326 [0,1,0,1,0,0|2,0,0]=4 16163 B11R1.899 CCCCCOC1(CCC1)C 34a_100000759064_100000718602 [0,1,0,1,0,0|2,0,0]=4 16164 B11R1.899 CCCCCOC1(CCC1)C 7a_100000759064_100000210326 [0,1,0,1,0,0|2,0,0]=4 16165 B11R1.899 CCCCCOC1(CSC1)C 7a_100016018533_100000210326 [0,1,0,1,0,0|1,1,0]=4 16166 B11R1.899 CCCCOCC1(CCC1)C 34a_100000210227_100000726658 [0,1,0,1,0,0|2,0,0]=4 16167 B11R1.899 CCCCOCC1(CCC1)C 7a_100000210227_100000726658 [0,1,0,1,0,0|2,0,0]=4 16168 B11R1.899 CCOCCNC1(CCC1)C 2230a_100000692455_100011215890 [0,1,0,1,0,0|2,0,0]=4 16169 B11R1.899 CCOCCNC1(CCC1)C 34a_100000692455_100000210147 [0,1,0,1,0,0|2,0,0]=4 16170 B11R1.899 CCOCCNC1(COC1)C 2230a_100000732644_100011215890 [0,1,0,1,0,0|1,0,0]=3 16171 B11R1.899 CCOCCOC1(CCC1)C 34a_100000759064_100000210147 [0,1,0,1,0,0|1,0,0]=3 16172 B11R1.899 CCOCCOC1(CCC1)C 7a_100000759064_100011215890 [0,1,0,1,0,0|1,0,0]=3 16173 B11R1.899 CCOCCOC1(CSC1)C 7a_100016018533_100011215890 [0,1,0,1,0,0|0,1,0]=3 16174 B11R1.899 CCOCSCC1(COC1)C 62a_100000739092_100009817586 [0,1,0,1,0,0|2,0,0]=4 16175 B11R1.899 CCOCSCC1(COC1)C 62a_100009817586_100000739092 [0,1,0,1,0,0|2,0,0]=4 16176 B11R1.899 CCSCCNC1(COC1)C 2230a_100000732644_100000757381 [0,1,0,1,0,0|1,1,0]=4 16177 B11R1.899 CCSCCOC1(CCC1)C 34a_100000759064_100000757381 [0,1,0,1,0,0|1,1,0]=4 16178 B11R1.899 CCSCCOC1(CCC1)C 7a_100000759064_100000757381 [0,1,0,1,0,0|1,1,0]=4 16179 B11R1.899 CCSCCOC1(CSC1)C 7a_100016018533_100000757381 [0,1,0,1,0,0|0,2,0]=4 16180 B11R1.899 COCCNCC1(CCC1)C 2230a_100000209980_100000726658 [0,1,0,1,0,0|2,0,0]=4 16181 B11R1.899 COCCNCC1(CCC1)C 2230a_100000706607_100011201679 [0,1,0,1,0,0|2,0,0]=4 16182 B11R1.899 COCCNCC1(CCC1)O 2230a_100000752638_100011201679 [0,1,0,1,0,0|2,0,0]=4 16183 B11R1.899 COCCOCC1(CCC1)C 34a_100000210237_100000726658 [0,1,0,1,0,0|1,0,0]=3 16184 B11R1.899 COCCOCC1(COC1)C 34a_100000210237_100009817586 [0,1,0,1,0,0|2,0,0]=4 16185 B11R1.899 COCCOCC1(CSC1)C 34a_100000732658_100011201679 [0,1,0,1,0,0|2,0,0]=4 16186 B11R1.899 COCCOCC1(CSC1)C 7a_100000732658_100000233755 [0,1,0,1,0,0|2,0,0]=4 16187 B11R1.899 COCCSCC1(CCC1)C 62a_100000233755_100000726658 [0,1,0,1,0,0|1,1,0]=4 16188 B11R1.899 COCCSCC1(CCC1)C 62a_100000726658_100000233755 [0,1,0,1,0,0|1,1,0]=4 16189 B11R1.899 CSCCOCC1(CCC1)C 34a_100000230434_100000726658 [0,1,0,1,0,0|1,1,0]=4 16190 B11R1.899 CSCCOCC1(CCC1)C 7a_100000230434_100000726658 [0,1,0,1,0,0|1,1,0]=4 16191 B11R1.27 CCCCOC1CCC(=O)C1 34a_100012614533_100000210210 [0,1,0,1,0,0|2,0,0]=4 16192 B11R1.27 CCCCOC1CCC(C1)C 34a_100000698185_100000210210 [0,1,0,1,0,0|2,0,0]=4 16193 B11R1.27 CCCCOC1CCN(C1)C 7a_100000210227_200012183744 [0,1,0,1,0,0|2,0,0]=4 16194 B11R1.27 CCOCCN1CCC(C1)O 2230a_100011215560_100011215890 [0,1,0,1,0,0|2,0,0]=4 16195 B11R1.27 CCOCCN1CCC(C1)O 269982a_100011215560_100011215890 [0,1,0,1,0,0|2,0,0]=4 16196 B11R1.27 CCOCCN1CC[C@@H](C1)F 2230a_100015203821_100011215890 [0,1,0,1,0,0|2,0,0]=4 16197 B11R1.27 CCOCCN1CC[C@@H](C1)F 269982a_100015203821_100011215890 [0,1,0,1,0,0|2,0,0]=4 16198 B11R1.27 CCOCCN1CC[C@@H](C1)F 34a_100015203821_100000210147 [0,1,0,1,0,0|2,0,0]=4 16199 B11R1.27 CCOCCN1CC[C@H](C1)C 2230a_100016987628_100011215890 [0,1,0,1,0,0|2,0,0]=4 16200 B11R1.27 CCOCCN1CC[C@H](C1)C 269982a_100016987628_100011215890 [0,1,0,1,0,0|2,0,0]=4 16201 B11R1.27 CCOCCN1CC[C@H](C1)C 34a_100016987628_100000210147 [0,1,0,1,0,0|2,0,0]=4 16202 B11R1.27 COCCNC1CCC(C1)C 270004a_100000209980_100011215218 [0,1,0,1,0,0|2,0,0]=4 16203 B11R1.27 COCCNC1CCC(C1)O 270004a_100000209980_100012614533 [0,1,0,1,0,0|2,0,0]=4 16204 B11R1.27 COCCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100011201679 [0,1,0,1,0,0|2,0,0]=4 16205 B11R1.27 COCCOC1CCC(=O)C1 34a_100012614533_100011201679 [0,1,0,1,0,0|1,0,0]=3 16206 B11R1.27 COCCOC1CCC(C1)C 34a_100000698185_100011201679 [0,1,0,1,0,0|1,0,0]=3 16207 B11R1.27 COCCOC1CNC(=O)C1 34a_100000690082_100011201679 [0,1,0,1,0,0|1,0,1]=4 16208 B11R1.27 COCCOC1COC(=O)O1 34a_100000210237_100000032252 [0,1,0,1,0,0|1,0,1]=4 16209 B11R1.27 COCCSC1CCN(C1)C 62a_100000233755_200012183744 [0,1,0,1,0,0|1,1,0]=4 16210 B11R1.27 CSCCOC1CCC(=O)C1 34a_100012614533_100000212216 [0,1,0,1,0,0|1,1,0]=4 16211 B11R1.27 CSCCOC1CCC(C1)C 34a_100000698185_100000212216 [0,1,0,1,0,0|1,1,0]=4 16212 B11R1.27 CSCCOC1CCN(C1)C 7a_100000230434_200012183744 [0,1,0,1,0,0|1,1,0]=4 16213 B11R1.46 C=COCCOCC1CC1C 34a_100000744939_100000039644 [0,1,0,1,0,0|1,0,1]=4 16214 B11R1.46 C=COCCOCC1CC1C 7a_100000744939_100000039644 [0,1,0,1,0,0|1,0,1]=4 16215 B11R1.46 CC1CC1COCCCCF 34a_100000744939_100000729493 [0,1,0,1,0,0|2,0,0]=4 16216 B11R1.46 CC1CC1COCCCCF 7a_100000744939_100000729493 [0,1,0,1,0,0|2,0,0]=4 16217 B11R1.46 CC1CC1COCCCCO 34a_100000744939_100011216708 [0,1,0,1,0,0|2,0,0]=4 16218 B11R1.46 CC1CC1COCCCCO 7a_100000744939_100000210776 [0,1,0,1,0,0|2,0,0]=4 16219 B11R1.46 CCCCCOCC1CC1C 34a_100000744939_100000718602 [0,1,0,1,0,0|2,0,0]=4 16220 B11R1.46 CCCCCOCC1CC1C 7a_100000744939_100000210326 [0,1,0,1,0,0|2,0,0]=4 16221 B11R1.46 CCOCCOCC1CC1C 34a_100000744939_100000210147 [0,1,0,1,0,0|1,0,0]=3 16222 B11R1.46 CCOCCOCC1CC1C 7a_100000744939_100011215890 [0,1,0,1,0,0|1,0,0]=3 16223 B11R1.46 CCSCCOCC1CC1C 34a_100000744939_100000757381 [0,1,0,1,0,0|1,1,0]=4 16224 B11R1.46 CCSCCOCC1CC1C 7a_100000744939_100000757381 [0,1,0,1,0,0|1,1,0]=4 16225 B11R1.46 COCCCOCC1CC1C 34a_100000744939_100000740836 [0,1,0,1,0,0|1,0,0]=3 16226 B11R1.46 COCCCOCC1CC1C 7a_100000744939_100000740836 [0,1,0,1,0,0|1,0,0]=3 16227 B11R1.46 COCCOCN[C@@H]1C[C@@H]1F 2230a_100015190264_100000231047 [0,1,0,1,0,0|2,0,0]=4 16228 B11R1.46 COCCOCN[C@@H]1C[C@H]1F 2230a_100025746932_100000231047 [0,1,0,1,0,0|2,0,0]=4 16229 B11R1.53 CC(C)C1CCCCC1O[13CH3] 34a_100011709184_200025704644 [0,1,0,1,0,0|2,0,0]=4 16230 B11R1.53 CC(C)C1CCCCC1O[13CH3] 7a_100011709184_200025704644 [0,1,0,1,0,0|2,0,0]=4 16231 B11R1.53 CCN1CCOC[C@@H]1C(C)C 2230a_100025712635_100000210202 [0,1,0,1,0,0|2,0,0]=4 16232 B11R1.53 CCN1CCOC[C@@H]1C(C)C 269982a_100025712635_100000204670 [0,1,0,1,0,0|2,0,0]=4 16233 B11R1.53 CCN1CCOC[C@@H]1C(C)C 34a_100025712635_100000210202 [0,1,0,1,0,0|2,0,0]=4 16234 B11R1.53 CC[C@H]1COCCN1C(C)C 2230a_100016988097_100000210206 [0,1,0,1,0,0|2,0,0]=4 16235 B11R1.53 CC[C@H]1COCCN1C(C)C 269982a_100016988097_100000210206 [0,1,0,1,0,0|2,0,0]=4 16236 B11R1.53 CC[C@H]1COCCN1C(C)C 34a_100016988097_100000210206 [0,1,0,1,0,0|2,0,0]=4 16237 B11R1.53 COC1CCCCC1C(C)C 34a_100011709184_200000210301 [0,1,0,1,0,0|2,0,0]=4 16238 B11R1.53 COC1CCCCC1C(C)C 7a_100011709184_200000210301 [0,1,0,1,0,0|2,0,0]=4 16239 B11R1.53 COC1COCCC1N(C)C 270004a_100102631434_100000095984 [0,1,0,1,0,0|2,0,0]=4 16240 B11R1.86 CC(C)CC1COCCN1C 2230a_100000755734_200000210301 [0,1,0,1,0,0|2,0,0]=4 16241 B11R1.86 CC(C)CC1COCCN1C 269982a_100000755734_200000210301 [0,1,0,1,0,0|2,0,0]=4 16242 B11R1.86 CC(C)CC1COCCN1C 34a_100000755734_200000210301 [0,1,0,1,0,0|2,0,0]=4 16243 B11R1.86 CC(C)CC1COCCN1[13CH3] 2230a_100000755734_200025704644 [0,1,0,1,0,0|2,0,0]=4 16244 B11R1.86 CC(C)CC1COCCN1[13CH3] 269982a_100000755734_200025704644 [0,1,0,1,0,0|2,0,0]=4 16245 B11R1.86 CC(C)CC1COCCN1[13CH3] 34a_100000755734_200025704644 [0,1,0,1,0,0|2,0,0]=4 16246 B11R1.86 CC(C)OC1CCCCC1C 34a_100000211207_100000210206 [0,1,0,1,0,0|2,0,0]=4 16247 B11R1.86 CC(C)OC1CCCCC1C 7a_100000211207_100000210206 [0,1,0,1,0,0|2,0,0]=4 16248 B11R1.86 CC(C)OC1CNCCC1C 34a_100000696640_100000210206 [0,1,0,1,0,0|2,0,0]=4 16249 B11R1.86 CC(C)OC1COCCC1=O 34a_100000212225_100012180262 [0,1,0,1,0,0|2,0,0]=4 16250 B11R1.86 CC(C)O[C@H]1COCC[C@H]1N 34a_100016994285_100000210206 [0,1,0,1,0,0|2,0,0]=4 16251 B11R1.90 CC(C)OCC1CCCN1C 34a_100000743107_100000210206 [0,1,0,1,0,0|2,0,0]=4 16252 B11R1.91 C=C(C)CCN1CCOCC1 2230a_100015191051_100000730704 [0,1,0,1,0,0|2,0,0]=4 16253 B11R1.91 C=C(C)CCN1CCOCC1 269982a_100015191051_100000730704 [0,1,0,1,0,0|2,0,0]=4 16254 B11R1.91 C=C(C)CCN1CCOCC1 34a_100015191051_100000730704 [0,1,0,1,0,0|2,0,0]=4 16255 B11R1.91 CC(=O)CCC1CCOCC1 1458a_100000070787_100011934994 [0,1,0,1,0,0|2,0,0]=4 16256 B11R1.91 CC(=O)CCN1CCOCC1 1458a_100000070787_100000753993 [0,1,0,1,0,0|2,0,0]=4 16257 B11R1.91 CC(=O)CCN1CCOCC1 1458a_100000749337_200000210301 [0,1,0,1,0,0|2,0,0]=4 16258 B11R1.91 CC(=O)CCN1CCOCC1 269982a_100015191051_100000053229 [0,1,0,1,0,0|2,0,0]=4 16259 B11R1.91 CC(=O)NC[C@H]1COCCO1 11a_100010981119_100015343762 [0,1,0,1,0,0|1,0,1]=4 16260 B11R1.91 CC(=O)NC[C@H]1COCCO1 1626a_100010981119_100015343762 [0,1,0,1,0,0|1,0,1]=4 16261 B11R1.91 CC(=O)NC[C@H]1COCCO1 240690a_100010981119_100015343762 [0,1,0,1,0,0|1,0,1]=4 16262 B11R1.91 CC(=O)NC[C@H]1COCCO1 527a_100010981119_100103153847 [0,1,0,1,0,0|1,0,1]=4 16263 B11R1.91 CC(C)CCN1CCOCC1 2230a_100015191051_100000210312 [0,1,0,1,0,0|2,0,0]=4 16264 B11R1.91 CC(C)CCN1CCOCC1 269982a_100015191051_100000210312 [0,1,0,1,0,0|2,0,0]=4 16265 B11R1.91 CC(C)CCN1CCOCC1 34a_100015191051_100000210312 [0,1,0,1,0,0|2,0,0]=4 16266 B11R1.91 CC(C)NCC1CCCCO1 2230a_100000174945_100000210206 [0,1,0,1,0,0|2,0,0]=4 16267 B11R1.91 CC(C)NCC1CCCCO1 2230a_100138425928_100000211543 [0,1,0,1,0,0|2,0,0]=4 16268 B11R1.91 CC(C)NCC1CCCCO1 34a_100000174945_100000210206 [0,1,0,1,0,0|2,0,0]=4 16269 B11R1.91 CC(C)NCC1CCCCO1 34a_100138425928_100000211543 [0,1,0,1,0,0|2,0,0]=4 16270 B11R1.91 CC(C)NCC1CCCOC1 2230a_100000720124_100000210206 [0,1,0,1,0,0|2,0,0]=4 16271 B11R1.91 CC(C)NCC1CCCOC1 2230a_100138425928_100000741521 [0,1,0,1,0,0|2,0,0]=4 16272 B11R1.91 CC(C)NCC1CCCOC1 34a_100000720124_100000210206 [0,1,0,1,0,0|2,0,0]=4 16273 B11R1.91 CC(C)NCC1CCCOC1 34a_100138425928_100000741521 [0,1,0,1,0,0|2,0,0]=4 16274 B11R1.91 CC(C)NC[C@H]1COCCO1 2230a_100010981119_100000210206 [0,1,0,1,0,0|1,0,0]=3 16275 B11R1.91 CC(C)NC[C@H]1COCCO1 34a_100010981119_100000210206 [0,1,0,1,0,0|1,0,0]=3 16276 B11R1.91 CC(C)OCC1CCCCC1 34a_100000212181_100000210206 [0,1,0,1,0,0|2,0,0]=4 16277 B11R1.91 CC(C)OCC1CCCCC1 34a_100000212225_100000211423 [0,1,0,1,0,0|2,0,0]=4 16278 B11R1.91 CC(C)OCC1CCCCC1 7a_100000212181_100000210206 [0,1,0,1,0,0|2,0,0]=4 16279 B11R1.91 CC(C)OCC1CCCCN1 34a_100000210821_100000210206 [0,1,0,1,0,0|2,0,0]=4 16280 B11R1.91 CC(C)OCC1CCCCO1 34a_100000211370_100000210206 [0,1,0,1,0,0|1,0,0]=3 16281 B11R1.91 CC(C)OCC1CCCCO1 34a_100000212225_100000211543 [0,1,0,1,0,0|1,0,0]=3 16282 B11R1.91 CC(C)OCC1CCCCO1 7a_100000211370_100000210206 [0,1,0,1,0,0|1,0,0]=3 16283 B11R1.91 CC(C)OCC1CCCNC1 34a_100000211344_100000210206 [0,1,0,1,0,0|2,0,0]=4 16284 B11R1.91 CC(C)OCC1CCCOC1 34a_100000212225_100000741521 [0,1,0,1,0,0|1,0,0]=3 16285 B11R1.91 CC(C)OCC1CCCOC1 34a_100000741520_100000210206 [0,1,0,1,0,0|1,0,0]=3 16286 B11R1.91 CC(C)OCN1CCCOC1 2230a_100000131196_100000709892 [0,1,0,1,0,0|2,0,0]=4 16287 B11R1.91 CC(C)OCN1CCCOC1 269982a_100000131196_100000709892 [0,1,0,1,0,0|2,0,0]=4 16288 B11R1.91 CC(C)OCN1CCCOC1 34a_100000131196_100000709892 [0,1,0,1,0,0|2,0,0]=4 16289 B11R1.91 CC(C)OC[C@@H]1CNCCO1 34a_100015189573_100000210206 [0,1,0,1,0,0|1,0,0]=3 16290 B11R1.91 CC(C)OC[C@@H]1COCCN1 34a_100000717676_100000210206 [0,1,0,1,0,0|1,0,0]=3 16291 B11R1.91 CC(C)OC[C@H]1COCCO1 34a_100009875890_100000210206 [0,1,0,1,0,0|0,0,0]=2 16292 B11R1.91 CC(C)SCC1CCCCO1 62a_100000210206_100000211543 [0,1,0,1,0,0|1,1,0]=4 16293 B11R1.91 CC(C)SCC1CCCCO1 62a_100000211543_100000210206 [0,1,0,1,0,0|1,1,0]=4 16294 B11R1.91 CC(C)SCC1CCCOC1 62a_100000210206_100000741521 [0,1,0,1,0,0|1,1,0]=4 16295 B11R1.91 CC(C)SCC1CCCOC1 62a_100000741521_100000210206 [0,1,0,1,0,0|1,1,0]=4 16296 B11R1.91 CC(O)CCN1CCOCC1 2230a_100015191051_100012276601 [0,1,0,1,0,0|2,0,0]=4 16297 B11R1.91 CC(O)CCN1CCOCC1 269982a_100015191051_100012276601 [0,1,0,1,0,0|2,0,0]=4 16298 B11R1.91 CC(O)CCN1CCOCC1 34a_100015191051_100012276601 [0,1,0,1,0,0|2,0,0]=4 16299 B11R1.91 CN(C)CCC1CCOCC1 2230a_100102631434_100011934994 [0,1,0,1,0,0|2,0,0]=4 16300 B11R1.91 CN(C)CCC1CCOCC1 269982a_100102631434_100011934994 [0,1,0,1,0,0|2,0,0]=4 16301 B11R1.91 CN(C)CCN1CCOCC1 2230a_100000225678_200000210301 [0,1,0,1,0,0|2,0,0]=4 16302 B11R1.91 CN(C)CCN1CCOCC1 2230a_100102631434_100025781966 [0,1,0,1,0,0|2,0,0]=4 16303 B11R1.91 CN(C)CCN1CCOCC1 269982a_100000225678_200000210301 [0,1,0,1,0,0|2,0,0]=4 16304 B11R1.91 CN(C)CCN1CCOCC1 269982a_100015191051_100000755713 [0,1,0,1,0,0|2,0,0]=4 16305 B11R1.91 CN(C)CCN1CCOCC1 269982a_100102631434_100000753993 [0,1,0,1,0,0|2,0,0]=4 16306 B11R1.91 CN([13CH3])CCN1CCOCC1 2230a_100000225678_200025704644 [0,1,0,1,0,0|2,0,0]=4 16307 B11R1.91 CN([13CH3])CCN1CCOCC1 269982a_100000225678_200025704644 [0,1,0,1,0,0|2,0,0]=4 16308 B11R1.91 [13CH3]C(=O)CCN1CCOCC1 1458a_100000749337_200025704644 [0,1,0,1,0,0|2,0,0]=4 16309 B11R1.99 BrCCCCCOCC1CC1 34a_100000746331_100000742324 [0,1,0,1,0,0|2,0,0]=4 16310 B11R1.99 BrCCCCCOCC1CC1 7a_100000746331_100000742324 [0,1,0,1,0,0|2,0,0]=4 16311 B11R1.99 BrCCCCCOCC1CO1 34a_100000746331_102125554688 [0,1,0,1,0,0|1,0,0]=3 16312 B11R1.99 BrCCCCCOCC1CO1 7a_100000746331_102125554688 [0,1,0,1,0,0|1,0,0]=3 16313 B11R1.99 BrCCCCCOCC1CS1 7a_100000746331_100000031435 [0,1,0,1,0,0|1,1,0]=4 16314 B11R1.99 BrCCCCCOC[C@@H]1CO1 7a_100000746331_100000745022 [0,1,0,1,0,0|1,0,0]=3 16315 B11R1.99 BrCCCCOCCC1CC1 34a_100011216708_100000694398 [0,1,0,1,0,0|2,0,0]=4 16316 B11R1.99 BrCCCCOCCC1CO1 34a_100011216708_100000732470 [0,1,0,1,0,0|2,0,0]=4 16317 B11R1.99 BrCCOCCOCC1CC1 34a_100000692535_100000742324 [0,1,0,1,0,0|1,0,0]=3 16318 B11R1.99 BrCCOCCOCC1CC1 7a_100000692535_100000742324 [0,1,0,1,0,0|1,0,0]=3 16319 B11R1.99 BrCCOCCOCC1CO1 34a_100000692535_102125554688 [0,1,0,1,0,0|0,0,0]=2 16320 B11R1.99 BrCCOCCOCC1CO1 7a_100000692535_102125554688 [0,1,0,1,0,0|0,0,0]=2 16321 B11R1.99 BrCCOCCOCC1CS1 7a_100000692535_100000031435 [0,1,0,1,0,0|0,1,0]=3 16322 B11R1.99 BrCCOCCOC[C@@H]1CO1 7a_100000692535_100000745022 [0,1,0,1,0,0|0,0,0]=2 16323 B11R1.99 C#CCCCCOCC1CO1 34a_100000766709_102125554688 [0,1,0,1,0,0|1,0,1]=4 16324 B11R1.99 C#CCCCCOCC1CO1 7a_100000766709_102125554688 [0,1,0,1,0,0|1,0,1]=4 16325 B11R1.99 C#CCCCCOC[C@@H]1CO1 34a_100000757423_100010269958 [0,1,0,1,0,0|1,0,1]=4 16326 B11R1.99 C#CCCCCOC[C@@H]1CO1 7a_100000766709_100000745022 [0,1,0,1,0,0|1,0,1]=4 16327 B11R1.99 C#CCOCCNCC1CO1 2230a_100000700922_100011216344 [0,1,0,1,0,0|1,0,1]=4 16328 B11R1.99 C#CCOCCNCC1CO1 34a_100000700922_102125554688 [0,1,0,1,0,0|1,0,1]=4 16329 B11R1.99 C#CCOCCOCC1CC1 34a_100000054580_100000742324 [0,1,0,1,0,0|1,0,1]=4 16330 B11R1.99 C#CCOCCOCC1CC1 34a_100000211283_100010402529 [0,1,0,1,0,0|1,0,1]=4 16331 B11R1.99 C#CCOCCOCC1CC1 7a_100000054580_100000742324 [0,1,0,1,0,0|1,0,1]=4 16332 B11R1.99 C#CCOCCOCC1CO1 34a_100000054580_102125554688 [0,1,0,1,0,0|0,0,1]=3 16333 B11R1.99 C#CCOCCOCC1CO1 7a_100000054580_102125554688 [0,1,0,1,0,0|0,0,1]=3 16334 B11R1.99 C#CCOCCOCC1CS1 7a_100000054580_100000031435 [0,1,0,1,0,0|0,1,1]=4 16335 B11R1.99 C#CCOCCOC[C@@H]1CO1 34a_100000757423_100010402529 [0,1,0,1,0,0|0,0,1]=3 16336 B11R1.99 C#CCOCCOC[C@@H]1CO1 7a_100000054580_100000745022 [0,1,0,1,0,0|0,0,1]=3 16337 B11R1.99 C#CCOCCSCC1CO1 62a_100010402529_102125554688 [0,1,0,1,0,0|0,1,1]=4 16338 B11R1.99 C#CCOCCSCC1CO1 62a_102125554688_100010402529 [0,1,0,1,0,0|0,1,1]=4 16339 B11R1.99 C#CCOCCSC[C@@H]1CO1 62a_100000745022_100010402529 [0,1,0,1,0,0|0,1,1]=4 16340 B11R1.99 C#CCOCCSC[C@@H]1CO1 62a_100010402529_100000745022 [0,1,0,1,0,0|0,1,1]=4 16341 B11R1.99 C/C=C/CCOCCC1CC1 34a_100016278192_100000694398 [0,1,0,1,0,0|2,0,0]=4 16342 B11R1.99 C/C=C/CCOCCC1CO1 34a_100016278192_100000732470 [0,1,0,1,0,0|1,0,1]=4 16343 B11R1.99 C=CCCCCOCC1CO1 34a_100000766645_102125554688 [0,1,0,1,0,0|1,0,1]=4 16344 B11R1.99 C=CCCCCOCC1CO1 7a_100000766645_102125554688 [0,1,0,1,0,0|1,0,1]=4 16345 B11R1.99 C=CCCCCOC[C@@H]1CO1 34a_100000757423_100011215482 [0,1,0,1,0,0|1,0,1]=4 16346 B11R1.99 C=CCCCCOC[C@@H]1CO1 7a_100000766645_100000745022 [0,1,0,1,0,0|1,0,1]=4 16347 B11R1.99 C=CCOCCOCC1CC1 34a_100000037705_100000742324 [0,1,0,1,0,0|1,0,1]=4 16348 B11R1.99 C=CCOCCOCC1CC1 7a_100000037705_100000742324 [0,1,0,1,0,0|1,0,1]=4 16349 B11R1.99 C=CCOCCOCC1CO1 34a_100000037705_102125554688 [0,1,0,1,0,0|0,0,1]=3 16350 B11R1.99 C=CCOCCOCC1CO1 7a_100000037705_102125554688 [0,1,0,1,0,0|0,0,1]=3 16351 B11R1.99 C=CCOCCOCC1CS1 7a_100000037705_100000031435 [0,1,0,1,0,0|0,1,1]=4 16352 B11R1.99 C=CCOCCOC[C@@H]1CO1 7a_100000037705_100000745022 [0,1,0,1,0,0|0,0,1]=3 16353 B11R1.99 C=COCCOCCC1CC1 34a_100000033082_100000694398 [0,1,0,1,0,0|1,0,1]=4 16354 B11R1.99 C=COCCOCCC1CC1 34a_100000754188_100000039644 [0,1,0,1,0,0|1,0,1]=4 16355 B11R1.99 C=COCCOCCC1CC1 7a_100000754188_100000039644 [0,1,0,1,0,0|1,0,1]=4 16356 B11R1.99 C=COCCOCCC1CO1 34a_100000033082_100000732470 [0,1,0,1,0,0|0,0,2]=4 16357 B11R1.99 C=COCCOCC[C@@H]1CO1 34a_100009820653_100000039644 [0,1,0,1,0,0|0,0,2]=4 16358 B11R1.99 CC#CCCOCCC1CC1 34a_100000750427_100000694398 [0,1,0,1,0,0|2,0,0]=4 16359 B11R1.99 CC#CCCOCCC1CO1 34a_100000750427_100000732470 [0,1,0,1,0,0|1,0,1]=4 16360 B11R1.99 CC/C=C\CCOCC1CC1 34a_100000211283_100015370543 [0,1,0,1,0,0|2,0,0]=4 16361 B11R1.99 CC/C=C\CCOCC1CC1 34a_100016288707_100000742324 [0,1,0,1,0,0|2,0,0]=4 16362 B11R1.99 CC/C=C\CCOCC1CC1 7a_100016288707_100000742324 [0,1,0,1,0,0|2,0,0]=4 16363 B11R1.99 CC/C=C\CCOCC1CO1 34a_100016288707_102125554688 [0,1,0,1,0,0|1,0,0]=3 16364 B11R1.99 CC/C=C\CCOCC1CO1 7a_100016288707_102125554688 [0,1,0,1,0,0|1,0,0]=3 16365 B11R1.99 CC/C=C\CCOCC1CS1 7a_100016288707_100000031435 [0,1,0,1,0,0|1,1,0]=4 16366 B11R1.99 CC/C=C\CCOC[C@@H]1CO1 34a_100000757423_100015370543 [0,1,0,1,0,0|1,0,0]=3 16367 B11R1.99 CC/C=C\CCOC[C@@H]1CO1 7a_100016288707_100000745022 [0,1,0,1,0,0|1,0,0]=3 16368 B11R1.99 CC/C=C\CCSCC1CO1 62a_100015370543_102125554688 [0,1,0,1,0,0|1,1,0]=4 16369 B11R1.99 CC/C=C\CCSCC1CO1 62a_102125554688_100015370543 [0,1,0,1,0,0|1,1,0]=4 16370 B11R1.99 CC/C=C\CCSC[C@@H]1CO1 62a_100000745022_100015370543 [0,1,0,1,0,0|1,1,0]=4 16371 B11R1.99 CC/C=C\CCSC[C@@H]1CO1 62a_100015370543_100000745022 [0,1,0,1,0,0|1,1,0]=4 16372 B11R1.99 CC/C=C\COCCC1CO1 34a_100016268518_100000732470 [0,1,0,1,0,0|1,0,1]=4 16373 B11R1.99 CC/C=C\COCC[C@@H]1CO1 34a_100009820653_100103147603 [0,1,0,1,0,0|1,0,1]=4 16374 B11R1.99 CC=C=CCCOCC1CO1 34a_100011020354_102125554688 [0,1,0,1,0,0|1,0,1]=4 16375 B11R1.99 CC=CCCCOCC1CO1 34a_100020645299_102125554688 [0,1,0,1,0,0|1,0,1]=4 16376 B11R1.99 CCC#CCCOCC1CC1 34a_100000036655_100000742324 [0,1,0,1,0,0|2,0,0]=4 16377 B11R1.99 CCC#CCCOCC1CC1 7a_100000036655_100000742324 [0,1,0,1,0,0|2,0,0]=4 16378 B11R1.99 CCC#CCCOCC1CO1 34a_100000036655_102125554688 [0,1,0,1,0,0|1,0,0]=3 16379 B11R1.99 CCC#CCCOCC1CO1 7a_100000036655_102125554688 [0,1,0,1,0,0|1,0,0]=3 16380 B11R1.99 CCC#CCCOCC1CS1 7a_100000036655_100000031435 [0,1,0,1,0,0|1,1,0]=4 16381 B11R1.99 CCC#CCCOC[C@@H]1CO1 7a_100000036655_100000745022 [0,1,0,1,0,0|1,0,0]=3 16382 B11R1.99 CCC#CCOCCC1CO1 34a_100000032950_100000732470 [0,1,0,1,0,0|1,0,1]=4 16383 B11R1.99 CCC#CCOCC[C@@H]1CO1 34a_100009820653_100009813939 [0,1,0,1,0,0|1,0,1]=4 16384 B11R1.99 CCC/C=C/COCC1CO1 34a_100016278788_102125554688 [0,1,0,1,0,0|1,0,1]=4 16385 B11R1.99 CCC/C=C/COCC1CO1 7a_100016278788_102125554688 [0,1,0,1,0,0|1,0,1]=4 16386 B11R1.99 CCC/C=C/COC[C@@H]1CO1 7a_100016278788_100000745022 [0,1,0,1,0,0|1,0,1]=4 16387 B11R1.99 CCCC#CCOCC1CO1 34a_100000034806_102125554688 [0,1,0,1,0,0|1,0,1]=4 16388 B11R1.99 CCCC#CCOCC1CO1 7a_100000034806_102125554688 [0,1,0,1,0,0|1,0,1]=4 16389 B11R1.99 CCCC#CCOC[C@@H]1CO1 7a_100000034806_100000745022 [0,1,0,1,0,0|1,0,1]=4 16390 B11R1.99 CCCCCCCOC1CC1 34a_100000210272_100000211595 [0,1,0,1,0,0|2,0,0]=4 16391 B11R1.99 CCCCCCNCC1CO1 2230a_100000210581_100011216344 [0,1,0,1,0,0|2,0,0]=4 16392 B11R1.99 CCCCCCOCC1CC1 34a_100000210259_100000742324 [0,1,0,1,0,0|2,0,0]=4 16393 B11R1.99 CCCCCCOCC1CC1 34a_100000211283_100000210314 [0,1,0,1,0,0|2,0,0]=4 16394 B11R1.99 CCCCCCOCC1CC1 7a_100000210259_100000742324 [0,1,0,1,0,0|2,0,0]=4 16395 B11R1.99 CCCCCCOCC1CO1 34a_100000210259_102125554688 [0,1,0,1,0,0|1,0,0]=3 16396 B11R1.99 CCCCCCOCC1CO1 7a_100000210259_102125554688 [0,1,0,1,0,0|1,0,0]=3 16397 B11R1.99 CCCCCCOCC1CS1 7a_100000210259_100000031435 [0,1,0,1,0,0|1,1,0]=4 16398 B11R1.99 CCCCCCOC[C@@H]1CO1 34a_100000757423_100000210314 [0,1,0,1,0,0|1,0,0]=3 16399 B11R1.99 CCCCCCOC[C@@H]1CO1 7a_100000210259_100000745022 [0,1,0,1,0,0|1,0,0]=3 16400 B11R1.99 CCCCCCSCC1CO1 62a_100000210314_102125554688 [0,1,0,1,0,0|1,1,0]=4 16401 B11R1.99 CCCCCCSCC1CO1 62a_102125554688_100000210757 [0,1,0,1,0,0|1,1,0]=4 16402 B11R1.99 CCCCCCSC[C@@H]1CO1 62a_100000210314_100000745022 [0,1,0,1,0,0|1,1,0]=4 16403 B11R1.99 CCCCCCSC[C@@H]1CO1 62a_100000745022_100000210757 [0,1,0,1,0,0|1,1,0]=4 16404 B11R1.99 CCCCCNCCC1CO1 2230a_100000209983_100000732470 [0,1,0,1,0,0|2,0,0]=4 16405 B11R1.99 CCCCCOCCC1CC1 34a_100000210253_100000694398 [0,1,0,1,0,0|2,0,0]=4 16406 B11R1.99 CCCCCOCCC1CC1 34a_100000754188_100000718602 [0,1,0,1,0,0|2,0,0]=4 16407 B11R1.99 CCCCCOCCC1CC1 7a_100000210253_100000764125 [0,1,0,1,0,0|2,0,0]=4 16408 B11R1.99 CCCCCOCCC1CC1 7a_100000754188_100000210326 [0,1,0,1,0,0|2,0,0]=4 16409 B11R1.99 CCCCCOCCC1CO1 34a_100000210253_100000732470 [0,1,0,1,0,0|1,0,0]=3 16410 B11R1.99 CCCCCOCCC1CO1 7a_100000210253_100000732470 [0,1,0,1,0,0|1,0,0]=3 16411 B11R1.99 CCCCCOCC[C@@H]1CO1 34a_100009820653_100000718602 [0,1,0,1,0,0|1,0,0]=3 16412 B11R1.99 CCCCCSCCC1CO1 62a_100000210326_100000732470 [0,1,0,1,0,0|1,1,0]=4 16413 B11R1.99 CCCCCSCCC1CO1 62a_100000732470_100000210326 [0,1,0,1,0,0|1,1,0]=4 16414 B11R1.99 CCCCNCCCC1CO1 2230a_100000102301_100000733510 [0,1,0,1,0,0|2,0,0]=4 16415 B11R1.99 CCCCNCCCC1CO1 7a_106832991798_100000733510 [0,1,0,1,0,0|2,0,0]=4 16416 B11R1.99 CCCCOCCCC1CO1 34a_100000210227_100000733510 [0,1,0,1,0,0|2,0,0]=4 16417 B11R1.99 CCCCOCCCC1CO1 7a_100000210227_100000733510 [0,1,0,1,0,0|2,0,0]=4 16418 B11R1.99 CCCCOCCNC1CC1 34a_100000212008_100000743108 [0,1,0,1,0,0|2,0,0]=4 16419 B11R1.99 CCCCOCCNC1CC1 34a_100000738766_100000210210 [0,1,0,1,0,0|2,0,0]=4 16420 B11R1.99 CCCCOCCOC1CC1 34a_100000210238_100000211595 [0,1,0,1,0,0|1,0,0]=3 16421 B11R1.99 CCCCOCCSC1CC1 62a_100000743108_100000211595 [0,1,0,1,0,0|1,1,0]=4 16422 B11R1.99 CCCCOCNCC1CC1 2230a_100000735609_100011995733 [0,1,0,1,0,0|2,0,0]=4 16423 B11R1.99 CCCCOCNCC1CC1 34a_100000735609_100011995733 [0,1,0,1,0,0|2,0,0]=4 16424 B11R1.99 CCCCOCOCC1CC1 34a_100000211283_100011995733 [0,1,0,1,0,0|2,0,0]=4 16425 B11R1.99 CCCCOCOC[C@@H]1CO1 34a_100000757423_100011995733 [0,1,0,1,0,0|1,0,0]=3 16426 B11R1.99 CCCCOCSCC1CC1 62a_100000756562_100011995733 [0,1,0,1,0,0|2,0,0]=4 16427 B11R1.99 CCCCOCSCC1CC1 62a_100011995733_100000742324 [0,1,0,1,0,0|2,0,0]=4 16428 B11R1.99 CCCCOCSCC1CO1 62a_100011995733_102125554688 [0,1,0,1,0,0|1,1,0]=4 16429 B11R1.99 CCCCOCSCC1CO1 62a_102125554688_100011995733 [0,1,0,1,0,0|1,1,0]=4 16430 B11R1.99 CCCCOCSC[C@@H]1CO1 62a_100000745022_100011995733 [0,1,0,1,0,0|1,1,0]=4 16431 B11R1.99 CCCCOCSC[C@@H]1CO1 62a_100011995733_100000745022 [0,1,0,1,0,0|1,1,0]=4 16432 B11R1.99 CCCCSCCCC1CO1 62a_100000210211_100000733510 [0,1,0,1,0,0|2,0,0]=4 16433 B11R1.99 CCCCSCCCC1CO1 62a_100000733510_100000210210 [0,1,0,1,0,0|2,0,0]=4 16434 B11R1.99 CCCCSCCOC1CC1 34a_200000230436_100000211595 [0,1,0,1,0,0|1,1,0]=4 16435 B11R1.99 CCCOCCNCC1CC1 2230a_100000735609_100011215938 [0,1,0,1,0,0|2,0,0]=4 16436 B11R1.99 CCCOCCNCC1CC1 2230a_100161115042_100000742324 [0,1,0,1,0,0|2,0,0]=4 16437 B11R1.99 CCCOCCNCC1CC1 269862a_100161115042_100000741477 [0,1,0,1,0,0|2,0,0]=4 16438 B11R1.99 CCCOCCNCC1CC1 34a_100000735609_100011215938 [0,1,0,1,0,0|2,0,0]=4 16439 B11R1.99 CCCOCCNCC1CC1 34a_100161115042_100000742324 [0,1,0,1,0,0|2,0,0]=4 16440 B11R1.99 CCCOCCNCC1CO1 2230a_100161115042_100011216344 [0,1,0,1,0,0|1,0,0]=3 16441 B11R1.99 CCCOCCNCC1CO1 34a_100161115042_102125554688 [0,1,0,1,0,0|1,0,0]=3 16442 B11R1.99 CCCOCCOCC1CC1 34a_100000211283_100011215938 [0,1,0,1,0,0|1,0,0]=3 16443 B11R1.99 CCCOCCOCC1CC1 34a_100000752267_100000742324 [0,1,0,1,0,0|1,0,0]=3 16444 B11R1.99 CCCOCCOCC1CC1 7a_100000752267_100000742324 [0,1,0,1,0,0|1,0,0]=3 16445 B11R1.99 CCCOCCOCC1CO1 34a_100000752267_102125554688 [0,1,0,1,0,0|0,0,0]=2 16446 B11R1.99 CCCOCCOCC1CO1 7a_100000752267_102125554688 [0,1,0,1,0,0|0,0,0]=2 16447 B11R1.99 CCCOCCOCC1CS1 7a_100000752267_100000031435 [0,1,0,1,0,0|0,1,0]=3 16448 B11R1.99 CCCOCCOC[C@@H]1CO1 34a_100000757423_100011215938 [0,1,0,1,0,0|0,0,0]=2 16449 B11R1.99 CCCOCCOC[C@@H]1CO1 7a_100000752267_100000745022 [0,1,0,1,0,0|0,0,0]=2 16450 B11R1.99 CCCOCCSCC1CC1 62a_100000756562_100011215938 [0,1,0,1,0,0|1,1,0]=4 16451 B11R1.99 CCCOCCSCC1CC1 62a_100011215938_100000742324 [0,1,0,1,0,0|1,1,0]=4 16452 B11R1.99 CCCOCCSCC1CO1 62a_100011215938_102125554688 [0,1,0,1,0,0|0,1,0]=3 16453 B11R1.99 CCCOCCSCC1CO1 62a_102125554688_100011215938 [0,1,0,1,0,0|0,1,0]=3 16454 B11R1.99 CCCOCCSCC1CS1 62a_100000031435_100011215938 [0,1,0,1,0,0|0,2,0]=4 16455 B11R1.99 CCCOCCSCC1CS1 62a_100011215938_100000031435 [0,1,0,1,0,0|0,2,0]=4 16456 B11R1.99 CCCOCCSC[C@@H]1CO1 62a_100000745022_100011215938 [0,1,0,1,0,0|0,1,0]=3 16457 B11R1.99 CCCOCCSC[C@@H]1CO1 62a_100011215938_100000745022 [0,1,0,1,0,0|0,1,0]=3 16458 B11R1.99 CCCSCCNCC1CO1 2230a_100020603323_100011216344 [0,1,0,1,0,0|1,1,0]=4 16459 B11R1.99 CCCSCCOCC1CC1 34a_200000230433_100000742324 [0,1,0,1,0,0|1,1,0]=4 16460 B11R1.99 CCCSCCOCC1CC1 7a_200000230433_100000742324 [0,1,0,1,0,0|1,1,0]=4 16461 B11R1.99 CCCSCCOCC1CO1 34a_200000230433_102125554688 [0,1,0,1,0,0|0,1,0]=3 16462 B11R1.99 CCCSCCOCC1CO1 7a_200000230433_102125554688 [0,1,0,1,0,0|0,1,0]=3 16463 B11R1.99 CCCSCCOCC1CS1 7a_200000230433_100000031435 [0,1,0,1,0,0|0,2,0]=4 16464 B11R1.99 CCCSCCOC[C@@H]1CO1 7a_200000230433_100000745022 [0,1,0,1,0,0|0,1,0]=3 16465 B11R1.99 CCOCCCNCC1CC1 2230a_100000210961_100000742324 [0,1,0,1,0,0|2,0,0]=4 16466 B11R1.99 CCOCCCNCC1CC1 2230a_100000735609_100012232248 [0,1,0,1,0,0|2,0,0]=4 16467 B11R1.99 CCOCCCNCC1CC1 269862a_100000210961_100000741477 [0,1,0,1,0,0|2,0,0]=4 16468 B11R1.99 CCOCCCNCC1CC1 34a_100000210961_100000742324 [0,1,0,1,0,0|2,0,0]=4 16469 B11R1.99 CCOCCCNCC1CC1 34a_100000735609_100012232248 [0,1,0,1,0,0|2,0,0]=4 16470 B11R1.99 CCOCCCNCC1CO1 2230a_100000210961_100011216344 [0,1,0,1,0,0|1,0,0]=3 16471 B11R1.99 CCOCCCNCC1CO1 34a_100000210961_102125554688 [0,1,0,1,0,0|1,0,0]=3 16472 B11R1.99 CCOCCCOCC1CC1 34a_100000211283_100012232248 [0,1,0,1,0,0|1,0,0]=3 16473 B11R1.99 CCOCCCOCC1CC1 34a_100000757476_100000742324 [0,1,0,1,0,0|1,0,0]=3 16474 B11R1.99 CCOCCCOCC1CC1 7a_100000757476_100000742324 [0,1,0,1,0,0|1,0,0]=3 16475 B11R1.99 CCOCCCOCC1CO1 34a_100000757476_102125554688 [0,1,0,1,0,0|0,0,0]=2 16476 B11R1.99 CCOCCCOCC1CO1 7a_100000757476_102125554688 [0,1,0,1,0,0|0,0,0]=2 16477 B11R1.99 CCOCCCOCC1CS1 7a_100000757476_100000031435 [0,1,0,1,0,0|0,1,0]=3 16478 B11R1.99 CCOCCCOC[C@@H]1CO1 34a_100000757423_100012232248 [0,1,0,1,0,0|0,0,0]=2 16479 B11R1.99 CCOCCCOC[C@@H]1CO1 7a_100000757476_100000745022 [0,1,0,1,0,0|0,0,0]=2 16480 B11R1.99 CCOCCCSCC1CC1 62a_100000756562_100012232248 [0,1,0,1,0,0|1,1,0]=4 16481 B11R1.99 CCOCCCSCC1CC1 62a_100012232248_100000742324 [0,1,0,1,0,0|1,1,0]=4 16482 B11R1.99 CCOCCCSCC1CO1 62a_100012232248_102125554688 [0,1,0,1,0,0|0,1,0]=3 16483 B11R1.99 CCOCCCSCC1CO1 62a_102125554688_100012232248 [0,1,0,1,0,0|0,1,0]=3 16484 B11R1.99 CCOCCCSCC1CS1 62a_100000031435_100012232248 [0,1,0,1,0,0|0,2,0]=4 16485 B11R1.99 CCOCCCSCC1CS1 62a_100012232248_100000031435 [0,1,0,1,0,0|0,2,0]=4 16486 B11R1.99 CCOCCCSC[C@@H]1CO1 62a_100000745022_100012232248 [0,1,0,1,0,0|0,1,0]=3 16487 B11R1.99 CCOCCCSC[C@@H]1CO1 62a_100012232248_100000745022 [0,1,0,1,0,0|0,1,0]=3 16488 B11R1.99 CCOCCNCCC1CC1 2230a_102516460346_100000694398 [0,1,0,1,0,0|2,0,0]=4 16489 B11R1.99 CCOCCNCCC1CC1 34a_100000764129_100000210147 [0,1,0,1,0,0|2,0,0]=4 16490 B11R1.99 CCOCCNCCC1CC1 34a_102516460346_100000694398 [0,1,0,1,0,0|2,0,0]=4 16491 B11R1.99 CCOCCNCCC1CO1 2230a_102516460346_100000732470 [0,1,0,1,0,0|1,0,0]=3 16492 B11R1.99 CCOCCNCCC1CO1 34a_102516460346_100000732470 [0,1,0,1,0,0|1,0,0]=3 16493 B11R1.99 CCOCCOCCC1CC1 34a_100000210136_100000694398 [0,1,0,1,0,0|1,0,0]=3 16494 B11R1.99 CCOCCOCCC1CC1 34a_100000754188_100000210147 [0,1,0,1,0,0|1,0,0]=3 16495 B11R1.99 CCOCCOCCC1CC1 7a_100000210136_100000764125 [0,1,0,1,0,0|1,0,0]=3 16496 B11R1.99 CCOCCOCCC1CC1 7a_100000754188_100011215890 [0,1,0,1,0,0|1,0,0]=3 16497 B11R1.99 CCOCCOCCC1CO1 34a_100000210136_100000732470 [0,1,0,1,0,0|0,0,0]=2 16498 B11R1.99 CCOCCOCCC1CO1 7a_100000210136_100000732470 [0,1,0,1,0,0|0,0,0]=2 16499 B11R1.99 CCOCCOCC[C@@H]1CO1 34a_100009820653_100000210147 [0,1,0,1,0,0|0,0,0]=2 16500 B11R1.99 CCOCCSCCC1CC1 62a_100000210147_100000764125 [0,1,0,1,0,0|1,1,0]=4 16501 B11R1.99 CCOCCSCCC1CC1 62a_100000764125_100011215890 [0,1,0,1,0,0|1,1,0]=4 16502 B11R1.99 CCOCCSCCC1CO1 62a_100000210147_100000732470 [0,1,0,1,0,0|0,1,0]=3 16503 B11R1.99 CCOCCSCCC1CO1 62a_100000732470_100011215890 [0,1,0,1,0,0|0,1,0]=3 16504 B11R1.99 CCOCSCCCC1CO1 62a_100000733510_100000739092 [0,1,0,1,0,0|1,0,0]=3 16505 B11R1.99 CCOCSCCCC1CO1 62a_100000739092_100000733510 [0,1,0,1,0,0|1,0,0]=3 16506 B11R1.99 CCSCCCOCC1CC1 34a_100011216438_100000742324 [0,1,0,1,0,0|1,1,0]=4 16507 B11R1.99 CCSCCCOCC1CC1 7a_100011216438_100000742324 [0,1,0,1,0,0|1,1,0]=4 16508 B11R1.99 CCSCCCOCC1CO1 34a_100011216438_102125554688 [0,1,0,1,0,0|0,1,0]=3 16509 B11R1.99 CCSCCCOCC1CO1 7a_100011216438_102125554688 [0,1,0,1,0,0|0,1,0]=3 16510 B11R1.99 CCSCCCOCC1CS1 7a_100011216438_100000031435 [0,1,0,1,0,0|0,2,0]=4 16511 B11R1.99 CCSCCCOC[C@@H]1CO1 7a_100011216438_100000745022 [0,1,0,1,0,0|0,1,0]=3 16512 B11R1.99 CCSCCNCCC1CO1 2230a_100000106463_100000732470 [0,1,0,1,0,0|1,1,0]=4 16513 B11R1.99 CCSCCOCCC1CC1 34a_100000212035_100000694398 [0,1,0,1,0,0|1,1,0]=4 16514 B11R1.99 CCSCCOCCC1CC1 34a_100000754188_100000757381 [0,1,0,1,0,0|1,1,0]=4 16515 B11R1.99 CCSCCOCCC1CC1 7a_100000212035_100000764125 [0,1,0,1,0,0|1,1,0]=4 16516 B11R1.99 CCSCCOCCC1CC1 7a_100000754188_100000757381 [0,1,0,1,0,0|1,1,0]=4 16517 B11R1.99 CCSCCOCCC1CO1 34a_100000212035_100000732470 [0,1,0,1,0,0|0,1,0]=3 16518 B11R1.99 CCSCCOCCC1CO1 7a_100000212035_100000732470 [0,1,0,1,0,0|0,1,0]=3 16519 B11R1.99 CCSCCOCC[C@@H]1CO1 34a_100009820653_100000757381 [0,1,0,1,0,0|0,1,0]=3 16520 B11R1.99 CCSCCSCCC1CO1 62a_100000732470_100000757381 [0,1,0,1,0,0|0,2,0]=4 16521 B11R1.99 CCSCCSCCC1CO1 62a_100000757381_100000732470 [0,1,0,1,0,0|0,2,0]=4 16522 B11R1.99 CNCCCCCOC1CC1 34a_100000722520_100000211595 [0,1,0,1,0,0|2,0,0]=4 16523 B11R1.99 CNCCCOCCC1CC1 34a_100000213112_100000694398 [0,1,0,1,0,0|2,0,0]=4 16524 B11R1.99 CNCCCOCCC1CO1 34a_100000213112_100000732470 [0,1,0,1,0,0|2,0,0]=4 16525 B11R1.99 CNCCOCCOC1CC1 34a_100000228057_100000211595 [0,1,0,1,0,0|1,0,0]=3 16526 B11R1.99 COCCCCCNC1CC1 34a_100000747528_100000211595 [0,1,0,1,0,0|2,0,0]=4 16527 B11R1.99 COCCCCNCC1CC1 2230a_100000735609_100000730899 [0,1,0,1,0,0|2,0,0]=4 16528 B11R1.99 COCCCCNCC1CC1 34a_100000735609_100000755781 [0,1,0,1,0,0|2,0,0]=4 16529 B11R1.99 COCCCCOCC1CC1 34a_100000211283_100000755781 [0,1,0,1,0,0|2,0,0]=4 16530 B11R1.99 COCCCCOCC1CC1 34a_100000740925_100000742324 [0,1,0,1,0,0|2,0,0]=4 16531 B11R1.99 COCCCCOCC1CO1 34a_100000740925_102125554688 [0,1,0,1,0,0|1,0,0]=3 16532 B11R1.99 COCCCCOCC1CO1 34a_100010889290_200000210301 [0,1,0,1,0,0|1,0,0]=3 16533 B11R1.99 COCCCCOCC1CO1 7a_100010889290_200000210301 [0,1,0,1,0,0|1,0,0]=3 16534 B11R1.99 COCCCCOC[C@@H]1CO1 34a_100000757423_100000755781 [0,1,0,1,0,0|1,0,0]=3 16535 B11R1.99 COCCCCSCC1CC1 62a_100000730899_100000742324 [0,1,0,1,0,0|2,0,0]=4 16536 B11R1.99 COCCCCSCC1CC1 62a_100000756562_100000730899 [0,1,0,1,0,0|2,0,0]=4 16537 B11R1.99 COCCCCSCC1CO1 62a_100000730899_102125554688 [0,1,0,1,0,0|1,1,0]=4 16538 B11R1.99 COCCCCSCC1CO1 62a_102125554688_100000730899 [0,1,0,1,0,0|1,1,0]=4 16539 B11R1.99 COCCCCSC[C@@H]1CO1 62a_100000730899_100000745022 [0,1,0,1,0,0|1,1,0]=4 16540 B11R1.99 COCCCCSC[C@@H]1CO1 62a_100000745022_100000730899 [0,1,0,1,0,0|1,1,0]=4 16541 B11R1.99 COCCCNCCC1CC1 34a_100000764129_100000740836 [0,1,0,1,0,0|2,0,0]=4 16542 B11R1.99 COCCCNCCC1CC1 34a_100150723488_100000694398 [0,1,0,1,0,0|2,0,0]=4 16543 B11R1.99 COCCCOCCC1CC1 34a_100000740835_100000694398 [0,1,0,1,0,0|1,0,0]=3 16544 B11R1.99 COCCCOCCC1CC1 34a_100000754188_100000740836 [0,1,0,1,0,0|1,0,0]=3 16545 B11R1.99 COCCCOCCC1CC1 7a_100000754188_100000740836 [0,1,0,1,0,0|1,0,0]=3 16546 B11R1.99 COCCCOCCC1CO1 34a_100000740835_100000732470 [0,1,0,1,0,0|2,0,0]=4 16547 B11R1.99 COCCCOCC[C@@H]1CO1 34a_100009820653_100000740836 [0,1,0,1,0,0|2,0,0]=4 16548 B11R1.99 COCCCSCCC1CC1 62a_100000709357_100000764125 [0,1,0,1,0,0|1,1,0]=4 16549 B11R1.99 COCCCSCCC1CC1 62a_100000764125_100000709357 [0,1,0,1,0,0|1,1,0]=4 16550 B11R1.99 COCCNCCCC1CO1 2230a_100000209980_100000733510 [0,1,0,1,0,0|2,0,0]=4 16551 B11R1.99 COCCOCC#CC1CC1 34a_100000083941_100011201679 [0,1,0,1,0,0|1,0,1]=4 16552 B11R1.99 COCCOCC#CC1CC1 34a_100000210237_100009895102 [0,1,0,1,0,0|1,0,1]=4 16553 B11R1.99 COCCOCC#CC1CC1 7a_100000083941_100000233755 [0,1,0,1,0,0|1,0,1]=4 16554 B11R1.99 COCCOCCCC1CO1 34a_100000210237_100000733510 [0,1,0,1,0,0|1,0,0]=3 16555 B11R1.99 COCCOCCNC1CC1 34a_100000212008_100000695917 [0,1,0,1,0,0|1,0,0]=3 16556 B11R1.99 COCCOCCNC1CC1 34a_100000738766_100011201679 [0,1,0,1,0,0|1,0,0]=3 16557 B11R1.99 COCCOCCNC1CC1 34a_100000745349_100000211595 [0,1,0,1,0,0|1,0,0]=3 16558 B11R1.99 COCCOCCOC1CC1 34a_100011215163_100000211595 [0,1,0,1,0,0|0,0,0]=2 16559 B11R1.99 COCCOCCSC1CC1 62a_100000695917_100000211595 [0,1,0,1,0,0|0,1,0]=3 16560 B11R1.99 COCCOCNCC1CC1 2230a_100000735609_100000231047 [0,1,0,1,0,0|1,0,0]=3 16561 B11R1.99 COCCOCSCC1CC1 62a_100000231047_100000742324 [0,1,0,1,0,0|1,0,0]=3 16562 B11R1.99 COCCOCSCC1CC1 62a_100000756562_100000231047 [0,1,0,1,0,0|1,0,0]=3 16563 B11R1.99 COCCOCSCC1CO1 62a_100000231047_102125554688 [0,1,0,1,0,0|2,0,0]=4 16564 B11R1.99 COCCOCSCC1CO1 62a_102125554688_100000231047 [0,1,0,1,0,0|2,0,0]=4 16565 B11R1.99 COCCOCSCC1CS1 62a_100000031435_100000231047 [0,1,0,1,0,0|2,0,0]=4 16566 B11R1.99 COCCOCSCC1CS1 62a_100000231047_100000031435 [0,1,0,1,0,0|2,0,0]=4 16567 B11R1.99 COCCOCSC[C@@H]1CO1 62a_100000231047_100000745022 [0,1,0,1,0,0|2,0,0]=4 16568 B11R1.99 COCCOCSC[C@@H]1CO1 62a_100000745022_100000231047 [0,1,0,1,0,0|2,0,0]=4 16569 B11R1.99 COCCSCCCC1CO1 62a_100000233755_100000733510 [0,1,0,1,0,0|1,1,0]=4 16570 B11R1.99 COCCSCCCC1CO1 62a_100000733510_100000233755 [0,1,0,1,0,0|1,1,0]=4 16571 B11R1.99 CSCCCCOCC1CC1 34a_100011217163_100000742324 [0,1,0,1,0,0|2,0,0]=4 16572 B11R1.99 CSCCCCOCC1CC1 7a_100011217163_100000742324 [0,1,0,1,0,0|2,0,0]=4 16573 B11R1.99 CSCCCCOCC1CO1 34a_100011217163_102125554688 [0,1,0,1,0,0|1,0,0]=3 16574 B11R1.99 CSCCCCOCC1CO1 7a_100011217163_102125554688 [0,1,0,1,0,0|1,0,0]=3 16575 B11R1.99 CSCCCCOCC1CS1 7a_100011217163_100000031435 [0,1,0,1,0,0|1,1,0]=4 16576 B11R1.99 CSCCCCOC[C@@H]1CO1 7a_100011217163_100000745022 [0,1,0,1,0,0|1,0,0]=3 16577 B11R1.99 CSCCCOCCC1CC1 34a_100000690336_100000694398 [0,1,0,1,0,0|1,1,0]=4 16578 B11R1.99 CSCCCOCCC1CC1 7a_100000690336_100000764125 [0,1,0,1,0,0|1,1,0]=4 16579 B11R1.99 CSCCCOCCC1CO1 34a_100000690336_100000732470 [0,1,0,1,0,0|2,0,0]=4 16580 B11R1.99 CSCCCOCCC1CO1 7a_100000690336_100000732470 [0,1,0,1,0,0|2,0,0]=4 16581 B11R1.99 CSCCOCCCC1CO1 34a_100000230434_100000733510 [0,1,0,1,0,0|1,1,0]=4 16582 B11R1.99 CSCCOCCCC1CO1 7a_100000230434_100000733510 [0,1,0,1,0,0|1,1,0]=4 16583 B11R1.99 CSCCOCCNC1CC1 34a_100000738766_100000212216 [0,1,0,1,0,0|1,1,0]=4 16584 B11R1.99 ClCCCCCOCC1CC1 34a_100000746330_100000742324 [0,1,0,1,0,0|2,0,0]=4 16585 B11R1.99 ClCCCCCOCC1CC1 7a_100000746330_100000742324 [0,1,0,1,0,0|2,0,0]=4 16586 B11R1.99 ClCCCCCOCC1CO1 34a_100000746330_102125554688 [0,1,0,1,0,0|1,0,0]=3 16587 B11R1.99 ClCCCCCOCC1CO1 7a_100000746330_102125554688 [0,1,0,1,0,0|1,0,0]=3 16588 B11R1.99 ClCCCCCOCC1CS1 7a_100000746330_100000031435 [0,1,0,1,0,0|1,1,0]=4 16589 B11R1.99 ClCCCCCOC[C@@H]1CO1 7a_100000746330_100000745022 [0,1,0,1,0,0|1,0,0]=3 16590 B11R1.99 ClCCCCOCCC1CC1 34a_100000210776_100000694398 [0,1,0,1,0,0|2,0,0]=4 16591 B11R1.99 ClCCCCOCCC1CC1 7a_100000210776_100000764125 [0,1,0,1,0,0|2,0,0]=4 16592 B11R1.99 ClCCCCOCCC1CO1 34a_100000210776_100000732470 [0,1,0,1,0,0|2,0,0]=4 16593 B11R1.99 ClCCCCOCCC1CO1 7a_100000210776_100000732470 [0,1,0,1,0,0|2,0,0]=4 16594 B11R1.99 ClCCOCCOCC1CC1 34a_100011215305_100000742324 [0,1,0,1,0,0|1,0,0]=3 16595 B11R1.99 ClCCOCCOCC1CC1 7a_100011215305_100000742324 [0,1,0,1,0,0|1,0,0]=3 16596 B11R1.99 ClCCOCCOCC1CO1 34a_100011215305_102125554688 [0,1,0,1,0,0|0,0,0]=2 16597 B11R1.99 ClCCOCCOCC1CO1 7a_100011215305_102125554688 [0,1,0,1,0,0|0,0,0]=2 16598 B11R1.99 ClCCOCCOCC1CS1 7a_100011215305_100000031435 [0,1,0,1,0,0|0,1,0]=3 16599 B11R1.99 ClCCOCCOC[C@@H]1CO1 7a_100011215305_100000745022 [0,1,0,1,0,0|0,0,0]=2 16600 B11R1.99 FCCCCCOCC1CC1 34a_100000211283_100000729378 [0,1,0,1,0,0|2,0,0]=4 16601 B11R1.99 FCCCCCOC[C@@H]1CO1 34a_100000757423_100000729378 [0,1,0,1,0,0|1,0,0]=3 16602 B11R1.99 FCCCCCSCC1CO1 62a_100000729378_102125554688 [0,1,0,1,0,0|1,1,0]=4 16603 B11R1.99 FCCCCCSCC1CO1 62a_102125554688_100000729378 [0,1,0,1,0,0|1,1,0]=4 16604 B11R1.99 FCCCCCSC[C@@H]1CO1 62a_100000729378_100000745022 [0,1,0,1,0,0|1,1,0]=4 16605 B11R1.99 FCCCCCSC[C@@H]1CO1 62a_100000745022_100000729378 [0,1,0,1,0,0|1,1,0]=4 16606 B11R1.99 FCCCCOCCC1CC1 34a_100000754188_100000729493 [0,1,0,1,0,0|2,0,0]=4 16607 B11R1.99 FCCCCOCCC1CC1 34a_100011995726_100000694398 [0,1,0,1,0,0|2,0,0]=4 16608 B11R1.99 FCCCCOCCC1CC1 7a_100000754188_100000729493 [0,1,0,1,0,0|2,0,0]=4 16609 B11R1.99 FCCCCOCCC1CC1 7a_100011995726_100000764125 [0,1,0,1,0,0|2,0,0]=4 16610 B11R1.99 FCCCCOCCC1CO1 34a_100011995726_100000732470 [0,1,0,1,0,0|2,0,0]=4 16611 B11R1.99 FCCCCOCCC1CO1 7a_100011995726_100000732470 [0,1,0,1,0,0|2,0,0]=4 16612 B11R1.99 FCCCCOCC[C@@H]1CO1 34a_100009820653_100000729493 [0,1,0,1,0,0|2,0,0]=4 16613 B11R1.99 FCCOCCOCC1CC1 34a_200015357709_100000742324 [0,1,0,1,0,0|1,0,0]=3 16614 B11R1.99 FCCOCCOCC1CC1 7a_200015357709_100000742324 [0,1,0,1,0,0|1,0,0]=3 16615 B11R1.99 FCCOCCOCC1CO1 34a_200015357709_102125554688 [0,1,0,1,0,0|0,0,0]=2 16616 B11R1.99 FCCOCCOCC1CO1 7a_200015357709_102125554688 [0,1,0,1,0,0|0,0,0]=2 16617 B11R1.99 FCCOCCOCC1CS1 7a_200015357709_100000031435 [0,1,0,1,0,0|0,1,0]=3 16618 B11R1.99 FCCOCCOC[C@@H]1CO1 7a_200015357709_100000745022 [0,1,0,1,0,0|0,0,0]=2 16619 B11R1.99 ICCCCCOCC1CC1 34a_200012148887_100000742324 [0,1,0,1,0,0|2,0,0]=4 16620 B11R1.99 ICCCCCOCC1CC1 7a_200012148887_100000742324 [0,1,0,1,0,0|2,0,0]=4 16621 B11R1.99 ICCCCCOCC1CO1 34a_200012148887_102125554688 [0,1,0,1,0,0|1,0,0]=3 16622 B11R1.99 ICCCCCOCC1CO1 7a_200012148887_102125554688 [0,1,0,1,0,0|1,0,0]=3 16623 B11R1.99 ICCCCCOCC1CS1 7a_200012148887_100000031435 [0,1,0,1,0,0|1,1,0]=4 16624 B11R1.99 ICCCCCOC[C@@H]1CO1 7a_200012148887_100000745022 [0,1,0,1,0,0|1,0,0]=3 16625 B11R1.99 ICCCCOCCC1CC1 34a_200012148704_100000694398 [0,1,0,1,0,0|2,0,0]=4 16626 B11R1.99 ICCCCOCCC1CO1 34a_200012148704_100000732470 [0,1,0,1,0,0|2,0,0]=4 16627 B11R1.99 ICCOCCOCC1CC1 34a_100012149058_100000742324 [0,1,0,1,0,0|1,0,0]=3 16628 B11R1.99 ICCOCCOCC1CC1 7a_100012149058_100000742324 [0,1,0,1,0,0|1,0,0]=3 16629 B11R1.99 ICCOCCOCC1CO1 34a_100012149058_102125554688 [0,1,0,1,0,0|0,0,0]=2 16630 B11R1.99 ICCOCCOCC1CO1 7a_100012149058_102125554688 [0,1,0,1,0,0|0,0,0]=2 16631 B11R1.99 ICCOCCOCC1CS1 7a_100012149058_100000031435 [0,1,0,1,0,0|0,1,0]=3 16632 B11R1.99 ICCOCCOC[C@@H]1CO1 7a_100012149058_100000745022 [0,1,0,1,0,0|0,0,0]=2 16633 B11R1.99 N#CCOCCSCC1CO1 62a_102125554688_200000047693 [0,1,0,1,0,0|0,1,1]=4 16634 B11R1.99 N#CCOCCSCC1CO1 62a_200000047693_102125554688 [0,1,0,1,0,0|0,1,1]=4 16635 B11R1.99 N#CCOCCSC[C@@H]1CO1 62a_100000745022_200000047693 [0,1,0,1,0,0|0,1,1]=4 16636 B11R1.99 N#CCOCCSC[C@@H]1CO1 62a_200000047693_100000745022 [0,1,0,1,0,0|0,1,1]=4 16637 B11R1.99 NCCCCCOCC1CC1 34a_100000762737_100000742324 [0,1,0,1,0,0|2,0,0]=4 16638 B11R1.99 NCCCCCOCC1CO1 34a_100000762737_102125554688 [0,1,0,1,0,0|1,0,0]=3 16639 B11R1.99 NCCCCOCCC1CC1 34a_100000750430_100000694398 [0,1,0,1,0,0|2,0,0]=4 16640 B11R1.99 NCCCCOCCC1CO1 34a_100000750430_100000732470 [0,1,0,1,0,0|2,0,0]=4 16641 B11R1.99 NCCOCCOCC1CC1 34a_100000211614_100000742324 [0,1,0,1,0,0|1,0,0]=3 16642 B11R1.99 NCCOCCOCC1CO1 34a_100000211614_102125554688 [0,1,0,1,0,0|0,0,0]=2 16643 B11R1.99 NOCCOCCCC1CO1 34a_100000700252_100000733510 [0,1,0,1,0,0|2,0,0]=4 16644 B11R1.99 OCCCCCNCC1CO1 2230a_100000762737_100011216344 [0,1,0,1,0,0|2,0,0]=4 16645 B11R1.99 OCCCCCNCC1CO1 34a_100000762737_102125554688 [0,1,0,1,0,0|2,0,0]=4 16646 B11R1.99 OCCCCCOCC1CC1 34a_100000211283_100000746330 [0,1,0,1,0,0|2,0,0]=4 16647 B11R1.99 OCCCCCOC[C@@H]1CO1 34a_100000757423_100000746330 [0,1,0,1,0,0|1,0,0]=3 16648 B11R1.99 OCCCCCSCC1CO1 62a_100000746330_102125554688 [0,1,0,1,0,0|1,1,0]=4 16649 B11R1.99 OCCCCCSCC1CO1 62a_102125554688_100000746330 [0,1,0,1,0,0|1,1,0]=4 16650 B11R1.99 OCCCCCSC[C@@H]1CO1 62a_100000745022_100000746330 [0,1,0,1,0,0|1,1,0]=4 16651 B11R1.99 OCCCCCSC[C@@H]1CO1 62a_100000746330_100000745022 [0,1,0,1,0,0|1,1,0]=4 16652 B11R1.99 OCCCCOCCC1CC1 34a_100000754188_100011216708 [0,1,0,1,0,0|2,0,0]=4 16653 B11R1.99 OCCCCOCCC1CC1 7a_100000754188_100000210776 [0,1,0,1,0,0|2,0,0]=4 16654 B11R1.99 OCCCCOCC[C@@H]1CO1 34a_100009820653_100011216708 [0,1,0,1,0,0|2,0,0]=4 16655 B11R1.99 OCCOCCNCC1CC1 2230a_100000211614_100000742324 [0,1,0,1,0,0|2,0,0]=4 16656 B11R1.99 OCCOCCNCC1CC1 2230a_100000735609_100011215305 [0,1,0,1,0,0|2,0,0]=4 16657 B11R1.99 OCCOCCNCC1CC1 269862a_100000211614_100000741477 [0,1,0,1,0,0|2,0,0]=4 16658 B11R1.99 OCCOCCNCC1CC1 34a_100000211614_100000742324 [0,1,0,1,0,0|2,0,0]=4 16659 B11R1.99 OCCOCCNCC1CC1 34a_100000735609_100000692535 [0,1,0,1,0,0|2,0,0]=4 16660 B11R1.99 OCCOCCNCC1CO1 2230a_100000211614_100011216344 [0,1,0,1,0,0|1,0,0]=3 16661 B11R1.99 OCCOCCNCC1CO1 34a_100000211614_102125554688 [0,1,0,1,0,0|1,0,0]=3 16662 B11R1.99 OCCOCCOCC1CC1 34a_100000211283_100000692535 [0,1,0,1,0,0|1,0,0]=3 16663 B11R1.99 OCCOCCOC[C@@H]1CO1 34a_100000757423_100000692535 [0,1,0,1,0,0|0,0,0]=2 16664 B11R1.99 OCCOCCSCC1CC1 62a_100000756562_100011215305 [0,1,0,1,0,0|1,1,0]=4 16665 B11R1.99 OCCOCCSCC1CC1 62a_100011215305_100000742324 [0,1,0,1,0,0|1,1,0]=4 16666 B11R1.99 OCCOCCSCC1CO1 62a_100011215305_102125554688 [0,1,0,1,0,0|0,1,0]=3 16667 B11R1.99 OCCOCCSCC1CO1 62a_102125554688_100011215305 [0,1,0,1,0,0|0,1,0]=3 16668 B11R1.99 OCCOCCSCC1CS1 62a_100000031435_100011215305 [0,1,0,1,0,0|0,2,0]=4 16669 B11R1.99 OCCOCCSCC1CS1 62a_100011215305_100000031435 [0,1,0,1,0,0|0,2,0]=4 16670 B11R1.99 OCCOCCSC[C@@H]1CO1 62a_100000745022_100011215305 [0,1,0,1,0,0|0,1,0]=3 16671 B11R1.99 OCCOCCSC[C@@H]1CO1 62a_100011215305_100000745022 [0,1,0,1,0,0|0,1,0]=3 16672 B11R1.99 OCCSCCNCC1CO1 2230a_100011219999_100011216344 [0,1,0,1,0,0|1,1,0]=4 16673 B11R1.99 [13CH3]OCCCCOCC1CO1 34a_100010889290_200025704644 [0,1,0,1,0,0|1,0,0]=3 16674 B11R1.99 [13CH3]OCCCCOCC1CO1 7a_100010889290_200025704644 [0,1,0,1,0,0|1,0,0]=3 16675 B11R1.102 C=C(C)CCOCC1CC1C 34a_100000744939_100000730704 [0,1,0,1,0,0|2,0,0]=4 16676 B11R1.102 C=C(C)CCOCC1CC1C 7a_100000744939_100000730704 [0,1,0,1,0,0|2,0,0]=4 16677 B11R1.102 CC(=O)CCOCC1CC1C 7a_100000744939_100000053229 [0,1,0,1,0,0|2,0,0]=4 16678 B11R1.102 CC(C)CCOCC1CC1C 34a_100000744939_100000210312 [0,1,0,1,0,0|2,0,0]=4 16679 B11R1.102 CC(C)CCOCC1CC1C 7a_100000744939_100000210626 [0,1,0,1,0,0|2,0,0]=4 16680 B11R1.102 CC(O)CCOCC1CC1C 34a_100000744939_100012276601 [0,1,0,1,0,0|2,0,0]=4 16681 B11R1.102 CC(O)CCOCC1CC1C 7a_100000744939_100012276601 [0,1,0,1,0,0|2,0,0]=4 16682 B11R1.102 CC1CC1COCCN(C)C 7a_100000744939_100000755713 [0,1,0,1,0,0|2,0,0]=4 16683 B11R1.161 CC(C)OCCN1CCC1C 269982a_100000755817_100000211751 [0,1,0,1,0,0|2,0,0]=4 16684 B11R1.161 CC(C)OCCN1CCC1C 34a_100000755817_100000211751 [0,1,0,1,0,0|2,0,0]=4 16685 B11R1.172 C=C(Br)CCOC1CCOC1 34a_100009813270_100000690089 [0,1,0,1,0,0|1,0,1]=4 16686 B11R1.172 C=C(C)CCN[C@@H]1CCOC1 2230a_200015188469_100000730704 [0,1,0,1,0,0|2,0,0]=4 16687 B11R1.172 C=C(C)CCN[C@H]1CCOC1 2230a_100015188467_100000730704 [0,1,0,1,0,0|2,0,0]=4 16688 B11R1.172 C=C(C)CCN[C@H]1CCOC1 34a_100015188467_100000730704 [0,1,0,1,0,0|2,0,0]=4 16689 B11R1.172 C=C(C)CCOC1CCCC1 34a_100000210269_100000730704 [0,1,0,1,0,0|2,0,0]=4 16690 B11R1.172 C=C(C)CCOC1CCCC1 34a_100000764851_100000179811 [0,1,0,1,0,0|2,0,0]=4 16691 B11R1.172 C=C(C)CCOC1CCCC1 7a_100000210269_100000730704 [0,1,0,1,0,0|2,0,0]=4 16692 B11R1.172 C=C(C)CCOC1CCOC1 34a_100000764851_100000690089 [0,1,0,1,0,0|1,0,0]=3 16693 B11R1.172 C=C(C)CCOC1CCSC1 7a_100011232664_100000730704 [0,1,0,1,0,0|1,1,0]=4 16694 B11R1.172 C=C(C)CCO[C@H]1CCOC1 34a_100000717292_100000730704 [0,1,0,1,0,0|1,0,0]=3 16695 B11R1.172 C=C(C)CCSC1CCOC1 62a_100000730704_100000690089 [0,1,0,1,0,0|1,1,0]=4 16696 B11R1.172 CC(=CCOC1CCOC1)C 34a_100000753907_100000690089 [0,1,0,1,0,0|1,0,1]=4 16697 B11R1.172 CC(=CCO[C@H]1CCOC1)C 34a_100000717292_100000761012 [0,1,0,1,0,0|1,0,1]=4 16698 B11R1.172 CC(=O)CCOC1CCCC1 34a_100000759926_100000179811 [0,1,0,1,0,0|2,0,0]=4 16699 B11R1.172 CC(=O)CCOC1CCCC1 7a_100000210269_100000053229 [0,1,0,1,0,0|2,0,0]=4 16700 B11R1.172 CC(=O)CCOC1CCCC1 7a_100000759926_100000179811 [0,1,0,1,0,0|2,0,0]=4 16701 B11R1.172 CC(=O)CCOC1CCOC1 34a_100000759926_100000690089 [0,1,0,1,0,0|1,0,0]=3 16702 B11R1.172 CC(=O)CCOC1CCOC1 7a_100000759926_100000731011 [0,1,0,1,0,0|1,0,0]=3 16703 B11R1.172 CC(=O)CCOC1CCSC1 7a_100011232664_100000053229 [0,1,0,1,0,0|1,1,0]=4 16704 B11R1.172 CC(=O)CCSC1CCOC1 62a_100000053229_100000690089 [0,1,0,1,0,0|1,1,0]=4 16705 B11R1.172 CC(=O)OCO[C@H]1CCOC1 34a_100000717292_100009813279 [0,1,0,1,0,0|2,0,0]=4 16706 B11R1.172 CC(Br)CCOC1CCCC1 34a_100009893172_100000179811 [0,1,0,1,0,0|2,0,0]=4 16707 B11R1.172 CC(Br)CCOC1CCOC1 34a_100009893172_100000690089 [0,1,0,1,0,0|1,0,0]=3 16708 B11R1.172 CC(C)CCNC1CCOC1 270004a_100000210545_100000752484 [0,1,0,1,0,0|2,0,0]=4 16709 B11R1.172 CC(C)CCN[C@@H]1CCOC1 2230a_200015188469_100000210312 [0,1,0,1,0,0|2,0,0]=4 16710 B11R1.172 CC(C)CCN[C@@H]1CCOC1 269862a_200015188469_100000185833 [0,1,0,1,0,0|2,0,0]=4 16711 B11R1.172 CC(C)CCN[C@H]1CCOC1 2230a_100015188467_100000210312 [0,1,0,1,0,0|2,0,0]=4 16712 B11R1.172 CC(C)CCN[C@H]1CCOC1 269862a_100015188467_100000185833 [0,1,0,1,0,0|2,0,0]=4 16713 B11R1.172 CC(C)CCN[C@H]1CCOC1 34a_100015188467_100000210312 [0,1,0,1,0,0|2,0,0]=4 16714 B11R1.172 CC(C)CCOC1CCCC1 34a_100000210254_100000179811 [0,1,0,1,0,0|2,0,0]=4 16715 B11R1.172 CC(C)CCOC1CCCC1 34a_100000210269_100000210312 [0,1,0,1,0,0|2,0,0]=4 16716 B11R1.172 CC(C)CCOC1CCCC1 7a_100000210254_100000179811 [0,1,0,1,0,0|2,0,0]=4 16717 B11R1.172 CC(C)CCOC1CCCC1 7a_100000210269_100000210626 [0,1,0,1,0,0|2,0,0]=4 16718 B11R1.172 CC(C)CCOC1CCOC1 34a_100000210254_100000690089 [0,1,0,1,0,0|1,0,0]=3 16719 B11R1.172 CC(C)CCOC1CCOC1 7a_100000210254_100000731011 [0,1,0,1,0,0|1,0,0]=3 16720 B11R1.172 CC(C)CCOC1CCSC1 7a_100011232664_100000210626 [0,1,0,1,0,0|1,1,0]=4 16721 B11R1.172 CC(C)CCO[C@H]1CCOC1 34a_100000717292_100000210312 [0,1,0,1,0,0|1,0,0]=3 16722 B11R1.172 CC(C)CCSC1CCOC1 62a_100000210312_100000690089 [0,1,0,1,0,0|1,1,0]=4 16723 B11R1.172 CC(C)OCCC1CCCC1 34a_100000212225_100000760354 [0,1,0,1,0,0|2,0,0]=4 16724 B11R1.172 CC(C)OCCC1CCCC1 34a_100000749090_100000210206 [0,1,0,1,0,0|2,0,0]=4 16725 B11R1.172 CC(C)OCCC1CCCC1 7a_100000749090_100000210206 [0,1,0,1,0,0|2,0,0]=4 16726 B11R1.172 CC(C)OCCC1CCNC1 34a_100016987287_100000210206 [0,1,0,1,0,0|2,0,0]=4 16727 B11R1.172 CC(C)OCCC1CCOC1 34a_100011879284_100000210206 [0,1,0,1,0,0|1,0,0]=3 16728 B11R1.172 CC(C)OCCN1CCCC1 2230a_100000188435_100000211751 [0,1,0,1,0,0|2,0,0]=4 16729 B11R1.172 CC(C)OCCN1CCCC1 269982a_100000188435_100000211751 [0,1,0,1,0,0|2,0,0]=4 16730 B11R1.172 CC(C)OCCN1CCSC1 2230a_100011215254_100000211751 [0,1,0,1,0,0|1,1,0]=4 16731 B11R1.172 CC(C)OCCN1CCSC1 269982a_100011215254_100000211751 [0,1,0,1,0,0|1,1,0]=4 16732 B11R1.172 CC(C)OCN[C@@H]1CCOC1 2230a_200015188469_100000709892 [0,1,0,1,0,0|2,0,0]=4 16733 B11R1.172 CC(C)OCN[C@H]1CCOC1 2230a_100015188467_100000709892 [0,1,0,1,0,0|2,0,0]=4 16734 B11R1.172 CC(C)OCN[C@H]1CCOC1 34a_100015188467_100000709892 [0,1,0,1,0,0|2,0,0]=4 16735 B11R1.172 CC(C)OCO[C@H]1CCOC1 34a_100000717292_100000709892 [0,1,0,1,0,0|2,0,0]=4 16736 B11R1.172 CC(C)OCSC1CCOC1 62a_100000709892_100000690089 [0,1,0,1,0,0|2,0,0]=4 16737 B11R1.172 CC(O)CCNC1CCOC1 2230a_200000755665_100000731011 [0,1,0,1,0,0|2,0,0]=4 16738 B11R1.172 CC(O)CCNC1CCOC1 270004a_200000755665_100000752484 [0,1,0,1,0,0|2,0,0]=4 16739 B11R1.172 CC(O)CCN[C@@H]1CCOC1 2230a_200015188469_100012276601 [0,1,0,1,0,0|2,0,0]=4 16740 B11R1.172 CC(O)CCN[C@H]1CCOC1 2230a_100015188467_100012276601 [0,1,0,1,0,0|2,0,0]=4 16741 B11R1.172 CC(O)CCN[C@H]1CCOC1 34a_100015188467_100012276601 [0,1,0,1,0,0|2,0,0]=4 16742 B11R1.172 CC(O)CCOC1CCCC1 34a_100000210269_100012276601 [0,1,0,1,0,0|2,0,0]=4 16743 B11R1.172 CC(O)CCOC1CCCC1 7a_100000210269_100012276601 [0,1,0,1,0,0|2,0,0]=4 16744 B11R1.172 CC(O)CCOC1CCSC1 7a_100011232664_100012276601 [0,1,0,1,0,0|1,1,0]=4 16745 B11R1.172 CC(O)CCO[C@H]1CCOC1 34a_100000717292_100012276601 [0,1,0,1,0,0|1,0,0]=3 16746 B11R1.172 CC(O)CCSC1CCOC1 62a_100012276601_100000690089 [0,1,0,1,0,0|1,1,0]=4 16747 B11R1.172 CN(C)CCNC1CCOC1 270004a_100000210585_100000752484 [0,1,0,1,0,0|2,0,0]=4 16748 B11R1.172 CN(C)CCOC1CCCC1 7a_100000210269_100000755713 [0,1,0,1,0,0|2,0,0]=4 16749 B11R1.172 CN(C)CCOC1CCSC1 7a_100011232664_100000755713 [0,1,0,1,0,0|1,1,0]=4 16750 B11R1.172 C[C@@H](N)CCOC1CCCC1 34a_100000706166_100000179811 [0,1,0,1,0,0|2,0,0]=4 16751 B11R1.172 C[C@@H](N)CCOC1CCOC1 34a_100000706166_100000690089 [0,1,0,1,0,0|1,0,0]=3 16752 B11R1.172 FC(F)CCOC1CCOC1 34a_100103093639_100000690089 [0,1,0,1,0,0|2,0,0]=4 16753 B11R1.172 NC(=O)CCOC1CCOC1 34a_100000757172_100000690089 [0,1,0,1,0,0|2,0,0]=4 16754 B11R1.172 NC(=O)CCOC1CCOC1 7a_100000757172_100000731011 [0,1,0,1,0,0|2,0,0]=4 16755 B11R1.172 NC(=O)CCO[C@H]1CCOC1 34a_100000717292_100000731001 [0,1,0,1,0,0|2,0,0]=4 16756 B11R1.174 C=C(Br)CCOCC1CCO1 34a_100009813270_100000103362 [0,1,0,1,0,0|1,0,1]=4 16757 B11R1.174 C=C(C)CCNC[C@@H]1CCO1 2230a_100020831831_100000730704 [0,1,0,1,0,0|2,0,0]=4 16758 B11R1.174 C=C(C)CCNC[C@@H]1CCO1 34a_100020831831_100000730704 [0,1,0,1,0,0|2,0,0]=4 16759 B11R1.174 C=C(C)CCOCC1CCC1 34a_100000760304_100000730704 [0,1,0,1,0,0|2,0,0]=4 16760 B11R1.174 C=C(C)CCOCC1CCC1 34a_100000764851_100000763275 [0,1,0,1,0,0|2,0,0]=4 16761 B11R1.174 C=C(C)CCOCC1CCO1 34a_100000039022_100000730704 [0,1,0,1,0,0|1,0,0]=3 16762 B11R1.174 C=C(C)CCOCC1CCO1 34a_100000764851_100000103362 [0,1,0,1,0,0|1,0,0]=3 16763 B11R1.174 C=C(C)CCSCC1CCO1 62a_100000103362_100000730704 [0,1,0,1,0,0|1,1,0]=4 16764 B11R1.174 C=C(C)CCSCC1CCO1 62a_100000730704_100000103362 [0,1,0,1,0,0|1,1,0]=4 16765 B11R1.174 CC(=CCOCC1CCO1)C 34a_100000039022_100000761012 [0,1,0,1,0,0|1,0,1]=4 16766 B11R1.174 CC(=CCOCC1CCO1)C 34a_100000753907_100000103362 [0,1,0,1,0,0|1,0,1]=4 16767 B11R1.174 CC(=O)CCCOC1COC1 34a_100000759063_100009818527 [0,1,0,1,0,0|1,0,1]=4 16768 B11R1.174 CC(=O)CCCOC1COC1 7a_100000759063_100009818527 [0,1,0,1,0,0|1,0,1]=4 16769 B11R1.174 CC(=O)CCOCC1CCC1 34a_100000759926_100000763275 [0,1,0,1,0,0|2,0,0]=4 16770 B11R1.174 CC(=O)CCOCC1CCC1 7a_100000759926_100000763275 [0,1,0,1,0,0|2,0,0]=4 16771 B11R1.174 CC(=O)CCOCC1CCO1 34a_100000759926_100000103362 [0,1,0,1,0,0|1,0,0]=3 16772 B11R1.174 CC(=O)CCOCC1CCO1 7a_100000759926_100000103362 [0,1,0,1,0,0|1,0,0]=3 16773 B11R1.174 CC(=O)CCSCC1CCO1 62a_100000053229_100000103362 [0,1,0,1,0,0|1,1,0]=4 16774 B11R1.174 CC(=O)CCSCC1CCO1 62a_100000103362_100000053229 [0,1,0,1,0,0|1,1,0]=4 16775 B11R1.174 CC(=O)NCCOC1COC1 34a_100000158858_100009818527 [0,1,0,1,0,0|1,0,1]=4 16776 B11R1.174 CC(=O)OCCOC1CCC1 34a_100000748187_100009814007 [0,1,0,1,0,0|1,0,1]=4 16777 B11R1.174 CC(=O)OCCOC1CSC1 7a_100000072292_100009814007 [0,1,0,1,0,0|0,1,1]=4 16778 B11R1.174 CC(=O)OCCSC1COC1 62a_100009814007_100009818527 [0,1,0,1,0,0|0,1,1]=4 16779 B11R1.174 CC(=O)OCOCC1CCO1 34a_100000039022_100009813279 [0,1,0,1,0,0|2,0,0]=4 16780 B11R1.174 CC(Br)CCOCC1CCC1 34a_100009893172_100000763275 [0,1,0,1,0,0|2,0,0]=4 16781 B11R1.174 CC(Br)CCOCC1CCO1 34a_100009893172_100000103362 [0,1,0,1,0,0|1,0,0]=3 16782 B11R1.174 CC(C)CCCNC1COC1 2230a_100016991112_100011214892 [0,1,0,1,0,0|2,0,0]=4 16783 B11R1.174 CC(C)CCCNC1COC1 34a_200000737386_100009818527 [0,1,0,1,0,0|2,0,0]=4 16784 B11R1.174 CC(C)CCCOC1CCC1 34a_100000210774_100000749161 [0,1,0,1,0,0|2,0,0]=4 16785 B11R1.174 CC(C)CCCOC1CCC1 34a_100000748187_100011214892 [0,1,0,1,0,0|2,0,0]=4 16786 B11R1.174 CC(C)CCCOC1COC1 34a_100000210774_100009818527 [0,1,0,1,0,0|1,0,0]=3 16787 B11R1.174 CC(C)CCCOC1COC1 7a_100000210774_100009818527 [0,1,0,1,0,0|1,0,0]=3 16788 B11R1.174 CC(C)CCCOC1CSC1 7a_100000072292_100011214892 [0,1,0,1,0,0|1,1,0]=4 16789 B11R1.174 CC(C)CCCSC1COC1 62a_100011214892_100009818527 [0,1,0,1,0,0|1,1,0]=4 16790 B11R1.174 CC(C)CCNC[C@@H]1CCO1 2230a_100020831831_100000210312 [0,1,0,1,0,0|2,0,0]=4 16791 B11R1.174 CC(C)CCNC[C@@H]1CCO1 269862a_100020831831_100000185833 [0,1,0,1,0,0|2,0,0]=4 16792 B11R1.174 CC(C)CCNC[C@@H]1CCO1 34a_100020831831_100000210312 [0,1,0,1,0,0|2,0,0]=4 16793 B11R1.174 CC(C)CCOCC1CCC1 34a_100000210254_100000763275 [0,1,0,1,0,0|2,0,0]=4 16794 B11R1.174 CC(C)CCOCC1CCC1 34a_100000760304_100000210312 [0,1,0,1,0,0|2,0,0]=4 16795 B11R1.174 CC(C)CCOCC1CCC1 7a_100000210254_100000763275 [0,1,0,1,0,0|2,0,0]=4 16796 B11R1.174 CC(C)CCOCC1CCO1 34a_100000039022_100000210312 [0,1,0,1,0,0|1,0,0]=3 16797 B11R1.174 CC(C)CCOCC1CCO1 34a_100000210254_100000103362 [0,1,0,1,0,0|1,0,0]=3 16798 B11R1.174 CC(C)CCOCC1CCO1 7a_100000210254_100000103362 [0,1,0,1,0,0|1,0,0]=3 16799 B11R1.174 CC(C)CCSCC1CCO1 62a_100000103362_100000210312 [0,1,0,1,0,0|1,1,0]=4 16800 B11R1.174 CC(C)CCSCC1CCO1 62a_100000210312_100000103362 [0,1,0,1,0,0|1,1,0]=4 16801 B11R1.174 CC(C)NCCOC1CCC1 34a_100000224655_100000749161 [0,1,0,1,0,0|2,0,0]=4 16802 B11R1.174 CC(C)NCCOC1COC1 34a_100000224655_100009818527 [0,1,0,1,0,0|1,0,0]=3 16803 B11R1.174 CC(C)OCCNC1CCC1 2230a_100000749019_100000211751 [0,1,0,1,0,0|2,0,0]=4 16804 B11R1.174 CC(C)OCCNC1CCC1 270004a_100000701111_100000241760 [0,1,0,1,0,0|2,0,0]=4 16805 B11R1.174 CC(C)OCCNC1CCC1 34a_100000701111_100000749161 [0,1,0,1,0,0|2,0,0]=4 16806 B11R1.174 CC(C)OCCNC1CCC1 34a_100000749019_100000211751 [0,1,0,1,0,0|2,0,0]=4 16807 B11R1.174 CC(C)OCCNC1COC1 2230a_100016991112_100000211751 [0,1,0,1,0,0|1,0,0]=3 16808 B11R1.174 CC(C)OCCNC1COC1 34a_100000701111_100009818527 [0,1,0,1,0,0|1,0,0]=3 16809 B11R1.174 CC(C)OCCOC1CCC1 34a_100000211219_100000749161 [0,1,0,1,0,0|1,0,0]=3 16810 B11R1.174 CC(C)OCCOC1CCC1 34a_100000748187_100000211751 [0,1,0,1,0,0|1,0,0]=3 16811 B11R1.174 CC(C)OCCOC1COC1 34a_100000211219_100009818527 [0,1,0,1,0,0|0,0,0]=2 16812 B11R1.174 CC(C)OCCOC1COC1 7a_100000211219_100009818527 [0,1,0,1,0,0|0,0,0]=2 16813 B11R1.174 CC(C)OCCOC1CSC1 7a_100000072292_100000211751 [0,1,0,1,0,0|0,1,0]=3 16814 B11R1.174 CC(C)OCCSC1CCC1 62a_100000211751_100000749161 [0,1,0,1,0,0|1,1,0]=4 16815 B11R1.174 CC(C)OCCSC1COC1 62a_100000211751_100009818527 [0,1,0,1,0,0|0,1,0]=3 16816 B11R1.174 CC(C)OCNCC1COC1 2230a_100015281925_100000709892 [0,1,0,1,0,0|2,0,0]=4 16817 B11R1.174 CC(C)OCNCC1COC1 34a_100015281925_100000709892 [0,1,0,1,0,0|2,0,0]=4 16818 B11R1.174 CC(C)OCOCC1CCO1 34a_100000039022_100000709892 [0,1,0,1,0,0|2,0,0]=4 16819 B11R1.174 CC(C)OCOCC1COC1 34a_100000060846_100000709892 [0,1,0,1,0,0|2,0,0]=4 16820 B11R1.174 CC(C)OCSCC1COC1 62a_100000709892_100010264016 [0,1,0,1,0,0|2,0,0]=4 16821 B11R1.174 CC(C)OCSCC1COC1 62a_100010264016_100000709892 [0,1,0,1,0,0|2,0,0]=4 16822 B11R1.174 CC(C)SCCNC1COC1 2230a_100016991112_100000730970 [0,1,0,1,0,0|1,1,0]=4 16823 B11R1.174 CC(C)SCCNC1COC1 34a_100000731138_100009818527 [0,1,0,1,0,0|1,1,0]=4 16824 B11R1.174 CC(C)SCCOC1CCC1 34a_100000748187_100000730970 [0,1,0,1,0,0|1,1,0]=4 16825 B11R1.174 CC(C)SCCOC1CCC1 34a_200011212901_100000749161 [0,1,0,1,0,0|1,1,0]=4 16826 B11R1.174 CC(C)SCCOC1COC1 34a_200011212901_100009818527 [0,1,0,1,0,0|0,1,0]=3 16827 B11R1.174 CC(C)SCCOC1COC1 7a_200011212901_100009818527 [0,1,0,1,0,0|0,1,0]=3 16828 B11R1.174 CC(C)SCCOC1CSC1 7a_100000072292_100000730970 [0,1,0,1,0,0|0,2,0]=4 16829 B11R1.174 CC(C)SCCSC1COC1 62a_100000730970_100009818527 [0,1,0,1,0,0|0,2,0]=4 16830 B11R1.174 CC(O)CCCNC1COC1 2230a_100016991112_200000718107 [0,1,0,1,0,0|2,0,0]=4 16831 B11R1.174 CC(O)CCCOC1CCC1 34a_100000748187_200000718107 [0,1,0,1,0,0|2,0,0]=4 16832 B11R1.174 CC(O)CCCOC1CSC1 7a_100000072292_200000718107 [0,1,0,1,0,0|1,1,0]=4 16833 B11R1.174 CC(O)CCCSC1COC1 62a_200000718107_100009818527 [0,1,0,1,0,0|1,1,0]=4 16834 B11R1.174 CC(O)CCNCC1CCO1 2230a_200000755665_100000103362 [0,1,0,1,0,0|2,0,0]=4 16835 B11R1.174 CC(O)CCNC[C@@H]1CCO1 2230a_100020831831_100012276601 [0,1,0,1,0,0|2,0,0]=4 16836 B11R1.174 CC(O)CCNC[C@@H]1CCO1 34a_100020831831_100012276601 [0,1,0,1,0,0|2,0,0]=4 16837 B11R1.174 CC(O)CCOCC1CCC1 34a_100000760304_100012276601 [0,1,0,1,0,0|2,0,0]=4 16838 B11R1.174 CC(O)CCOCC1CCO1 34a_100000039022_100012276601 [0,1,0,1,0,0|1,0,0]=3 16839 B11R1.174 CC(O)CCSCC1CCO1 62a_100000103362_100012276601 [0,1,0,1,0,0|1,1,0]=4 16840 B11R1.174 CC(O)CCSCC1CCO1 62a_100012276601_100000103362 [0,1,0,1,0,0|1,1,0]=4 16841 B11R1.174 CN(C)CCSCC1CCO1 62a_100000103362_100000755713 [0,1,0,1,0,0|1,1,0]=4 16842 B11R1.174 C[C@@H](N)CCOCC1CCC1 34a_100000706166_100000763275 [0,1,0,1,0,0|2,0,0]=4 16843 B11R1.174 C[C@@H](N)CCOCC1CCO1 34a_100000706166_100000103362 [0,1,0,1,0,0|1,0,0]=3 16844 B11R1.174 FC(F)CCOCC1CCO1 34a_100103093639_100000103362 [0,1,0,1,0,0|2,0,0]=4 16845 B11R1.174 NC(=O)CCOCC1CCO1 34a_100000039022_100000731001 [0,1,0,1,0,0|2,0,0]=4 16846 B11R1.174 NC(=O)CCOCC1CCO1 34a_100000757172_100000103362 [0,1,0,1,0,0|2,0,0]=4 16847 B11R1.174 NC(=O)CCOCC1CCO1 7a_100000757172_100000103362 [0,1,0,1,0,0|2,0,0]=4 16848 B11R1.174 NC(=O)OCCOC1COC1 7a_100000766696_100009818527 [0,1,0,1,0,0|1,0,1]=4 16849 B11R1.176 C=C(C)CCOCCC1CC1 34a_100000754188_100000730704 [0,1,0,1,0,0|2,0,0]=4 16850 B11R1.176 C=C(C)CCOCCC1CC1 34a_100000764851_100000694398 [0,1,0,1,0,0|2,0,0]=4 16851 B11R1.176 C=C(C)CCOCCC1CC1 7a_100000754188_100000730704 [0,1,0,1,0,0|2,0,0]=4 16852 B11R1.176 CC(=CCCOC[C@@H]1CO1)C 34a_100000757423_100011217483 [0,1,0,1,0,0|1,0,1]=4 16853 B11R1.176 CC(=O)CCCOCC1CO1 34a_100000759063_102125554688 [0,1,0,1,0,0|1,0,1]=4 16854 B11R1.176 CC(=O)CCCOCC1CO1 7a_100000759063_102125554688 [0,1,0,1,0,0|1,0,1]=4 16855 B11R1.176 CC(=O)CCCOC[C@@H]1CO1 34a_100000757423_100000685027 [0,1,0,1,0,0|1,0,1]=4 16856 B11R1.176 CC(=O)CCCOC[C@@H]1CO1 7a_100000759063_100000745022 [0,1,0,1,0,0|1,0,1]=4 16857 B11R1.176 CC(=O)CCOCCC1CC1 34a_100000759926_100000694398 [0,1,0,1,0,0|2,0,0]=4 16858 B11R1.176 CC(=O)CCOCCC1CC1 7a_100000754188_100000053229 [0,1,0,1,0,0|2,0,0]=4 16859 B11R1.176 CC(=O)CCOCCC1CC1 7a_100000759926_100000764125 [0,1,0,1,0,0|2,0,0]=4 16860 B11R1.176 CC(=O)NCCOCC1CO1 34a_100000158858_102125554688 [0,1,0,1,0,0|1,0,1]=4 16861 B11R1.176 CC(=O)OCCOCC1CC1 34a_100000211283_100009814007 [0,1,0,1,0,0|1,0,1]=4 16862 B11R1.176 CC(=O)OCCOC[C@@H]1CO1 34a_100000757423_100009814007 [0,1,0,1,0,0|0,0,1]=3 16863 B11R1.176 CC(=O)OCCSCC1CO1 62a_100009814007_102125554688 [0,1,0,1,0,0|0,1,1]=4 16864 B11R1.176 CC(=O)OCCSCC1CO1 62a_102125554688_100009814007 [0,1,0,1,0,0|0,1,1]=4 16865 B11R1.176 CC(=O)OCCSC[C@@H]1CO1 62a_100000745022_100009814007 [0,1,0,1,0,0|0,1,1]=4 16866 B11R1.176 CC(=O)OCCSC[C@@H]1CO1 62a_100009814007_100000745022 [0,1,0,1,0,0|0,1,1]=4 16867 B11R1.176 CC(Br)CCOCCC1CC1 34a_100009893172_100000694398 [0,1,0,1,0,0|2,0,0]=4 16868 B11R1.176 CC(C)CCCNCC1CO1 2230a_200000737386_100011216344 [0,1,0,1,0,0|2,0,0]=4 16869 B11R1.176 CC(C)CCCNCC1CO1 34a_200000737386_102125554688 [0,1,0,1,0,0|2,0,0]=4 16870 B11R1.176 CC(C)CCCOCC1CC1 34a_100000210774_100000742324 [0,1,0,1,0,0|2,0,0]=4 16871 B11R1.176 CC(C)CCCOCC1CC1 34a_100000211283_100011214892 [0,1,0,1,0,0|2,0,0]=4 16872 B11R1.176 CC(C)CCCOCC1CC1 7a_100000210774_100000742324 [0,1,0,1,0,0|2,0,0]=4 16873 B11R1.176 CC(C)CCCOCC1CO1 34a_100000210774_102125554688 [0,1,0,1,0,0|1,0,0]=3 16874 B11R1.176 CC(C)CCCOCC1CO1 7a_100000210774_102125554688 [0,1,0,1,0,0|1,0,0]=3 16875 B11R1.176 CC(C)CCCOCC1CS1 7a_100000210774_100000031435 [0,1,0,1,0,0|1,1,0]=4 16876 B11R1.176 CC(C)CCCOC[C@@H]1CO1 34a_100000757423_100011214892 [0,1,0,1,0,0|1,0,0]=3 16877 B11R1.176 CC(C)CCCOC[C@@H]1CO1 7a_100000210774_100000745022 [0,1,0,1,0,0|1,0,0]=3 16878 B11R1.176 CC(C)CCCSCC1CO1 62a_100011214892_102125554688 [0,1,0,1,0,0|1,1,0]=4 16879 B11R1.176 CC(C)CCCSCC1CO1 62a_102125554688_100011214892 [0,1,0,1,0,0|1,1,0]=4 16880 B11R1.176 CC(C)CCCSC[C@@H]1CO1 62a_100000745022_100011214892 [0,1,0,1,0,0|1,1,0]=4 16881 B11R1.176 CC(C)CCCSC[C@@H]1CO1 62a_100011214892_100000745022 [0,1,0,1,0,0|1,1,0]=4 16882 B11R1.176 CC(C)CCOCCC1CC1 34a_100000210254_100000694398 [0,1,0,1,0,0|2,0,0]=4 16883 B11R1.176 CC(C)CCOCCC1CC1 34a_100000754188_100000210312 [0,1,0,1,0,0|2,0,0]=4 16884 B11R1.176 CC(C)CCOCCC1CC1 7a_100000210254_100000764125 [0,1,0,1,0,0|2,0,0]=4 16885 B11R1.176 CC(C)CCOCCC1CC1 7a_100000754188_100000210626 [0,1,0,1,0,0|2,0,0]=4 16886 B11R1.176 CC(C)NCCOCC1CC1 34a_100000224655_100000742324 [0,1,0,1,0,0|2,0,0]=4 16887 B11R1.176 CC(C)NCCOCC1CO1 34a_100000224655_102125554688 [0,1,0,1,0,0|1,0,0]=3 16888 B11R1.176 CC(C)OCCNCC1CC1 2230a_100000701111_100000742324 [0,1,0,1,0,0|2,0,0]=4 16889 B11R1.176 CC(C)OCCNCC1CC1 2230a_100000735609_100000211751 [0,1,0,1,0,0|2,0,0]=4 16890 B11R1.176 CC(C)OCCNCC1CC1 269862a_100000701111_100000741477 [0,1,0,1,0,0|2,0,0]=4 16891 B11R1.176 CC(C)OCCNCC1CC1 34a_100000701111_100000742324 [0,1,0,1,0,0|2,0,0]=4 16892 B11R1.176 CC(C)OCCNCC1CC1 34a_100000735609_100000211751 [0,1,0,1,0,0|2,0,0]=4 16893 B11R1.176 CC(C)OCCNCC1CO1 2230a_100000701111_100011216344 [0,1,0,1,0,0|1,0,0]=3 16894 B11R1.176 CC(C)OCCNCC1CO1 34a_100000701111_102125554688 [0,1,0,1,0,0|1,0,0]=3 16895 B11R1.176 CC(C)OCCOCC1CC1 34a_100000211219_100000742324 [0,1,0,1,0,0|1,0,0]=3 16896 B11R1.176 CC(C)OCCOCC1CC1 34a_100000211283_100000211751 [0,1,0,1,0,0|1,0,0]=3 16897 B11R1.176 CC(C)OCCOCC1CC1 7a_100000211219_100000742324 [0,1,0,1,0,0|1,0,0]=3 16898 B11R1.176 CC(C)OCCOCC1CO1 34a_100000211219_102125554688 [0,1,0,1,0,0|0,0,0]=2 16899 B11R1.176 CC(C)OCCOCC1CO1 7a_100000211219_102125554688 [0,1,0,1,0,0|0,0,0]=2 16900 B11R1.176 CC(C)OCCOCC1CS1 7a_100000211219_100000031435 [0,1,0,1,0,0|0,1,0]=3 16901 B11R1.176 CC(C)OCCOC[C@@H]1CO1 34a_100000757423_100000211751 [0,1,0,1,0,0|0,0,0]=2 16902 B11R1.176 CC(C)OCCOC[C@@H]1CO1 7a_100000211219_100000745022 [0,1,0,1,0,0|0,0,0]=2 16903 B11R1.176 CC(C)OCCSCC1CC1 62a_100000211751_100000742324 [0,1,0,1,0,0|1,1,0]=4 16904 B11R1.176 CC(C)OCCSCC1CC1 62a_100000756562_100000211751 [0,1,0,1,0,0|1,1,0]=4 16905 B11R1.176 CC(C)OCCSCC1CO1 62a_100000211751_102125554688 [0,1,0,1,0,0|0,1,0]=3 16906 B11R1.176 CC(C)OCCSCC1CO1 62a_102125554688_100000211751 [0,1,0,1,0,0|0,1,0]=3 16907 B11R1.176 CC(C)OCCSCC1CS1 62a_100000031435_100000211751 [0,1,0,1,0,0|0,2,0]=4 16908 B11R1.176 CC(C)OCCSCC1CS1 62a_100000211751_100000031435 [0,1,0,1,0,0|0,2,0]=4 16909 B11R1.176 CC(C)OCCSC[C@@H]1CO1 62a_100000211751_100000745022 [0,1,0,1,0,0|0,1,0]=3 16910 B11R1.176 CC(C)OCCSC[C@@H]1CO1 62a_100000745022_100000211751 [0,1,0,1,0,0|0,1,0]=3 16911 B11R1.176 CC(C)OCOCC[C@@H]1CO1 34a_100009820653_100000709892 [0,1,0,1,0,0|2,0,0]=4 16912 B11R1.176 CC(C)OCSCCC1CO1 62a_100000709892_100000732470 [0,1,0,1,0,0|2,0,0]=4 16913 B11R1.176 CC(C)OCSCCC1CO1 62a_100000732470_100000709892 [0,1,0,1,0,0|2,0,0]=4 16914 B11R1.176 CC(C)SCCNCC1CO1 2230a_100000731138_100011216344 [0,1,0,1,0,0|1,1,0]=4 16915 B11R1.176 CC(C)SCCNCC1CO1 34a_100000731138_102125554688 [0,1,0,1,0,0|1,1,0]=4 16916 B11R1.176 CC(C)SCCOCC1CC1 34a_100000211283_100000730970 [0,1,0,1,0,0|1,1,0]=4 16917 B11R1.176 CC(C)SCCOCC1CC1 34a_200011212901_100000742324 [0,1,0,1,0,0|1,1,0]=4 16918 B11R1.176 CC(C)SCCOCC1CC1 7a_200011212901_100000742324 [0,1,0,1,0,0|1,1,0]=4 16919 B11R1.176 CC(C)SCCOCC1CO1 34a_200011212901_102125554688 [0,1,0,1,0,0|0,1,0]=3 16920 B11R1.176 CC(C)SCCOCC1CO1 7a_200011212901_102125554688 [0,1,0,1,0,0|0,1,0]=3 16921 B11R1.176 CC(C)SCCOCC1CS1 7a_200011212901_100000031435 [0,1,0,1,0,0|0,2,0]=4 16922 B11R1.176 CC(C)SCCOC[C@@H]1CO1 34a_100000757423_100000730970 [0,1,0,1,0,0|0,1,0]=3 16923 B11R1.176 CC(C)SCCOC[C@@H]1CO1 7a_200011212901_100000745022 [0,1,0,1,0,0|0,1,0]=3 16924 B11R1.176 CC(C)SCCSCC1CO1 62a_100000730970_102125554688 [0,1,0,1,0,0|0,2,0]=4 16925 B11R1.176 CC(C)SCCSCC1CO1 62a_102125554688_100000730970 [0,1,0,1,0,0|0,2,0]=4 16926 B11R1.176 CC(C)SCCSC[C@@H]1CO1 62a_100000730970_100000745022 [0,1,0,1,0,0|0,2,0]=4 16927 B11R1.176 CC(C)SCCSC[C@@H]1CO1 62a_100000745022_100000730970 [0,1,0,1,0,0|0,2,0]=4 16928 B11R1.176 CC(O)CCCOCC1CC1 34a_100000211283_200000718107 [0,1,0,1,0,0|2,0,0]=4 16929 B11R1.176 CC(O)CCCOC[C@@H]1CO1 34a_100000757423_200000718107 [0,1,0,1,0,0|1,0,0]=3 16930 B11R1.176 CC(O)CCCSCC1CO1 62a_102125554688_200000718107 [0,1,0,1,0,0|1,1,0]=4 16931 B11R1.176 CC(O)CCCSCC1CO1 62a_200000718107_102125554688 [0,1,0,1,0,0|1,1,0]=4 16932 B11R1.176 CC(O)CCCSC[C@@H]1CO1 62a_100000745022_200000718107 [0,1,0,1,0,0|1,1,0]=4 16933 B11R1.176 CC(O)CCCSC[C@@H]1CO1 62a_200000718107_100000745022 [0,1,0,1,0,0|1,1,0]=4 16934 B11R1.176 CC(O)CCOCCC1CC1 34a_100000754188_100012276601 [0,1,0,1,0,0|2,0,0]=4 16935 B11R1.176 CC(O)CCOCCC1CC1 7a_100000754188_100012276601 [0,1,0,1,0,0|2,0,0]=4 16936 B11R1.176 CN(C)CCOCCC1CC1 7a_100000754188_100000755713 [0,1,0,1,0,0|2,0,0]=4 16937 B11R1.176 C[C@@H](N)CCOCCC1CC1 34a_100000706166_100000694398 [0,1,0,1,0,0|2,0,0]=4 16938 B11R1.176 NC(=O)OCCOCC1CO1 7a_100000766696_102125554688 [0,1,0,1,0,0|1,0,1]=4 16939 B11R1.176 NC(=O)OCCOC[C@@H]1CO1 34a_100000757423_200011214921 [0,1,0,1,0,0|1,0,1]=4 16940 B11R1.176 NC(=O)OCCOC[C@@H]1CO1 7a_100000766696_100000745022 [0,1,0,1,0,0|1,0,1]=4 16941 B11R1.193 COC[C@@H]1CCCN1C(C)C 2230a_100020646714_100000210206 [0,1,0,1,0,0|2,0,0]=4 16942 B11R1.193 COC[C@@H]1CCCN1C(C)C 269982a_100020646714_100000210206 [0,1,0,1,0,0|2,0,0]=4 16943 B11R1.193 COC[C@@H]1CCCN1C(C)C 34a_100020646714_100000210206 [0,1,0,1,0,0|2,0,0]=4 16944 B11R1.233 COCCN1CCCC1(C)C 2230a_100000761399_100011201679 [0,1,0,1,0,0|2,0,0]=4 16945 B11R1.233 COCCN1CCCC1(C)C 269982a_100000761399_100000233755 [0,1,0,1,0,0|2,0,0]=4 16946 B11R1.233 COCCN1CCCC1(C)C 34a_100000761399_100011201679 [0,1,0,1,0,0|2,0,0]=4 16947 B11R1.233 COCCN1CCSC1(C)C 2230a_100011217261_100011201679 [0,1,0,1,0,0|1,1,0]=4 16948 B11R1.233 COCCN1CCSC1(C)C 269982a_100011217261_100000233755 [0,1,0,1,0,0|1,1,0]=4 16949 B11R1.233 COCCN1CCSC1(C)C 34a_100011217261_100011201679 [0,1,0,1,0,0|1,1,0]=4 16950 B11R1.742 CC(C)OC1CCCCCC1 34a_100000210887_100000210206 [0,1,0,1,0,0|2,0,0]=4 16951 B11R1.742 CC(C)OC1CCCCCC1 34a_100000212225_100011217769 [0,1,0,1,0,0|2,0,0]=4 16952 B11R1.742 CC(C)OC1CCCCCC1 7a_100000210887_100000210206 [0,1,0,1,0,0|2,0,0]=4 16953 B11R1.898 C#CCCOCC1OC1(C)C 34a_200010283642_100000688953 [0,1,0,1,0,0|1,0,1]=4 16954 B11R1.898 C#CCCOCC1OC1(C)C 7a_200010283642_100000688953 [0,1,0,1,0,0|1,0,1]=4 16955 B11R1.898 C/C=C/COCC1OC1(C)C 34a_200010283642_100102629194 [0,1,0,1,0,0|1,0,1]=4 16956 B11R1.898 C/C=C/COCC1OC1(C)C 7a_200010283642_100102629194 [0,1,0,1,0,0|1,0,1]=4 16957 B11R1.898 C=CCCOCC1OC1(C)C 34a_200010283642_100000754431 [0,1,0,1,0,0|1,0,1]=4 16958 B11R1.898 C=CCCOCC1OC1(C)C 7a_200010283642_100000754431 [0,1,0,1,0,0|1,0,1]=4 16959 B11R1.898 CC#CCOCC1OC1(C)C 34a_200010283642_100000748600 [0,1,0,1,0,0|1,0,1]=4 16960 B11R1.898 CC#CCOCC1OC1(C)C 7a_200010283642_100000748600 [0,1,0,1,0,0|1,0,1]=4 16961 B11R1.898 CC1(OC1COCCC#N)C 7a_200010283642_100000184422 [0,1,0,1,0,0|2,0,0]=4 16962 B11R1.898 CC1(OC1COCCCF)C 34a_200010283642_100011934791 [0,1,0,1,0,0|2,0,0]=4 16963 B11R1.898 CC1(OC1COCCCF)C 7a_200010283642_100011934791 [0,1,0,1,0,0|2,0,0]=4 16964 B11R1.898 CC1(OC1COCCCO)C 34a_200010283642_100000230001 [0,1,0,1,0,0|2,0,0]=4 16965 B11R1.898 CC1(OC1COCCCO)C 7a_200010283642_100011215043 [0,1,0,1,0,0|2,0,0]=4 16966 B11R1.898 CC=CCOCC1OC1(C)C 34a_200010283642_100000070051 [0,1,0,1,0,0|1,0,1]=4 16967 B11R1.898 CC=CCOCC1OC1(C)C 7a_200010283642_100000070051 [0,1,0,1,0,0|1,0,1]=4 16968 B11R1.898 CCCCOCC1CC1(C)C 34a_100000728257_100000210210 [0,1,0,1,0,0|2,0,0]=4 16969 B11R1.898 CCCCOCC1CC1(C)C 7a_100000728257_100000210211 [0,1,0,1,0,0|2,0,0]=4 16970 B11R1.898 CCCCOCC1OC1(C)C 34a_200010283642_100000210210 [0,1,0,1,0,0|1,0,0]=3 16971 B11R1.898 CCCCOCC1OC1(C)C 7a_200010283642_100000210211 [0,1,0,1,0,0|1,0,0]=3 16972 B11R1.898 COCCOCC1CC1(C)C 34a_100000728257_100011201679 [0,1,0,1,0,0|1,0,0]=3 16973 B11R1.898 COCCOCC1CC1(C)C 7a_100000728257_100000233755 [0,1,0,1,0,0|1,0,0]=3 16974 B11R1.898 COCCOCC1CC1(F)F 34a_100000056500_100011201679 [0,1,0,1,0,0|2,0,0]=4 16975 B11R1.898 COCCOCC1CC1(F)F 34a_100000210237_100009817841 [0,1,0,1,0,0|2,0,0]=4 16976 B11R1.898 COCCOCC1CC1(F)F 7a_100000056500_100000233755 [0,1,0,1,0,0|2,0,0]=4 16977 B11R1.898 COCCOCC1OC1(C)C 34a_200010283642_100011201679 [0,1,0,1,0,0|0,0,0]=2 16978 B11R1.898 COCCOCC1OC1(C)C 7a_200010283642_100000233755 [0,1,0,1,0,0|0,0,0]=2 16979 B11R1.898 CSCCOCC1CC1(C)C 34a_100000728257_100000212216 [0,1,0,1,0,0|1,1,0]=4 16980 B11R1.898 CSCCOCC1CC1(C)C 7a_100000728257_100000212216 [0,1,0,1,0,0|1,1,0]=4 16981 B11R1.898 CSCCOCC1OC1(C)C 34a_200010283642_100000212216 [0,1,0,1,0,0|0,1,0]=3 16982 B11R1.898 CSCCOCC1OC1(C)C 7a_200010283642_100000212216 [0,1,0,1,0,0|0,1,0]=3 16983 B11R1.17 CC1CCCCC1OCCF 34a_100000211207_100011217306 [0,1,0,1,0,0|2,0,0]=4 16984 B11R1.17 CC1CCCCC1OCCF 7a_100000211207_100011217306 [0,1,0,1,0,0|2,0,0]=4 16985 B11R1.17 CC1CCCCC1OCCO 34a_100000211207_100000211926 [0,1,0,1,0,0|2,0,0]=4 16986 B11R1.17 CC1CCCCC1OCCO 7a_100000211207_100000211926 [0,1,0,1,0,0|2,0,0]=4 16987 B11R1.17 CC1CCCCN1CCO[13CH3] 34a_100011305533_200025704644 [0,1,0,1,0,0|2,0,0]=4 16988 B11R1.17 CC1CCNCC1OCCF 34a_100000696640_100011217306 [0,1,0,1,0,0|2,0,0]=4 16989 B11R1.17 CC1CCNCC1OCCO 34a_100000696640_100000211926 [0,1,0,1,0,0|2,0,0]=4 16990 B11R1.17 CCCCN1CCOC[C@@H]1C 2230a_100009815349_100000210211 [0,1,0,1,0,0|2,0,0]=4 16991 B11R1.17 CCCCN1CCOC[C@@H]1C 269982a_100009815349_100000210211 [0,1,0,1,0,0|2,0,0]=4 16992 B11R1.17 CCCCN1CCOC[C@@H]1C 34a_100009815349_100000210210 [0,1,0,1,0,0|2,0,0]=4 16993 B11R1.17 CCCOC1CCCCC1C 34a_100000211207_100000210303 [0,1,0,1,0,0|2,0,0]=4 16994 B11R1.17 CCCOC1CCCCC1C 7a_100000211207_100000210303 [0,1,0,1,0,0|2,0,0]=4 16995 B11R1.17 CCCOC1CNCCC1C 34a_100000696640_100000210303 [0,1,0,1,0,0|2,0,0]=4 16996 B11R1.17 CCCOC1COCCC1=O 34a_100000210258_100012180262 [0,1,0,1,0,0|2,0,0]=4 16997 B11R1.17 CCCO[C@H]1COCC[C@H]1N 34a_100016994285_100000210303 [0,1,0,1,0,0|2,0,0]=4 16998 B11R1.17 CCOCC1CCCCC1=O 34a_100009861125_100000210202 [0,1,0,1,0,0|2,0,0]=4 16999 B11R1.17 CCOCC1CCCCC1=O 7a_100009861125_100000210202 [0,1,0,1,0,0|2,0,0]=4 17000 B11R1.17 CCOCC1CCCCN1C 34a_100000225079_100000210202 [0,1,0,1,0,0|2,0,0]=4 17001 B11R1.17 CCOCC1CCCCN1C 34a_100121572206_100015186950 [0,1,0,1,0,0|2,0,0]=4 17002 B11R1.17 CCOCC1COCCC1N 34a_214813039666_100000210202 [0,1,0,1,0,0|1,0,0]=3 17003 B11R1.17 CCOCC1COCCN1C 34a_100013547906_100000210202 [0,1,0,1,0,0|1,0,0]=3 17004 B11R1.17 CCOCN1CCCCC1C 269982a_100000211376_100000739092 [0,1,0,1,0,0|2,0,0]=4 17005 B11R1.17 CN1CCOCC1COCF 34a_100013547906_100015361967 [0,1,0,1,0,0|2,0,0]=4 17006 B11R1.17 COCCC1CCCCN1C 2230a_100015186528_200000210301 [0,1,0,1,0,0|2,0,0]=4 17007 B11R1.17 COCCC1CCCCN1C 269982a_100015186528_200000210301 [0,1,0,1,0,0|2,0,0]=4 17008 B11R1.17 COCCC1CCCCN1C 34a_100015186528_200000210301 [0,1,0,1,0,0|2,0,0]=4 17009 B11R1.17 COCCC1CCCCN1C 34a_100138415774_100000211948 [0,1,0,1,0,0|2,0,0]=4 17010 B11R1.17 COCCC1CCCCN1[13CH3] 2230a_100015186528_200025704644 [0,1,0,1,0,0|2,0,0]=4 17011 B11R1.17 COCCC1CCCCN1[13CH3] 269982a_100015186528_200025704644 [0,1,0,1,0,0|2,0,0]=4 17012 B11R1.17 COCCC1CCCCN1[13CH3] 34a_100015186528_200025704644 [0,1,0,1,0,0|2,0,0]=4 17013 B11R1.17 COCCN1CCCCC1C 2230a_100000211376_100011201679 [0,1,0,1,0,0|2,0,0]=4 17014 B11R1.17 COCCN1CCCCC1C 269982a_100000211376_100000233755 [0,1,0,1,0,0|2,0,0]=4 17015 B11R1.17 COCCN1CCCCC1C 34a_100000211376_100011201679 [0,1,0,1,0,0|2,0,0]=4 17016 B11R1.17 COCCN1CCCCC1C 34a_100011305533_200000210301 [0,1,0,1,0,0|2,0,0]=4 17017 B11R1.17 COCCN1CCOC[C@@H]1C 2230a_100009815349_100011201679 [0,1,0,1,0,0|1,0,0]=3 17018 B11R1.17 COCCN1CCOC[C@@H]1C 269982a_100009815349_100000233755 [0,1,0,1,0,0|1,0,0]=3 17019 B11R1.17 COCCN1CCOC[C@@H]1C 34a_100009815349_100011201679 [0,1,0,1,0,0|1,0,0]=3 17020 B11R1.17 COCNC1CCCCC1C 2230a_100000211402_100000766300 [0,1,0,1,0,0|2,0,0]=4 17021 B11R1.17 COCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100000766300 [0,1,0,1,0,0|2,0,0]=4 17022 B11R1.17 COCN[C@H]1CCOC[C@@H]1F 2230a_100016994078_100000766300 [0,1,0,1,0,0|2,0,0]=4 17023 B11R1.17 CSCCN1CCOC[C@@H]1C 2230a_100009815349_100000751147 [0,1,0,1,0,0|1,1,0]=4 17024 B11R1.17 CSCCN1CCOC[C@@H]1C 269982a_100009815349_100000212216 [0,1,0,1,0,0|1,1,0]=4 17025 B11R1.17 CSCCN1CCOC[C@@H]1C 34a_100009815349_100000212216 [0,1,0,1,0,0|1,1,0]=4 17026 B11R1.17 CSCOC1CCCCC1C 34a_100000211207_100011218213 [0,1,0,1,0,0|2,0,0]=4 17027 B11R1.17 CSCOC1CNCCC1C 34a_100000696640_100011218213 [0,1,0,1,0,0|2,0,0]=4 17028 B11R1.17 CSCO[C@H]1COCC[C@H]1N 34a_100016994285_100011218213 [0,1,0,1,0,0|2,0,0]=4 17029 B11R1.17 NC1CCOCC1COCF 34a_214813039666_100015361967 [0,1,0,1,0,0|2,0,0]=4 17030 B11R1.17 NCCOC1COCCC1=O 34a_100000210304_100012180262 [0,1,0,1,0,0|2,0,0]=4 17031 B11R1.17 N[C@@H]1CCOC[C@@H]1OCCF 34a_100016994285_100011217306 [0,1,0,1,0,0|2,0,0]=4 17032 B11R1.17 N[C@@H]1CCOC[C@@H]1OCCO 34a_100016994285_100000211926 [0,1,0,1,0,0|2,0,0]=4 17033 B11R1.17 O=C1CCOCC1OCCBr 34a_100000211926_100012180262 [0,1,0,1,0,0|2,0,0]=4 17034 B11R1.18 CCC1CCCN1CCOC 2230a_100000754278_100011201679 [0,1,0,1,0,0|2,0,0]=4 17035 B11R1.18 CCC1CCCN1CCOC 269982a_100000754278_100000233755 [0,1,0,1,0,0|2,0,0]=4 17036 B11R1.18 CCC1CCCN1CCOC 34a_100000754278_100011201679 [0,1,0,1,0,0|2,0,0]=4 17037 B11R1.18 CCN1CCC[C@@H]1COCF 34a_100011739246_100015361967 [0,1,0,1,0,0|2,0,0]=4 17038 B11R1.18 CCN1CCC[C@@H]1COCF 7a_100011739246_100015361967 [0,1,0,1,0,0|2,0,0]=4 17039 B11R1.18 CCOCN1CCCC1CC 269982a_100000754278_100000739092 [0,1,0,1,0,0|2,0,0]=4 17040 B11R1.18 CCOC[C@H]1CCCN1CC 34a_100011739246_100000210202 [0,1,0,1,0,0|2,0,0]=4 17041 B11R1.18 CCOC[C@H]1CCCN1CC 7a_100011739246_100000210202 [0,1,0,1,0,0|2,0,0]=4 17042 B11R1.18 COCCN1CCC[C@@H]1CO 2230a_100000745186_100011201679 [0,1,0,1,0,0|2,0,0]=4 17043 B11R1.18 COCCN1CCC[C@@H]1CO 269982a_100000745186_100000233755 [0,1,0,1,0,0|2,0,0]=4 17044 B11R1.18 COCCN1CCC[C@@H]1CO 34a_100000745186_100011201679 [0,1,0,1,0,0|2,0,0]=4 17045 B11R1.28 BrCCCOC1CCCOC1 34a_100011217188_100000693364 [0,1,0,1,0,0|2,0,0]=4 17046 B11R1.28 BrCCOCC1CCCCC1 34a_100000211926_100000211423 [0,1,0,1,0,0|2,0,0]=4 17047 B11R1.28 BrCCOCC1CCCCO1 34a_100000211926_100000211543 [0,1,0,1,0,0|1,0,0]=3 17048 B11R1.28 BrCCOCC1CCCOC1 34a_100000211926_100000741521 [0,1,0,1,0,0|1,0,0]=3 17049 B11R1.28 C#CCCOC1CCCOC1 34a_100000754041_100000688953 [0,1,0,1,0,0|1,0,1]=4 17050 B11R1.28 C#CCCOC1CCCOC1 34a_100011215631_100000693364 [0,1,0,1,0,0|1,0,1]=4 17051 B11R1.28 C#CCCOC1CCOCC1 34a_100000744328_100000688953 [0,1,0,1,0,0|1,0,1]=4 17052 B11R1.28 C#CCNC[C@H]1COCCO1 2230a_100010981119_100000038162 [0,1,0,1,0,0|1,0,1]=4 17053 B11R1.28 C#CCNC[C@H]1COCCO1 34a_100010981119_100000184674 [0,1,0,1,0,0|1,0,1]=4 17054 B11R1.28 C#CCOCC1CCCCO1 34a_100000210247_100000211543 [0,1,0,1,0,0|1,0,1]=4 17055 B11R1.28 C#CCOCC1CCCCO1 34a_100000211370_100000184674 [0,1,0,1,0,0|1,0,1]=4 17056 B11R1.28 C#CCOCC1CCCCO1 7a_100000211370_100000038162 [0,1,0,1,0,0|1,0,1]=4 17057 B11R1.28 C#CCOCC1CCCOC1 34a_100000210247_100000741521 [0,1,0,1,0,0|1,0,1]=4 17058 B11R1.28 C#CCOCC1CCCOC1 34a_100000741520_100000184674 [0,1,0,1,0,0|1,0,1]=4 17059 B11R1.28 C#CCOC[C@@H]1CNCCO1 34a_100015189573_100000184674 [0,1,0,1,0,0|1,0,1]=4 17060 B11R1.28 C#CCOC[C@@H]1COCCN1 34a_100000717676_100000184674 [0,1,0,1,0,0|1,0,1]=4 17061 B11R1.28 C#CCOC[C@H]1COCCO1 34a_100009875890_100000184674 [0,1,0,1,0,0|0,0,1]=3 17062 B11R1.28 C/C=C/COC1CCCOC1 34a_100000754041_100102629194 [0,1,0,1,0,0|1,0,1]=4 17063 B11R1.28 C/C=C/COC1CCCOC1 34a_100016270725_100000693364 [0,1,0,1,0,0|1,0,1]=4 17064 B11R1.28 C/C=C/COC1CCOCC1 34a_100000744328_100102629194 [0,1,0,1,0,0|1,0,1]=4 17065 B11R1.28 C=CCCOC1CCCOC1 34a_100000754041_100000754431 [0,1,0,1,0,0|1,0,1]=4 17066 B11R1.28 C=CCCOC1CCCOC1 34a_100011205117_100000693364 [0,1,0,1,0,0|1,0,1]=4 17067 B11R1.28 C=CCCOC1CCOCC1 34a_100000744328_100000754431 [0,1,0,1,0,0|1,0,1]=4 17068 B11R1.28 C=CCNC[C@H]1COCCO1 2230a_100010981119_100000210623 [0,1,0,1,0,0|1,0,1]=4 17069 B11R1.28 C=CCNC[C@H]1COCCO1 34a_100010981119_100015514636 [0,1,0,1,0,0|1,0,1]=4 17070 B11R1.28 C=CCOCC1CCCCO1 34a_100000211370_100015514636 [0,1,0,1,0,0|1,0,1]=4 17071 B11R1.28 C=CCOCC1CCCCO1 34a_200000210373_100000211543 [0,1,0,1,0,0|1,0,1]=4 17072 B11R1.28 C=CCOCC1CCCCO1 7a_100000211370_100015514636 [0,1,0,1,0,0|1,0,1]=4 17073 B11R1.28 C=CCOCC1CCCOC1 34a_100000741520_100015514636 [0,1,0,1,0,0|1,0,1]=4 17074 B11R1.28 C=CCOCC1CCCOC1 34a_200000210373_100000741521 [0,1,0,1,0,0|1,0,1]=4 17075 B11R1.28 C=CCOC[C@@H]1CNCCO1 34a_100015189573_100015514636 [0,1,0,1,0,0|1,0,1]=4 17076 B11R1.28 C=CCOC[C@@H]1COCCN1 34a_100000717676_100015514636 [0,1,0,1,0,0|1,0,1]=4 17077 B11R1.28 C=CCOC[C@H]1COCCO1 34a_100009875890_100015514636 [0,1,0,1,0,0|0,0,1]=3 17078 B11R1.28 C=COCCN1CCOCC1 2230a_100015191051_100000039644 [0,1,0,1,0,0|1,0,1]=4 17079 B11R1.28 C=COCCN1CCOCC1 269982a_100015191051_100000039644 [0,1,0,1,0,0|1,0,1]=4 17080 B11R1.28 C=COCCN1CCOCC1 34a_100015191051_100000039644 [0,1,0,1,0,0|1,0,1]=4 17081 B11R1.28 CC#CCOC1CCCOC1 34a_100000754041_100000748600 [0,1,0,1,0,0|1,0,1]=4 17082 B11R1.28 CC#CCOC1CCCOC1 34a_100000761923_100000693364 [0,1,0,1,0,0|1,0,1]=4 17083 B11R1.28 CC#CCOC1CCOCC1 34a_100000744328_100000748600 [0,1,0,1,0,0|1,0,1]=4 17084 B11R1.28 CC=CCOC1CCCOC1 34a_100000754041_100000070051 [0,1,0,1,0,0|1,0,1]=4 17085 B11R1.28 CC=CCOC1CCOCC1 34a_100000744328_100000070051 [0,1,0,1,0,0|1,0,1]=4 17086 B11R1.28 CCCCCN1CCCOC1 2230a_100000131196_100000210326 [0,1,0,1,0,0|2,0,0]=4 17087 B11R1.28 CCCCCN1CCCOC1 269982a_100000131196_100000210215 [0,1,0,1,0,0|2,0,0]=4 17088 B11R1.28 CCCCCN1CCCOC1 34a_100000131196_100000718602 [0,1,0,1,0,0|2,0,0]=4 17089 B11R1.28 CCCCCN1CCOCC1 2230a_100015191051_100000210326 [0,1,0,1,0,0|2,0,0]=4 17090 B11R1.28 CCCCCN1CCOCC1 269982a_100015191051_100000210215 [0,1,0,1,0,0|2,0,0]=4 17091 B11R1.28 CCCCCN1CCOCC1 34a_100015191051_100000718602 [0,1,0,1,0,0|2,0,0]=4 17092 B11R1.28 CCCCNC1CCCOC1 2230a_100000719290_100000210211 [0,1,0,1,0,0|2,0,0]=4 17093 B11R1.28 CCCCNC1CCCOC1 270004a_100000102301_100000753404 [0,1,0,1,0,0|2,0,0]=4 17094 B11R1.28 CCCCNC1CCCOC1 34a_100000719290_100000210210 [0,1,0,1,0,0|2,0,0]=4 17095 B11R1.28 CCCCNC1CCCOC1 7a_106832991798_100000693364 [0,1,0,1,0,0|2,0,0]=4 17096 B11R1.28 CCCCNC1CCOCC1 2230a_100000741149_100000210211 [0,1,0,1,0,0|2,0,0]=4 17097 B11R1.28 CCCCNC1CCOCC1 270004a_100000102301_100011217826 [0,1,0,1,0,0|2,0,0]=4 17098 B11R1.28 CCCCNC1CCOCC1 34a_100000741149_100000210210 [0,1,0,1,0,0|2,0,0]=4 17099 B11R1.28 CCCCNC1CCOCC1 7a_106832991798_100000686592 [0,1,0,1,0,0|2,0,0]=4 17100 B11R1.28 CCCCOC1CC=CCC1 34a_100000073881_100000210210 [0,1,0,1,0,0|2,0,0]=4 17101 B11R1.28 CCCCOC1CCCCC1 34a_100000210227_100000210327 [0,1,0,1,0,0|2,0,0]=4 17102 B11R1.28 CCCCOC1CCCCC1 34a_100000210231_100000210210 [0,1,0,1,0,0|2,0,0]=4 17103 B11R1.28 CCCCOC1CCCCC1 7a_100000210227_100000210327 [0,1,0,1,0,0|2,0,0]=4 17104 B11R1.28 CCCCOC1CCCCC1 7a_100000210231_100000210211 [0,1,0,1,0,0|2,0,0]=4 17105 B11R1.28 CCCCOC1CCCCO1 34a_100000033831_100000210210 [0,1,0,1,0,0|2,0,0]=4 17106 B11R1.28 CCCCOC1CCCOC1 34a_100000210227_100000693364 [0,1,0,1,0,0|1,0,0]=3 17107 B11R1.28 CCCCOC1CCCOC1 34a_100000754041_100000210210 [0,1,0,1,0,0|1,0,0]=3 17108 B11R1.28 CCCCOC1CCCOC1 7a_100000210227_100000693364 [0,1,0,1,0,0|1,0,0]=3 17109 B11R1.28 CCCCOC1CCCSC1 7a_100015962668_100000210211 [0,1,0,1,0,0|1,1,0]=4 17110 B11R1.28 CCCCOC1CCOCC1 34a_100000744328_100000210210 [0,1,0,1,0,0|1,0,0]=3 17111 B11R1.28 CCCCOC1CCOCC1 7a_100000210227_100000686592 [0,1,0,1,0,0|1,0,0]=3 17112 B11R1.28 CCCCOC1CCSCC1 34a_100000210227_100000069128 [0,1,0,1,0,0|1,1,0]=4 17113 B11R1.28 CCCCOC1CCSCC1 34a_100000731022_100000210210 [0,1,0,1,0,0|1,1,0]=4 17114 B11R1.28 CCCCOC1CCSCC1 7a_100000210227_100011500858 [0,1,0,1,0,0|1,1,0]=4 17115 B11R1.28 CCCCOC1CCSCC1 7a_100000731022_100000210211 [0,1,0,1,0,0|1,1,0]=4 17116 B11R1.28 CCCCSC1CCCOC1 62a_100000210211_100000693364 [0,1,0,1,0,0|1,1,0]=4 17117 B11R1.28 CCCCSC1CCOCC1 62a_100000210211_100011324220 [0,1,0,1,0,0|1,1,0]=4 17118 B11R1.28 CCCNCC1CCCCO1 2230a_100000174945_100000210303 [0,1,0,1,0,0|2,0,0]=4 17119 B11R1.28 CCCNCC1CCCCO1 34a_100000174945_100000210303 [0,1,0,1,0,0|2,0,0]=4 17120 B11R1.28 CCCNCC1CCCOC1 2230a_100000720124_100000210303 [0,1,0,1,0,0|2,0,0]=4 17121 B11R1.28 CCCNCC1CCCOC1 34a_100000720124_100000210303 [0,1,0,1,0,0|2,0,0]=4 17122 B11R1.28 CCCNCC1CCOCC1 2230a_100000746373_100000210303 [0,1,0,1,0,0|2,0,0]=4 17123 B11R1.28 CCCNCC1CCOCC1 269862a_100020643023_100000749017 [0,1,0,1,0,0|2,0,0]=4 17124 B11R1.28 CCCNCC1CCOCC1 34a_100000746373_100000210303 [0,1,0,1,0,0|2,0,0]=4 17125 B11R1.28 CCCNC[C@H]1COCCO1 2230a_100010981119_100000210303 [0,1,0,1,0,0|1,0,0]=3 17126 B11R1.28 CCCNC[C@H]1COCCO1 34a_100010981119_100000210303 [0,1,0,1,0,0|1,0,0]=3 17127 B11R1.28 CCCOCC1CCCCC1 34a_100000210258_100000211423 [0,1,0,1,0,0|2,0,0]=4 17128 B11R1.28 CCCOCC1CCCCC1 34a_100000212181_100000210303 [0,1,0,1,0,0|2,0,0]=4 17129 B11R1.28 CCCOCC1CCCCC1 7a_100000212181_100000210303 [0,1,0,1,0,0|2,0,0]=4 17130 B11R1.28 CCCOCC1CCCCN1 34a_100000210821_100000210303 [0,1,0,1,0,0|2,0,0]=4 17131 B11R1.28 CCCOCC1CCCCO1 34a_100000210258_100000211543 [0,1,0,1,0,0|1,0,0]=3 17132 B11R1.28 CCCOCC1CCCCO1 34a_100000211370_100000210303 [0,1,0,1,0,0|1,0,0]=3 17133 B11R1.28 CCCOCC1CCCCO1 7a_100000211370_100000210303 [0,1,0,1,0,0|1,0,0]=3 17134 B11R1.28 CCCOCC1CCCNC1 34a_100000211344_100000210303 [0,1,0,1,0,0|2,0,0]=4 17135 B11R1.28 CCCOCC1CCCOC1 34a_100000210258_100000741521 [0,1,0,1,0,0|1,0,0]=3 17136 B11R1.28 CCCOCC1CCCOC1 34a_100000741520_100000210303 [0,1,0,1,0,0|1,0,0]=3 17137 B11R1.28 CCCOCC1CCOCC1 34a_100000210258_100000754603 [0,1,0,1,0,0|2,0,0]=4 17138 B11R1.28 CCCOCC1CCOCC1 34a_100000749013_100000210303 [0,1,0,1,0,0|2,0,0]=4 17139 B11R1.28 CCCOC[C@@H]1CNCCO1 34a_100015189573_100000210303 [0,1,0,1,0,0|1,0,0]=3 17140 B11R1.28 CCCOC[C@@H]1COCCN1 34a_100000717676_100000210303 [0,1,0,1,0,0|1,0,0]=3 17141 B11R1.28 CCCOC[C@H]1COCCO1 34a_100009875890_100000210303 [0,1,0,1,0,0|0,0,0]=2 17142 B11R1.28 CCCSCC1CCCCO1 62a_100000210303_100000211543 [0,1,0,1,0,0|1,1,0]=4 17143 B11R1.28 CCCSCC1CCCCO1 62a_100000211543_100000210303 [0,1,0,1,0,0|1,1,0]=4 17144 B11R1.28 CCCSCC1CCCOC1 62a_100000210303_100000741521 [0,1,0,1,0,0|1,1,0]=4 17145 B11R1.28 CCCSCC1CCCOC1 62a_100000741521_100000210303 [0,1,0,1,0,0|1,1,0]=4 17146 B11R1.28 CCCSCC1CCOCC1 62a_100000210303_100000749018 [0,1,0,1,0,0|2,0,0]=4 17147 B11R1.28 CCCSCC1CCOCC1 62a_100000754603_100000210303 [0,1,0,1,0,0|2,0,0]=4 17148 B11R1.28 CCNCCC1CCCCO1 2230a_100015183643_100000210202 [0,1,0,1,0,0|2,0,0]=4 17149 B11R1.28 CCNCCC1CCCCO1 34a_100015183643_100000210202 [0,1,0,1,0,0|2,0,0]=4 17150 B11R1.28 CCNCCC1CCOCC1 2230a_100000755988_100000210202 [0,1,0,1,0,0|2,0,0]=4 17151 B11R1.28 CCNCCC1CCOCC1 2230a_100015525214_100011934994 [0,1,0,1,0,0|2,0,0]=4 17152 B11R1.28 CCNCCC1CCOCC1 34a_100000755988_100000210202 [0,1,0,1,0,0|2,0,0]=4 17153 B11R1.28 CCNCCN1CCOCC1 2230a_100015525214_100025781966 [0,1,0,1,0,0|2,0,0]=4 17154 B11R1.28 CCOCCC1CCCCC1 34a_100011217863_100000210202 [0,1,0,1,0,0|2,0,0]=4 17155 B11R1.28 CCOCCC1CCCCC1 34a_100121572206_100011209188 [0,1,0,1,0,0|2,0,0]=4 17156 B11R1.28 CCOCCC1CCCCC1 7a_100011217863_100000210202 [0,1,0,1,0,0|2,0,0]=4 17157 B11R1.28 CCOCCC1CCCCN1 34a_100000211664_100000210202 [0,1,0,1,0,0|2,0,0]=4 17158 B11R1.28 CCOCCC1CCCNC1 34a_100000752241_100000210202 [0,1,0,1,0,0|2,0,0]=4 17159 B11R1.28 CCOCCC1CCNCC1 34a_100015190746_100000210202 [0,1,0,1,0,0|2,0,0]=4 17160 B11R1.28 CCOCCC1CCOCC1 34a_100011933979_100000210202 [0,1,0,1,0,0|1,0,0]=3 17161 B11R1.28 CCOCCC1CCOCC1 34a_100121572206_100011934994 [0,1,0,1,0,0|1,0,0]=3 17162 B11R1.28 CCOCCC1CCOCC1 7a_100011933979_100000210202 [0,1,0,1,0,0|1,0,0]=3 17163 B11R1.28 CCOCCC1OCCCO1 34a_100121572206_100000764188 [0,1,0,1,0,0|2,0,0]=4 17164 B11R1.28 CCOCCN1CC=CCC1 2230a_100000698166_100011215890 [0,1,0,1,0,0|2,0,0]=4 17165 B11R1.28 CCOCCN1CC=CCC1 269982a_100000698166_100011215890 [0,1,0,1,0,0|2,0,0]=4 17166 B11R1.28 CCOCCN1CC=CCC1 34a_100000698166_100000210147 [0,1,0,1,0,0|2,0,0]=4 17167 B11R1.28 CCOCCN1CCCCC1 34a_100121572206_100000739454 [0,1,0,1,0,0|2,0,0]=4 17168 B11R1.28 CCOCCN1CCCOC1 2230a_100000131196_100011215890 [0,1,0,1,0,0|1,0,0]=3 17169 B11R1.28 CCOCCN1CCCOC1 269982a_100000131196_100011215890 [0,1,0,1,0,0|1,0,0]=3 17170 B11R1.28 CCOCCN1CCCOC1 34a_100000131196_100000210147 [0,1,0,1,0,0|1,0,0]=3 17171 B11R1.28 CCOCCN1CCOCC1 2230a_100015191051_100011215890 [0,1,0,1,0,0|1,0,0]=3 17172 B11R1.28 CCOCCN1CCOCC1 269982a_100015191051_100011215890 [0,1,0,1,0,0|1,0,0]=3 17173 B11R1.28 CCOCCN1CCOCC1 34a_100015191051_100000210147 [0,1,0,1,0,0|1,0,0]=3 17174 B11R1.28 CCOCCN1CCSCC1 2230a_100000737611_100011215890 [0,1,0,1,0,0|1,1,0]=4 17175 B11R1.28 CCOCCN1CCSCC1 269982a_100000737611_100011215890 [0,1,0,1,0,0|1,1,0]=4 17176 B11R1.28 CCOCCN1CCSCC1 7a_100000686052_100000210202 [0,1,0,1,0,0|1,1,0]=4 17177 B11R1.28 CCOCC[C@@H]1CNCCN1 34a_100016989929_100000210202 [0,1,0,1,0,0|2,0,0]=4 17178 B11R1.28 CCOCOC1CCCCC1 34a_100121572206_100011935260 [0,1,0,1,0,0|2,0,0]=4 17179 B11R1.28 CCOCSC1CCCCC1 62a_100000210327_100000739092 [0,1,0,1,0,0|2,0,0]=4 17180 B11R1.28 CCOCSC1CCCCC1 62a_100000739092_100000210327 [0,1,0,1,0,0|2,0,0]=4 17181 B11R1.28 CCOCSC1CCCOC1 62a_100000739092_100000693364 [0,1,0,1,0,0|1,0,0]=3 17182 B11R1.28 CCOCSC1CCOCC1 62a_100000739092_100011324220 [0,1,0,1,0,0|2,0,0]=4 17183 B11R1.28 CCSCCC1CCOCC1 62a_100000210202_100011934994 [0,1,0,1,0,0|1,1,0]=4 17184 B11R1.28 CCSCCC1CCOCC1 62a_100011934994_100000210202 [0,1,0,1,0,0|1,1,0]=4 17185 B11R1.28 CCSCCN1CCCOC1 2230a_100000131196_100000757381 [0,1,0,1,0,0|1,1,0]=4 17186 B11R1.28 CCSCCN1CCCOC1 269982a_100000131196_100000757381 [0,1,0,1,0,0|1,1,0]=4 17187 B11R1.28 CCSCCN1CCCOC1 34a_100000131196_100000757381 [0,1,0,1,0,0|1,1,0]=4 17188 B11R1.28 CCSCCN1CCOCC1 2230a_100015191051_100000757381 [0,1,0,1,0,0|1,1,0]=4 17189 B11R1.28 CCSCCN1CCOCC1 269982a_100015191051_100000757381 [0,1,0,1,0,0|1,1,0]=4 17190 B11R1.28 CCSCCN1CCOCC1 34a_100015191051_100000757381 [0,1,0,1,0,0|1,1,0]=4 17191 B11R1.28 CCSCCN1CCOCC1 62a_100000210202_100000211760 [0,1,0,1,0,0|1,1,0]=4 17192 B11R1.28 CNCCCN1CCOCC1 2230a_106832991635_100000748698 [0,1,0,1,0,0|2,0,0]=4 17193 B11R1.28 CNCCCN1CCOCC1 34a_100102657272_100000748698 [0,1,0,1,0,0|2,0,0]=4 17194 B11R1.28 CNCCCN1CCOCC1 7a_106832991635_100000748698 [0,1,0,1,0,0|2,0,0]=4 17195 B11R1.28 CNCCOC1CCCCC1 2230a_106832991635_100011211530 [0,1,0,1,0,0|2,0,0]=4 17196 B11R1.28 CNCCOC1CCCCC1 34a_100015206981_200000210301 [0,1,0,1,0,0|2,0,0]=4 17197 B11R1.28 CNCCOC1CCCCC1 34a_100102657272_100011211530 [0,1,0,1,0,0|2,0,0]=4 17198 B11R1.28 CNCCOC1CCCCC1 7a_106832991635_100011211530 [0,1,0,1,0,0|2,0,0]=4 17199 B11R1.28 CNCCOC1CCCCO1 2230a_106832991635_100000744793 [0,1,0,1,0,0|2,0,0]=4 17200 B11R1.28 CNCCOC1CCCCO1 34a_100102657272_100000744793 [0,1,0,1,0,0|2,0,0]=4 17201 B11R1.28 CNCCOC1CCCCO1 7a_106832991635_100000744793 [0,1,0,1,0,0|2,0,0]=4 17202 B11R1.28 COCCCC1CCCCC1 34a_100000198086_200000210301 [0,1,0,1,0,0|2,0,0]=4 17203 B11R1.28 COCCCC1CCCCC1 34a_100138415774_100011713725 [0,1,0,1,0,0|2,0,0]=4 17204 B11R1.28 COCCCC1CCCCC1 7a_100000198086_200000210301 [0,1,0,1,0,0|2,0,0]=4 17205 B11R1.28 COCCCC1CCCCN1 34a_100011934581_200000210301 [0,1,0,1,0,0|2,0,0]=4 17206 B11R1.28 COCCCC1CCCNC1 34a_100150707839_200000210301 [0,1,0,1,0,0|2,0,0]=4 17207 B11R1.28 COCCCC1CCNCC1 34a_100016988962_200000210301 [0,1,0,1,0,0|2,0,0]=4 17208 B11R1.28 COCCCN1CCCCC1 34a_100000212458_200000210301 [0,1,0,1,0,0|2,0,0]=4 17209 B11R1.28 COCCCN1CCCCC1 34a_100138415774_100000690320 [0,1,0,1,0,0|2,0,0]=4 17210 B11R1.28 COCCCN1CCCOC1 2230a_100000131196_100000740836 [0,1,0,1,0,0|2,0,0]=4 17211 B11R1.28 COCCCN1CCCOC1 269982a_100000131196_100000740836 [0,1,0,1,0,0|2,0,0]=4 17212 B11R1.28 COCCCN1CCCOC1 34a_100000131196_100000740836 [0,1,0,1,0,0|2,0,0]=4 17213 B11R1.28 COCCCN1CCOCC1 2230a_100015191051_100000740836 [0,1,0,1,0,0|1,0,0]=3 17214 B11R1.28 COCCCN1CCOCC1 269982a_100015191051_100000740836 [0,1,0,1,0,0|1,0,0]=3 17215 B11R1.28 COCCCN1CCOCC1 34a_100000212840_200000210301 [0,1,0,1,0,0|1,0,0]=3 17216 B11R1.28 COCCCN1CCOCC1 34a_100015191051_100000740836 [0,1,0,1,0,0|1,0,0]=3 17217 B11R1.28 COCCCN1CCOCC1 34a_100138415774_100000748698 [0,1,0,1,0,0|1,0,0]=3 17218 B11R1.28 COCCCN1CCSCC1 2230a_100000737611_100000740836 [0,1,0,1,0,0|1,1,0]=4 17219 B11R1.28 COCCCN1CCSCC1 269982a_100000737611_100000740836 [0,1,0,1,0,0|1,1,0]=4 17220 B11R1.28 COCCNC1CCCCC1 2230a_100000182618_100011201679 [0,1,0,1,0,0|2,0,0]=4 17221 B11R1.28 COCCNC1CCCCC1 270004a_100000209980_100000210434 [0,1,0,1,0,0|2,0,0]=4 17222 B11R1.28 COCCNC1CCCCC1 34a_100000182618_100011201679 [0,1,0,1,0,0|2,0,0]=4 17223 B11R1.28 COCCNC1CCCCC1 34a_100000200466_200000210301 [0,1,0,1,0,0|2,0,0]=4 17224 B11R1.28 COCCNC1CCCOC1 2230a_100000719290_100011201679 [0,1,0,1,0,0|1,0,0]=3 17225 B11R1.28 COCCNC1CCCOC1 270004a_100000209980_100000753404 [0,1,0,1,0,0|1,0,0]=3 17226 B11R1.28 COCCNC1CCCOC1 34a_100000719290_100011201679 [0,1,0,1,0,0|1,0,0]=3 17227 B11R1.28 COCCNC1CCCSC1 270004a_100000209980_100000057913 [0,1,0,1,0,0|1,1,0]=4 17228 B11R1.28 COCCNC1CCNCC1 270004a_100000209980_100015192401 [0,1,0,1,0,0|2,0,0]=4 17229 B11R1.28 COCCNC1CCOCC1 2230a_100000741149_100011201679 [0,1,0,1,0,0|1,0,0]=3 17230 B11R1.28 COCCNC1CCOCC1 270004a_100000209980_100011217826 [0,1,0,1,0,0|1,0,0]=3 17231 B11R1.28 COCCNC1CCOCC1 34a_100000708129_200000210301 [0,1,0,1,0,0|1,0,0]=3 17232 B11R1.28 COCCNC1CCOCC1 34a_100000741149_100011201679 [0,1,0,1,0,0|1,0,0]=3 17233 B11R1.28 COCCNC1CCSCC1 2230a_100000748639_100011201679 [0,1,0,1,0,0|1,1,0]=4 17234 B11R1.28 COCCNC1CCSCC1 270004a_100000209980_100000203788 [0,1,0,1,0,0|1,1,0]=4 17235 B11R1.28 COCCNC1CCSCC1 34a_100000748639_100011201679 [0,1,0,1,0,0|1,1,0]=4 17236 B11R1.28 COCCOC1C=CCCC1 34a_100011215024_100011201679 [0,1,0,1,0,0|1,0,1]=4 17237 B11R1.28 COCCOC1CC=CCC1 34a_100000073881_100011201679 [0,1,0,1,0,0|1,0,0]=3 17238 B11R1.28 COCCOC1CCCCC1 34a_100000210231_100011201679 [0,1,0,1,0,0|1,0,0]=3 17239 B11R1.28 COCCOC1CCCCC1 34a_100000210237_100000210327 [0,1,0,1,0,0|1,0,0]=3 17240 B11R1.28 COCCOC1CCCCC1 34a_100011249652_200000210301 [0,1,0,1,0,0|1,0,0]=3 17241 B11R1.28 COCCOC1CCCCC1 34a_100138415774_100011211530 [0,1,0,1,0,0|1,0,0]=3 17242 B11R1.28 COCCOC1CCCCC1 7a_100000210231_100000233755 [0,1,0,1,0,0|1,0,0]=3 17243 B11R1.28 COCCOC1CCCCC1 7a_100011249652_200000210301 [0,1,0,1,0,0|1,0,0]=3 17244 B11R1.28 COCCOC1CCCCO1 34a_100000033831_100011201679 [0,1,0,1,0,0|1,0,0]=3 17245 B11R1.28 COCCOC1CCCCO1 34a_100000034223_200000210301 [0,1,0,1,0,0|1,0,0]=3 17246 B11R1.28 COCCOC1CCCCO1 34a_100138415774_100000744793 [0,1,0,1,0,0|1,0,0]=3 17247 B11R1.28 COCCOC1CCCCO1 7a_100000034223_200000210301 [0,1,0,1,0,0|1,0,0]=3 17248 B11R1.28 COCCOC1CCCOC1 34a_100000210237_100000693364 [0,1,0,1,0,0|0,0,0]=2 17249 B11R1.28 COCCOC1CCCOC1 34a_100000754041_100011201679 [0,1,0,1,0,0|0,0,0]=2 17250 B11R1.28 COCCOC1CCCSC1 7a_100015962668_100000233755 [0,1,0,1,0,0|0,1,0]=3 17251 B11R1.28 COCCOC1CCOCC1 34a_100000744328_100011201679 [0,1,0,1,0,0|0,0,0]=2 17252 B11R1.28 COCCOC1CCSCC1 34a_100000210237_100000069128 [0,1,0,1,0,0|0,1,0]=3 17253 B11R1.28 COCCOC1CCSCC1 34a_100000731022_100011201679 [0,1,0,1,0,0|0,1,0]=3 17254 B11R1.28 COCCOC1CCSCC1 7a_100000731022_100000233755 [0,1,0,1,0,0|0,1,0]=3 17255 B11R1.28 COCCSC1CCCCC1 62a_100000210327_100000233755 [0,1,0,1,0,0|1,1,0]=4 17256 B11R1.28 COCCSC1CCCCC1 62a_100000233755_100000210327 [0,1,0,1,0,0|1,1,0]=4 17257 B11R1.28 COCCSC1CCCOC1 62a_100000233755_100000693364 [0,1,0,1,0,0|0,1,0]=3 17258 B11R1.28 COCCSC1CCOCC1 62a_100000233755_100011324220 [0,1,0,1,0,0|0,1,0]=3 17259 B11R1.28 COCCSC1CCSCC1 62a_100000233755_100000069128 [0,1,0,1,0,0|0,2,0]=4 17260 B11R1.28 COCNCC1CCCCC1 2230a_100000210473_100000766300 [0,1,0,1,0,0|2,0,0]=4 17261 B11R1.28 COCNCC1CCCCO1 2230a_100000174945_100000766300 [0,1,0,1,0,0|2,0,0]=4 17262 B11R1.28 COCNCC1CCCOC1 2230a_100000720124_100000766300 [0,1,0,1,0,0|2,0,0]=4 17263 B11R1.28 COCNCC1CCOCC1 2230a_100000746373_100000766300 [0,1,0,1,0,0|1,0,0]=3 17264 B11R1.28 COCNCC1CCSCC1 2230a_100015188806_100000766300 [0,1,0,1,0,0|1,1,0]=4 17265 B11R1.28 COCNC[C@H]1COCCO1 2230a_100010981119_100000766300 [0,1,0,1,0,0|1,0,0]=3 17266 B11R1.28 COCSCC1CCCCC1 62a_100000211423_100000766300 [0,1,0,1,0,0|2,0,0]=4 17267 B11R1.28 COCSCC1CCCCC1 62a_100000766300_100000211423 [0,1,0,1,0,0|2,0,0]=4 17268 B11R1.28 COCSCC1CCCCO1 62a_100000211543_100000766300 [0,1,0,1,0,0|1,1,0]=4 17269 B11R1.28 COCSCC1CCCCO1 62a_100000766300_100000211543 [0,1,0,1,0,0|1,1,0]=4 17270 B11R1.28 COCSCC1CCCOC1 62a_100000741521_100000766300 [0,1,0,1,0,0|1,1,0]=4 17271 B11R1.28 COCSCC1CCCOC1 62a_100000766300_100000741521 [0,1,0,1,0,0|1,1,0]=4 17272 B11R1.28 COCSCC1CCOCC1 62a_100000754603_100000766300 [0,1,0,1,0,0|1,0,0]=3 17273 B11R1.28 COCSCC1CCOCC1 62a_100000766300_100000749018 [0,1,0,1,0,0|1,0,0]=3 17274 B11R1.28 CSCCCN1CCOCC1 62a_200000210301_100000748698 [0,1,0,1,0,0|1,1,0]=4 17275 B11R1.28 CSCCNC1CCCOC1 2230a_100000719290_100000751147 [0,1,0,1,0,0|1,1,0]=4 17276 B11R1.28 CSCCNC1CCCOC1 270004a_100020590264_100000753404 [0,1,0,1,0,0|1,1,0]=4 17277 B11R1.28 CSCCNC1CCCOC1 34a_100000719290_100000212216 [0,1,0,1,0,0|1,1,0]=4 17278 B11R1.28 CSCCNC1CCOCC1 2230a_100000741149_100000751147 [0,1,0,1,0,0|1,1,0]=4 17279 B11R1.28 CSCCNC1CCOCC1 270004a_100020590264_100011217826 [0,1,0,1,0,0|1,1,0]=4 17280 B11R1.28 CSCCNC1CCOCC1 34a_100000741149_100000212216 [0,1,0,1,0,0|1,1,0]=4 17281 B11R1.28 CSCCOC1CC=CCC1 34a_100000073881_100000212216 [0,1,0,1,0,0|1,1,0]=4 17282 B11R1.28 CSCCOC1CCCCC1 34a_100000210231_100000212216 [0,1,0,1,0,0|1,1,0]=4 17283 B11R1.28 CSCCOC1CCCCC1 34a_100000230434_100000210327 [0,1,0,1,0,0|1,1,0]=4 17284 B11R1.28 CSCCOC1CCCCC1 62a_100011211530_200000210301 [0,1,0,1,0,0|1,1,0]=4 17285 B11R1.28 CSCCOC1CCCCC1 62a_200000210301_100011211530 [0,1,0,1,0,0|1,1,0]=4 17286 B11R1.28 CSCCOC1CCCCC1 7a_100000210231_100000212216 [0,1,0,1,0,0|1,1,0]=4 17287 B11R1.28 CSCCOC1CCCCC1 7a_100000230434_100000210327 [0,1,0,1,0,0|1,1,0]=4 17288 B11R1.28 CSCCOC1CCCCO1 34a_100000033831_100000212216 [0,1,0,1,0,0|1,1,0]=4 17289 B11R1.28 CSCCOC1CCCCO1 62a_100000744793_200000210301 [0,1,0,1,0,0|1,1,0]=4 17290 B11R1.28 CSCCOC1CCCCO1 62a_200000210301_100000744793 [0,1,0,1,0,0|1,1,0]=4 17291 B11R1.28 CSCCOC1CCCOC1 34a_100000230434_100000693364 [0,1,0,1,0,0|0,1,0]=3 17292 B11R1.28 CSCCOC1CCCOC1 34a_100000754041_100000212216 [0,1,0,1,0,0|0,1,0]=3 17293 B11R1.28 CSCCOC1CCCOC1 7a_100000230434_100000693364 [0,1,0,1,0,0|0,1,0]=3 17294 B11R1.28 CSCCOC1CCCSC1 7a_100015962668_100000212216 [0,1,0,1,0,0|0,2,0]=4 17295 B11R1.28 CSCCOC1CCOCC1 34a_100000744328_100000212216 [0,1,0,1,0,0|0,1,0]=3 17296 B11R1.28 CSCCOC1CCOCC1 7a_100000230434_100000686592 [0,1,0,1,0,0|0,1,0]=3 17297 B11R1.28 CSCCOC1CCSCC1 34a_100000230434_100000069128 [0,1,0,1,0,0|0,2,0]=4 17298 B11R1.28 CSCCOC1CCSCC1 34a_100000731022_100000212216 [0,1,0,1,0,0|0,2,0]=4 17299 B11R1.28 CSCCOC1CCSCC1 7a_100000230434_100011500858 [0,1,0,1,0,0|0,2,0]=4 17300 B11R1.28 CSCCOC1CCSCC1 7a_100000731022_100000212216 [0,1,0,1,0,0|0,2,0]=4 17301 B11R1.28 CSCCSC1CCCOC1 62a_100000212216_100000693364 [0,1,0,1,0,0|0,2,0]=4 17302 B11R1.28 CSCCSC1CCOCC1 62a_100000212216_100011324220 [0,1,0,1,0,0|0,2,0]=4 17303 B11R1.28 CSCNCC1CCCCO1 2230a_100000174945_100011218213 [0,1,0,1,0,0|2,0,0]=4 17304 B11R1.28 CSCNCC1CCCCO1 34a_100000174945_100011218213 [0,1,0,1,0,0|2,0,0]=4 17305 B11R1.28 CSCNCC1CCCOC1 2230a_100000720124_100011218213 [0,1,0,1,0,0|2,0,0]=4 17306 B11R1.28 CSCNCC1CCCOC1 34a_100000720124_100011218213 [0,1,0,1,0,0|2,0,0]=4 17307 B11R1.28 CSCNCC1CCOCC1 2230a_100000746373_100011218213 [0,1,0,1,0,0|1,1,0]=4 17308 B11R1.28 CSCNCC1CCOCC1 34a_100000746373_100011218213 [0,1,0,1,0,0|1,1,0]=4 17309 B11R1.28 CSCNC[C@H]1COCCO1 2230a_100010981119_100011218213 [0,1,0,1,0,0|1,0,0]=3 17310 B11R1.28 CSCNC[C@H]1COCCO1 34a_100010981119_100011218213 [0,1,0,1,0,0|1,0,0]=3 17311 B11R1.28 CSCOCC1CCCCC1 34a_100000212181_100011218213 [0,1,0,1,0,0|2,0,0]=4 17312 B11R1.28 CSCOCC1CCCCN1 34a_100000210821_100011218213 [0,1,0,1,0,0|2,0,0]=4 17313 B11R1.28 CSCOCC1CCCCO1 34a_100000211370_100011218213 [0,1,0,1,0,0|1,0,0]=3 17314 B11R1.28 CSCOCC1CCCNC1 34a_100000211344_100011218213 [0,1,0,1,0,0|2,0,0]=4 17315 B11R1.28 CSCOCC1CCCOC1 34a_100000741520_100011218213 [0,1,0,1,0,0|1,0,0]=3 17316 B11R1.28 CSCOCC1CCOCC1 34a_100000749013_100011218213 [0,1,0,1,0,0|1,1,0]=4 17317 B11R1.28 CSCOC[C@@H]1CNCCO1 34a_100015189573_100011218213 [0,1,0,1,0,0|1,0,0]=3 17318 B11R1.28 CSCOC[C@@H]1COCCN1 34a_100000717676_100011218213 [0,1,0,1,0,0|1,0,0]=3 17319 B11R1.28 CSCOC[C@H]1COCCO1 34a_100009875890_100011218213 [0,1,0,1,0,0|0,0,0]=2 17320 B11R1.28 CSCSCC1CCCCO1 62a_100000211543_100011218213 [0,1,0,1,0,0|1,1,0]=4 17321 B11R1.28 CSCSCC1CCCCO1 62a_100011218213_100000211543 [0,1,0,1,0,0|1,1,0]=4 17322 B11R1.28 CSCSCC1CCCOC1 62a_100000741521_100011218213 [0,1,0,1,0,0|1,1,0]=4 17323 B11R1.28 CSCSCC1CCCOC1 62a_100011218213_100000741521 [0,1,0,1,0,0|1,1,0]=4 17324 B11R1.28 CSCSCC1CCOCC1 62a_100000754603_100011218213 [0,1,0,1,0,0|1,1,0]=4 17325 B11R1.28 CSCSCC1CCOCC1 62a_100011218213_100000749018 [0,1,0,1,0,0|1,1,0]=4 17326 B11R1.28 ClCCCOC1CCCOC1 34a_100000230001_100000693364 [0,1,0,1,0,0|2,0,0]=4 17327 B11R1.28 FCCCCN1CCOCC1 2230a_100015191051_100000729493 [0,1,0,1,0,0|2,0,0]=4 17328 B11R1.28 FCCCCN1CCOCC1 269982a_100015191051_100000729493 [0,1,0,1,0,0|2,0,0]=4 17329 B11R1.28 FCCCCN1CCOCC1 34a_100015191051_100000729493 [0,1,0,1,0,0|2,0,0]=4 17330 B11R1.28 FCCCOC1CCCOC1 34a_100000754041_100011934791 [0,1,0,1,0,0|2,0,0]=4 17331 B11R1.28 FCCCOC1CCCOC1 34a_100000759539_100000693364 [0,1,0,1,0,0|2,0,0]=4 17332 B11R1.28 FCCCOC1CCOCC1 34a_100000744328_100011934791 [0,1,0,1,0,0|2,0,0]=4 17333 B11R1.28 FCCNCC1CCCCO1 2230a_100000174945_100011217306 [0,1,0,1,0,0|2,0,0]=4 17334 B11R1.28 FCCNCC1CCCCO1 34a_100000174945_100011217306 [0,1,0,1,0,0|2,0,0]=4 17335 B11R1.28 FCCNCC1CCCCO1 34a_100000724931_100000211543 [0,1,0,1,0,0|2,0,0]=4 17336 B11R1.28 FCCNCC1CCCOC1 2230a_100000720124_100011217306 [0,1,0,1,0,0|2,0,0]=4 17337 B11R1.28 FCCNCC1CCCOC1 34a_100000720124_100011217306 [0,1,0,1,0,0|2,0,0]=4 17338 B11R1.28 FCCNCC1CCCOC1 34a_100000724931_100000741521 [0,1,0,1,0,0|2,0,0]=4 17339 B11R1.28 FCCNC[C@H]1COCCO1 2230a_100010981119_100011217306 [0,1,0,1,0,0|1,0,0]=3 17340 B11R1.28 FCCNC[C@H]1COCCO1 34a_100010981119_100011217306 [0,1,0,1,0,0|1,0,0]=3 17341 B11R1.28 FCCOCC1CCCCC1 34a_100000212181_100011217306 [0,1,0,1,0,0|2,0,0]=4 17342 B11R1.28 FCCOCC1CCCCC1 7a_100000212181_100011217306 [0,1,0,1,0,0|2,0,0]=4 17343 B11R1.28 FCCOCC1CCCCN1 34a_100000210821_100011217306 [0,1,0,1,0,0|2,0,0]=4 17344 B11R1.28 FCCOCC1CCCCO1 34a_100000211370_100011217306 [0,1,0,1,0,0|1,0,0]=3 17345 B11R1.28 FCCOCC1CCCCO1 7a_100000211370_100011217306 [0,1,0,1,0,0|1,0,0]=3 17346 B11R1.28 FCCOCC1CCCNC1 34a_100000211344_100011217306 [0,1,0,1,0,0|2,0,0]=4 17347 B11R1.28 FCCOCC1CCCOC1 34a_100000741520_100011217306 [0,1,0,1,0,0|1,0,0]=3 17348 B11R1.28 FCCOC[C@@H]1CNCCO1 34a_100015189573_100011217306 [0,1,0,1,0,0|1,0,0]=3 17349 B11R1.28 FCCOC[C@@H]1COCCN1 34a_100000717676_100011217306 [0,1,0,1,0,0|1,0,0]=3 17350 B11R1.28 FCCOC[C@H]1COCCO1 34a_100009875890_100011217306 [0,1,0,1,0,0|0,0,0]=2 17351 B11R1.28 FCCSCC1CCCCO1 62a_100000211543_100011217306 [0,1,0,1,0,0|1,1,0]=4 17352 B11R1.28 FCCSCC1CCCCO1 62a_100011217306_100000211543 [0,1,0,1,0,0|1,1,0]=4 17353 B11R1.28 FCCSCC1CCCOC1 62a_100000741521_100011217306 [0,1,0,1,0,0|1,1,0]=4 17354 B11R1.28 FCCSCC1CCCOC1 62a_100011217306_100000741521 [0,1,0,1,0,0|1,1,0]=4 17355 B11R1.28 FCNCCC1CCOCC1 34a_100000755988_100015361967 [0,1,0,1,0,0|2,0,0]=4 17356 B11R1.28 FCOCCC1CCCCC1 34a_100011217863_100015361967 [0,1,0,1,0,0|2,0,0]=4 17357 B11R1.28 FCOCCC1CCCCC1 7a_100011217863_100015361967 [0,1,0,1,0,0|2,0,0]=4 17358 B11R1.28 FCOCCC1CCNCC1 34a_100015190746_100015361967 [0,1,0,1,0,0|2,0,0]=4 17359 B11R1.28 FCOCCC1CCOCC1 34a_100011933979_100015361967 [0,1,0,1,0,0|1,0,0]=3 17360 B11R1.28 FCOCCC1CCOCC1 7a_100011933979_100015361967 [0,1,0,1,0,0|1,0,0]=3 17361 B11R1.28 FCOCCN1CCSCC1 7a_100000686052_100015361967 [0,1,0,1,0,0|1,1,0]=4 17362 B11R1.28 FCSCCC1CCOCC1 62a_100011934994_100015361967 [0,1,0,1,0,0|1,1,0]=4 17363 B11R1.28 FCSCCC1CCOCC1 62a_100015361967_100011934994 [0,1,0,1,0,0|1,1,0]=4 17364 B11R1.28 FCSCCN1CCOCC1 62a_100015361967_100000211760 [0,1,0,1,0,0|1,1,0]=4 17365 B11R1.28 N#CCNC[C@H]1COCCO1 2230a_100010981119_100011215382 [0,1,0,1,0,0|1,0,1]=4 17366 B11R1.28 N#CCOCC1CCCCO1 7a_100000211370_100011215382 [0,1,0,1,0,0|1,0,1]=4 17367 B11R1.28 NCCCOC1CCCOC1 34a_100000182051_100000693364 [0,1,0,1,0,0|2,0,0]=4 17368 B11R1.28 NCCOCC1CCCCC1 34a_100000210304_100000211423 [0,1,0,1,0,0|2,0,0]=4 17369 B11R1.28 NCCOCC1CCCCO1 34a_100000210304_100000211543 [0,1,0,1,0,0|1,0,0]=3 17370 B11R1.28 NCCOCC1CCCOC1 34a_100000210304_100000741521 [0,1,0,1,0,0|1,0,0]=3 17371 B11R1.28 NOCCOC1CCCCC1 34a_100000700252_100000210327 [0,1,0,1,0,0|2,0,0]=4 17372 B11R1.28 NOCCOC1CCCOC1 34a_100000700252_100000693364 [0,1,0,1,0,0|1,0,0]=3 17373 B11R1.28 NOCCOC1CCSCC1 34a_100000700252_100000069128 [0,1,0,1,0,0|1,1,0]=4 17374 B11R1.28 O=CCNC[C@H]1COCCO1 2230a_100010981119_200015260668 [0,1,0,1,0,0|1,0,1]=4 17375 B11R1.28 O=CCNC[C@H]1COCCO1 34a_100010981119_200009817547 [0,1,0,1,0,0|1,0,1]=4 17376 B11R1.28 O=CCOCC1CCCCO1 34a_100000211370_200009817547 [0,1,0,1,0,0|1,0,1]=4 17377 B11R1.28 O=CCOCC1CCCCO1 7a_100000211370_200015260668 [0,1,0,1,0,0|1,0,1]=4 17378 B11R1.28 O=CCOCC1CCCOC1 34a_100000741520_200009817547 [0,1,0,1,0,0|1,0,1]=4 17379 B11R1.28 O=CCOC[C@@H]1CNCCO1 34a_100015189573_200009817547 [0,1,0,1,0,0|1,0,1]=4 17380 B11R1.28 O=CCOC[C@@H]1COCCN1 34a_100000717676_200009817547 [0,1,0,1,0,0|1,0,1]=4 17381 B11R1.28 O=CCOC[C@H]1COCCO1 34a_100009875890_200009817547 [0,1,0,1,0,0|0,0,1]=3 17382 B11R1.28 OCCCCN1CCOCC1 2230a_100015191051_100000210776 [0,1,0,1,0,0|2,0,0]=4 17383 B11R1.28 OCCCCN1CCOCC1 269982a_100015191051_100000210776 [0,1,0,1,0,0|2,0,0]=4 17384 B11R1.28 OCCCCN1CCOCC1 34a_100015191051_100011216708 [0,1,0,1,0,0|2,0,0]=4 17385 B11R1.28 OCCCOC1CCCOC1 34a_100000754041_100000230001 [0,1,0,1,0,0|2,0,0]=4 17386 B11R1.28 OCCCOC1CCOCC1 34a_100000744328_100000230001 [0,1,0,1,0,0|2,0,0]=4 17387 B11R1.28 OCCNCC1CCCCO1 2230a_100000174945_100000211926 [0,1,0,1,0,0|2,0,0]=4 17388 B11R1.28 OCCNCC1CCCCO1 2230a_100016997473_100000211543 [0,1,0,1,0,0|2,0,0]=4 17389 B11R1.28 OCCNCC1CCCCO1 34a_100000174945_100000211926 [0,1,0,1,0,0|2,0,0]=4 17390 B11R1.28 OCCNCC1CCCCO1 34a_100016990907_100000211543 [0,1,0,1,0,0|2,0,0]=4 17391 B11R1.28 OCCNCC1CCCOC1 2230a_100000720124_100000211926 [0,1,0,1,0,0|2,0,0]=4 17392 B11R1.28 OCCNCC1CCCOC1 2230a_100016997473_100000741521 [0,1,0,1,0,0|2,0,0]=4 17393 B11R1.28 OCCNCC1CCCOC1 34a_100000720124_100000211926 [0,1,0,1,0,0|2,0,0]=4 17394 B11R1.28 OCCNCC1CCCOC1 34a_100016990907_100000741521 [0,1,0,1,0,0|2,0,0]=4 17395 B11R1.28 OCCNC[C@H]1COCCO1 2230a_100010981119_100000211926 [0,1,0,1,0,0|1,0,0]=3 17396 B11R1.28 OCCNC[C@H]1COCCO1 34a_100010981119_100000211926 [0,1,0,1,0,0|1,0,0]=3 17397 B11R1.28 OCCOCC1CCCCC1 34a_100000212181_100000211926 [0,1,0,1,0,0|2,0,0]=4 17398 B11R1.28 OCCOCC1CCCCC1 7a_100000212181_100000211926 [0,1,0,1,0,0|2,0,0]=4 17399 B11R1.28 OCCOCC1CCCCN1 34a_100000210821_100000211926 [0,1,0,1,0,0|2,0,0]=4 17400 B11R1.28 OCCOCC1CCCCO1 34a_100000211370_100000211926 [0,1,0,1,0,0|1,0,0]=3 17401 B11R1.28 OCCOCC1CCCCO1 7a_100000211370_100000211926 [0,1,0,1,0,0|1,0,0]=3 17402 B11R1.28 OCCOCC1CCCNC1 34a_100000211344_100000211926 [0,1,0,1,0,0|2,0,0]=4 17403 B11R1.28 OCCOCC1CCCOC1 34a_100000741520_100000211926 [0,1,0,1,0,0|1,0,0]=3 17404 B11R1.28 OCCOC[C@@H]1CNCCO1 34a_100015189573_100000211926 [0,1,0,1,0,0|1,0,0]=3 17405 B11R1.28 OCCOC[C@@H]1COCCN1 34a_100000717676_100000211926 [0,1,0,1,0,0|1,0,0]=3 17406 B11R1.28 OCCOC[C@H]1COCCO1 34a_100009875890_100000211926 [0,1,0,1,0,0|0,0,0]=2 17407 B11R1.28 OCCSCC1CCCCO1 62a_100000211543_100000211926 [0,1,0,1,0,0|1,1,0]=4 17408 B11R1.28 OCCSCC1CCCCO1 62a_100000211926_100000211543 [0,1,0,1,0,0|1,1,0]=4 17409 B11R1.28 OCCSCC1CCCOC1 62a_100000211926_100000741521 [0,1,0,1,0,0|1,1,0]=4 17410 B11R1.28 OCCSCC1CCCOC1 62a_100000741521_100000211926 [0,1,0,1,0,0|1,1,0]=4 17411 B11R1.28 [13CH3]NCCOC1CCCCC1 34a_100015206981_200025704644 [0,1,0,1,0,0|2,0,0]=4 17412 B11R1.28 [13CH3]OCCCC1CCCCC1 34a_100000198086_200025704644 [0,1,0,1,0,0|2,0,0]=4 17413 B11R1.28 [13CH3]OCCCC1CCCCC1 7a_100000198086_200025704644 [0,1,0,1,0,0|2,0,0]=4 17414 B11R1.28 [13CH3]OCCCC1CCCCN1 34a_100011934581_200025704644 [0,1,0,1,0,0|2,0,0]=4 17415 B11R1.28 [13CH3]OCCCC1CCCNC1 34a_100150707839_200025704644 [0,1,0,1,0,0|2,0,0]=4 17416 B11R1.28 [13CH3]OCCCC1CCNCC1 34a_100016988962_200025704644 [0,1,0,1,0,0|2,0,0]=4 17417 B11R1.28 [13CH3]OCCCN1CCCCC1 34a_100000212458_200025704644 [0,1,0,1,0,0|2,0,0]=4 17418 B11R1.28 [13CH3]OCCCN1CCOCC1 34a_100000212840_200025704644 [0,1,0,1,0,0|1,0,0]=3 17419 B11R1.28 [13CH3]OCCNC1CCCCC1 34a_100000200466_200025704644 [0,1,0,1,0,0|2,0,0]=4 17420 B11R1.28 [13CH3]OCCNC1CCOCC1 34a_100000708129_200025704644 [0,1,0,1,0,0|1,0,0]=3 17421 B11R1.28 [13CH3]OCCOC1CCCCC1 34a_100011249652_200025704644 [0,1,0,1,0,0|1,0,0]=3 17422 B11R1.28 [13CH3]OCCOC1CCCCC1 7a_100011249652_200025704644 [0,1,0,1,0,0|1,0,0]=3 17423 B11R1.28 [13CH3]OCCOC1CCCCO1 34a_100000034223_200025704644 [0,1,0,1,0,0|1,0,0]=3 17424 B11R1.28 [13CH3]OCCOC1CCCCO1 7a_100000034223_200025704644 [0,1,0,1,0,0|1,0,0]=3 17425 B11R1.28 [13CH3]SCCCN1CCOCC1 62a_200025704644_100000748698 [0,1,0,1,0,0|1,1,0]=4 17426 B11R1.28 [13CH3]SCCOC1CCCCC1 62a_100011211530_200025704644 [0,1,0,1,0,0|1,1,0]=4 17427 B11R1.28 [13CH3]SCCOC1CCCCC1 62a_200025704644_100011211530 [0,1,0,1,0,0|1,1,0]=4 17428 B11R1.28 [13CH3]SCCOC1CCCCO1 62a_100000744793_200025704644 [0,1,0,1,0,0|1,1,0]=4 17429 B11R1.28 [13CH3]SCCOC1CCCCO1 62a_200025704644_100000744793 [0,1,0,1,0,0|1,1,0]=4 17430 B11R1.41 CCC1CCCCC1OCF 34a_100000210738_100015361967 [0,1,0,1,0,0|2,0,0]=4 17431 B11R1.41 CCC1CCCCC1OCF 7a_100000210738_100015361967 [0,1,0,1,0,0|2,0,0]=4 17432 B11R1.41 CCC1CCCCN1COC 2230a_100000210034_100000766300 [0,1,0,1,0,0|2,0,0]=4 17433 B11R1.41 CCC1CCCCN1COC 269982a_100000210034_100000766300 [0,1,0,1,0,0|2,0,0]=4 17434 B11R1.41 CCCC1CCCCC1OC 34a_100011217265_200000210301 [0,1,0,1,0,0|2,0,0]=4 17435 B11R1.41 CCCC1CCCCC1OC 7a_100011217265_200000210301 [0,1,0,1,0,0|2,0,0]=4 17436 B11R1.41 CCCC1CCCCC1O[13CH3] 34a_100011217265_200025704644 [0,1,0,1,0,0|2,0,0]=4 17437 B11R1.41 CCCC1CCCCC1O[13CH3] 7a_100011217265_200025704644 [0,1,0,1,0,0|2,0,0]=4 17438 B11R1.41 CCCC1COCCN1CC 2230a_102495339903_100000210202 [0,1,0,1,0,0|2,0,0]=4 17439 B11R1.41 CCCC1COCCN1CC 269982a_102495339903_100000204670 [0,1,0,1,0,0|2,0,0]=4 17440 B11R1.41 CCCC1COCCN1CC 34a_102495339903_100000210202 [0,1,0,1,0,0|2,0,0]=4 17441 B11R1.41 CCCC1COCCN1CF 269982a_102495339903_100015361967 [0,1,0,1,0,0|2,0,0]=4 17442 B11R1.41 CCCC1COCCN1CF 34a_102495339903_100015361967 [0,1,0,1,0,0|2,0,0]=4 17443 B11R1.41 CCCN1CCOC[C@@H]1CC 2230a_100016988097_100000210303 [0,1,0,1,0,0|2,0,0]=4 17444 B11R1.41 CCCN1CCOC[C@@H]1CC 269982a_100016988097_100000210303 [0,1,0,1,0,0|2,0,0]=4 17445 B11R1.41 CCCN1CCOC[C@@H]1CC 34a_100016988097_100000210303 [0,1,0,1,0,0|2,0,0]=4 17446 B11R1.41 CCN1CCCCC1COC 2230a_100015184032_100000210202 [0,1,0,1,0,0|2,0,0]=4 17447 B11R1.41 CCN1CCCCC1COC 269982a_100015184032_100000204670 [0,1,0,1,0,0|2,0,0]=4 17448 B11R1.41 CCN1CCCCC1COC 34a_100000225091_200000210301 [0,1,0,1,0,0|2,0,0]=4 17449 B11R1.41 CCN1CCCCC1COC 34a_100015184032_100000210202 [0,1,0,1,0,0|2,0,0]=4 17450 B11R1.41 CCN1CCCCC1COC 7a_100000225091_200000210301 [0,1,0,1,0,0|2,0,0]=4 17451 B11R1.41 CCN1CCCCC1CO[13CH3] 34a_100000225091_200025704644 [0,1,0,1,0,0|2,0,0]=4 17452 B11R1.41 CCN1CCCCC1CO[13CH3] 7a_100000225091_200025704644 [0,1,0,1,0,0|2,0,0]=4 17453 B11R1.41 CCN1CCOC[C@@H]1COC 2230a_100016989928_100000210202 [0,1,0,1,0,0|1,0,0]=3 17454 B11R1.41 CCN1CCOC[C@@H]1COC 269982a_100016989928_100000204670 [0,1,0,1,0,0|1,0,0]=3 17455 B11R1.41 CCN1CCOC[C@@H]1COC 34a_100016989928_100000210202 [0,1,0,1,0,0|1,0,0]=3 17456 B11R1.41 CCNC1CCCCC1OC 270004a_100015525214_100000740605 [0,1,0,1,0,0|2,0,0]=4 17457 B11R1.41 CCNC1CCCCC1OC 34a_100011208099_100000210202 [0,1,0,1,0,0|2,0,0]=4 17458 B11R1.41 CCNC1CCOCC1OC 270004a_100015525214_100000095984 [0,1,0,1,0,0|1,0,0]=3 17459 B11R1.41 CCOC1CCCCC1CC 34a_100000210738_100000210202 [0,1,0,1,0,0|2,0,0]=4 17460 B11R1.41 CCOC1CCCCC1CC 7a_100000210738_100000210202 [0,1,0,1,0,0|2,0,0]=4 17461 B11R1.41 CCOC1CCCCC1CN 34a_100011216029_100000210202 [0,1,0,1,0,0|2,0,0]=4 17462 B11R1.41 CCOC1CCCCC1NC 270004a_106832991635_200000031474 [0,1,0,1,0,0|2,0,0]=4 17463 B11R1.41 CCO[C@@H]1CCCC[C@H]1NC 34a_100000708425_100000210202 [0,1,0,1,0,0|2,0,0]=4 17464 B11R1.41 CCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000210202 [0,1,0,1,0,0|1,0,0]=3 17465 B11R1.41 CCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000210202 [0,1,0,1,0,0|1,0,0]=3 17466 B11R1.41 CC[C@H]1COCCN1CCF 2230a_100016988097_100011217306 [0,1,0,1,0,0|2,0,0]=4 17467 B11R1.41 CC[C@H]1COCCN1CCF 269982a_100016988097_100011217306 [0,1,0,1,0,0|2,0,0]=4 17468 B11R1.41 CC[C@H]1COCCN1CCF 34a_100016988097_100011217306 [0,1,0,1,0,0|2,0,0]=4 17469 B11R1.41 CC[C@H]1COCCN1CCO 2230a_100016988097_100000211926 [0,1,0,1,0,0|2,0,0]=4 17470 B11R1.41 CC[C@H]1COCCN1CCO 269982a_100016988097_100000211926 [0,1,0,1,0,0|2,0,0]=4 17471 B11R1.41 CC[C@H]1COCCN1CCO 34a_100016988097_100000211926 [0,1,0,1,0,0|2,0,0]=4 17472 B11R1.41 CC[C@H]1COCCN1COC 2230a_100016988097_100000766300 [0,1,0,1,0,0|2,0,0]=4 17473 B11R1.41 CC[C@H]1COCCN1COC 269982a_100016988097_100000766300 [0,1,0,1,0,0|2,0,0]=4 17474 B11R1.41 CC[C@H]1COCCN1CSC 2230a_100016988097_100011218213 [0,1,0,1,0,0|2,0,0]=4 17475 B11R1.41 CC[C@H]1COCCN1CSC 269982a_100016988097_100011218213 [0,1,0,1,0,0|2,0,0]=4 17476 B11R1.41 CC[C@H]1COCCN1CSC 34a_100016988097_100011218213 [0,1,0,1,0,0|2,0,0]=4 17477 B11R1.41 COC[C@H]1COCCN1CF 269982a_100016989928_100015361967 [0,1,0,1,0,0|2,0,0]=4 17478 B11R1.41 COC[C@H]1COCCN1CF 34a_100016989928_100015361967 [0,1,0,1,0,0|2,0,0]=4 17479 B11R1.41 CO[C@H]1CCCC[C@@H]1OCF 34a_200009815850_100015361967 [0,1,0,1,0,0|2,0,0]=4 17480 B11R1.41 CO[C@H]1CCCC[C@@H]1OCF 7a_200009815850_100015361967 [0,1,0,1,0,0|2,0,0]=4 17481 B11R1.47 BrCCCCCOC1CCC1 34a_100000746331_100000749161 [0,1,0,1,0,0|2,0,0]=4 17482 B11R1.47 BrCCCCCOC1COC1 34a_100000746331_100009818527 [0,1,0,1,0,0|1,0,0]=3 17483 B11R1.47 BrCCCCCOC1COC1 7a_100000746331_100009818527 [0,1,0,1,0,0|1,0,0]=3 17484 B11R1.47 BrCCCCOCC1CCC1 34a_100011216708_100000763275 [0,1,0,1,0,0|2,0,0]=4 17485 B11R1.47 BrCCCCOCC1CCO1 34a_100011216708_100000103362 [0,1,0,1,0,0|1,0,0]=3 17486 B11R1.47 BrCCCCOCC1COC1 34a_100011216708_100010264016 [0,1,0,1,0,0|2,0,0]=4 17487 B11R1.47 BrCCOCCOC1CCC1 34a_100000692535_100000749161 [0,1,0,1,0,0|1,0,0]=3 17488 B11R1.47 BrCCOCCOC1COC1 34a_100000692535_100009818527 [0,1,0,1,0,0|0,0,0]=2 17489 B11R1.47 BrCCOCCOC1COC1 7a_100000692535_100009818527 [0,1,0,1,0,0|0,0,0]=2 17490 B11R1.47 C#CCCCCOC1COC1 34a_100000766709_100009818527 [0,1,0,1,0,0|1,0,1]=4 17491 B11R1.47 C#CCCCCOC1COC1 7a_100000766709_100009818527 [0,1,0,1,0,0|1,0,1]=4 17492 B11R1.47 C#CCCCOCC1CCO1 34a_100000039022_100000695029 [0,1,0,1,0,0|1,0,1]=4 17493 B11R1.47 C#CCCCOCC1CCO1 34a_100000215630_100000103362 [0,1,0,1,0,0|1,0,1]=4 17494 B11R1.47 C#CCCCOCC1CCO1 7a_100000215630_100000103362 [0,1,0,1,0,0|1,0,1]=4 17495 B11R1.47 C#CCOCCNC1COC1 2230a_100016991112_100010402529 [0,1,0,1,0,0|1,0,1]=4 17496 B11R1.47 C#CCOCCNC1COC1 34a_100000700922_100009818527 [0,1,0,1,0,0|1,0,1]=4 17497 B11R1.47 C#CCOCCOC1CCC1 34a_100000054580_100000749161 [0,1,0,1,0,0|1,0,1]=4 17498 B11R1.47 C#CCOCCOC1CCC1 34a_100000748187_100010402529 [0,1,0,1,0,0|1,0,1]=4 17499 B11R1.47 C#CCOCCOC1COC1 34a_100000054580_100009818527 [0,1,0,1,0,0|0,0,1]=3 17500 B11R1.47 C#CCOCCOC1COC1 7a_100000054580_100009818527 [0,1,0,1,0,0|0,0,1]=3 17501 B11R1.47 C#CCOCCOC1CSC1 7a_100000072292_100010402529 [0,1,0,1,0,0|0,1,1]=4 17502 B11R1.47 C#CCOCCSC1COC1 62a_100010402529_100009818527 [0,1,0,1,0,0|0,1,1]=4 17503 B11R1.47 C/C=C/CCOCC1CCC1 34a_100016278192_100000763275 [0,1,0,1,0,0|2,0,0]=4 17504 B11R1.47 C/C=C/CCOCC1CCO1 34a_100016278192_100000103362 [0,1,0,1,0,0|1,0,0]=3 17505 B11R1.47 C/C=C/CCOCC1COC1 34a_100016278192_100010264016 [0,1,0,1,0,0|1,0,1]=4 17506 B11R1.47 C=CCCCCOC1COC1 34a_100000766645_100009818527 [0,1,0,1,0,0|1,0,1]=4 17507 B11R1.47 C=CCCCCOC1COC1 7a_100000766645_100009818527 [0,1,0,1,0,0|1,0,1]=4 17508 B11R1.47 C=CCCCOCC1CCO1 34a_100000039022_100000757094 [0,1,0,1,0,0|1,0,1]=4 17509 B11R1.47 C=CCCCOCC1CCO1 34a_100000758997_100000103362 [0,1,0,1,0,0|1,0,1]=4 17510 B11R1.47 C=CCCCOCC1CCO1 7a_100000758997_100000103362 [0,1,0,1,0,0|1,0,1]=4 17511 B11R1.47 C=CCOCCOC1CCC1 34a_100000037705_100000749161 [0,1,0,1,0,0|1,0,1]=4 17512 B11R1.47 C=CCOCCOC1COC1 34a_100000037705_100009818527 [0,1,0,1,0,0|0,0,1]=3 17513 B11R1.47 C=CCOCCOC1COC1 7a_100000037705_100009818527 [0,1,0,1,0,0|0,0,1]=3 17514 B11R1.47 C=COCCNC[C@@H]1CCO1 2230a_100020831831_100000039644 [0,1,0,1,0,0|1,0,1]=4 17515 B11R1.47 C=COCCNC[C@@H]1CCO1 34a_100020831831_100000039644 [0,1,0,1,0,0|1,0,1]=4 17516 B11R1.47 C=COCCOCC1CCC1 34a_100000033082_100000763275 [0,1,0,1,0,0|1,0,1]=4 17517 B11R1.47 C=COCCOCC1CCC1 34a_100000760304_100000039644 [0,1,0,1,0,0|1,0,1]=4 17518 B11R1.47 C=COCCOCC1CCO1 34a_100000033082_100000103362 [0,1,0,1,0,0|0,0,1]=3 17519 B11R1.47 C=COCCOCC1CCO1 34a_100000039022_100000039644 [0,1,0,1,0,0|0,0,1]=3 17520 B11R1.47 C=COCCOCC1COC1 34a_100000033082_100010264016 [0,1,0,1,0,0|0,0,2]=4 17521 B11R1.47 C=COCCOCC1COC1 34a_100000060846_100000039644 [0,1,0,1,0,0|0,0,2]=4 17522 B11R1.47 C=COCCSCC1CCO1 62a_100000039644_100000103362 [0,1,0,1,0,0|0,1,1]=4 17523 B11R1.47 C=COCCSCC1CCO1 62a_100000103362_100000039644 [0,1,0,1,0,0|0,1,1]=4 17524 B11R1.47 CC#CCCOCC1CCC1 34a_100000750427_100000763275 [0,1,0,1,0,0|2,0,0]=4 17525 B11R1.47 CC#CCCOCC1CCO1 34a_100000750427_100000103362 [0,1,0,1,0,0|1,0,0]=3 17526 B11R1.47 CC#CCCOCC1COC1 34a_100000750427_100010264016 [0,1,0,1,0,0|1,0,1]=4 17527 B11R1.47 CC/C=C\CCNC1COC1 2230a_100016991112_100015370543 [0,1,0,1,0,0|2,0,0]=4 17528 B11R1.47 CC/C=C\CCOC1CCC1 34a_100000748187_100015370543 [0,1,0,1,0,0|2,0,0]=4 17529 B11R1.47 CC/C=C\CCOC1CCC1 34a_100016288707_100000749161 [0,1,0,1,0,0|2,0,0]=4 17530 B11R1.47 CC/C=C\CCOC1COC1 34a_100016288707_100009818527 [0,1,0,1,0,0|1,0,0]=3 17531 B11R1.47 CC/C=C\CCOC1COC1 7a_100016288707_100009818527 [0,1,0,1,0,0|1,0,0]=3 17532 B11R1.47 CC/C=C\CCOC1CSC1 7a_100000072292_100015370543 [0,1,0,1,0,0|1,1,0]=4 17533 B11R1.47 CC/C=C\CCSC1COC1 62a_100015370543_100009818527 [0,1,0,1,0,0|1,1,0]=4 17534 B11R1.47 CC/C=C\COCC1CCO1 34a_100000039022_100103147603 [0,1,0,1,0,0|1,0,1]=4 17535 B11R1.47 CC/C=C\COCC1CCO1 34a_100016268518_100000103362 [0,1,0,1,0,0|1,0,1]=4 17536 B11R1.47 CC/C=C\COCC1COC1 34a_100000060846_100103147603 [0,1,0,1,0,0|1,0,1]=4 17537 B11R1.47 CC/C=C\COCC1COC1 34a_100016268518_100010264016 [0,1,0,1,0,0|1,0,1]=4 17538 B11R1.47 CC=C=CCCOC1COC1 34a_100011020354_100009818527 [0,1,0,1,0,0|1,0,1]=4 17539 B11R1.47 CC=CCCCOC1COC1 34a_100020645299_100009818527 [0,1,0,1,0,0|1,0,1]=4 17540 B11R1.47 CCC#CCCOC1CCC1 34a_100000036655_100000749161 [0,1,0,1,0,0|2,0,0]=4 17541 B11R1.47 CCC#CCCOC1COC1 34a_100000036655_100009818527 [0,1,0,1,0,0|1,0,0]=3 17542 B11R1.47 CCC#CCCOC1COC1 7a_100000036655_100009818527 [0,1,0,1,0,0|1,0,0]=3 17543 B11R1.47 CCC#CCOCC1CCO1 34a_100000032950_100000103362 [0,1,0,1,0,0|1,0,1]=4 17544 B11R1.47 CCC#CCOCC1CCO1 34a_100000039022_100009813939 [0,1,0,1,0,0|1,0,1]=4 17545 B11R1.47 CCC#CCOCC1COC1 34a_100000032950_100010264016 [0,1,0,1,0,0|1,0,1]=4 17546 B11R1.47 CCC#CCOCC1COC1 34a_100000060846_100009813939 [0,1,0,1,0,0|1,0,1]=4 17547 B11R1.47 CCC/C=C/COC1COC1 34a_100016278788_100009818527 [0,1,0,1,0,0|1,0,1]=4 17548 B11R1.47 CCC/C=C/COC1COC1 7a_100016278788_100009818527 [0,1,0,1,0,0|1,0,1]=4 17549 B11R1.47 CCCC#CCOC1COC1 34a_100000034806_100009818527 [0,1,0,1,0,0|1,0,1]=4 17550 B11R1.47 CCCC#CCOC1COC1 7a_100000034806_100009818527 [0,1,0,1,0,0|1,0,1]=4 17551 B11R1.47 CCCCCCNC1COC1 2230a_100016991112_100000210314 [0,1,0,1,0,0|2,0,0]=4 17552 B11R1.47 CCCCCCOC1CCC1 34a_100000210259_100000749161 [0,1,0,1,0,0|2,0,0]=4 17553 B11R1.47 CCCCCCOC1CCC1 34a_100000748187_100000210314 [0,1,0,1,0,0|2,0,0]=4 17554 B11R1.47 CCCCCCOC1COC1 34a_100000210259_100009818527 [0,1,0,1,0,0|1,0,0]=3 17555 B11R1.47 CCCCCCOC1COC1 7a_100000210259_100009818527 [0,1,0,1,0,0|1,0,0]=3 17556 B11R1.47 CCCCCCOC1CSC1 7a_100000072292_100000210314 [0,1,0,1,0,0|1,1,0]=4 17557 B11R1.47 CCCCCCSC1COC1 62a_100000210314_100009818527 [0,1,0,1,0,0|1,1,0]=4 17558 B11R1.47 CCCCCNCC1CCO1 2230a_100000209983_100000103362 [0,1,0,1,0,0|2,0,0]=4 17559 B11R1.47 CCCCCNCC1COC1 2230a_100000209983_100010264016 [0,1,0,1,0,0|2,0,0]=4 17560 B11R1.47 CCCCCNCC1COC1 2230a_100015281925_100000210326 [0,1,0,1,0,0|2,0,0]=4 17561 B11R1.47 CCCCCNCC1COC1 34a_100015281925_100000718602 [0,1,0,1,0,0|2,0,0]=4 17562 B11R1.47 CCCCCNC[C@@H]1CCO1 2230a_100020831831_100000210326 [0,1,0,1,0,0|2,0,0]=4 17563 B11R1.47 CCCCCNC[C@@H]1CCO1 34a_100020831831_100000718602 [0,1,0,1,0,0|2,0,0]=4 17564 B11R1.47 CCCCCOCC1CCC1 34a_100000210253_100000763275 [0,1,0,1,0,0|2,0,0]=4 17565 B11R1.47 CCCCCOCC1CCC1 34a_100000760304_100000718602 [0,1,0,1,0,0|2,0,0]=4 17566 B11R1.47 CCCCCOCC1CCC1 7a_100000210253_100000763275 [0,1,0,1,0,0|2,0,0]=4 17567 B11R1.47 CCCCCOCC1CCO1 34a_100000039022_100000718602 [0,1,0,1,0,0|1,0,0]=3 17568 B11R1.47 CCCCCOCC1CCO1 34a_100000210253_100000103362 [0,1,0,1,0,0|1,0,0]=3 17569 B11R1.47 CCCCCOCC1CCO1 7a_100000210253_100000103362 [0,1,0,1,0,0|1,0,0]=3 17570 B11R1.47 CCCCCOCC1CNC1 34a_100016987283_100000718602 [0,1,0,1,0,0|2,0,0]=4 17571 B11R1.47 CCCCCOCC1COC1 34a_100000060846_100000718602 [0,1,0,1,0,0|1,0,0]=3 17572 B11R1.47 CCCCCOCC1COC1 34a_100000210253_100010264016 [0,1,0,1,0,0|1,0,0]=3 17573 B11R1.47 CCCCCOCC1COC1 7a_100000210253_100010264016 [0,1,0,1,0,0|1,0,0]=3 17574 B11R1.47 CCCCCSCC1CCO1 62a_100000103362_100000210326 [0,1,0,1,0,0|1,1,0]=4 17575 B11R1.47 CCCCCSCC1CCO1 62a_100000210326_100000103362 [0,1,0,1,0,0|1,1,0]=4 17576 B11R1.47 CCCCCSCC1COC1 62a_100000210326_100010264016 [0,1,0,1,0,0|1,1,0]=4 17577 B11R1.47 CCCCCSCC1COC1 62a_100010264016_100000210326 [0,1,0,1,0,0|1,1,0]=4 17578 B11R1.47 CCCCOCCC1COC1 34a_100009855314_100000210210 [0,1,0,1,0,0|2,0,0]=4 17579 B11R1.47 CCCCOCCN1CCC1 269982a_100000754969_100000743108 [0,1,0,1,0,0|2,0,0]=4 17580 B11R1.47 CCCCOCNC1CCC1 2230a_100000749019_100011995733 [0,1,0,1,0,0|2,0,0]=4 17581 B11R1.47 CCCCOCNC1CCC1 34a_100000749019_100011995733 [0,1,0,1,0,0|2,0,0]=4 17582 B11R1.47 CCCCOCNC1COC1 2230a_100016991112_100011995733 [0,1,0,1,0,0|2,0,0]=4 17583 B11R1.47 CCCCOCOC1CCC1 34a_100000748187_100011995733 [0,1,0,1,0,0|2,0,0]=4 17584 B11R1.47 CCCCOCSC1CCC1 62a_100011995733_100000749161 [0,1,0,1,0,0|2,0,0]=4 17585 B11R1.47 CCCCOCSC1COC1 62a_100011995733_100009818527 [0,1,0,1,0,0|1,1,0]=4 17586 B11R1.47 CCCOCCNC1CCC1 2230a_100000749019_100011215938 [0,1,0,1,0,0|2,0,0]=4 17587 B11R1.47 CCCOCCNC1CCC1 270004a_100161115042_100000241760 [0,1,0,1,0,0|2,0,0]=4 17588 B11R1.47 CCCOCCNC1CCC1 34a_100000749019_100011215938 [0,1,0,1,0,0|2,0,0]=4 17589 B11R1.47 CCCOCCNC1CCC1 34a_100161115042_100000749161 [0,1,0,1,0,0|2,0,0]=4 17590 B11R1.47 CCCOCCNC1COC1 2230a_100016991112_100011215938 [0,1,0,1,0,0|1,0,0]=3 17591 B11R1.47 CCCOCCNC1COC1 34a_100161115042_100009818527 [0,1,0,1,0,0|1,0,0]=3 17592 B11R1.47 CCCOCCOC1CCC1 34a_100000748187_100011215938 [0,1,0,1,0,0|1,0,0]=3 17593 B11R1.47 CCCOCCOC1CCC1 34a_100000752267_100000749161 [0,1,0,1,0,0|1,0,0]=3 17594 B11R1.47 CCCOCCOC1COC1 34a_100000752267_100009818527 [0,1,0,1,0,0|0,0,0]=2 17595 B11R1.47 CCCOCCOC1COC1 7a_100000752267_100009818527 [0,1,0,1,0,0|0,0,0]=2 17596 B11R1.47 CCCOCCOC1CSC1 7a_100000072292_100011215938 [0,1,0,1,0,0|0,1,0]=3 17597 B11R1.47 CCCOCCSC1CCC1 62a_100011215938_100000749161 [0,1,0,1,0,0|1,1,0]=4 17598 B11R1.47 CCCOCCSC1COC1 62a_100011215938_100009818527 [0,1,0,1,0,0|0,1,0]=3 17599 B11R1.47 CCCSCCOC1CCC1 34a_200000230433_100000749161 [0,1,0,1,0,0|1,1,0]=4 17600 B11R1.47 CCCSCCOC1COC1 34a_200000230433_100009818527 [0,1,0,1,0,0|0,1,0]=3 17601 B11R1.47 CCCSCCOC1COC1 7a_200000230433_100009818527 [0,1,0,1,0,0|0,1,0]=3 17602 B11R1.47 CCOCCCNC1CCC1 2230a_100000749019_100012232248 [0,1,0,1,0,0|2,0,0]=4 17603 B11R1.47 CCOCCCNC1CCC1 270004a_100000210961_100000241760 [0,1,0,1,0,0|2,0,0]=4 17604 B11R1.47 CCOCCCNC1CCC1 34a_100000210961_100000749161 [0,1,0,1,0,0|2,0,0]=4 17605 B11R1.47 CCOCCCNC1CCC1 34a_100000749019_100012232248 [0,1,0,1,0,0|2,0,0]=4 17606 B11R1.47 CCOCCCNC1COC1 2230a_100016991112_100012232248 [0,1,0,1,0,0|1,0,0]=3 17607 B11R1.47 CCOCCCNC1COC1 34a_100000210961_100009818527 [0,1,0,1,0,0|1,0,0]=3 17608 B11R1.47 CCOCCCOC1CCC1 34a_100000748187_100012232248 [0,1,0,1,0,0|1,0,0]=3 17609 B11R1.47 CCOCCCOC1CCC1 34a_100000757476_100000749161 [0,1,0,1,0,0|1,0,0]=3 17610 B11R1.47 CCOCCCOC1COC1 34a_100000757476_100009818527 [0,1,0,1,0,0|0,0,0]=2 17611 B11R1.47 CCOCCCOC1COC1 7a_100000757476_100009818527 [0,1,0,1,0,0|0,0,0]=2 17612 B11R1.47 CCOCCCOC1CSC1 7a_100000072292_100012232248 [0,1,0,1,0,0|0,1,0]=3 17613 B11R1.47 CCOCCCSC1CCC1 62a_100012232248_100000749161 [0,1,0,1,0,0|1,1,0]=4 17614 B11R1.47 CCOCCCSC1COC1 62a_100012232248_100009818527 [0,1,0,1,0,0|0,1,0]=3 17615 B11R1.47 CCOCCNCC1CCC1 2230a_100000738700_100011215890 [0,1,0,1,0,0|2,0,0]=4 17616 B11R1.47 CCOCCNCC1CCC1 2230a_102516460346_100000763275 [0,1,0,1,0,0|2,0,0]=4 17617 B11R1.47 CCOCCNCC1CCC1 269862a_100011200944_100000753134 [0,1,0,1,0,0|2,0,0]=4 17618 B11R1.47 CCOCCNCC1CCC1 34a_100000738700_100000210147 [0,1,0,1,0,0|2,0,0]=4 17619 B11R1.47 CCOCCNCC1CCC1 34a_102516460346_100000763275 [0,1,0,1,0,0|2,0,0]=4 17620 B11R1.47 CCOCCNCC1CCO1 2230a_102516460346_100000103362 [0,1,0,1,0,0|1,0,0]=3 17621 B11R1.47 CCOCCNCC1CCO1 34a_102516460346_100000103362 [0,1,0,1,0,0|1,0,0]=3 17622 B11R1.47 CCOCCNCC1COC1 2230a_100015281925_100011215890 [0,1,0,1,0,0|1,0,0]=3 17623 B11R1.47 CCOCCNCC1COC1 2230a_102516460346_100010264016 [0,1,0,1,0,0|1,0,0]=3 17624 B11R1.47 CCOCCNCC1COC1 34a_100015281925_100000210147 [0,1,0,1,0,0|1,0,0]=3 17625 B11R1.47 CCOCCNCC1COC1 34a_102516460346_100010264016 [0,1,0,1,0,0|1,0,0]=3 17626 B11R1.47 CCOCCNC[C@@H]1CCO1 2230a_100020831831_100011215890 [0,1,0,1,0,0|1,0,0]=3 17627 B11R1.47 CCOCCNC[C@@H]1CCO1 34a_100020831831_100000210147 [0,1,0,1,0,0|1,0,0]=3 17628 B11R1.47 CCOCCNN=C1COC1 4a_100000732670_100000058695 [0,1,0,1,0,0|1,0,1]=4 17629 B11R1.47 CCOCCOCC1CCC1 34a_100000210136_100000763275 [0,1,0,1,0,0|1,0,0]=3 17630 B11R1.47 CCOCCOCC1CCC1 34a_100000760304_100000210147 [0,1,0,1,0,0|1,0,0]=3 17631 B11R1.47 CCOCCOCC1CCC1 7a_100000210136_100000763275 [0,1,0,1,0,0|1,0,0]=3 17632 B11R1.47 CCOCCOCC1CCO1 34a_100000039022_100000210147 [0,1,0,1,0,0|0,0,0]=2 17633 B11R1.47 CCOCCOCC1CCO1 34a_100000210136_100000103362 [0,1,0,1,0,0|0,0,0]=2 17634 B11R1.47 CCOCCOCC1CCO1 7a_100000210136_100000103362 [0,1,0,1,0,0|0,0,0]=2 17635 B11R1.47 CCOCCOCC1CNC1 34a_100016987283_100000210147 [0,1,0,1,0,0|1,0,0]=3 17636 B11R1.47 CCOCCOCC1COC1 34a_100000060846_100000210147 [0,1,0,1,0,0|0,0,0]=2 17637 B11R1.47 CCOCCOCC1COC1 34a_100000210136_100010264016 [0,1,0,1,0,0|0,0,0]=2 17638 B11R1.47 CCOCCOCC1COC1 7a_100000210136_100010264016 [0,1,0,1,0,0|0,0,0]=2 17639 B11R1.47 CCOCCSCC1CCC1 62a_100000210147_100000763275 [0,1,0,1,0,0|1,1,0]=4 17640 B11R1.47 CCOCCSCC1CCC1 62a_100000763275_100011215890 [0,1,0,1,0,0|1,1,0]=4 17641 B11R1.47 CCOCCSCC1CCO1 62a_100000103362_100011215890 [0,1,0,1,0,0|0,1,0]=3 17642 B11R1.47 CCOCCSCC1CCO1 62a_100000210147_100000103362 [0,1,0,1,0,0|0,1,0]=3 17643 B11R1.47 CCOCCSCC1COC1 62a_100000210147_100010264016 [0,1,0,1,0,0|0,1,0]=3 17644 B11R1.47 CCOCCSCC1COC1 62a_100010264016_100011215890 [0,1,0,1,0,0|0,1,0]=3 17645 B11R1.47 CCSCCCOC1CCC1 34a_100011216438_100000749161 [0,1,0,1,0,0|1,1,0]=4 17646 B11R1.47 CCSCCCOC1COC1 34a_100011216438_100009818527 [0,1,0,1,0,0|0,1,0]=3 17647 B11R1.47 CCSCCCOC1COC1 7a_100011216438_100009818527 [0,1,0,1,0,0|0,1,0]=3 17648 B11R1.47 CCSCCNCC1CCO1 2230a_100000106463_100000103362 [0,1,0,1,0,0|1,1,0]=4 17649 B11R1.47 CCSCCNCC1COC1 2230a_100000106463_100010264016 [0,1,0,1,0,0|1,1,0]=4 17650 B11R1.47 CCSCCNCC1COC1 2230a_100015281925_100000757381 [0,1,0,1,0,0|1,1,0]=4 17651 B11R1.47 CCSCCNCC1COC1 34a_100015281925_100000757381 [0,1,0,1,0,0|1,1,0]=4 17652 B11R1.47 CCSCCNC[C@@H]1CCO1 2230a_100020831831_100000757381 [0,1,0,1,0,0|1,1,0]=4 17653 B11R1.47 CCSCCNC[C@@H]1CCO1 34a_100020831831_100000757381 [0,1,0,1,0,0|1,1,0]=4 17654 B11R1.47 CCSCCOCC1CCC1 34a_100000212035_100000763275 [0,1,0,1,0,0|1,1,0]=4 17655 B11R1.47 CCSCCOCC1CCC1 34a_100000760304_100000757381 [0,1,0,1,0,0|1,1,0]=4 17656 B11R1.47 CCSCCOCC1CCC1 7a_100000212035_100000763275 [0,1,0,1,0,0|1,1,0]=4 17657 B11R1.47 CCSCCOCC1CCO1 34a_100000039022_100000757381 [0,1,0,1,0,0|0,1,0]=3 17658 B11R1.47 CCSCCOCC1CCO1 34a_100000212035_100000103362 [0,1,0,1,0,0|0,1,0]=3 17659 B11R1.47 CCSCCOCC1CCO1 7a_100000212035_100000103362 [0,1,0,1,0,0|0,1,0]=3 17660 B11R1.47 CCSCCOCC1CNC1 34a_100016987283_100000757381 [0,1,0,1,0,0|1,1,0]=4 17661 B11R1.47 CCSCCOCC1COC1 34a_100000060846_100000757381 [0,1,0,1,0,0|0,1,0]=3 17662 B11R1.47 CCSCCOCC1COC1 34a_100000212035_100010264016 [0,1,0,1,0,0|0,1,0]=3 17663 B11R1.47 CCSCCOCC1COC1 7a_100000212035_100010264016 [0,1,0,1,0,0|0,1,0]=3 17664 B11R1.47 CCSCCSCC1CCO1 62a_100000103362_100000757381 [0,1,0,1,0,0|0,2,0]=4 17665 B11R1.47 CCSCCSCC1CCO1 62a_100000757381_100000103362 [0,1,0,1,0,0|0,2,0]=4 17666 B11R1.47 CCSCCSCC1COC1 62a_100000757381_100010264016 [0,1,0,1,0,0|0,2,0]=4 17667 B11R1.47 CCSCCSCC1COC1 62a_100010264016_100000757381 [0,1,0,1,0,0|0,2,0]=4 17668 B11R1.47 CNCCCOCC1CCC1 34a_100000213112_100000763275 [0,1,0,1,0,0|2,0,0]=4 17669 B11R1.47 CNCCCOCC1CCO1 34a_100000213112_100000103362 [0,1,0,1,0,0|1,0,0]=3 17670 B11R1.47 CNCCCOCC1COC1 34a_100000213112_100010264016 [0,1,0,1,0,0|2,0,0]=4 17671 B11R1.47 COCCCCNC1CCC1 2230a_100000749019_100000730899 [0,1,0,1,0,0|2,0,0]=4 17672 B11R1.47 COCCCCNC1CCC1 34a_100000749019_100000755781 [0,1,0,1,0,0|2,0,0]=4 17673 B11R1.47 COCCCCNC1COC1 2230a_100016991112_100000730899 [0,1,0,1,0,0|2,0,0]=4 17674 B11R1.47 COCCCCOC1CCC1 34a_100000740925_100000749161 [0,1,0,1,0,0|2,0,0]=4 17675 B11R1.47 COCCCCOC1CCC1 34a_100000748187_100000755781 [0,1,0,1,0,0|2,0,0]=4 17676 B11R1.47 COCCCCOC1COC1 34a_100000740925_100009818527 [0,1,0,1,0,0|1,0,0]=3 17677 B11R1.47 COCCCCOC1CSC1 7a_100000072292_100000730899 [0,1,0,1,0,0|1,1,0]=4 17678 B11R1.47 COCCCCSC1CCC1 62a_100000730899_100000749161 [0,1,0,1,0,0|2,0,0]=4 17679 B11R1.47 COCCCCSC1COC1 62a_100000730899_100009818527 [0,1,0,1,0,0|1,1,0]=4 17680 B11R1.47 COCCCNCC1CCC1 2230a_100000738700_100000740836 [0,1,0,1,0,0|2,0,0]=4 17681 B11R1.47 COCCCNCC1CCC1 269862a_100150723488_100000753134 [0,1,0,1,0,0|2,0,0]=4 17682 B11R1.47 COCCCNCC1CCC1 34a_100000738700_100000740836 [0,1,0,1,0,0|2,0,0]=4 17683 B11R1.47 COCCCNCC1CCC1 34a_100150723488_100000763275 [0,1,0,1,0,0|2,0,0]=4 17684 B11R1.47 COCCCNCC1CCO1 34a_100150723488_100000103362 [0,1,0,1,0,0|1,0,0]=3 17685 B11R1.47 COCCCNC[C@@H]1CCO1 2230a_100020831831_100000740836 [0,1,0,1,0,0|1,0,0]=3 17686 B11R1.47 COCCCNC[C@@H]1CCO1 34a_100020831831_100000740836 [0,1,0,1,0,0|1,0,0]=3 17687 B11R1.47 COCCCOCC1CCC1 34a_100000740835_100000763275 [0,1,0,1,0,0|1,0,0]=3 17688 B11R1.47 COCCCOCC1CCC1 34a_100000760304_100000740836 [0,1,0,1,0,0|1,0,0]=3 17689 B11R1.47 COCCCOCC1CCO1 34a_100000039022_100000740836 [0,1,0,1,0,0|0,0,0]=2 17690 B11R1.47 COCCCOCC1CCO1 34a_100000740835_100000103362 [0,1,0,1,0,0|0,0,0]=2 17691 B11R1.47 COCCCOCC1CNC1 34a_100016987283_100000740836 [0,1,0,1,0,0|2,0,0]=4 17692 B11R1.47 COCCCOCC1COC1 34a_100000060846_100000740836 [0,1,0,1,0,0|2,0,0]=4 17693 B11R1.47 COCCCOCC1COC1 34a_100000740835_100010264016 [0,1,0,1,0,0|2,0,0]=4 17694 B11R1.47 COCCCSCC1CCC1 62a_100000709357_100000763275 [0,1,0,1,0,0|1,1,0]=4 17695 B11R1.47 COCCCSCC1CCC1 62a_100000763275_100000709357 [0,1,0,1,0,0|1,1,0]=4 17696 B11R1.47 COCCCSCC1CCO1 62a_100000103362_100000709357 [0,1,0,1,0,0|0,1,0]=3 17697 B11R1.47 COCCCSCC1CCO1 62a_100000709357_100000103362 [0,1,0,1,0,0|0,1,0]=3 17698 B11R1.47 COCCOCCC1COC1 34a_100009855314_100011201679 [0,1,0,1,0,0|1,0,0]=3 17699 B11R1.47 COCCOCCN1CCC1 269982a_100000754969_100000695917 [0,1,0,1,0,0|1,0,0]=3 17700 B11R1.47 COCCOCNC1CCC1 2230a_100000749019_100000231047 [0,1,0,1,0,0|1,0,0]=3 17701 B11R1.47 COCCOCNC1COC1 2230a_100016991112_100000231047 [0,1,0,1,0,0|2,0,0]=4 17702 B11R1.47 COCCOCSC1CCC1 62a_100000231047_100000749161 [0,1,0,1,0,0|1,0,0]=3 17703 B11R1.47 COCCOCSC1COC1 62a_100000231047_100009818527 [0,1,0,1,0,0|2,0,0]=4 17704 B11R1.47 CSCCCCOC1CCC1 34a_100011217163_100000749161 [0,1,0,1,0,0|2,0,0]=4 17705 B11R1.47 CSCCCCOC1COC1 34a_100011217163_100009818527 [0,1,0,1,0,0|1,0,0]=3 17706 B11R1.47 CSCCCCOC1COC1 7a_100011217163_100009818527 [0,1,0,1,0,0|1,0,0]=3 17707 B11R1.47 CSCCCNCC1CCO1 2230a_100000749238_100000103362 [0,1,0,1,0,0|1,1,0]=4 17708 B11R1.47 CSCCCOCC1CCC1 34a_100000690336_100000763275 [0,1,0,1,0,0|1,1,0]=4 17709 B11R1.47 CSCCCOCC1CCC1 7a_100000690336_100000763275 [0,1,0,1,0,0|1,1,0]=4 17710 B11R1.47 CSCCCOCC1CCO1 34a_100000690336_100000103362 [0,1,0,1,0,0|0,1,0]=3 17711 B11R1.47 CSCCCOCC1CCO1 7a_100000690336_100000103362 [0,1,0,1,0,0|0,1,0]=3 17712 B11R1.47 CSCCCOCC1COC1 34a_100000690336_100010264016 [0,1,0,1,0,0|2,0,0]=4 17713 B11R1.47 CSCCCOCC1COC1 7a_100000690336_100010264016 [0,1,0,1,0,0|2,0,0]=4 17714 B11R1.47 CSCCOCCC1COC1 34a_100009855314_100000212216 [0,1,0,1,0,0|1,1,0]=4 17715 B11R1.47 ClCC#CCOCC1CCO1 34a_200000047223_100000103362 [0,1,0,1,0,0|1,0,1]=4 17716 B11R1.47 ClCCCCCOC1CCC1 34a_100000746330_100000749161 [0,1,0,1,0,0|2,0,0]=4 17717 B11R1.47 ClCCCCCOC1COC1 34a_100000746330_100009818527 [0,1,0,1,0,0|1,0,0]=3 17718 B11R1.47 ClCCCCCOC1COC1 7a_100000746330_100009818527 [0,1,0,1,0,0|1,0,0]=3 17719 B11R1.47 ClCCCCOCC1CCC1 34a_100000210776_100000763275 [0,1,0,1,0,0|2,0,0]=4 17720 B11R1.47 ClCCCCOCC1CCC1 7a_100000210776_100000763275 [0,1,0,1,0,0|2,0,0]=4 17721 B11R1.47 ClCCCCOCC1CCO1 34a_100000210776_100000103362 [0,1,0,1,0,0|1,0,0]=3 17722 B11R1.47 ClCCCCOCC1CCO1 7a_100000210776_100000103362 [0,1,0,1,0,0|1,0,0]=3 17723 B11R1.47 ClCCCCOCC1COC1 34a_100000210776_100010264016 [0,1,0,1,0,0|2,0,0]=4 17724 B11R1.47 ClCCCCOCC1COC1 7a_100000210776_100010264016 [0,1,0,1,0,0|2,0,0]=4 17725 B11R1.47 ClCCOCCOC1CCC1 34a_100011215305_100000749161 [0,1,0,1,0,0|1,0,0]=3 17726 B11R1.47 ClCCOCCOC1COC1 34a_100011215305_100009818527 [0,1,0,1,0,0|0,0,0]=2 17727 B11R1.47 ClCCOCCOC1COC1 7a_100011215305_100009818527 [0,1,0,1,0,0|0,0,0]=2 17728 B11R1.47 FCCCCCNC1COC1 2230a_100016991112_100000729378 [0,1,0,1,0,0|2,0,0]=4 17729 B11R1.47 FCCCCCOC1CCC1 34a_100000748187_100000729378 [0,1,0,1,0,0|2,0,0]=4 17730 B11R1.47 FCCCCCOC1CSC1 7a_100000072292_100000729378 [0,1,0,1,0,0|1,1,0]=4 17731 B11R1.47 FCCCCCSC1COC1 62a_100000729378_100009818527 [0,1,0,1,0,0|1,1,0]=4 17732 B11R1.47 FCCCCNC[C@@H]1CCO1 2230a_100020831831_100000729493 [0,1,0,1,0,0|2,0,0]=4 17733 B11R1.47 FCCCCNC[C@@H]1CCO1 34a_100020831831_100000729493 [0,1,0,1,0,0|2,0,0]=4 17734 B11R1.47 FCCCCOCC1CCC1 34a_100000760304_100000729493 [0,1,0,1,0,0|2,0,0]=4 17735 B11R1.47 FCCCCOCC1CCC1 34a_100011995726_100000763275 [0,1,0,1,0,0|2,0,0]=4 17736 B11R1.47 FCCCCOCC1CCC1 7a_100011995726_100000763275 [0,1,0,1,0,0|2,0,0]=4 17737 B11R1.47 FCCCCOCC1CCO1 34a_100000039022_100000729493 [0,1,0,1,0,0|1,0,0]=3 17738 B11R1.47 FCCCCOCC1CCO1 34a_100011995726_100000103362 [0,1,0,1,0,0|1,0,0]=3 17739 B11R1.47 FCCCCOCC1CCO1 7a_100011995726_100000103362 [0,1,0,1,0,0|1,0,0]=3 17740 B11R1.47 FCCCCOCC1COC1 34a_100000060846_100000729493 [0,1,0,1,0,0|2,0,0]=4 17741 B11R1.47 FCCCCOCC1COC1 34a_100011995726_100010264016 [0,1,0,1,0,0|2,0,0]=4 17742 B11R1.47 FCCCCOCC1COC1 7a_100011995726_100010264016 [0,1,0,1,0,0|2,0,0]=4 17743 B11R1.47 FCCCCSCC1CCO1 62a_100000103362_100000729493 [0,1,0,1,0,0|1,1,0]=4 17744 B11R1.47 FCCCCSCC1CCO1 62a_100000729493_100000103362 [0,1,0,1,0,0|1,1,0]=4 17745 B11R1.47 FCCOCCOC1CCC1 34a_200015357709_100000749161 [0,1,0,1,0,0|1,0,0]=3 17746 B11R1.47 FCCOCCOC1COC1 34a_200015357709_100009818527 [0,1,0,1,0,0|0,0,0]=2 17747 B11R1.47 FCCOCCOC1COC1 7a_200015357709_100009818527 [0,1,0,1,0,0|0,0,0]=2 17748 B11R1.47 ICCCCCOC1CCC1 34a_200012148887_100000749161 [0,1,0,1,0,0|2,0,0]=4 17749 B11R1.47 ICCCCCOC1COC1 34a_200012148887_100009818527 [0,1,0,1,0,0|1,0,0]=3 17750 B11R1.47 ICCCCCOC1COC1 7a_200012148887_100009818527 [0,1,0,1,0,0|1,0,0]=3 17751 B11R1.47 ICCCCOCC1CCC1 34a_200012148704_100000763275 [0,1,0,1,0,0|2,0,0]=4 17752 B11R1.47 ICCCCOCC1CCO1 34a_200012148704_100000103362 [0,1,0,1,0,0|1,0,0]=3 17753 B11R1.47 ICCCCOCC1COC1 34a_200012148704_100010264016 [0,1,0,1,0,0|2,0,0]=4 17754 B11R1.47 ICCOCCOC1CCC1 34a_100012149058_100000749161 [0,1,0,1,0,0|1,0,0]=3 17755 B11R1.47 ICCOCCOC1COC1 34a_100012149058_100009818527 [0,1,0,1,0,0|0,0,0]=2 17756 B11R1.47 ICCOCCOC1COC1 7a_100012149058_100009818527 [0,1,0,1,0,0|0,0,0]=2 17757 B11R1.47 N#CCOCCNC1COC1 2230a_100016991112_200000047693 [0,1,0,1,0,0|1,0,1]=4 17758 B11R1.47 N#CCOCCOC1CSC1 7a_100000072292_200000047693 [0,1,0,1,0,0|0,1,1]=4 17759 B11R1.47 N#CCOCCSC1COC1 62a_200000047693_100009818527 [0,1,0,1,0,0|0,1,1]=4 17760 B11R1.47 NCCCCCOC1CCC1 34a_100000762737_100000749161 [0,1,0,1,0,0|2,0,0]=4 17761 B11R1.47 NCCCCCOC1COC1 34a_100000762737_100009818527 [0,1,0,1,0,0|1,0,0]=3 17762 B11R1.47 NCCCCOCC1CCC1 34a_100000750430_100000763275 [0,1,0,1,0,0|2,0,0]=4 17763 B11R1.47 NCCCCOCC1CCO1 34a_100000750430_100000103362 [0,1,0,1,0,0|1,0,0]=3 17764 B11R1.47 NCCCCOCC1COC1 34a_100000750430_100010264016 [0,1,0,1,0,0|2,0,0]=4 17765 B11R1.47 NCCOCCOC1CCC1 34a_100000211614_100000749161 [0,1,0,1,0,0|1,0,0]=3 17766 B11R1.47 NCCOCCOC1COC1 34a_100000211614_100009818527 [0,1,0,1,0,0|0,0,0]=2 17767 B11R1.47 OCC#CCOCC1CCO1 34a_100000039022_200000047223 [0,1,0,1,0,0|1,0,1]=4 17768 B11R1.47 OCCCCCNC1COC1 2230a_100016991112_100000746330 [0,1,0,1,0,0|2,0,0]=4 17769 B11R1.47 OCCCCCNC1COC1 34a_100000762737_100009818527 [0,1,0,1,0,0|2,0,0]=4 17770 B11R1.47 OCCCCCOC1CCC1 34a_100000748187_100000746330 [0,1,0,1,0,0|2,0,0]=4 17771 B11R1.47 OCCCCCOC1CSC1 7a_100000072292_100000746330 [0,1,0,1,0,0|1,1,0]=4 17772 B11R1.47 OCCCCCSC1COC1 62a_100000746330_100009818527 [0,1,0,1,0,0|1,1,0]=4 17773 B11R1.47 OCCCCNCC1CCO1 2230a_100000750430_100000103362 [0,1,0,1,0,0|2,0,0]=4 17774 B11R1.47 OCCCCNCC1CCO1 34a_100000750430_100000103362 [0,1,0,1,0,0|2,0,0]=4 17775 B11R1.47 OCCCCNC[C@@H]1CCO1 2230a_100020831831_100000210776 [0,1,0,1,0,0|2,0,0]=4 17776 B11R1.47 OCCCCNC[C@@H]1CCO1 34a_100020831831_100011216708 [0,1,0,1,0,0|2,0,0]=4 17777 B11R1.47 OCCCCOCC1CCC1 34a_100000760304_100011216708 [0,1,0,1,0,0|2,0,0]=4 17778 B11R1.47 OCCCCOCC1CCO1 34a_100000039022_100011216708 [0,1,0,1,0,0|1,0,0]=3 17779 B11R1.47 OCCCCOCC1COC1 34a_100000060846_100011216708 [0,1,0,1,0,0|2,0,0]=4 17780 B11R1.47 OCCCCSCC1CCO1 62a_100000103362_100000210776 [0,1,0,1,0,0|1,1,0]=4 17781 B11R1.47 OCCCCSCC1CCO1 62a_100000210776_100000103362 [0,1,0,1,0,0|1,1,0]=4 17782 B11R1.47 OCCOCCNC1CCC1 2230a_100000749019_100011215305 [0,1,0,1,0,0|2,0,0]=4 17783 B11R1.47 OCCOCCNC1CCC1 270004a_100000211614_100000241760 [0,1,0,1,0,0|2,0,0]=4 17784 B11R1.47 OCCOCCNC1CCC1 34a_100000211614_100000749161 [0,1,0,1,0,0|2,0,0]=4 17785 B11R1.47 OCCOCCNC1CCC1 34a_100000749019_100000692535 [0,1,0,1,0,0|2,0,0]=4 17786 B11R1.47 OCCOCCNC1COC1 2230a_100016991112_100011215305 [0,1,0,1,0,0|1,0,0]=3 17787 B11R1.47 OCCOCCNC1COC1 34a_100000211614_100009818527 [0,1,0,1,0,0|1,0,0]=3 17788 B11R1.47 OCCOCCOC1CCC1 34a_100000748187_100000692535 [0,1,0,1,0,0|1,0,0]=3 17789 B11R1.47 OCCOCCOC1CSC1 7a_100000072292_100011215305 [0,1,0,1,0,0|0,1,0]=3 17790 B11R1.47 OCCOCCSC1CCC1 62a_100011215305_100000749161 [0,1,0,1,0,0|1,1,0]=4 17791 B11R1.47 OCCOCCSC1COC1 62a_100011215305_100009818527 [0,1,0,1,0,0|0,1,0]=3 17792 B11R1.109 CCCN1CCCC1COC 34a_200000694710_200000210301 [0,1,0,1,0,0|2,0,0]=4 17793 B11R1.109 CCCN1CCCC1COC 7a_200000694710_200000210301 [0,1,0,1,0,0|2,0,0]=4 17794 B11R1.109 CCCN1CCCC1CO[13CH3] 34a_200000694710_200025704644 [0,1,0,1,0,0|2,0,0]=4 17795 B11R1.109 CCCN1CCCC1CO[13CH3] 7a_200000694710_200025704644 [0,1,0,1,0,0|2,0,0]=4 17796 B11R1.109 CCCN1CCC[C@H]1COC 2230a_100020646714_100000210303 [0,1,0,1,0,0|2,0,0]=4 17797 B11R1.109 CCCN1CCC[C@H]1COC 269982a_100020646714_100000210303 [0,1,0,1,0,0|2,0,0]=4 17798 B11R1.109 CCCN1CCC[C@H]1COC 34a_100020646714_100000210303 [0,1,0,1,0,0|2,0,0]=4 17799 B11R1.109 COC[C@@H]1CCCN1CCF 2230a_100020646714_100011217306 [0,1,0,1,0,0|2,0,0]=4 17800 B11R1.109 COC[C@@H]1CCCN1CCF 269982a_100020646714_100011217306 [0,1,0,1,0,0|2,0,0]=4 17801 B11R1.109 COC[C@@H]1CCCN1CCF 34a_100020646714_100011217306 [0,1,0,1,0,0|2,0,0]=4 17802 B11R1.109 COC[C@@H]1CCCN1CCO 2230a_100020646714_100000211926 [0,1,0,1,0,0|2,0,0]=4 17803 B11R1.109 COC[C@@H]1CCCN1CCO 269982a_100020646714_100000211926 [0,1,0,1,0,0|2,0,0]=4 17804 B11R1.109 COC[C@@H]1CCCN1CCO 34a_100020646714_100000211926 [0,1,0,1,0,0|2,0,0]=4 17805 B11R1.109 COC[C@@H]1CCCN1COC 2230a_100020646714_100000766300 [0,1,0,1,0,0|2,0,0]=4 17806 B11R1.109 COC[C@@H]1CCCN1COC 269982a_100020646714_100000766300 [0,1,0,1,0,0|2,0,0]=4 17807 B11R1.109 COC[C@@H]1CCCN1CSC 2230a_100020646714_100011218213 [0,1,0,1,0,0|2,0,0]=4 17808 B11R1.109 COC[C@@H]1CCCN1CSC 269982a_100020646714_100011218213 [0,1,0,1,0,0|2,0,0]=4 17809 B11R1.109 COC[C@@H]1CCCN1CSC 34a_100020646714_100011218213 [0,1,0,1,0,0|2,0,0]=4 17810 B11R1.190 CC1CCN1CCOCCO 269982a_100000755817_100011215305 [0,1,0,1,0,0|2,0,0]=4 17811 B11R1.190 CC1CCN1CCOCCO 34a_100000755817_100000692535 [0,1,0,1,0,0|2,0,0]=4 17812 B11R1.190 CCCCOCN1CCC1C 269982a_100000755817_100011995733 [0,1,0,1,0,0|2,0,0]=4 17813 B11R1.190 CCCCOCN1CCC1C 34a_100000755817_100011995733 [0,1,0,1,0,0|2,0,0]=4 17814 B11R1.190 CCCOCCN1CCC1C 269982a_100000755817_100011215938 [0,1,0,1,0,0|2,0,0]=4 17815 B11R1.190 CCCOCCN1CCC1C 34a_100000755817_100011215938 [0,1,0,1,0,0|2,0,0]=4 17816 B11R1.190 CCOCCCN1CCC1C 269982a_100000755817_100012232248 [0,1,0,1,0,0|2,0,0]=4 17817 B11R1.190 CCOCCCN1CCC1C 34a_100000755817_100012232248 [0,1,0,1,0,0|2,0,0]=4 17818 B11R1.190 CCOCCOC1CCC1=O 34a_100000210136_100009892977 [0,1,0,1,0,0|1,0,1]=4 17819 B11R1.190 CCOCCOC1CCC1=O 7a_100000210136_100009892977 [0,1,0,1,0,0|1,0,1]=4 17820 B11R1.190 COCCCCN1CCC1C 269982a_100000755817_100000730899 [0,1,0,1,0,0|2,0,0]=4 17821 B11R1.190 COCCCCN1CCC1C 34a_100000755817_100000755781 [0,1,0,1,0,0|2,0,0]=4 17822 B11R1.190 COCCOCN1CCC1C 269982a_100000755817_100000231047 [0,1,0,1,0,0|1,0,0]=3 17823 B11R1.203 BrCCOC1CCCCCC1 34a_100000211926_100011217769 [0,1,0,1,0,0|2,0,0]=4 17824 B11R1.203 CCCCN1CCCOCC1 2230a_100000685342_100000210211 [0,1,0,1,0,0|2,0,0]=4 17825 B11R1.203 CCCCN1CCCOCC1 269982a_100000685342_100000210211 [0,1,0,1,0,0|2,0,0]=4 17826 B11R1.203 CCCCN1CCCOCC1 34a_100000685342_100000210210 [0,1,0,1,0,0|2,0,0]=4 17827 B11R1.203 CCCOC1CCCCCC1 34a_100000210258_100011217769 [0,1,0,1,0,0|2,0,0]=4 17828 B11R1.203 CCCOC1CCCCCC1 34a_100000210887_100000210303 [0,1,0,1,0,0|2,0,0]=4 17829 B11R1.203 CCCOC1CCCCCC1 7a_100000210887_100000210303 [0,1,0,1,0,0|2,0,0]=4 17830 B11R1.203 CCOCC1CCCCCC1 34a_100000699130_100000210202 [0,1,0,1,0,0|2,0,0]=4 17831 B11R1.203 CCOCC1CCCCCC1 34a_100121572206_200000696569 [0,1,0,1,0,0|2,0,0]=4 17832 B11R1.203 CCOCC1CCCCCC1 7a_100000699130_100000210202 [0,1,0,1,0,0|2,0,0]=4 17833 B11R1.203 CCOCC1CNCCOC1 34a_100103147999_100000210202 [0,1,0,1,0,0|1,0,0]=3 17834 B11R1.203 CCOCN1CCCCCC1 269982a_100000185865_100000739092 [0,1,0,1,0,0|2,0,0]=4 17835 B11R1.203 CCOCN1CCCOCC1 269982a_100000685342_100000739092 [0,1,0,1,0,0|2,0,0]=4 17836 B11R1.203 COCCN1CCCCCC1 2230a_100000185865_100011201679 [0,1,0,1,0,0|2,0,0]=4 17837 B11R1.203 COCCN1CCCCCC1 269982a_100000185865_100000233755 [0,1,0,1,0,0|2,0,0]=4 17838 B11R1.203 COCCN1CCCCCC1 34a_100000185865_100011201679 [0,1,0,1,0,0|2,0,0]=4 17839 B11R1.203 COCCN1CCCCCC1 34a_100000238007_200000210301 [0,1,0,1,0,0|2,0,0]=4 17840 B11R1.203 COCCN1CCCOCC1 2230a_100000685342_100011201679 [0,1,0,1,0,0|1,0,0]=3 17841 B11R1.203 COCCN1CCCOCC1 269982a_100000685342_100000233755 [0,1,0,1,0,0|1,0,0]=3 17842 B11R1.203 COCCN1CCCOCC1 34a_100000685342_100011201679 [0,1,0,1,0,0|1,0,0]=3 17843 B11R1.203 COCNC1CCCCCC1 2230a_100000210984_100000766300 [0,1,0,1,0,0|2,0,0]=4 17844 B11R1.203 COCSC1CCCCCC1 62a_100000766300_100011217769 [0,1,0,1,0,0|2,0,0]=4 17845 B11R1.203 COCSC1CCCCCC1 62a_100011217769_100000766300 [0,1,0,1,0,0|2,0,0]=4 17846 B11R1.203 CSCCN1CCCOCC1 2230a_100000685342_100000751147 [0,1,0,1,0,0|1,1,0]=4 17847 B11R1.203 CSCCN1CCCOCC1 269982a_100000685342_100000212216 [0,1,0,1,0,0|1,1,0]=4 17848 B11R1.203 CSCCN1CCCOCC1 34a_100000685342_100000212216 [0,1,0,1,0,0|1,1,0]=4 17849 B11R1.203 CSCOC1CCCCCC1 34a_100000210887_100011218213 [0,1,0,1,0,0|2,0,0]=4 17850 B11R1.203 FCCOC1CCCCCC1 34a_100000210887_100011217306 [0,1,0,1,0,0|2,0,0]=4 17851 B11R1.203 FCCOC1CCCCCC1 7a_100000210887_100011217306 [0,1,0,1,0,0|2,0,0]=4 17852 B11R1.203 FCOCC1CCCCCC1 34a_100000699130_100015361967 [0,1,0,1,0,0|2,0,0]=4 17853 B11R1.203 FCOCC1CCCCCC1 7a_100000699130_100015361967 [0,1,0,1,0,0|2,0,0]=4 17854 B11R1.203 FCOCC1CNCCOC1 34a_100103147999_100015361967 [0,1,0,1,0,0|2,0,0]=4 17855 B11R1.203 NCCOC1CCCCCC1 34a_100000210304_100011217769 [0,1,0,1,0,0|2,0,0]=4 17856 B11R1.203 OCCOC1CCCCCC1 34a_100000210887_100000211926 [0,1,0,1,0,0|2,0,0]=4 17857 B11R1.203 OCCOC1CCCCCC1 7a_100000210887_100000211926 [0,1,0,1,0,0|2,0,0]=4 17858 B11R1.203 [13CH3]OCCN1CCCCCC1 34a_100000238007_200025704644 [0,1,0,1,0,0|2,0,0]=4 17859 B11R1.232 CCCCN1CCC1COC 2230a_100015195929_100000210211 [0,1,0,1,0,0|2,0,0]=4 17860 B11R1.232 CCCCN1CCC1COC 269982a_100015195929_100000210211 [0,1,0,1,0,0|2,0,0]=4 17861 B11R1.232 CCCCN1CCC1COC 34a_100015195929_100000210210 [0,1,0,1,0,0|2,0,0]=4 17862 B11R1.232 CCOCN1CCC1COC 269982a_100015195929_100000739092 [0,1,0,1,0,0|1,0,0]=3 17863 B11R1.232 COCCN1CCC1COC 2230a_100015195929_100011201679 [0,1,0,1,0,0|2,0,0]=4 17864 B11R1.232 COCCN1CCC1COC 269982a_100015195929_100000233755 [0,1,0,1,0,0|2,0,0]=4 17865 B11R1.232 COCCN1CCC1COC 34a_100015195929_100011201679 [0,1,0,1,0,0|2,0,0]=4 17866 B11R1.1 C=C1CCN(CC1)CCOC 2230a_100000752442_100011201679 [0,1,0,1,0,0|2,0,0]=4 17867 B11R1.1 C=C1CCN(CC1)CCOC 269982a_100000752442_100000233755 [0,1,0,1,0,0|2,0,0]=4 17868 B11R1.1 C=C1CCN(CC1)CCOC 34a_100000752442_100011201679 [0,1,0,1,0,0|2,0,0]=4 17869 B11R1.1 CCOCC1CCC(CC1)C 34a_100000701341_100000210202 [0,1,0,1,0,0|2,0,0]=4 17870 B11R1.1 CCOC[C@@H]1CN[C@H](CN1)C 34a_100160570299_100000210202 [0,1,0,1,0,0|2,0,0]=4 17871 B11R1.1 CCOC[C@H]1CC[C@@H](CC1)N 34a_100009821084_100000210202 [0,1,0,1,0,0|2,0,0]=4 17872 B11R1.1 COCCC1CCC(CC1)N 34a_100000070672_200000210301 [0,1,0,1,0,0|2,0,0]=4 17873 B11R1.1 COCCC1CCN(CC1)C 2230a_100011255180_200000210301 [0,1,0,1,0,0|2,0,0]=4 17874 B11R1.1 COCCC1CCN(CC1)C 269982a_100011255180_200000210301 [0,1,0,1,0,0|2,0,0]=4 17875 B11R1.1 COCCC1CCN(CC1)C 34a_100011255180_200000210301 [0,1,0,1,0,0|2,0,0]=4 17876 B11R1.1 COCCC1CCN(CC1)[13CH3] 2230a_100011255180_200025704644 [0,1,0,1,0,0|2,0,0]=4 17877 B11R1.1 COCCC1CCN(CC1)[13CH3] 269982a_100011255180_200025704644 [0,1,0,1,0,0|2,0,0]=4 17878 B11R1.1 COCCC1CCN(CC1)[13CH3] 34a_100011255180_200025704644 [0,1,0,1,0,0|2,0,0]=4 17879 B11R1.1 COCCN1CCC(CC1)C 2230a_100000188429_100011201679 [0,1,0,1,0,0|2,0,0]=4 17880 B11R1.1 COCCN1CCC(CC1)C 269982a_100000188429_100000233755 [0,1,0,1,0,0|2,0,0]=4 17881 B11R1.1 COCCN1CCC(CC1)C 34a_100000188429_100011201679 [0,1,0,1,0,0|2,0,0]=4 17882 B11R1.1 COCCN1CCC(CC1)F 2230a_100015193889_100011201679 [0,1,0,1,0,0|2,0,0]=4 17883 B11R1.1 COCCN1CCC(CC1)F 269982a_100015193889_100000233755 [0,1,0,1,0,0|2,0,0]=4 17884 B11R1.1 COCCN1CCC(CC1)F 34a_100015193889_100011201679 [0,1,0,1,0,0|2,0,0]=4 17885 B11R1.1 COCCN1CCC(CC1)O 2230a_100025773856_100011201679 [0,1,0,1,0,0|2,0,0]=4 17886 B11R1.1 COCCN1CCC(CC1)O 269982a_100025773856_100000233755 [0,1,0,1,0,0|2,0,0]=4 17887 B11R1.1 COCCN1CCN(CC1)C 2230a_100000188432_100011201679 [0,1,0,1,0,0|2,0,0]=4 17888 B11R1.1 COCCN1CCN(CC1)C 2230a_100000235850_200000210301 [0,1,0,1,0,0|2,0,0]=4 17889 B11R1.1 COCCN1CCN(CC1)C 269982a_100000188432_100000233755 [0,1,0,1,0,0|2,0,0]=4 17890 B11R1.1 COCCN1CCN(CC1)C 269982a_100000235850_200000210301 [0,1,0,1,0,0|2,0,0]=4 17891 B11R1.1 COCCN1CCN(CC1)[13CH3] 2230a_100000235850_200025704644 [0,1,0,1,0,0|2,0,0]=4 17892 B11R1.1 COCCN1CCN(CC1)[13CH3] 269982a_100000235850_200025704644 [0,1,0,1,0,0|2,0,0]=4 17893 B11R1.1 COCCN1CCS(=O)CC1 2230a_100000752083_100011201679 [0,1,0,1,0,0|1,1,0]=4 17894 B11R1.1 COCCN1CCS(=O)CC1 269982a_100000752083_100000233755 [0,1,0,1,0,0|1,1,0]=4 17895 B11R1.1 [13CH3]OCCC1CCC(CC1)N 34a_100000070672_200025704644 [0,1,0,1,0,0|2,0,0]=4 17896 B11R1.13 CCOC1CCCC(C1C)C 34a_100011217532_100000210202 [0,1,0,1,0,0|2,0,0]=4 17897 B11R1.13 CCOC1CCCC(C1C)C 7a_100011217532_100000210202 [0,1,0,1,0,0|2,0,0]=4 17898 B11R1.25 C=CC(C)COC1CCOC1 34a_100011215527_100000690089 [0,1,0,1,0,0|1,0,1]=4 17899 B11R1.25 C=CC(C)COC1CCOC1 7a_100011215527_100000731011 [0,1,0,1,0,0|1,0,1]=4 17900 B11R1.25 C=CC(O)CO[C@H]1CCOC1 34a_100000717292_100000730141 [0,1,0,1,0,0|1,0,1]=4 17901 B11R1.25 C=C[C@H](N)COC1CCOC1 34a_100016989147_100000690089 [0,1,0,1,0,0|1,0,1]=4 17902 B11R1.25 CC(CN)COC1CCOC1 34a_100000744482_100000690089 [0,1,0,1,0,0|2,0,0]=4 17903 B11R1.25 CCC(=O)COC1CCOC1 34a_100000725409_100000690089 [0,1,0,1,0,0|1,0,1]=4 17904 B11R1.25 CCC(C)CNC1CCOC1 2230a_100020588543_100000731011 [0,1,0,1,0,0|2,0,0]=4 17905 B11R1.25 CCC(C)CNC1CCOC1 270004a_100020588543_100000752484 [0,1,0,1,0,0|2,0,0]=4 17906 B11R1.25 CCC(C)CN[C@@H]1CCOC1 2230a_200015188469_100000748023 [0,1,0,1,0,0|2,0,0]=4 17907 B11R1.25 CCC(C)CN[C@@H]1CCOC1 270004a_200015188469_100000243153 [0,1,0,1,0,0|2,0,0]=4 17908 B11R1.25 CCC(C)CN[C@H]1CCOC1 2230a_100015188467_100000748023 [0,1,0,1,0,0|2,0,0]=4 17909 B11R1.25 CCC(C)CN[C@H]1CCOC1 270004a_100015188467_100000243153 [0,1,0,1,0,0|2,0,0]=4 17910 B11R1.25 CCC(C)CN[C@H]1CCOC1 34a_100015188467_100000748023 [0,1,0,1,0,0|2,0,0]=4 17911 B11R1.25 CCC(C)COC1CCCC1 34a_100000210269_100000748023 [0,1,0,1,0,0|2,0,0]=4 17912 B11R1.25 CCC(C)COC1CCCC1 7a_100000210269_100000748023 [0,1,0,1,0,0|2,0,0]=4 17913 B11R1.25 CCC(C)COC1CCSC1 7a_100011232664_100000748023 [0,1,0,1,0,0|1,1,0]=4 17914 B11R1.25 CCC(C)CO[C@H]1CCOC1 34a_100000717292_100000748023 [0,1,0,1,0,0|1,0,0]=3 17915 B11R1.25 CCC(C)CSC1CCOC1 62a_100000748023_100000690089 [0,1,0,1,0,0|1,1,0]=4 17916 B11R1.25 CCC(O)CNC1CCOC1 2230a_100011218483_100000731011 [0,1,0,1,0,0|2,0,0]=4 17917 B11R1.25 CCC(O)CNC1CCOC1 270004a_100011218483_100000752484 [0,1,0,1,0,0|2,0,0]=4 17918 B11R1.25 CCC(O)CN[C@@H]1CCOC1 2230a_200015188469_100011218378 [0,1,0,1,0,0|2,0,0]=4 17919 B11R1.25 CCC(O)CN[C@H]1CCOC1 2230a_100015188467_100011218378 [0,1,0,1,0,0|2,0,0]=4 17920 B11R1.25 CCC(O)CN[C@H]1CCOC1 34a_100015188467_100011218378 [0,1,0,1,0,0|2,0,0]=4 17921 B11R1.25 CCC(O)COC1CCCC1 34a_100000210269_100011218378 [0,1,0,1,0,0|2,0,0]=4 17922 B11R1.25 CCC(O)COC1CCCC1 7a_100000210269_100011218378 [0,1,0,1,0,0|2,0,0]=4 17923 B11R1.25 CCC(O)COC1CCSC1 7a_100011232664_100011218378 [0,1,0,1,0,0|1,1,0]=4 17924 B11R1.25 CCC(O)CO[C@H]1CCOC1 34a_100000717292_100011218378 [0,1,0,1,0,0|1,0,0]=3 17925 B11R1.25 CCC(O)CSC1CCOC1 62a_100011218378_100000690089 [0,1,0,1,0,0|1,1,0]=4 17926 B11R1.25 CC[C@H](C)CN[C@@H]1CCOC1 2230a_200015188469_100009816398 [0,1,0,1,0,0|2,0,0]=4 17927 B11R1.25 CC[C@H](C)CN[C@H]1CCOC1 2230a_100015188467_100009816398 [0,1,0,1,0,0|2,0,0]=4 17928 B11R1.25 CC[C@H](C)CN[C@H]1CCOC1 34a_100015188467_100009816398 [0,1,0,1,0,0|2,0,0]=4 17929 B11R1.25 CC[C@H](C)COC1CCCC1 34a_100000210269_100009816398 [0,1,0,1,0,0|2,0,0]=4 17930 B11R1.25 CC[C@H](C)COC1CCCC1 7a_100000210269_100009816398 [0,1,0,1,0,0|2,0,0]=4 17931 B11R1.25 CC[C@H](C)COC1CCCC1 7a_100009816381_100000179811 [0,1,0,1,0,0|2,0,0]=4 17932 B11R1.25 CC[C@H](C)COC1CCOC1 7a_100009816381_100000731011 [0,1,0,1,0,0|1,0,0]=3 17933 B11R1.25 CC[C@H](C)COC1CCSC1 7a_100011232664_100009816398 [0,1,0,1,0,0|1,1,0]=4 17934 B11R1.25 CC[C@H](C)CO[C@H]1CCOC1 34a_100000717292_100009816398 [0,1,0,1,0,0|1,0,0]=3 17935 B11R1.25 CC[C@H](C)CSC1CCOC1 62a_100009816398_100000690089 [0,1,0,1,0,0|1,1,0]=4 17936 B11R1.25 CNC(=O)COC1CCOC1 34a_100000750040_100000690089 [0,1,0,1,0,0|1,0,1]=4 17937 B11R1.25 CNC(=O)CO[C@H]1CCOC1 34a_100000717292_100000183359 [0,1,0,1,0,0|1,0,1]=4 17938 B11R1.25 COC(=O)CN[C@@H]1CCOC1 2230a_200015188469_100000747449 [0,1,0,1,0,0|1,0,1]=4 17939 B11R1.25 COC(=O)CN[C@H]1CCOC1 2230a_100015188467_100000747449 [0,1,0,1,0,0|1,0,1]=4 17940 B11R1.25 COC(=O)CN[C@H]1CCOC1 34a_100015188467_100000747449 [0,1,0,1,0,0|1,0,1]=4 17941 B11R1.25 COC(=O)COC1CCCC1 34a_100000210269_100000747449 [0,1,0,1,0,0|1,0,1]=4 17942 B11R1.25 COC(=O)COC1CCCC1 7a_100000210269_100000747449 [0,1,0,1,0,0|1,0,1]=4 17943 B11R1.25 COC(=O)COC1CCSC1 7a_100011232664_100000747449 [0,1,0,1,0,0|0,1,1]=4 17944 B11R1.25 COC(=O)CO[C@H]1CCOC1 34a_100000717292_100000747449 [0,1,0,1,0,0|0,0,1]=3 17945 B11R1.25 COC(=O)CSC1CCOC1 62a_100000747449_100000690089 [0,1,0,1,0,0|0,1,1]=4 17946 B11R1.25 COC(C)COC1CCCC1 34a_100000690652_100000179811 [0,1,0,1,0,0|1,0,0]=3 17947 B11R1.25 COC(C)COC1CCOC1 34a_100000690652_100000690089 [0,1,0,1,0,0|0,0,0]=2 17948 B11R1.25 COC(C)SCC1CCOC1 62a_100000702531_100009879195 [0,1,0,1,0,0|2,0,0]=4 17949 B11R1.25 COC(C)SCC1CCOC1 62a_100009879195_100000702531 [0,1,0,1,0,0|2,0,0]=4 17950 B11R1.25 CO[C@H](C)CNC1CCCC1 2230a_100020591295_100000179811 [0,1,0,1,0,0|2,0,0]=4 17951 B11R1.25 CO[C@H](C)CNC1CCCC1 270004a_100020591295_100000210133 [0,1,0,1,0,0|2,0,0]=4 17952 B11R1.25 CO[C@H](C)CNC1CCOC1 2230a_100020591295_100000731011 [0,1,0,1,0,0|1,0,0]=3 17953 B11R1.25 CO[C@H](C)CNC1CCOC1 270004a_100020591295_100000752484 [0,1,0,1,0,0|1,0,0]=3 17954 B11R1.25 CO[C@H](C)CNC1CCSC1 270004a_100020591295_100000212027 [0,1,0,1,0,0|1,1,0]=4 17955 B11R1.25 C[C@@H](CO)CO[C@H]1CCOC1 34a_100000717292_100000059175 [0,1,0,1,0,0|2,0,0]=4 17956 B11R1.25 ClCC(Cl)COC1CCOC1 34a_100000033668_100000690089 [0,1,0,1,0,0|2,0,0]=4 17957 B11R1.25 NC[C@@H](F)COC1CCOC1 34a_100015665980_100000690089 [0,1,0,1,0,0|2,0,0]=4 17958 B11R1.25 OCC(O)CO[C@H]1CCOC1 34a_100000717292_100011219619 [0,1,0,1,0,0|2,0,0]=4 17959 B11R1.25 OC[C@H](O)CO[C@H]1CCOC1 34a_100000717292_100009815848 [0,1,0,1,0,0|2,0,0]=4 17960 B11R1.25 O[C@@H](CF)CO[C@H]1CCOC1 34a_100000717292_100015614560 [0,1,0,1,0,0|2,0,0]=4 17961 B11R1.40 CC(CN1CCOCC1)N[13CH3] 2230a_100000739823_200025704644 [0,1,0,1,0,0|2,0,0]=4 17962 B11R1.40 CCC(=O)CC1CCCCO1 1458a_100000210414_100000211543 [0,1,0,1,0,0|2,0,0]=4 17963 B11R1.40 CCC(=O)CC1CCCCO1 1458a_100000238585_100000210202 [0,1,0,1,0,0|2,0,0]=4 17964 B11R1.40 CCC(=O)CC1CCCOC1 1458a_100000210414_100000741521 [0,1,0,1,0,0|2,0,0]=4 17965 B11R1.40 CCC(=O)CC1CCCOC1 1458a_100000741523_100000210202 [0,1,0,1,0,0|2,0,0]=4 17966 B11R1.40 CCC(C)CN1CCOCC1 2230a_100015191051_100000748023 [0,1,0,1,0,0|2,0,0]=4 17967 B11R1.40 CCC(C)CN1CCOCC1 269982a_100015191051_100000748023 [0,1,0,1,0,0|2,0,0]=4 17968 B11R1.40 CCC(C)CN1CCOCC1 270004a_100015191051_100000243153 [0,1,0,1,0,0|2,0,0]=4 17969 B11R1.40 CCC(C)CN1CCOCC1 34a_100015191051_100000748023 [0,1,0,1,0,0|2,0,0]=4 17970 B11R1.40 CCC(O)CN1CCOCC1 2230a_100015191051_100011218378 [0,1,0,1,0,0|2,0,0]=4 17971 B11R1.40 CCC(O)CN1CCOCC1 269982a_100015191051_100011218378 [0,1,0,1,0,0|2,0,0]=4 17972 B11R1.40 CCC(O)CN1CCOCC1 34a_100015191051_100011218378 [0,1,0,1,0,0|2,0,0]=4 17973 B11R1.40 CCN(C)CC1CCCCO1 2230a_100000225621_100000211543 [0,1,0,1,0,0|2,0,0]=4 17974 B11R1.40 CCN(C)CC1CCCCO1 2230a_100000225654_100000210202 [0,1,0,1,0,0|2,0,0]=4 17975 B11R1.40 CCN(C)CC1CCCCO1 2230a_100015185122_200000210301 [0,1,0,1,0,0|2,0,0]=4 17976 B11R1.40 CCN(C)CC1CCCCO1 269982a_100000225621_100000211543 [0,1,0,1,0,0|2,0,0]=4 17977 B11R1.40 CCN(C)CC1CCCCO1 269982a_100000225654_100000204670 [0,1,0,1,0,0|2,0,0]=4 17978 B11R1.40 CCN(C)CC1CCCCO1 269982a_100015185122_200000210301 [0,1,0,1,0,0|2,0,0]=4 17979 B11R1.40 CCN(C)CC1CCCCO1 34a_100000225654_100000210202 [0,1,0,1,0,0|2,0,0]=4 17980 B11R1.40 CCN(C)CC1CCCCO1 34a_100015185122_200000210301 [0,1,0,1,0,0|2,0,0]=4 17981 B11R1.40 CCN(C)CC1CCCOC1 2230a_100000225621_100000741521 [0,1,0,1,0,0|2,0,0]=4 17982 B11R1.40 CCN(C)CC1CCCOC1 269982a_100000225621_100000741521 [0,1,0,1,0,0|2,0,0]=4 17983 B11R1.40 CCN(C)CC1COCCO1 2230a_100011398995_100000210202 [0,1,0,1,0,0|1,0,0]=3 17984 B11R1.40 CCN(C)CC1COCCO1 269982a_100011398995_100000204670 [0,1,0,1,0,0|1,0,0]=3 17985 B11R1.40 CCN(C)CC1COCCO1 34a_100011398995_100000210202 [0,1,0,1,0,0|1,0,0]=3 17986 B11R1.40 CCN([13CH3])CC1CCCCO1 2230a_100015185122_200025704644 [0,1,0,1,0,0|2,0,0]=4 17987 B11R1.40 CCN([13CH3])CC1CCCCO1 269982a_100015185122_200025704644 [0,1,0,1,0,0|2,0,0]=4 17988 B11R1.40 CCN([13CH3])CC1CCCCO1 34a_100015185122_200025704644 [0,1,0,1,0,0|2,0,0]=4 17989 B11R1.40 CC[C@H](C)CN1CCOCC1 2230a_100015191051_100009816398 [0,1,0,1,0,0|2,0,0]=4 17990 B11R1.40 CC[C@H](C)CN1CCOCC1 269982a_100015191051_100009816398 [0,1,0,1,0,0|2,0,0]=4 17991 B11R1.40 CC[C@H](C)CN1CCOCC1 34a_100015191051_100009816398 [0,1,0,1,0,0|2,0,0]=4 17992 B11R1.40 CN(CF)CC1COCCO1 269982a_100011398995_100015361967 [0,1,0,1,0,0|2,0,0]=4 17993 B11R1.40 CN(CF)CC1COCCO1 34a_100011398995_100015361967 [0,1,0,1,0,0|2,0,0]=4 17994 B11R1.40 CNC(C)CN1CCOCC1 2230a_100000739823_200000210301 [0,1,0,1,0,0|2,0,0]=4 17995 B11R1.40 COC(=O)CN1CCOCC1 2230a_100015191051_100000747449 [0,1,0,1,0,0|1,0,1]=4 17996 B11R1.40 COC(=O)CN1CCOCC1 269982a_100015191051_100000747449 [0,1,0,1,0,0|1,0,1]=4 17997 B11R1.40 COC(=O)CN1CCOCC1 34a_100015191051_100000747449 [0,1,0,1,0,0|1,0,1]=4 17998 B11R1.40 COC(C)SC1CCOCC1 62a_100009879195_100011324220 [0,1,0,1,0,0|2,0,0]=4 17999 B11R1.214 CCOCN1CC[C@H](C1)OC 269982a_100000766984_100000739092 [0,1,0,1,0,0|2,0,0]=4 18000 B11R1.235 CCC(C)COCC1CC1C 34a_100000744939_100000748023 [0,1,0,1,0,0|2,0,0]=4 18001 B11R1.235 CCC(C)COCC1CC1C 7a_100000744939_100000748023 [0,1,0,1,0,0|2,0,0]=4 18002 B11R1.235 CCC(O)COCC1CC1C 34a_100000744939_100011218378 [0,1,0,1,0,0|2,0,0]=4 18003 B11R1.235 CCC(O)COCC1CC1C 7a_100000744939_100011218378 [0,1,0,1,0,0|2,0,0]=4 18004 B11R1.235 CC[C@H](C)COCC1CC1C 34a_100000744939_100009816398 [0,1,0,1,0,0|2,0,0]=4 18005 B11R1.235 CC[C@H](C)COCC1CC1C 7a_100000744939_100009816398 [0,1,0,1,0,0|2,0,0]=4 18006 B11R1.235 COC(=O)COCC1CC1C 34a_100000744939_100000747449 [0,1,0,1,0,0|1,0,1]=4 18007 B11R1.235 COC(=O)COCC1CC1C 7a_100000744939_100000747449 [0,1,0,1,0,0|1,0,1]=4 18008 B11R1.236 C=CC(C)COCC1CCO1 34a_100011215527_100000103362 [0,1,0,1,0,0|1,0,1]=4 18009 B11R1.236 C=CC(C)COCC1CCO1 7a_100011215527_100000103362 [0,1,0,1,0,0|1,0,1]=4 18010 B11R1.236 C=CC(O)COCC1CCO1 34a_100000039022_100000730141 [0,1,0,1,0,0|1,0,1]=4 18011 B11R1.236 C=C[C@H](N)COCC1CCO1 34a_100016989147_100000103362 [0,1,0,1,0,0|1,0,1]=4 18012 B11R1.236 CC(CN)COCC1CCO1 34a_100000744482_100000103362 [0,1,0,1,0,0|2,0,0]=4 18013 B11R1.236 CCC(=O)COCC1CCO1 34a_100000725409_100000103362 [0,1,0,1,0,0|1,0,1]=4 18014 B11R1.236 CCC(C)CCOC1COC1 7a_100011215188_100009818527 [0,1,0,1,0,0|1,0,0]=3 18015 B11R1.236 CCC(C)CNCC1CCO1 2230a_100020588543_100000103362 [0,1,0,1,0,0|2,0,0]=4 18016 B11R1.236 CCC(C)CNC[C@@H]1CCO1 2230a_100020831831_100000748023 [0,1,0,1,0,0|2,0,0]=4 18017 B11R1.236 CCC(C)CNC[C@@H]1CCO1 270004a_100020831831_100000243153 [0,1,0,1,0,0|2,0,0]=4 18018 B11R1.236 CCC(C)CNC[C@@H]1CCO1 34a_100020831831_100000748023 [0,1,0,1,0,0|2,0,0]=4 18019 B11R1.236 CCC(C)COCC1CCC1 34a_100000760304_100000748023 [0,1,0,1,0,0|2,0,0]=4 18020 B11R1.236 CCC(C)COCC1CCO1 34a_100000039022_100000748023 [0,1,0,1,0,0|1,0,0]=3 18021 B11R1.236 CCC(C)CSCC1CCO1 62a_100000103362_100000748023 [0,1,0,1,0,0|1,1,0]=4 18022 B11R1.236 CCC(C)CSCC1CCO1 62a_100000748023_100000103362 [0,1,0,1,0,0|1,1,0]=4 18023 B11R1.236 CCC(O)CNCC1CCO1 2230a_100011218483_100000103362 [0,1,0,1,0,0|2,0,0]=4 18024 B11R1.236 CCC(O)CNC[C@@H]1CCO1 2230a_100020831831_100011218378 [0,1,0,1,0,0|2,0,0]=4 18025 B11R1.236 CCC(O)CNC[C@@H]1CCO1 34a_100020831831_100011218378 [0,1,0,1,0,0|2,0,0]=4 18026 B11R1.236 CCC(O)COCC1CCC1 34a_100000760304_100011218378 [0,1,0,1,0,0|2,0,0]=4 18027 B11R1.236 CCC(O)COCC1CCO1 34a_100000039022_100011218378 [0,1,0,1,0,0|1,0,0]=3 18028 B11R1.236 CCC(O)CSCC1CCO1 62a_100000103362_100011218378 [0,1,0,1,0,0|1,1,0]=4 18029 B11R1.236 CCC(O)CSCC1CCO1 62a_100011218378_100000103362 [0,1,0,1,0,0|1,1,0]=4 18030 B11R1.236 CC[C@H](C)CNC[C@@H]1CCO1 2230a_100020831831_100009816398 [0,1,0,1,0,0|2,0,0]=4 18031 B11R1.236 CC[C@H](C)CNC[C@@H]1CCO1 34a_100020831831_100009816398 [0,1,0,1,0,0|2,0,0]=4 18032 B11R1.236 CC[C@H](C)COCC1CCC1 34a_100000760304_100009816398 [0,1,0,1,0,0|2,0,0]=4 18033 B11R1.236 CC[C@H](C)COCC1CCC1 7a_100009816381_100000763275 [0,1,0,1,0,0|2,0,0]=4 18034 B11R1.236 CC[C@H](C)COCC1CCO1 34a_100000039022_100009816398 [0,1,0,1,0,0|1,0,0]=3 18035 B11R1.236 CC[C@H](C)COCC1CCO1 7a_100009816381_100000103362 [0,1,0,1,0,0|1,0,0]=3 18036 B11R1.236 CC[C@H](C)CSCC1CCO1 62a_100000103362_100009816398 [0,1,0,1,0,0|1,1,0]=4 18037 B11R1.236 CC[C@H](C)CSCC1CCO1 62a_100009816398_100000103362 [0,1,0,1,0,0|1,1,0]=4 18038 B11R1.236 CNC(=O)CCOC1COC1 34a_100000754576_100009818527 [0,1,0,1,0,0|2,0,0]=4 18039 B11R1.236 CNC(=O)COCC1CCO1 34a_100000039022_100000183359 [0,1,0,1,0,0|1,0,1]=4 18040 B11R1.236 CNC(=O)COCC1CCO1 34a_100000750040_100000103362 [0,1,0,1,0,0|1,0,1]=4 18041 B11R1.236 COC(=O)CNC[C@@H]1CCO1 2230a_100020831831_100000747449 [0,1,0,1,0,0|1,0,1]=4 18042 B11R1.236 COC(=O)CNC[C@@H]1CCO1 34a_100020831831_100000747449 [0,1,0,1,0,0|1,0,1]=4 18043 B11R1.236 COC(=O)COCC1CCC1 34a_100000760304_100000747449 [0,1,0,1,0,0|1,0,1]=4 18044 B11R1.236 COC(=O)COCC1CCO1 34a_100000039022_100000747449 [0,1,0,1,0,0|0,0,1]=3 18045 B11R1.236 COC(=O)CSCC1CCO1 62a_100000103362_100000747449 [0,1,0,1,0,0|0,1,1]=4 18046 B11R1.236 COC(=O)CSCC1CCO1 62a_100000747449_100000103362 [0,1,0,1,0,0|0,1,1]=4 18047 B11R1.236 COC(C)CCOC1COC1 7a_100000764861_100009818527 [0,1,0,1,0,0|2,0,0]=4 18048 B11R1.236 COC(C)COCC1CCC1 34a_100000690652_100000763275 [0,1,0,1,0,0|1,0,0]=3 18049 B11R1.236 COC(C)COCC1CCO1 34a_100000690652_100000103362 [0,1,0,1,0,0|0,0,0]=2 18050 B11R1.236 COC(C)COCC1COC1 34a_100000690652_100010264016 [0,1,0,1,0,0|2,0,0]=4 18051 B11R1.236 CO[C@H](C)CNCC1CCC1 2230a_100020591295_100000763275 [0,1,0,1,0,0|2,0,0]=4 18052 B11R1.236 CO[C@H](C)CNCC1CCC1 269862a_100020591295_100000753134 [0,1,0,1,0,0|2,0,0]=4 18053 B11R1.236 CO[C@H](C)CNCC1CCO1 2230a_100020591295_100000103362 [0,1,0,1,0,0|1,0,0]=3 18054 B11R1.236 C[C@@H](CO)COCC1CCO1 34a_100000039022_100000059175 [0,1,0,1,0,0|2,0,0]=4 18055 B11R1.236 ClCC(Cl)COCC1CCO1 34a_100000033668_100000103362 [0,1,0,1,0,0|2,0,0]=4 18056 B11R1.236 NC[C@@H](F)COCC1CCO1 34a_100015665980_100000103362 [0,1,0,1,0,0|2,0,0]=4 18057 B11R1.236 OCC(O)COCC1CCO1 34a_100000039022_100011219619 [0,1,0,1,0,0|2,0,0]=4 18058 B11R1.236 OC[C@H](O)COCC1CCO1 34a_100000039022_100009815848 [0,1,0,1,0,0|2,0,0]=4 18059 B11R1.236 O[C@@H](CF)COCC1CCO1 34a_100000039022_100015614560 [0,1,0,1,0,0|2,0,0]=4 18060 B11R1.237 CCC(C)CCNCC1CO1 2230a_100020591266_100011216344 [0,1,0,1,0,0|2,0,0]=4 18061 B11R1.237 CCC(C)CCOCC1CC1 7a_100011215188_100000742324 [0,1,0,1,0,0|2,0,0]=4 18062 B11R1.237 CCC(C)CCOCC1CO1 7a_100011215188_102125554688 [0,1,0,1,0,0|1,0,0]=3 18063 B11R1.237 CCC(C)CCOCC1CS1 7a_100011215188_100000031435 [0,1,0,1,0,0|1,1,0]=4 18064 B11R1.237 CCC(C)CCOC[C@@H]1CO1 7a_100011215188_100000745022 [0,1,0,1,0,0|1,0,0]=3 18065 B11R1.237 CCC(C)COCCC1CC1 34a_100000754188_100000748023 [0,1,0,1,0,0|2,0,0]=4 18066 B11R1.237 CCC(C)COCCC1CC1 7a_100000754188_100000748023 [0,1,0,1,0,0|2,0,0]=4 18067 B11R1.237 CCC(O)COCCC1CC1 34a_100000754188_100011218378 [0,1,0,1,0,0|2,0,0]=4 18068 B11R1.237 CCC(O)COCCC1CC1 7a_100000754188_100011218378 [0,1,0,1,0,0|2,0,0]=4 18069 B11R1.237 CC[C@H](C)COCCC1CC1 34a_100000754188_100009816398 [0,1,0,1,0,0|2,0,0]=4 18070 B11R1.237 CC[C@H](C)COCCC1CC1 7a_100000754188_100009816398 [0,1,0,1,0,0|2,0,0]=4 18071 B11R1.237 CC[C@H](C)COCCC1CC1 7a_100009816381_100000764125 [0,1,0,1,0,0|2,0,0]=4 18072 B11R1.237 CNC(=O)CCOCC1CO1 34a_100000754576_102125554688 [0,1,0,1,0,0|2,0,0]=4 18073 B11R1.237 CNC(=O)CCOC[C@@H]1CO1 34a_100000757423_100012179268 [0,1,0,1,0,0|2,0,0]=4 18074 B11R1.237 COC(=O)CCOC[C@@H]1CO1 34a_100000757423_100000742370 [0,1,0,1,0,0|2,0,0]=4 18075 B11R1.237 COC(=O)COCCC1CC1 34a_100000754188_100000747449 [0,1,0,1,0,0|1,0,1]=4 18076 B11R1.237 COC(=O)COCCC1CC1 7a_100000754188_100000747449 [0,1,0,1,0,0|1,0,1]=4 18077 B11R1.237 COC(C)CCOCC1CO1 7a_100000764861_102125554688 [0,1,0,1,0,0|2,0,0]=4 18078 B11R1.237 COC(C)CCOC[C@@H]1CO1 7a_100000764861_100000745022 [0,1,0,1,0,0|2,0,0]=4 18079 B11R1.237 COC(C)COCCC1CC1 34a_100000690652_100000694398 [0,1,0,1,0,0|1,0,0]=3 18080 B11R1.237 COC(C)COCCC1CO1 34a_100000690652_100000732470 [0,1,0,1,0,0|2,0,0]=4 18081 B11R1.237 CO[C@H](C)CNCCC1CC1 2230a_100020591295_100000694398 [0,1,0,1,0,0|2,0,0]=4 18082 B11R1.320 C/C=C/CCOCC1(CO1)C 34a_100016278192_100000760498 [0,1,0,1,0,0|1,0,1]=4 18083 B11R1.320 C=COCCOCC1(CO1)C 34a_100000033082_100000760498 [0,1,0,1,0,0|0,0,2]=4 18084 B11R1.320 CC#CCCOCC1(CO1)C 34a_100000750427_100000760498 [0,1,0,1,0,0|1,0,1]=4 18085 B11R1.320 CC/C=C\COCC1(CO1)C 34a_100016268518_100000760498 [0,1,0,1,0,0|1,0,1]=4 18086 B11R1.320 CC1(CO1)COCCCCBr 34a_100011216708_100000760498 [0,1,0,1,0,0|2,0,0]=4 18087 B11R1.320 CC1(CO1)COCCCCCl 34a_100000210776_100000760498 [0,1,0,1,0,0|2,0,0]=4 18088 B11R1.320 CC1(CO1)COCCCCF 34a_100011995726_100000760498 [0,1,0,1,0,0|2,0,0]=4 18089 B11R1.320 CC1(CO1)COCCCCI 34a_200012148704_100000760498 [0,1,0,1,0,0|2,0,0]=4 18090 B11R1.320 CC1(CO1)COCCCCN 34a_100000750430_100000760498 [0,1,0,1,0,0|2,0,0]=4 18091 B11R1.320 CCC#CCOCC1(CO1)C 34a_100000032950_100000760498 [0,1,0,1,0,0|1,0,1]=4 18092 B11R1.320 CCCCCOCC1(CC1)C 7a_100000698024_100000210326 [0,1,0,1,0,0|2,0,0]=4 18093 B11R1.320 CCCCCOCC1(CC1)F 34a_200000703853_100000718602 [0,1,0,1,0,0|2,0,0]=4 18094 B11R1.320 CCCCCOCC1(CC1)F 7a_200000703853_100000210326 [0,1,0,1,0,0|2,0,0]=4 18095 B11R1.320 CCCCCOCC1(CO1)C 34a_100000210253_100000760498 [0,1,0,1,0,0|1,0,0]=3 18096 B11R1.320 CCCCCSCC1(CO1)C 62a_100000210326_100000760498 [0,1,0,1,0,0|1,1,0]=4 18097 B11R1.320 CCCCCSCC1(CO1)C 62a_100000760498_100000210326 [0,1,0,1,0,0|1,1,0]=4 18098 B11R1.320 CCOCCNCC1(CC1)C 2230a_100000766693_100011215890 [0,1,0,1,0,0|2,0,0]=4 18099 B11R1.320 CCOCCNCC1(CC1)O 2230a_100011936951_100011215890 [0,1,0,1,0,0|2,0,0]=4 18100 B11R1.320 CCOCCNCC1(CO1)C 34a_102516460346_100000760498 [0,1,0,1,0,0|1,0,0]=3 18101 B11R1.320 CCOCCOCC1(CC1)C 7a_100000698024_100011215890 [0,1,0,1,0,0|1,0,0]=3 18102 B11R1.320 CCOCCOCC1(CC1)F 34a_200000703853_100000210147 [0,1,0,1,0,0|1,0,0]=3 18103 B11R1.320 CCOCCOCC1(CC1)F 7a_200000703853_100011215890 [0,1,0,1,0,0|1,0,0]=3 18104 B11R1.320 CCOCCOCC1(CO1)C 34a_100000210136_100000760498 [0,1,0,1,0,0|0,0,0]=2 18105 B11R1.320 CCOCCSCC1(CO1)C 62a_100000210147_100000760498 [0,1,0,1,0,0|0,1,0]=3 18106 B11R1.320 CCOCCSCC1(CO1)C 62a_100000760498_100011215890 [0,1,0,1,0,0|0,1,0]=3 18107 B11R1.320 CCSCCOCC1(CC1)C 7a_100000698024_100000757381 [0,1,0,1,0,0|1,1,0]=4 18108 B11R1.320 CCSCCOCC1(CC1)F 34a_200000703853_100000757381 [0,1,0,1,0,0|1,1,0]=4 18109 B11R1.320 CCSCCOCC1(CC1)F 7a_200000703853_100000757381 [0,1,0,1,0,0|1,1,0]=4 18110 B11R1.320 CCSCCOCC1(CO1)C 34a_100000212035_100000760498 [0,1,0,1,0,0|0,1,0]=3 18111 B11R1.320 CCSCCSCC1(CO1)C 62a_100000757381_100000760498 [0,1,0,1,0,0|0,2,0]=4 18112 B11R1.320 CCSCCSCC1(CO1)C 62a_100000760498_100000757381 [0,1,0,1,0,0|0,2,0]=4 18113 B11R1.320 CNCCCOCC1(CO1)C 34a_100000213112_100000760498 [0,1,0,1,0,0|2,0,0]=4 18114 B11R1.320 COCCCOCC1(CO1)C 34a_100000740835_100000760498 [0,1,0,1,0,0|2,0,0]=4 18115 B11R1.320 COCCOCNC1(CC1)C 2230a_100000757604_100000231047 [0,1,0,1,0,0|2,0,0]=4 18116 B11R1.320 CSCCCOCC1(CO1)C 34a_100000690336_100000760498 [0,1,0,1,0,0|2,0,0]=4 18117 B11R1.757 CCOCCN1C[C@@H]([C@@H]1C)O 2230a_206633788156_100011215890 [0,1,0,1,0,0|2,0,0]=4 18118 B11R1.757 CCOCCN1C[C@@H]([C@@H]1C)O 269982a_206633788156_100011215890 [0,1,0,1,0,0|2,0,0]=4 18119 B11R1.759 CCCCCN1CC(C1)OC 269982a_100000755009_100000210215 [0,1,0,1,0,0|2,0,0]=4 18120 B11R1.759 CCN1CC(C1)NCCOC 2230a_200015199589_100011201679 [0,1,0,1,0,0|2,0,0]=4 18121 B11R1.759 CCOCCN1CC(C1)CC 2230a_100015205115_100011215890 [0,1,0,1,0,0|2,0,0]=4 18122 B11R1.759 CCOCCN1CC(C1)CC 269982a_100015205115_100011215890 [0,1,0,1,0,0|2,0,0]=4 18123 B11R1.759 CCOCCN1CC(C1)OC 269982a_100000755009_100011215890 [0,1,0,1,0,0|1,0,0]=3 18124 B11R1.759 CCOCCN1CC(C1)SC 269982a_100016990038_100011215890 [0,1,0,1,0,0|1,1,0]=4 18125 B11R1.759 CCSCCN1CC(C1)OC 269982a_100000755009_100000757381 [0,1,0,1,0,0|1,1,0]=4 18126 B11R1.852 COC(C)N1CCCOCC1 269982a_100000685342_100009879195 [0,1,0,1,0,0|2,0,0]=4 18127 B11R1.29 CCCCC(=O)C1CCOC1 1458a_100000210183_100000690089 [0,1,0,1,0,0|2,0,0]=4 18128 B11R1.29 CCCCC(=O)C1CCOC1 1458a_100011219752_100000210211 [0,1,0,1,0,0|2,0,0]=4 18129 B11R1.29 CCCCN(C)C1CCOC1 2230a_100000207549_100000731011 [0,1,0,1,0,0|2,0,0]=4 18130 B11R1.29 CCCCN(C)C1CCOC1 2230a_100016988252_100000210211 [0,1,0,1,0,0|2,0,0]=4 18131 B11R1.29 CCCCN(C)C1CCOC1 269982a_100000207549_100000731011 [0,1,0,1,0,0|2,0,0]=4 18132 B11R1.29 CCCCN(C)C1CCOC1 269982a_100016988252_100000210211 [0,1,0,1,0,0|2,0,0]=4 18133 B11R1.29 CCCCN(C)C1CCOC1 270004a_100000207549_100000752484 [0,1,0,1,0,0|2,0,0]=4 18134 B11R1.29 CCCCN(C)C1CCOC1 34a_100016988252_100000210210 [0,1,0,1,0,0|2,0,0]=4 18135 B11R1.29 CCOCC(=O)C1CCOC1 1458a_100000211967_100000690089 [0,1,0,1,0,0|1,0,1]=4 18136 B11R1.29 CCOCN(C)C1CCOC1 269982a_100016988252_100000739092 [0,1,0,1,0,0|2,0,0]=4 18137 B11R1.29 COCCC(=O)C1CCCC1 1458a_100000210718_100000233755 [0,1,0,1,0,0|2,0,0]=4 18138 B11R1.29 COCCC(=O)C1CCCC1 1458a_100000749529_100000179811 [0,1,0,1,0,0|2,0,0]=4 18139 B11R1.29 COCCC(=O)C1CCOC1 1458a_100000749529_100000690089 [0,1,0,1,0,0|1,0,0]=3 18140 B11R1.29 COCCC(=O)C1CCOC1 1458a_100011219752_100000233755 [0,1,0,1,0,0|1,0,0]=3 18141 B11R1.29 COCCN(C)C1CCCC1 2230a_100000207505_100011201679 [0,1,0,1,0,0|2,0,0]=4 18142 B11R1.29 COCCN(C)C1CCCC1 2230a_100000743101_100000179811 [0,1,0,1,0,0|2,0,0]=4 18143 B11R1.29 COCCN(C)C1CCCC1 2230a_100000748032_200000210301 [0,1,0,1,0,0|2,0,0]=4 18144 B11R1.29 COCCN(C)C1CCCC1 269982a_100000207505_100000233755 [0,1,0,1,0,0|2,0,0]=4 18145 B11R1.29 COCCN(C)C1CCCC1 269982a_100000743101_100000179811 [0,1,0,1,0,0|2,0,0]=4 18146 B11R1.29 COCCN(C)C1CCCC1 269982a_100000748032_200000210301 [0,1,0,1,0,0|2,0,0]=4 18147 B11R1.29 COCCN(C)C1CCCC1 270004a_100000743101_100000210133 [0,1,0,1,0,0|2,0,0]=4 18148 B11R1.29 COCCN(C)C1CCCC1 34a_100000207505_100011201679 [0,1,0,1,0,0|2,0,0]=4 18149 B11R1.29 COCCN(C)C1CCCC1 34a_100000748032_200000210301 [0,1,0,1,0,0|2,0,0]=4 18150 B11R1.29 COCCN(C)C1CCOC1 2230a_100000743101_100000731011 [0,1,0,1,0,0|1,0,0]=3 18151 B11R1.29 COCCN(C)C1CCOC1 2230a_100016988252_100011201679 [0,1,0,1,0,0|1,0,0]=3 18152 B11R1.29 COCCN(C)C1CCOC1 2230a_200000722392_200000210301 [0,1,0,1,0,0|1,0,0]=3 18153 B11R1.29 COCCN(C)C1CCOC1 269982a_100000743101_100000731011 [0,1,0,1,0,0|1,0,0]=3 18154 B11R1.29 COCCN(C)C1CCOC1 269982a_100016988252_100000233755 [0,1,0,1,0,0|1,0,0]=3 18155 B11R1.29 COCCN(C)C1CCOC1 269982a_200000722392_200000210301 [0,1,0,1,0,0|1,0,0]=3 18156 B11R1.29 COCCN(C)C1CCOC1 270004a_100000743101_100000752484 [0,1,0,1,0,0|1,0,0]=3 18157 B11R1.29 COCCN(C)C1CCOC1 34a_100016988252_100011201679 [0,1,0,1,0,0|1,0,0]=3 18158 B11R1.29 COCCN(C)C1CCOC1 34a_200000722392_200000210301 [0,1,0,1,0,0|1,0,0]=3 18159 B11R1.29 COCCN(C)C1CCSC1 270004a_100000743101_100000212027 [0,1,0,1,0,0|1,1,0]=4 18160 B11R1.29 COCCN([13CH3])C1CCCC1 2230a_100000748032_200025704644 [0,1,0,1,0,0|2,0,0]=4 18161 B11R1.29 COCCN([13CH3])C1CCCC1 269982a_100000748032_200025704644 [0,1,0,1,0,0|2,0,0]=4 18162 B11R1.29 COCCN([13CH3])C1CCCC1 34a_100000748032_200025704644 [0,1,0,1,0,0|2,0,0]=4 18163 B11R1.29 COCCN([13CH3])C1CCOC1 2230a_200000722392_200025704644 [0,1,0,1,0,0|1,0,0]=3 18164 B11R1.29 COCCN([13CH3])C1CCOC1 269982a_200000722392_200025704644 [0,1,0,1,0,0|1,0,0]=3 18165 B11R1.29 COCCN([13CH3])C1CCOC1 34a_200000722392_200025704644 [0,1,0,1,0,0|1,0,0]=3 18166 B11R1.29 CSCCC(=O)C1CCOC1 1458a_100000174002_100000690089 [0,1,0,1,0,0|1,1,0]=4 18167 B11R1.29 CSCCC(=O)C1CCOC1 1458a_100011219752_100000751147 [0,1,0,1,0,0|1,1,0]=4 18168 B11R1.29 CSCCN(C)C1CCOC1 2230a_100000686725_100000731011 [0,1,0,1,0,0|1,1,0]=4 18169 B11R1.29 CSCCN(C)C1CCOC1 2230a_100016988252_100000751147 [0,1,0,1,0,0|1,1,0]=4 18170 B11R1.29 CSCCN(C)C1CCOC1 269982a_100000686725_100000731011 [0,1,0,1,0,0|1,1,0]=4 18171 B11R1.29 CSCCN(C)C1CCOC1 269982a_100016988252_100000212216 [0,1,0,1,0,0|1,1,0]=4 18172 B11R1.29 CSCCN(C)C1CCOC1 270004a_100000686725_100000752484 [0,1,0,1,0,0|1,1,0]=4 18173 B11R1.29 CSCCN(C)C1CCOC1 34a_100016988252_100000212216 [0,1,0,1,0,0|1,1,0]=4 18174 B11R1.182 CCOC1CC(CCC1C)C 34a_100011217446_100000210202 [0,1,0,1,0,0|2,0,0]=4 18175 B11R1.182 CCOC1CC(CCC1C)C 7a_100011217446_100000210202 [0,1,0,1,0,0|2,0,0]=4 18176 B11R1.282 CCC1CC1C(=O)CCOC 1458a_200011661523_100000233755 [0,1,0,1,0,0|2,0,0]=4 18177 B11R1.284 CC(CCCCl)OC1COC1 34a_200000718107_100009818527 [0,1,0,1,0,0|2,0,0]=4 18178 B11R1.284 CC(CCCCl)OC1COC1 7a_200000718107_100009818527 [0,1,0,1,0,0|2,0,0]=4 18179 B11R1.284 CCC#CC(C)OC1COC1 34a_100000033903_100009818527 [0,1,0,1,0,0|1,0,1]=4 18180 B11R1.284 CCC#CC(C)OC1COC1 7a_100000033903_100009818527 [0,1,0,1,0,0|1,0,1]=4 18181 B11R1.284 CCCCC(=O)CC1CCO1 1458a_100000210183_100000103362 [0,1,0,1,0,0|2,0,0]=4 18182 B11R1.284 CCCCC(C)NC1COC1 2230a_100016991112_200011215066 [0,1,0,1,0,0|2,0,0]=4 18183 B11R1.284 CCCCC(C)NC1COC1 270004a_100016991112_100000210087 [0,1,0,1,0,0|2,0,0]=4 18184 B11R1.284 CCCCC(C)OC1CCC1 34a_100000687866_100000749161 [0,1,0,1,0,0|2,0,0]=4 18185 B11R1.284 CCCCC(C)OC1CCC1 34a_100000748187_200011215066 [0,1,0,1,0,0|2,0,0]=4 18186 B11R1.284 CCCCC(C)OC1COC1 34a_100000687866_100009818527 [0,1,0,1,0,0|1,0,0]=3 18187 B11R1.284 CCCCC(C)OC1COC1 7a_100000687866_100009818527 [0,1,0,1,0,0|1,0,0]=3 18188 B11R1.284 CCCCC(C)OC1CSC1 7a_100000072292_200011215066 [0,1,0,1,0,0|1,1,0]=4 18189 B11R1.284 CCCCC(C)SC1COC1 62a_200011215066_100009818527 [0,1,0,1,0,0|1,1,0]=4 18190 B11R1.284 CCCCN(C)CC1CCO1 2230a_100000207549_100000103362 [0,1,0,1,0,0|2,0,0]=4 18191 B11R1.284 CCCCN(C)CC1CCO1 269982a_100000207549_100000103362 [0,1,0,1,0,0|2,0,0]=4 18192 B11R1.284 CCOCC(=O)CC1COC1 1458a_100000211967_100010264016 [0,1,0,1,0,0|1,0,1]=4 18193 B11R1.284 CCOCC(=O)NC1COC1 11a_100016991112_100000211967 [0,1,0,1,0,0|1,0,1]=4 18194 B11R1.284 CCOCC(=O)NC1COC1 1626a_100016991112_100000211967 [0,1,0,1,0,0|1,0,1]=4 18195 B11R1.284 CCOCC(=O)NC1COC1 240690a_100016991112_100000211967 [0,1,0,1,0,0|1,0,1]=4 18196 B11R1.284 CCOCC(=O)NC1COC1 527a_100016991112_100000211967 [0,1,0,1,0,0|1,0,1]=4 18197 B11R1.284 CCOCC(C)OC1CCC1 34a_100000718985_100000749161 [0,1,0,1,0,0|1,0,0]=3 18198 B11R1.284 CCOCC(C)OC1COC1 34a_100000718985_100009818527 [0,1,0,1,0,0|0,0,0]=2 18199 B11R1.284 CCOCC(C)OC1COC1 7a_100000718985_100009818527 [0,1,0,1,0,0|0,0,0]=2 18200 B11R1.284 CCSCC(C)NC1COC1 270004a_100016991112_200011216171 [0,1,0,1,0,0|1,1,0]=4 18201 B11R1.284 COCCC(=O)CC1CCC1 1458a_100000749529_100000763275 [0,1,0,1,0,0|2,0,0]=4 18202 B11R1.284 COCCC(=O)CC1CCC1 1458a_100000763092_100000233755 [0,1,0,1,0,0|2,0,0]=4 18203 B11R1.284 COCCC(=O)CC1CCO1 1458a_100000749529_100000103362 [0,1,0,1,0,0|1,0,0]=3 18204 B11R1.284 COCCN(C)CC1CCC1 2230a_100000743101_100000763275 [0,1,0,1,0,0|2,0,0]=4 18205 B11R1.284 COCCN(C)CC1CCC1 2230a_200000750244_100011201679 [0,1,0,1,0,0|2,0,0]=4 18206 B11R1.284 COCCN(C)CC1CCC1 269982a_100000743101_100000763275 [0,1,0,1,0,0|2,0,0]=4 18207 B11R1.284 COCCN(C)CC1CCC1 269982a_200000750244_100000233755 [0,1,0,1,0,0|2,0,0]=4 18208 B11R1.284 COCCN(C)CC1CCC1 34a_200000750244_100011201679 [0,1,0,1,0,0|2,0,0]=4 18209 B11R1.284 COCCN(C)CC1CCO1 2230a_100000743101_100000103362 [0,1,0,1,0,0|1,0,0]=3 18210 B11R1.284 COCCN(C)CC1CCO1 269982a_100000743101_100000103362 [0,1,0,1,0,0|1,0,0]=3 18211 B11R1.284 CSCCC(=O)CC1CCO1 1458a_100000174002_100000103362 [0,1,0,1,0,0|1,1,0]=4 18212 B11R1.284 CSCCN(C)CC1CCO1 2230a_100000686725_100000103362 [0,1,0,1,0,0|1,1,0]=4 18213 B11R1.284 CSCCN(C)CC1CCO1 269982a_100000686725_100000103362 [0,1,0,1,0,0|1,1,0]=4 18214 B11R1.285 CC(CCCCl)OCC1CO1 34a_200000718107_102125554688 [0,1,0,1,0,0|2,0,0]=4 18215 B11R1.285 CC(CCCCl)OCC1CO1 7a_200000718107_102125554688 [0,1,0,1,0,0|2,0,0]=4 18216 B11R1.285 CC(CCCCl)OC[C@@H]1CO1 7a_200000718107_100000745022 [0,1,0,1,0,0|2,0,0]=4 18217 B11R1.285 CCC#CC(C)OCC1CO1 34a_100000033903_102125554688 [0,1,0,1,0,0|1,0,1]=4 18218 B11R1.285 CCC#CC(C)OCC1CO1 7a_100000033903_102125554688 [0,1,0,1,0,0|1,0,1]=4 18219 B11R1.285 CCC#CC(C)OC[C@@H]1CO1 7a_100000033903_100000745022 [0,1,0,1,0,0|1,0,1]=4 18220 B11R1.285 CCCCC(C)NCC1CO1 2230a_100000126638_100011216344 [0,1,0,1,0,0|2,0,0]=4 18221 B11R1.285 CCCCC(C)OCC1CC1 34a_100000211283_200011215066 [0,1,0,1,0,0|2,0,0]=4 18222 B11R1.285 CCCCC(C)OCC1CC1 34a_100000687866_100000742324 [0,1,0,1,0,0|2,0,0]=4 18223 B11R1.285 CCCCC(C)OCC1CC1 7a_100000687866_100000742324 [0,1,0,1,0,0|2,0,0]=4 18224 B11R1.285 CCCCC(C)OCC1CO1 34a_100000687866_102125554688 [0,1,0,1,0,0|1,0,0]=3 18225 B11R1.285 CCCCC(C)OCC1CO1 7a_100000687866_102125554688 [0,1,0,1,0,0|1,0,0]=3 18226 B11R1.285 CCCCC(C)OCC1CS1 7a_100000687866_100000031435 [0,1,0,1,0,0|1,1,0]=4 18227 B11R1.285 CCCCC(C)OC[C@@H]1CO1 34a_100000757423_200011215066 [0,1,0,1,0,0|1,0,0]=3 18228 B11R1.285 CCCCC(C)OC[C@@H]1CO1 7a_100000687866_100000745022 [0,1,0,1,0,0|1,0,0]=3 18229 B11R1.285 CCCCC(C)SCC1CO1 62a_102125554688_200011215066 [0,1,0,1,0,0|1,1,0]=4 18230 B11R1.285 CCCCC(C)SCC1CO1 62a_200011215066_102125554688 [0,1,0,1,0,0|1,1,0]=4 18231 B11R1.285 CCCCC(C)SC[C@@H]1CO1 62a_100000745022_200011215066 [0,1,0,1,0,0|1,1,0]=4 18232 B11R1.285 CCCCC(C)SC[C@@H]1CO1 62a_200011215066_100000745022 [0,1,0,1,0,0|1,1,0]=4 18233 B11R1.285 CCOCC(=O)CCC1CO1 1458a_100000211967_100000732470 [0,1,0,1,0,0|1,0,1]=4 18234 B11R1.285 CCOCC(C)OCC1CC1 34a_100000718985_100000742324 [0,1,0,1,0,0|1,0,0]=3 18235 B11R1.285 CCOCC(C)OCC1CC1 7a_100000718985_100000742324 [0,1,0,1,0,0|1,0,0]=3 18236 B11R1.285 CCOCC(C)OCC1CO1 34a_100000718985_102125554688 [0,1,0,1,0,0|0,0,0]=2 18237 B11R1.285 CCOCC(C)OCC1CO1 7a_100000718985_102125554688 [0,1,0,1,0,0|0,0,0]=2 18238 B11R1.285 CCOCC(C)OCC1CS1 7a_100000718985_100000031435 [0,1,0,1,0,0|0,1,0]=3 18239 B11R1.285 CCOCC(C)OC[C@@H]1CO1 7a_100000718985_100000745022 [0,1,0,1,0,0|0,0,0]=2 18240 B11R1.285 COCCC(=O)CCC1CC1 1458a_100000749529_100000694398 [0,1,0,1,0,0|2,0,0]=4 18241 B11R1.285 COCCC(=O)CCC1CC1 1458a_100000756386_100000233755 [0,1,0,1,0,0|2,0,0]=4 18242 B11R1.285 COCCN(C)CCC1CC1 2230a_100000743101_100000694398 [0,1,0,1,0,0|2,0,0]=4 18243 B11R1.285 COCCN(C)CCC1CC1 269982a_100000743101_100000694398 [0,1,0,1,0,0|2,0,0]=4 18244 B11R1.299 CCCCCC(=O)C1COC1 1458a_100000212188_100000687716 [0,1,0,1,0,0|2,0,0]=4 18245 B11R1.299 CCCCCC(=O)C1COC1 1458a_100000758290_100000210326 [0,1,0,1,0,0|2,0,0]=4 18246 B11R1.299 CCCCCN(C)C1COC1 2230a_100102693430_100000210326 [0,1,0,1,0,0|2,0,0]=4 18247 B11R1.299 CCCCCN(C)C1COC1 269982a_100000223495_100000687716 [0,1,0,1,0,0|2,0,0]=4 18248 B11R1.299 CCCCCN(C)C1COC1 269982a_100102693430_100000210215 [0,1,0,1,0,0|2,0,0]=4 18249 B11R1.299 CCCCOC(C)C1CCC1 34a_100000766398_100000210210 [0,1,0,1,0,0|2,0,0]=4 18250 B11R1.299 CCCCOC(C)C1CCC1 7a_100000766398_100000210211 [0,1,0,1,0,0|2,0,0]=4 18251 B11R1.299 CCOCCC(=O)C1CCC1 1458a_100000209988_100011215890 [0,1,0,1,0,0|2,0,0]=4 18252 B11R1.299 CCOCCC(=O)C1CCC1 1458a_100000749530_100000749161 [0,1,0,1,0,0|2,0,0]=4 18253 B11R1.299 CCOCCC(=O)C1COC1 1458a_100000749530_100000687716 [0,1,0,1,0,0|1,0,0]=3 18254 B11R1.299 CCOCCC(=O)C1COC1 1458a_100000758290_100011215890 [0,1,0,1,0,0|1,0,0]=3 18255 B11R1.299 CCOCCN(C)C1CCC1 2230a_100000758072_100011215890 [0,1,0,1,0,0|2,0,0]=4 18256 B11R1.299 CCOCCN(C)C1CCC1 269982a_100000758072_100011215890 [0,1,0,1,0,0|2,0,0]=4 18257 B11R1.299 CCOCCN(C)C1CCC1 34a_100000758072_100000210147 [0,1,0,1,0,0|2,0,0]=4 18258 B11R1.299 CCOCCN(C)C1COC1 2230a_100102693430_100011215890 [0,1,0,1,0,0|1,0,0]=3 18259 B11R1.299 CCOCCN(C)C1COC1 269982a_100102693430_100011215890 [0,1,0,1,0,0|1,0,0]=3 18260 B11R1.299 CCSCCC(=O)C1COC1 1458a_100000230768_100000687716 [0,1,0,1,0,0|1,1,0]=4 18261 B11R1.299 CCSCCC(=O)C1COC1 1458a_100000758290_100000757381 [0,1,0,1,0,0|1,1,0]=4 18262 B11R1.299 CCSCCN(C)C1COC1 2230a_100102693430_100000757381 [0,1,0,1,0,0|1,1,0]=4 18263 B11R1.299 CCSCCN(C)C1COC1 269982a_100102693430_100000757381 [0,1,0,1,0,0|1,1,0]=4 18264 B11R1.299 COCCCC(=O)C1CCO1 1458a_100000089072_100000740836 [0,1,0,1,0,0|1,0,1]=4 18265 B11R1.299 COCCNC(=O)C1CCO1 1626a_100000209980_100000089072 [0,1,0,1,0,0|1,0,1]=4 18266 B11R1.299 COCCNC(=O)C1CCO1 240690a_100000209980_100000089072 [0,1,0,1,0,0|1,0,1]=4 18267 B11R1.299 COCCNC(=O)C1CCO1 527a_100000209980_100000089072 [0,1,0,1,0,0|1,0,1]=4 18268 B11R1.299 COCCNC(C)C1CCC1 2230a_100016994624_100011201679 [0,1,0,1,0,0|2,0,0]=4 18269 B11R1.299 COCCNC(C)C1CCC1 269862a_100000209980_100000760154 [0,1,0,1,0,0|2,0,0]=4 18270 B11R1.299 COCCNC(C)C1CCC1 34a_100016994624_100011201679 [0,1,0,1,0,0|2,0,0]=4 18271 B11R1.299 COCCOC(C)C1CCC1 34a_100000766398_100011201679 [0,1,0,1,0,0|1,0,0]=3 18272 B11R1.299 COCCOC(C)C1CCC1 7a_100000766398_100000233755 [0,1,0,1,0,0|1,0,0]=3 18273 B11R1.299 CSCCOC(C)C1CCC1 34a_100000766398_100000212216 [0,1,0,1,0,0|1,1,0]=4 18274 B11R1.299 CSCCOC(C)C1CCC1 7a_100000766398_100000212216 [0,1,0,1,0,0|1,1,0]=4 18275 B11R1.301 CCCCCC(=O)CC1CO1 1458a_100000212188_100011216344 [0,1,0,1,0,0|2,0,0]=4 18276 B11R1.301 CCCCCC(=O)C[C@@H]1CO1 1458a_100000212188_100000745022 [0,1,0,1,0,0|2,0,0]=4 18277 B11R1.301 CCCCCN(C)CC1CO1 2230a_100000223495_100011216344 [0,1,0,1,0,0|2,0,0]=4 18278 B11R1.301 CCCCCN(C)CC1CO1 269982a_100000223495_102125554688 [0,1,0,1,0,0|2,0,0]=4 18279 B11R1.301 CCCCCN(C)C[C@@H]1CO1 269982a_100000223495_100000745022 [0,1,0,1,0,0|2,0,0]=4 18280 B11R1.301 CCOCCC(=O)CC1CC1 1458a_100000738066_100011215890 [0,1,0,1,0,0|2,0,0]=4 18281 B11R1.301 CCOCCC(=O)CC1CC1 1458a_100000749530_100000742324 [0,1,0,1,0,0|2,0,0]=4 18282 B11R1.301 CCOCCC(=O)CC1CO1 1458a_100000749530_100011216344 [0,1,0,1,0,0|1,0,0]=3 18283 B11R1.301 CCOCCC(=O)CC1CS1 1458a_100000749530_100000031435 [0,1,0,1,0,0|1,1,0]=4 18284 B11R1.301 CCOCCC(=O)C[C@@H]1CO1 1458a_100000749530_100000745022 [0,1,0,1,0,0|1,0,0]=3 18285 B11R1.301 CCOCCN(C)CC1CC1 2230a_100000741881_100011215890 [0,1,0,1,0,0|2,0,0]=4 18286 B11R1.301 CCOCCN(C)CC1CC1 269982a_100000741881_100011215890 [0,1,0,1,0,0|2,0,0]=4 18287 B11R1.301 CCSCCC(=O)CC1CO1 1458a_100000230768_100011216344 [0,1,0,1,0,0|1,1,0]=4 18288 B11R1.301 CCSCCC(=O)C[C@@H]1CO1 1458a_100000230768_100000745022 [0,1,0,1,0,0|1,1,0]=4 18289 B11R1.301 COCCNC(C)CC1CC1 270004a_100000209980_200000686933 [0,1,0,1,0,0|2,0,0]=4 18290 B11R1.465 COCCN1C(CCC1C)C 2230a_100000687148_100011201679 [0,1,0,1,0,0|2,0,0]=4 18291 B11R1.465 COCCN1C(CCC1C)C 269982a_100000687148_100000233755 [0,1,0,1,0,0|2,0,0]=4 18292 B11R1.465 COCCN1C(CCC1C)C 34a_100000687148_100011201679 [0,1,0,1,0,0|2,0,0]=4 18293 B11R1.605 CCOC1C(CCCC1C)C 34a_100011218088_100000210202 [0,1,0,1,0,0|2,0,0]=4 18294 B11R1.605 CCOC1C(CCCC1C)C 7a_100011218088_100000210202 [0,1,0,1,0,0|2,0,0]=4 18295 B11R1.756 CCCCNC1(CCOC1)C 2230a_100000693475_100000210211 [0,1,0,1,0,0|2,0,0]=4 18296 B11R1.756 CCCCOC1(CCCC1)C 34a_100000751722_100000210210 [0,1,0,1,0,0|2,0,0]=4 18297 B11R1.756 CCCCOC1(CCCC1)C 7a_100000751722_100000210211 [0,1,0,1,0,0|2,0,0]=4 18298 B11R1.756 COCCNC1(CCOC1)C 2230a_100000693475_100011201679 [0,1,0,1,0,0|1,0,0]=3 18299 B11R1.756 COCCOC1(CCCC1)C 34a_100000751722_100011201679 [0,1,0,1,0,0|1,0,0]=3 18300 B11R1.756 COCCOC1(CCCC1)C 7a_100000751722_100000233755 [0,1,0,1,0,0|1,0,0]=3 18301 B11R1.756 CSCCNC1(CCOC1)C 2230a_100000693475_100000751147 [0,1,0,1,0,0|1,1,0]=4 18302 B11R1.756 CSCCOC1(CCCC1)C 34a_100000751722_100000212216 [0,1,0,1,0,0|1,1,0]=4 18303 B11R1.756 CSCCOC1(CCCC1)C 7a_100000751722_100000212216 [0,1,0,1,0,0|1,1,0]=4 18304 B11R1.900 CCOCC1(CCCCC1)C 34a_100000688186_100000210202 [0,1,0,1,0,0|2,0,0]=4 18305 B11R1.900 CCOCC1(CCCCC1)C 7a_100000688186_100000210202 [0,1,0,1,0,0|2,0,0]=4 18306 B11R1.900 CCOCC1(CCCCC1)F 34a_100000090305_100000210202 [0,1,0,1,0,0|2,0,0]=4 18307 B11R1.900 CCOCC1(CCCCC1)F 7a_100000090305_100000210202 [0,1,0,1,0,0|2,0,0]=4 18308 B11R1.900 CCOCC1(CCCCC1)N 34a_100000740034_100000210202 [0,1,0,1,0,0|2,0,0]=4 18309 B11R1.900 COCNC1(CCOCC1)C 2230a_100000692449_100000766300 [0,1,0,1,0,0|2,0,0]=4 18310 B11R1.1034 CCOCCC(=O)C1CC1C 1458a_100000211227_100011215890 [0,1,0,1,0,0|2,0,0]=4 18311 B11R2.248 CCOC1CC2CCC1C2 34a_100000211339_100000210202 [0,0,0,2,0,0|2,0,0]=4 18312 B11R2.248 CCOC1CC2CCC1C2 34a_100121572206_100000727232 [0,0,0,2,0,0|2,0,0]=4 18313 B11R2.248 COCC1CC2CCC1C2 34a_100000229996_200000210301 [0,0,0,2,0,0|2,0,0]=4 18314 B11R2.248 [13CH3]OCC1CC2CCC1C2 34a_100000229996_200025704644 [0,0,0,2,0,0|2,0,0]=4 18315 B11R2.76 CCOC1C2CCC1CC2 34a_100121572206_100009813300 [0,0,0,2,0,0|2,0,0]=4 18316 B11R2.191 CO[C@H]1CO[C@@H]2[C@H]1CCO2 34a_100015698664_200000210301 [0,0,0,2,0,0|2,0,0]=4 18317 B11R2.191 CO[C@H]1CO[C@@H]2[C@H]1CCO2 7a_100015698664_200000210301 [0,0,0,2,0,0|2,0,0]=4 18318 B11R2.191 [13CH3]O[C@H]1CO[C@@H]2[C@H]1CCO2 34a_100015698664_200025704644 [0,0,0,2,0,0|2,0,0]=4 18319 B11R2.191 [13CH3]O[C@H]1CO[C@@H]2[C@H]1CCO2 7a_100015698664_200025704644 [0,0,0,2,0,0|2,0,0]=4 18320 B11R2.232 CCN1C2CCC1COC2 2230a_100015205251_100000210202 [0,0,0,2,0,0|2,0,0]=4 18321 B11R2.232 CCN1C2CCC1COC2 269982a_100015205251_100000204670 [0,0,0,2,0,0|2,0,0]=4 18322 B11R2.232 CCN1C2CCC1COC2 34a_100015205251_100000210202 [0,0,0,2,0,0|2,0,0]=4 18323 B11R2.157 COCCN1CC2CC2C1 2230a_100000741873_100011201679 [0,0,0,2,0,0|2,0,0]=4 18324 B11R2.157 COCCN1CC2CC2C1 269982a_100000741873_100000233755 [0,0,0,2,0,0|2,0,0]=4 18325 B11R2.157 COCCN1CC2CC2C1 34a_100000741873_100011201679 [0,0,0,2,0,0|2,0,0]=4 18326 B11R2.238 C1CN(CCO1)CC2CC2 2230a_100015191051_100000742324 [0,0,0,2,0,0|2,0,0]=4 18327 B11R2.238 C1CN(CCO1)CC2CC2 269982a_100015191051_100000756562 [0,0,0,2,0,0|2,0,0]=4 18328 B11R2.238 C1CN(CCO1)CC2CC2 34a_100015191051_100000742324 [0,0,0,2,0,0|2,0,0]=4 18329 B11R2.238 C1CN(CCO1)CC2CO2 2230a_100015191051_100011216344 [0,0,0,2,0,0|1,0,0]=3 18330 B11R2.238 C1CN(CCO1)CC2CO2 269982a_100015191051_102125554688 [0,0,0,2,0,0|1,0,0]=3 18331 B11R2.238 C1CN(CCO1)CC2CO2 34a_100015191051_102125554688 [0,0,0,2,0,0|1,0,0]=3 18332 B11R2.238 C1CN(CCO1)CC2CS2 269982a_100015191051_100000031435 [0,0,0,2,0,0|1,1,0]=4 18333 B11R2.238 C1CN(CCO1)C[C@@H]2CO2 269982a_100015191051_100000745022 [0,0,0,2,0,0|1,0,0]=3 18334 B11R2.238 C1CN(CCS1)CC2CO2 2230a_100000737611_100011216344 [0,0,0,2,0,0|1,1,0]=4 18335 B11R2.238 C1CN(CCS1)CC2CO2 269982a_100000737611_102125554688 [0,0,0,2,0,0|1,1,0]=4 18336 B11R2.238 C1CN(CCS1)C[C@@H]2CO2 269982a_100000737611_100000745022 [0,0,0,2,0,0|1,1,0]=4 18337 B11R2.239 C1CC(C1)N2CCOCC2 269982a_100015191051_100000749161 [0,0,0,2,0,0|2,0,0]=4 18338 B11R2.239 C1CC(C1)N2CCOCC2 270004a_100015191051_100000241760 [0,0,0,2,0,0|2,0,0]=4 18339 B11R2.239 C1CC(C1)N2CCOCC2 34a_100015191051_100000749161 [0,0,0,2,0,0|2,0,0]=4 18340 B11R2.239 C1CN(CCO1)C2COC2 269982a_100015191051_100000687716 [0,0,0,2,0,0|1,0,0]=3 18341 B11R2.239 C1CN(CCO1)C2COC2 34a_100015191051_100009818527 [0,0,0,2,0,0|1,0,0]=3 18342 B11R2.239 C1CN(CCS1)C2COC2 269982a_100000737611_100000687716 [0,0,0,2,0,0|1,1,0]=4 18343 B11R2.258 CCOCC1C2C1CNC2 34a_100000045132_100000210202 [0,0,0,2,0,0|2,0,0]=4 18344 B11R2.258 COCNC1C2C1COC2 2230a_100000702821_100000766300 [0,0,0,2,0,0|2,0,0]=4 18345 B11R2.2 C1CC(CO1)N2CCSC2 2230a_100011215254_100000731011 [0,0,0,2,0,0|1,1,0]=4 18346 B11R2.2 C1CC(CO1)N2CCSC2 269982a_100011215254_100000731011 [0,0,0,2,0,0|1,1,0]=4 18347 B11R2.2 C1CC(CO1)N2CCSC2 270004a_100011215254_100000752484 [0,0,0,2,0,0|1,1,0]=4 18348 B11R2.2 C1CCN(C1)C2CCOC2 2230a_100000188435_100000731011 [0,0,0,2,0,0|2,0,0]=4 18349 B11R2.2 C1CCN(C1)C2CCOC2 269982a_100000188435_100000731011 [0,0,0,2,0,0|2,0,0]=4 18350 B11R2.2 C1CCN(C1)C2CCOC2 270004a_100000188435_100000752484 [0,0,0,2,0,0|2,0,0]=4 18351 B11R2.7 CC1CCN1C2CCOC2 269982a_100000755817_100000731011 [0,0,0,2,0,0|2,0,0]=4 18352 B11R2.7 CC1CCN1C2CCOC2 34a_100000755817_100000690089 [0,0,0,2,0,0|2,0,0]=4 18353 B11R2.237 C1CC(C1)NC2CCOC2 2230a_100000749019_100000731011 [0,0,0,2,0,0|2,0,0]=4 18354 B11R2.237 C1CC(C1)NC2CCOC2 34a_100000749019_100000690089 [0,0,0,2,0,0|2,0,0]=4 18355 B11R2.237 C1CC(C1)N[C@@H]2CCOC2 270004a_200015188469_100000241760 [0,0,0,2,0,0|2,0,0]=4 18356 B11R2.237 C1CC(C1)N[C@H]2CCOC2 270004a_100015188467_100000241760 [0,0,0,2,0,0|2,0,0]=4 18357 B11R2.237 C1CC(C1)N[C@H]2CCOC2 34a_100015188467_100000749161 [0,0,0,2,0,0|2,0,0]=4 18358 B11R2.237 C1CC(C1)OC2CCOC2 34a_100000748187_100000690089 [0,0,0,2,0,0|1,0,0]=3 18359 B11R2.237 C1CC(C1)O[C@H]2CCOC2 34a_100000717292_100000749161 [0,0,0,2,0,0|1,0,0]=3 18360 B11R2.237 C1CC(CO1)NC2COC2 2230a_100016991112_100000731011 [0,0,0,2,0,0|1,0,0]=3 18361 B11R2.237 C1CC(CO1)NC2COC2 270004a_100016991112_100000752484 [0,0,0,2,0,0|1,0,0]=3 18362 B11R2.237 C1CC(CO1)NC2CSC2 270004a_100016994217_100000752484 [0,0,0,2,0,0|1,1,0]=4 18363 B11R2.237 C1CC(CO1)OC2CSC2 7a_100000072292_100000731011 [0,0,0,2,0,0|0,1,0]=3 18364 B11R2.237 C1CC(CS1)NC2COC2 270004a_100016991112_100000212027 [0,0,0,2,0,0|1,1,0]=4 18365 B11R2.237 C1CC(CS1)OC2COC2 7a_100011232664_100009818527 [0,0,0,2,0,0|0,1,0]=3 18366 B11R2.237 C1CC(O1)CN2CCSC2 2230a_100011215254_100000103362 [0,0,0,2,0,0|1,1,0]=4 18367 B11R2.237 C1CC(O1)CN2CCSC2 269982a_100011215254_100000103362 [0,0,0,2,0,0|1,1,0]=4 18368 B11R2.237 C1CCC(C1)NC2COC2 2230a_100016991112_100000179811 [0,0,0,2,0,0|2,0,0]=4 18369 B11R2.237 C1CCC(C1)NC2COC2 270004a_100016991112_100000210133 [0,0,0,2,0,0|2,0,0]=4 18370 B11R2.237 C1CCC(C1)NC2COC2 34a_100000211070_100009818527 [0,0,0,2,0,0|2,0,0]=4 18371 B11R2.237 C1CCC(C1)OC2CCC2 34a_100000210269_100000749161 [0,0,0,2,0,0|2,0,0]=4 18372 B11R2.237 C1CCC(C1)OC2CCC2 34a_100000748187_100000179811 [0,0,0,2,0,0|2,0,0]=4 18373 B11R2.237 C1CCC(C1)OC2COC2 34a_100000210269_100009818527 [0,0,0,2,0,0|1,0,0]=3 18374 B11R2.237 C1CCC(C1)OC2COC2 7a_100000210269_100009818527 [0,0,0,2,0,0|1,0,0]=3 18375 B11R2.237 C1CCC(C1)OC2CSC2 7a_100000072292_100000179811 [0,0,0,2,0,0|1,1,0]=4 18376 B11R2.237 C1CCC(C1)SC2COC2 62a_100011217020_100009818527 [0,0,0,2,0,0|1,1,0]=4 18377 B11R2.237 C1CCN(C1)CC2CCO2 2230a_100000188435_100000103362 [0,0,0,2,0,0|2,0,0]=4 18378 B11R2.237 C1CCN(C1)CC2CCO2 269982a_100000188435_100000103362 [0,0,0,2,0,0|2,0,0]=4 18379 B11R2.237 C1COC(C1)OC2COC2 34a_100000085407_100009818527 [0,0,0,2,0,0|2,0,0]=4 18380 B11R2.237 C1C[C@@H](CO1)NC2COC2 34a_100015188467_100009818527 [0,0,0,2,0,0|1,0,0]=3 18381 B11R2.237 C1C[C@@H](CO1)OC2COC2 34a_100000717292_100009818527 [0,0,0,2,0,0|0,0,0]=2 18382 B11R2.385 C1CC(CO1)NCC2CC2 2230a_100000735609_100000731011 [0,0,0,2,0,0|2,0,0]=4 18383 B11R2.385 C1CC(CO1)NCC2CC2 270004a_100000735609_100000752484 [0,0,0,2,0,0|2,0,0]=4 18384 B11R2.385 C1CC(CO1)NCC2CC2 34a_100000735609_100000690089 [0,0,0,2,0,0|2,0,0]=4 18385 B11R2.385 C1CC(CO1)OCC2CC2 34a_100000211283_100000690089 [0,0,0,2,0,0|1,0,0]=3 18386 B11R2.385 C1CC(CO1)OC[C@@H]2CO2 34a_100000757423_100000690089 [0,0,0,2,0,0|0,0,0]=2 18387 B11R2.385 C1CC(CO1)SCC2CC2 62a_100000756562_100000690089 [0,0,0,2,0,0|1,1,0]=4 18388 B11R2.385 C1CC(CO1)SCC2CO2 62a_102125554688_100000690089 [0,0,0,2,0,0|0,1,0]=3 18389 B11R2.385 C1CC(CO1)SCC2CS2 62a_100000031435_100000690089 [0,0,0,2,0,0|0,2,0]=4 18390 B11R2.385 C1CC(CO1)SC[C@@H]2CO2 62a_100000745022_100000690089 [0,0,0,2,0,0|0,1,0]=3 18391 B11R2.385 C1CC(CS1)OCC2CC2 7a_100011232664_100000742324 [0,0,0,2,0,0|1,1,0]=4 18392 B11R2.385 C1CC(CS1)OCC2CO2 7a_100011232664_102125554688 [0,0,0,2,0,0|0,1,0]=3 18393 B11R2.385 C1CC(CS1)OCC2CS2 7a_100011232664_100000031435 [0,0,0,2,0,0|0,2,0]=4 18394 B11R2.385 C1CC(CS1)OC[C@@H]2CO2 7a_100011232664_100000745022 [0,0,0,2,0,0|0,1,0]=3 18395 B11R2.385 C1CCC(C1)NCC2CO2 2230a_100000211070_100011216344 [0,0,0,2,0,0|2,0,0]=4 18396 B11R2.385 C1CCC(C1)NCC2CO2 34a_100000211070_102125554688 [0,0,0,2,0,0|2,0,0]=4 18397 B11R2.385 C1CCC(C1)OCC2CC2 34a_100000210269_100000742324 [0,0,0,2,0,0|2,0,0]=4 18398 B11R2.385 C1CCC(C1)OCC2CC2 34a_100000211283_100000179811 [0,0,0,2,0,0|2,0,0]=4 18399 B11R2.385 C1CCC(C1)OCC2CC2 7a_100000210269_100000742324 [0,0,0,2,0,0|2,0,0]=4 18400 B11R2.385 C1CCC(C1)OCC2CO2 34a_100000210269_102125554688 [0,0,0,2,0,0|1,0,0]=3 18401 B11R2.385 C1CCC(C1)OCC2CO2 7a_100000210269_102125554688 [0,0,0,2,0,0|1,0,0]=3 18402 B11R2.385 C1CCC(C1)OCC2CS2 7a_100000210269_100000031435 [0,0,0,2,0,0|1,1,0]=4 18403 B11R2.385 C1CCC(C1)OC[C@@H]2CO2 34a_100000757423_100000179811 [0,0,0,2,0,0|1,0,0]=3 18404 B11R2.385 C1CCC(C1)OC[C@@H]2CO2 7a_100000210269_100000745022 [0,0,0,2,0,0|1,0,0]=3 18405 B11R2.385 C1CCC(C1)SCC2CO2 62a_100011217020_102125554688 [0,0,0,2,0,0|1,1,0]=4 18406 B11R2.385 C1CCC(C1)SCC2CO2 62a_102125554688_100000179811 [0,0,0,2,0,0|1,1,0]=4 18407 B11R2.385 C1CCC(C1)SC[C@@H]2CO2 62a_100000745022_100000179811 [0,0,0,2,0,0|1,1,0]=4 18408 B11R2.385 C1CCC(C1)SC[C@@H]2CO2 62a_100011217020_100000745022 [0,0,0,2,0,0|1,1,0]=4 18409 B11R2.385 C1COC(C1)OCC2CO2 34a_100000085407_102125554688 [0,0,0,2,0,0|2,0,0]=4 18410 B11R2.385 C1C[C@@H](CO1)NCC2CC2 2230a_100015188467_100000742324 [0,0,0,2,0,0|2,0,0]=4 18411 B11R2.385 C1C[C@@H](CO1)NCC2CC2 269862a_100015188467_100000741477 [0,0,0,2,0,0|2,0,0]=4 18412 B11R2.385 C1C[C@@H](CO1)NCC2CC2 34a_100015188467_100000742324 [0,0,0,2,0,0|2,0,0]=4 18413 B11R2.385 C1C[C@@H](CO1)NCC2CO2 2230a_100015188467_100011216344 [0,0,0,2,0,0|1,0,0]=3 18414 B11R2.385 C1C[C@@H](CO1)NCC2CO2 34a_100015188467_102125554688 [0,0,0,2,0,0|1,0,0]=3 18415 B11R2.385 C1C[C@@H](CO1)OCC2CC2 34a_100000717292_100000742324 [0,0,0,2,0,0|1,0,0]=3 18416 B11R2.385 C1C[C@@H](CO1)OCC2CO2 34a_100000717292_102125554688 [0,0,0,2,0,0|0,0,0]=2 18417 B11R2.385 C1C[C@H](CO1)NCC2CC2 2230a_200015188469_100000742324 [0,0,0,2,0,0|2,0,0]=4 18418 B11R2.385 C1C[C@H](CO1)NCC2CC2 269862a_200015188469_100000741477 [0,0,0,2,0,0|2,0,0]=4 18419 B11R2.385 C1C[C@H](CO1)NCC2CO2 2230a_200015188469_100011216344 [0,0,0,2,0,0|1,0,0]=3 18420 B11R2.115 CC1SCCN1CC2CO2 2230a_200011216479_100011216344 [0,0,0,2,0,0|1,1,0]=4 18421 B11R2.115 CC1SCCN1CC2CO2 269982a_200011216479_102125554688 [0,0,0,2,0,0|1,1,0]=4 18422 B11R2.115 CC1SCCN1CC2CO2 34a_200011216479_102125554688 [0,0,0,2,0,0|1,1,0]=4 18423 B11R2.115 CC1SCCN1C[C@@H]2CO2 269982a_200011216479_100000745022 [0,0,0,2,0,0|1,1,0]=4 18424 B11R2.115 C[C@@H]1CCCN1CC2CO2 2230a_100015189458_100011216344 [0,0,0,2,0,0|2,0,0]=4 18425 B11R2.115 C[C@@H]1CCCN1CC2CO2 269982a_100015189458_102125554688 [0,0,0,2,0,0|2,0,0]=4 18426 B11R2.115 C[C@@H]1CCCN1CC2CO2 34a_100015189458_102125554688 [0,0,0,2,0,0|2,0,0]=4 18427 B11R2.115 C[C@@H]1CCCN1C[C@@H]2CO2 269982a_100015189458_100000745022 [0,0,0,2,0,0|2,0,0]=4 18428 B11R2.115 C[C@H]1CCCN1CC2CO2 2230a_100020605311_100011216344 [0,0,0,2,0,0|2,0,0]=4 18429 B11R2.115 C[C@H]1CCCN1CC2CO2 269982a_100020605311_102125554688 [0,0,0,2,0,0|2,0,0]=4 18430 B11R2.115 C[C@H]1CCCN1C[C@@H]2CO2 269982a_100020605311_100000745022 [0,0,0,2,0,0|2,0,0]=4 18431 B11R2.459 CC1SCCN1C2COC2 269982a_200011216479_100000687716 [0,0,0,2,0,0|1,1,0]=4 18432 B11R2.459 CC1SCCN1C2COC2 34a_200011216479_100009818527 [0,0,0,2,0,0|1,1,0]=4 18433 B11R2.459 C[C@@H]1CCCN1C2COC2 269982a_100015189458_100000687716 [0,0,0,2,0,0|2,0,0]=4 18434 B11R2.459 C[C@@H]1CCCN1C2COC2 34a_100015189458_100009818527 [0,0,0,2,0,0|2,0,0]=4 18435 B11R2.459 C[C@H]1CCCN1C2COC2 269982a_100020605311_100000687716 [0,0,0,2,0,0|2,0,0]=4 18436 B11R2.512 CC1CCN1CC2CCO2 269982a_100000755817_100000103362 [0,0,0,2,0,0|2,0,0]=4 18437 B11R2.512 CC1CCN1CC2CCO2 34a_100000755817_100000103362 [0,0,0,2,0,0|2,0,0]=4 18438 B11R2.444 CC1CC1COCC2CC2 34a_100000744939_100000742324 [0,0,0,2,0,0|2,0,0]=4 18439 B11R2.444 CC1CC1COCC2CC2 7a_100000744939_100000742324 [0,0,0,2,0,0|2,0,0]=4 18440 B11R2.444 CC1CC1COCC2CO2 34a_100000744939_102125554688 [0,0,0,2,0,0|1,0,0]=3 18441 B11R2.444 CC1CC1COCC2CO2 7a_100000744939_102125554688 [0,0,0,2,0,0|1,0,0]=3 18442 B11R2.444 CC1CC1COCC2CS2 7a_100000744939_100000031435 [0,0,0,2,0,0|1,1,0]=4 18443 B11R2.444 CC1CC1COC[C@@H]2CO2 7a_100000744939_100000745022 [0,0,0,2,0,0|1,0,0]=3 18444 B11R2.774 CC1CC1COC2CCC2 34a_100000744939_100000749161 [0,0,0,2,0,0|2,0,0]=4 18445 B11R2.774 CC1CC1COC2COC2 34a_100000744939_100009818527 [0,0,0,2,0,0|1,0,0]=3 18446 B11R2.774 CC1CC1COC2COC2 7a_100000744939_100009818527 [0,0,0,2,0,0|1,0,0]=3 18447 B11R2.384 C1CC(C1)CNC2COC2 2230a_100016991112_100000763275 [0,0,0,2,0,0|2,0,0]=4 18448 B11R2.384 C1CC(C1)CNC2COC2 269862a_100016991112_100000753134 [0,0,0,2,0,0|2,0,0]=4 18449 B11R2.384 C1CC(C1)CNC2COC2 34a_100000738700_100009818527 [0,0,0,2,0,0|2,0,0]=4 18450 B11R2.384 C1CC(C1)COC2CCC2 34a_100000748187_100000763275 [0,0,0,2,0,0|2,0,0]=4 18451 B11R2.384 C1CC(C1)COC2CCC2 34a_100000760304_100000749161 [0,0,0,2,0,0|2,0,0]=4 18452 B11R2.384 C1CC(C1)COC2COC2 34a_100000760304_100009818527 [0,0,0,2,0,0|1,0,0]=3 18453 B11R2.384 C1CC(C1)COC2CSC2 7a_100000072292_100000763275 [0,0,0,2,0,0|1,1,0]=4 18454 B11R2.384 C1CC(C1)CSC2COC2 62a_100000763275_100009818527 [0,0,0,2,0,0|1,1,0]=4 18455 B11R2.384 C1CC(C1)NCC2CCO2 2230a_100000749019_100000103362 [0,0,0,2,0,0|2,0,0]=4 18456 B11R2.384 C1CC(C1)NCC2CCO2 34a_100000749019_100000103362 [0,0,0,2,0,0|2,0,0]=4 18457 B11R2.384 C1CC(C1)NC[C@@H]2CCO2 270004a_100020831831_100000241760 [0,0,0,2,0,0|2,0,0]=4 18458 B11R2.384 C1CC(C1)NC[C@@H]2CCO2 34a_100020831831_100000749161 [0,0,0,2,0,0|2,0,0]=4 18459 B11R2.384 C1CC(C1)OCC2CCO2 34a_100000039022_100000749161 [0,0,0,2,0,0|1,0,0]=3 18460 B11R2.384 C1CC(C1)OCC2CCO2 34a_100000748187_100000103362 [0,0,0,2,0,0|1,0,0]=3 18461 B11R2.384 C1CC(C1)SCC2CCO2 62a_100000103362_100000749161 [0,0,0,2,0,0|1,1,0]=4 18462 B11R2.384 C1CC(O1)CNC2COC2 2230a_100016991112_100000103362 [0,0,0,2,0,0|1,0,0]=3 18463 B11R2.384 C1CC(O1)COC2COC2 34a_100000039022_100009818527 [0,0,0,2,0,0|0,0,0]=2 18464 B11R2.384 C1CC(O1)COC2CSC2 7a_100000072292_100000103362 [0,0,0,2,0,0|0,1,0]=3 18465 B11R2.384 C1CC(O1)CSC2COC2 62a_100000103362_100009818527 [0,0,0,2,0,0|0,1,0]=3 18466 B11R2.384 C1C[C@H](O1)CNC2COC2 34a_100020831831_100009818527 [0,0,0,2,0,0|1,0,0]=3 18467 B11R2.384 C1NCC1COC2COC2 34a_100016987283_100009818527 [0,0,0,2,0,0|2,0,0]=4 18468 B11R2.384 C1OCC1COC2COC2 34a_100000060846_100009818527 [0,0,0,2,0,0|2,0,0]=4 18469 B11R2.1039 C(CC1CC1)NC2COC2 2230a_100016991112_100000694398 [0,0,0,2,0,0|2,0,0]=4 18470 B11R2.1039 C(CC1CC1)NC2COC2 34a_100000764129_100009818527 [0,0,0,2,0,0|2,0,0]=4 18471 B11R2.1039 C(CC1CC1)OC2COC2 34a_100000754188_100009818527 [0,0,0,2,0,0|1,0,0]=3 18472 B11R2.1039 C(CC1CC1)OC2COC2 7a_100000754188_100009818527 [0,0,0,2,0,0|1,0,0]=3 18473 B11R2.1039 C(CC1CC1)OC2CSC2 7a_100000072292_100000764125 [0,0,0,2,0,0|1,1,0]=4 18474 B11R2.1039 C(CC1CC1)SC2COC2 62a_100000764125_100009818527 [0,0,0,2,0,0|1,1,0]=4 18475 B11R2.1039 C(C[C@@H]1CO1)OC2COC2 34a_100009820653_100009818527 [0,0,0,2,0,0|2,0,0]=4 18476 B11R2.1039 C1CC(C1)CNCC2CO2 2230a_100000738700_100011216344 [0,0,0,2,0,0|2,0,0]=4 18477 B11R2.1039 C1CC(C1)CNCC2CO2 34a_100000738700_102125554688 [0,0,0,2,0,0|2,0,0]=4 18478 B11R2.1039 C1CC(C1)COCC2CC2 34a_100000211283_100000763275 [0,0,0,2,0,0|2,0,0]=4 18479 B11R2.1039 C1CC(C1)COCC2CC2 34a_100000760304_100000742324 [0,0,0,2,0,0|2,0,0]=4 18480 B11R2.1039 C1CC(C1)COCC2CO2 34a_100000760304_102125554688 [0,0,0,2,0,0|1,0,0]=3 18481 B11R2.1039 C1CC(C1)COC[C@@H]2CO2 34a_100000757423_100000763275 [0,0,0,2,0,0|1,0,0]=3 18482 B11R2.1039 C1CC(C1)CSCC2CO2 62a_100000763275_102125554688 [0,0,0,2,0,0|1,1,0]=4 18483 B11R2.1039 C1CC(C1)CSCC2CO2 62a_102125554688_100000763275 [0,0,0,2,0,0|1,1,0]=4 18484 B11R2.1039 C1CC(C1)CSC[C@@H]2CO2 62a_100000745022_100000763275 [0,0,0,2,0,0|1,1,0]=4 18485 B11R2.1039 C1CC(C1)CSC[C@@H]2CO2 62a_100000763275_100000745022 [0,0,0,2,0,0|1,1,0]=4 18486 B11R2.1039 C1CC(C1)OCCC2CC2 34a_100000748187_100000694398 [0,0,0,2,0,0|2,0,0]=4 18487 B11R2.1039 C1CC(C1)OCCC2CC2 34a_100000754188_100000749161 [0,0,0,2,0,0|2,0,0]=4 18488 B11R2.1039 C1CC(O1)CNCC2CC2 2230a_100000735609_100000103362 [0,0,0,2,0,0|2,0,0]=4 18489 B11R2.1039 C1CC(O1)CNCC2CC2 34a_100000735609_100000103362 [0,0,0,2,0,0|2,0,0]=4 18490 B11R2.1039 C1CC(O1)COCC2CC2 34a_100000039022_100000742324 [0,0,0,2,0,0|1,0,0]=3 18491 B11R2.1039 C1CC(O1)COCC2CC2 34a_100000211283_100000103362 [0,0,0,2,0,0|1,0,0]=3 18492 B11R2.1039 C1CC(O1)COCC2CO2 34a_100000039022_102125554688 [0,0,0,2,0,0|0,0,0]=2 18493 B11R2.1039 C1CC(O1)COC[C@@H]2CO2 34a_100000757423_100000103362 [0,0,0,2,0,0|0,0,0]=2 18494 B11R2.1039 C1CC(O1)CSCC2CC2 62a_100000103362_100000742324 [0,0,0,2,0,0|1,1,0]=4 18495 B11R2.1039 C1CC(O1)CSCC2CC2 62a_100000756562_100000103362 [0,0,0,2,0,0|1,1,0]=4 18496 B11R2.1039 C1CC(O1)CSCC2CO2 62a_100000103362_102125554688 [0,0,0,2,0,0|0,1,0]=3 18497 B11R2.1039 C1CC(O1)CSCC2CO2 62a_102125554688_100000103362 [0,0,0,2,0,0|0,1,0]=3 18498 B11R2.1039 C1CC(O1)CSCC2CS2 62a_100000031435_100000103362 [0,0,0,2,0,0|0,2,0]=4 18499 B11R2.1039 C1CC(O1)CSCC2CS2 62a_100000103362_100000031435 [0,0,0,2,0,0|0,2,0]=4 18500 B11R2.1039 C1CC(O1)CSC[C@@H]2CO2 62a_100000103362_100000745022 [0,0,0,2,0,0|0,1,0]=3 18501 B11R2.1039 C1CC(O1)CSC[C@@H]2CO2 62a_100000745022_100000103362 [0,0,0,2,0,0|0,1,0]=3 18502 B11R2.1039 C1C[C@H](O1)CNCC2CC2 2230a_100020831831_100000742324 [0,0,0,2,0,0|2,0,0]=4 18503 B11R2.1039 C1C[C@H](O1)CNCC2CC2 269862a_100020831831_100000741477 [0,0,0,2,0,0|2,0,0]=4 18504 B11R2.1039 C1C[C@H](O1)CNCC2CC2 34a_100020831831_100000742324 [0,0,0,2,0,0|2,0,0]=4 18505 B11R2.1039 C1C[C@H](O1)CNCC2CO2 2230a_100020831831_100011216344 [0,0,0,2,0,0|1,0,0]=3 18506 B11R2.1039 C1C[C@H](O1)CNCC2CO2 34a_100020831831_102125554688 [0,0,0,2,0,0|1,0,0]=3 18507 B11R2.1039 C1NCC1COCC2CO2 34a_100016987283_102125554688 [0,0,0,2,0,0|2,0,0]=4 18508 B11R2.1039 C1OCC1COCC2CO2 34a_100000060846_102125554688 [0,0,0,2,0,0|2,0,0]=4 18509 B11R2.1039 C1OCC1COC[C@@H]2CO2 34a_100000757423_100010264016 [0,0,0,2,0,0|2,0,0]=4 18510 B11R2.1034 C(CC1CC1)NCC2CO2 34a_100000764129_102125554688 [0,0,0,2,0,0|2,0,0]=4 18511 B11R2.1034 C(CC1CC1)OCC2CC2 34a_100000211283_100000694398 [0,0,0,2,0,0|2,0,0]=4 18512 B11R2.1034 C(CC1CC1)OCC2CC2 34a_100000754188_100000742324 [0,0,0,2,0,0|2,0,0]=4 18513 B11R2.1034 C(CC1CC1)OCC2CC2 7a_100000754188_100000742324 [0,0,0,2,0,0|2,0,0]=4 18514 B11R2.1034 C(CC1CC1)OCC2CO2 34a_100000754188_102125554688 [0,0,0,2,0,0|1,0,0]=3 18515 B11R2.1034 C(CC1CC1)OCC2CO2 7a_100000754188_102125554688 [0,0,0,2,0,0|1,0,0]=3 18516 B11R2.1034 C(CC1CC1)OCC2CS2 7a_100000754188_100000031435 [0,0,0,2,0,0|1,1,0]=4 18517 B11R2.1034 C(CC1CC1)OC[C@@H]2CO2 34a_100000757423_100000694398 [0,0,0,2,0,0|1,0,0]=3 18518 B11R2.1034 C(CC1CC1)OC[C@@H]2CO2 7a_100000754188_100000745022 [0,0,0,2,0,0|1,0,0]=3 18519 B11R2.1034 C(CC1CC1)SCC2CO2 62a_100000764125_102125554688 [0,0,0,2,0,0|1,1,0]=4 18520 B11R2.1034 C(CC1CC1)SCC2CO2 62a_102125554688_100000764125 [0,0,0,2,0,0|1,1,0]=4 18521 B11R2.1034 C(CC1CC1)SC[C@@H]2CO2 62a_100000745022_100000764125 [0,0,0,2,0,0|1,1,0]=4 18522 B11R2.1034 C(CC1CC1)SC[C@@H]2CO2 62a_100000764125_100000745022 [0,0,0,2,0,0|1,1,0]=4 18523 B11R2.1034 C(CC1CO1)OC[C@@H]2CO2 34a_100000757423_100000732470 [0,0,0,2,0,0|2,0,0]=4 18524 B11R2.1034 C(C[C@@H]1CO1)OCC2CO2 34a_100009820653_102125554688 [0,0,0,2,0,0|2,0,0]=4